NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | program | type | item_count |
|
|
29703 |
1bal   |
2546 | cing | recoord | dress | 2-parsed | STAR | dihedral angle | 101 |
data_1bal_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1bal
_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_1bal 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1bal
_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 1bal "Master copy" parsed_1bal
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1bal
_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 1bal.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bal 1
1 1bal.mr . . XPLOR/CNS 2 distance NOE simple 315 parsed_1bal 1
1 1bal.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1bal 1
1 1bal.mr . . XPLOR/CNS 4 distance NOE simple 44 parsed_1bal 1
1 1bal.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1bal 1
1 1bal.mr . . XPLOR/CNS 6 distance NOE simple 102 parsed_1bal 1
1 1bal.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1bal 1
1 1bal.mr . . XPLOR/CNS 8 distance NOE simple 169 parsed_1bal 1
1 1bal.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1bal 1
1 1bal.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 101 parsed_1bal 1
1 1bal.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bal 1
stop_
save_
save_CNS/XPLOR_dihedral_10
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1bal
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 10
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 1 . c . 2 . n . 2 . ca . 2 . c parsed_1bal 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 2 . c . 3 . n . 3 . ca . 3 . c parsed_1bal 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 3 . c . 4 . n . 4 . ca . 4 . c parsed_1bal 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 4 . c . 5 . n . 5 . ca . 5 . c parsed_1bal 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1bal 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1bal 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -185.0 -45.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1bal 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -185.0 -55.0 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1bal 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -30.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1bal 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -65.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1bal 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_1bal 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -45.0 . . 14 . c . 15 . n . 15 . ca . 15 . c parsed_1bal 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1bal 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_1bal 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1bal 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -45.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1bal 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1bal 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1bal 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -45.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1bal 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -75.0 . . 22 . c . 23 . n . 23 . ca . 23 . c parsed_1bal 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 85.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1bal 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 24 . c . 25 . n . 25 . ca . 25 . c parsed_1bal 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -55.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1bal 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1bal 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -25.0 . . 27 . c . 28 . n . 28 . ca . 28 . c parsed_1bal 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -55.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1bal 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -55.