NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
615260 |
5j6z   |
30061 | cing | 2-parsed | STAR | dihedral angle | 134 |
data_5j6z_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5j6z
_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_5j6z 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5j6z
_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 5j6z "Master copy" parsed_5j6z
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5j6z
_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 5j6z.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5j6z 1
1 5j6z.mr . . XPLOR/CNS 2 distance NOE ambi 2362 parsed_5j6z 1
1 5j6z.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 134 parsed_5j6z 1
1 5j6z.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5j6z 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_5j6z
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.9 -70.7 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_5j6z 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.4 53.4 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_5j6z 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.9 -31.3 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_5j6z 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 92.1 187.3 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_5j6z 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.1 -44.1 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_5j6z 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.8 170.2 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_5j6z 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -176.0 -37.0 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_5j6z 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.1 170.1 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_5j6z 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.4 -43.4 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_5j6z 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.3 165.3 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_5j6z 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.1 -100.1 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_5j6z 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.6 176.2 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_5j6z 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.1 -92.7 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_5j6z 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.3 151.3 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_5j6z 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.8 -81.6 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_5j6z 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.2 179.6 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_5j6z 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.8 -41.8 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_5j6z 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.0 -13.0 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_5j6z 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.8 -107.0 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_5j6z 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -18.9 37.5 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_5j6z 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.9 -101.5 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_5j6z 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.8 174.2 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_5j6z 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.2 -117.2 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_5j6z 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.2 170.2 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_5j6z 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.7 -96.7 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_5j6z 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.7 146.7 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_5j6z 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.8 -90.8 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_5j6z 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.2 147.2 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_5j6z 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.4 -96.4 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_5j6z 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.4 171.6 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_5j6z 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -198.2 -70.6 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_5j6z 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.4 180.2 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_5j6z 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.5 -50.7 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_5j6z 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.4 168.6 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_5j6z 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.3 -49.3 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_5j6z 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.4 163.0 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_5j6z 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.2 -67.0 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_5j6z 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97.5 137.5 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_5j6z 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.6 -61.6 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_5j6z 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.0 -16.2 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_5j6z 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.2 -139.2 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_5j6z 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.9 178.9 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_5j6z 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.1 -101.5 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_5j6z 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.7 163.7 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_5j6z 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.5 -93.5 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_5j6z 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.0 148.0 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_5j6z 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.1 -97.1 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_5j6z 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.2 152.2 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_5j6z 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.0 -104.0 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_5j6z 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.2 159.2 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_5j6z 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.1 -95.9 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_5j6z 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.5 173.3 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_5j6z 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.6 -100.6 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_5j6z 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.3 202.5 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_5j6z 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.4 -39.4 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_5j6z 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.5 156.5 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_5j6z 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -38.6 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_5j6z 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.7 -8.7 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_5j6z 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.5 -51.5 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_5j6z 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -34.9 5.1 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_5j6z 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.4 -49.6 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_5j6z 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 160.6 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_5j6z 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -114.6 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_5j6z 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.7 164.7 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_5j6z 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -116.0 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_5j6z 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.9 162.3 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_5j6z 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.