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_1bal 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -65.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1bal 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -15.0 . . 31 . c . 32 . n . 32 . ca . 32 . c parsed_1bal 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 32 . c . 33 . n . 33 . ca . 33 . c parsed_1bal 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -30.0 . . 34 . c . 35 . n . 35 . ca . 35 . c parsed_1bal 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5.0 175.0 . . 36 . c . 37 . n . 37 . ca . 37 . c parsed_1bal 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -35.0 . . 37 . c . 38 . n . 38 . ca . 38 . c parsed_1bal 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 38 . c . 39 . n . 39 . ca . 39 . c parsed_1bal 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -70.0 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1bal 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -65.0 . . 40 . c . 41 . n . 41 . ca . 41 . c parsed_1bal 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 41 . c . 42 . n . 42 . ca . 42 . c parsed_1bal 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -70.0 . . 42 . c . 43 . n . 43 . ca . 43 . c parsed_1bal 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -45.0 . . 43 . c . 44 . n . 44 . ca . 44 . c parsed_1bal 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_1bal 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 45 . c . 46 . n . 46 . ca . 46 . c parsed_1bal 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -65.0 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_1bal 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 47 . c . 48 . n . 48 . ca . 48 . c parsed_1bal 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -40.0 . . 48 . c . 49 . n . 49 . ca . 49 . c parsed_1bal 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 49 . c . 50 . n . 50 . ca . 50 . c parsed_1bal 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -10.0 . . 50 . c . 51 . n . 51 . ca . 51 . c parsed_1bal 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -220.0 -120.0 . . 12 . n . 12 . ca . 12 . c . 13 . n parsed_1bal 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 13 . n . 13 . ca . 13 . c . 14 . n parsed_1bal 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 45.0 . . 14 . n . 14 . ca . 14 . c . 15 . n parsed_1bal 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 35.0 . . 15 . n . 15 . ca . 15 . c . 16 . n parsed_1bal 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 30.0 . . 16 . n . 16 . ca . 16 . c . 17 . n parsed_1bal 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 10.0 . . 17 . n . 17 . ca . 17 . c . 18 . n parsed_1bal 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 45.0 . . 18 . n . 18 . ca . 18 . c . 19 . n parsed_1bal 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 15.0 . . 19 . n . 19 . ca . 19 . c . 20 . n parsed_1bal 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 20 . n . 20 . ca . 20 . c . 21 . n parsed_1bal 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 21 . n . 21 . ca . 21 . c . 22 . n parsed_1bal 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 22 . n . 22 . ca . 22 . c . 23 . n parsed_1bal 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 40.0 . . 23 . n . 23 . ca . 23 . c . 24 . n parsed_1bal 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 120.0 . . 24 . n . 24 . ca . 24 . c . 25 . n parsed_1bal 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.0 180.0 . . 25 . n . 25 . ca . 25 . c . 26 . n parsed_1bal 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 170.0 . . 26 . n . 26 . ca . 26 . c . 27 . n parsed_1bal 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 40.0 . . 27 . n . 27 . ca . 27 . c . 28 . n parsed_1bal 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 28 . n . 28 . ca . 28 . c . 29 . n parsed_1bal 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 25.0 . . 29 . n . 29 . ca . 29 . c . 30 . n parsed_1bal 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.0 185.0 . . 30 . n . 30 . ca . 30 . c . 31 . n parsed_1bal 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 255.0 . . 31 . n . 31 . ca . 31 . c . 32 . n parsed_1bal 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5.0 175.0 . . 32 . n . 32 . ca . 32 . c . 33 . n parsed_1bal 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 85.0 . . 33 . n . 33 . ca . 33 . c . 34 . n parsed_1bal 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 230.0 . . 34 . n . 34 . ca . 34 . c . 35 . n parsed_1bal 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.0 155.0 . . 35 . n . 35 . ca . 35 . c . 36 . n parsed_1bal 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 65.0 . . 37 . n . 37 . ca . 37 . c . 38 . n parsed_1bal 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.0 195.0 . . 38 . n . 38 . ca . 38 . c . 39 . n parsed_1bal 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 75.0 175.0 . . 39 . n . 39 . ca . 39 . c . 40 . n parsed_1bal 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -110.0 . . 40 . n . 40 . ca . 40 . c . 41 . n parsed_1bal 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 41 . n . 41 . ca . 41 . c . 42 . n parsed_1bal 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 45.0 . . 42 . n . 42 . ca . 42 . c . 43 . n parsed_1bal 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 10.0 . . 43 . n . 43 . ca . 43 . c . 44 . n parsed_1bal 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 44 . n . 44 . ca . 44 . c . 45 . n parsed_1bal 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 5.0 . . 45 . n . 45 . ca . 45 . c . 46 . n parsed_1bal 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.0 50.0 . . 46 . n . 46 . ca . 46 . c . 47 . n parsed_1bal 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 20.0 . . 47 . n . 47 . ca . 47 . c . 48 . n parsed_1bal 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -15.0 . . 12 . n . 12 . ca . 12 . cb . 12 . cg parsed_1bal 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.0 25.0 . . 14 . n . 14 . ca . 14 . cb . 14 . cg parsed_1bal 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 16 . n . 16 . ca . 16 . cb . 16 . cg1 parsed_1bal 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . n . 17 . ca . 17 . cb . 17 . cg parsed_1bal 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . n . 18 . ca . 18 . cb . 18 . cg parsed_1bal 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 19 . n . 19 . ca . 19 . cb . 19 . cg parsed_1bal 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 20 . n . 20 . ca . 20 . cb . 20 . cg parsed_1bal 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 22 . n . 22 . ca . 22 . cb . 22 . cg parsed_1bal 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 23 . n . 23 . ca . 23 . cb . 23 . cg parsed_1bal 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 25 . n . 25 . ca . 25 . cb . 25 . cg parsed_1bal 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . n . 30 . ca . 30 . cb . 30 . cg1 parsed_1bal 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 33 . n . 33 . ca . 33 . cb . 33 . og1 parsed_1bal 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 35 . n . 35 . ca . 35 . cb . 35 . cg1 parsed_1bal 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 39 . n . 39 . ca . 39 . cb . 39 . cg parsed_1bal 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 40 . n . 40 . ca . 40 . cb . 40 . og1 parsed_1bal 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 41 . n . 41 . ca . 41 . cb . 41 . cg parsed_1bal 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 43 . n . 43 . ca . 43 . cb . 43 . cg parsed_1bal 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 44 . n . 44 . ca . 44 . cb . 44 . cg1 parsed_1bal 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 47 . n . 47 . ca . 47 . cb . 47 . cg parsed_1bal 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 48 . n . 48 . ca . 48 . cb . 48 . cg parsed_1bal 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
;
remark phi angle constraints
! a2
;
1 1 3 6 parsed_1bal 1
2 "! s3" 6 1 6 6 parsed_1bal 1
3 "! l4" 9 1 9 6 parsed_1bal 1
4 "! e5" 12 1 12 6 parsed_1bal 1
5 "! e6" 15 1 15 6 parsed_1bal 1
6 "! q7" 18 1 18 6 parsed_1bal 1
7 "! d10" 21 1 21 7 parsed_1bal 1
8 "! a11" 24 1 24 7 parsed_1bal 1
9 "! l12" 27 1 27 7 parsed_1bal 1
10 "! s13" 30 1 30 7 parsed_1bal 1
11 "! p14" 33 1 33 7 parsed_1bal 1
12 "! a15" 36 1 36 7 parsed_1bal 1
13 "! i16" 39 1 39 7 parsed_1bal 1
14 "! r17" 42 1 42 7 parsed_1bal 1
15 "! r18" 45 1 45 7 parsed_1bal 1
16 "! l19" 48 1 48 7 parsed_1bal 1
17 "! l20" 51 1 51 7 parsed_1bal 1
18 "! a21" 54 1 54 7 parsed_1bal 1
19 "! e22" 57 1 57 7 parsed_1bal 1
20 "! h23" 60 1 60 7 parsed_1bal 1
21 "! n24" 63 1 63 7 parsed_1bal 1
22 "! l25" 66 1 66 7 parsed_1bal 1
23 "! d26" 69 1 69 7 parsed_1bal 1
24 "! a27" 72 1 72 7 parsed_1bal 1
25 "! s28" 75 1 75 7 parsed_1bal 1
26 "! a29" 78 1 78 7 parsed_1bal 1
27 "! i30" 81 1 81 7 parsed_1bal 1
28 "! k31" 84 1 84 7 parsed_1bal 1
29 "! g32" 87 1 87 7 parsed_1bal 1
30 "! t33" 90 1 90 7 parsed_1bal 1
31 "! v35" 93 1 93 7 parsed_1bal 1
32 "! g37" 96 1 96 7 parsed_1bal 1
33 "! r38" 99 1 99 7 parsed_1bal 1
34 "! l39" 102 1 102 7 parsed_1bal 1
35 "! t40" 105 1 105 7 parsed_1bal 1
36 "! r41" 108 1 108 7 parsed_1bal 1
37 "! e42" 111 1 111 7 parsed_1bal 1
38 "! d43" 114 1 114 7 parsed_1bal 1
39 "! v44" 117 1 117 7 parsed_1bal 1
40 "! e45" 120 1 120 7 parsed_1bal 1
41 "! k46" 123 1 123 7 parsed_1bal 1
42 "! h47" 126 1 126 7 parsed_1bal 1
43 "! l48" 129 1 129 7 parsed_1bal 1
44 "! a49" 132 1 132 7 parsed_1bal 1
45 "! k50" 135 1 135 7 parsed_1bal 1
46 "! a51" 138 1 138 7 parsed_1bal 1
47
;
Remark psi dihedral angle restraints
! l12
;
143 1 144 8 parsed_1bal 1
48 "! s13" 147 1 147 8 parsed_1bal 1
49 "! p14" 150 1 150 7 parsed_1bal 1
50 "! a15" 153 1 153 7 parsed_1bal 1
51 "! i16" 156 1 156 7 parsed_1bal 1
52 "! r17" 159 1 159 7 parsed_1bal 1
53 "! r18" 162 1 162 7 parsed_1bal 1
54 "! l19" 165 1 165 7 parsed_1bal 1
55 !l20 168 1 168 6 parsed_1bal 1
56 "! a21" 171 1 171 7 parsed_1bal 1
57 "! e22" 174 1 174 7 parsed_1bal 1
58 "! h23" 177 1 177 7 parsed_1bal 1
59 "! n24" 180 1 180 7 parsed_1bal 1
60 "! l25" 183 1 183 7 parsed_1bal 1
61 "! d26" 186 1 186 7 parsed_1bal 1
62 "! a27" 189 1 189 7 parsed_1bal 1
63 "! s28" 192 1 192 7 parsed_1bal 1
64 "! a29" 195 1 195 7 parsed_1bal 1
65 "! i30" 198 1 198 7 parsed_1bal 1
66 "! k31" 201 1 201 7 parsed_1bal 1
67 "! g32" 204 1 204 7 parsed_1bal 1
68 "! t33" 207 1 207 7 parsed_1bal 1
69 "! g34" 210 1 210 7 parsed_1bal 1
70 "! v35" 213 1 213 7 parsed_1bal 1
71 "! g37" 216 1 216 7 parsed_1bal 1
72 "! r38" 219 1 219 7 parsed_1bal 1
73 "! l39" 222 1 222 7 parsed_1bal 1
74 "! t40" 225 1 225 7 parsed_1bal 1
75 "! r41" 228 1 228 7 parsed_1bal 1
76 "! e42" 231 1 231 7 parsed_1bal 1
77 "! d43" 234 1 234 7 parsed_1bal 1
78 "! v44" 237 1 237 7 parsed_1bal 1
79 "! e45" 240 1 240 7 parsed_1bal 1
80 "! k46" 243 1 243 7 parsed_1bal 1
81 "! h47" 246 1 246 7 parsed_1bal 1
82
;
Remark chi1 torsion angle restraints
! l12
;
251 1 252 7 parsed_1bal 1
83 "! p14" 255 1 255 7 parsed_1bal 1
84 "! i16" 258 1 258 7 parsed_1bal 1
85 "! r17" 261 1 261 7 parsed_1bal 1
86 "! r18" 264 1 264 7 parsed_1bal 1
87 "! l19" 267 1 267 7 parsed_1bal 1
88 "! l20" 270 1 270 7 parsed_1bal 1
89 "! e22" 273 1 273 7 parsed_1bal 1
90 "! h23" 276 1 276 7 parsed_1bal 1
91 "! l25" 279 1 279 7 parsed_1bal 1
92 "! i30" 282 1 282 7 parsed_1bal 1
93 "! t33" 285 1 285 7 parsed_1bal 1
94 "! v35" 288 1 288 7 parsed_1bal 1
95 "! l39" 291 1 291 7 parsed_1bal 1
96 "! t40" 294 1 294 7 parsed_1bal 1
97 "! r41" 297 1 297 7 parsed_1bal 1
98 "! d43" 300 1 300 7 parsed_1bal 1
99 "! v44" 303 1 303 7 parsed_1bal 1
100 "! h47" 306 1 306 7 parsed_1bal 1
101 "! l48" 309 1 309 7 parsed_1bal 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 2, 2024 2:52:25 AM GMT (wattos1)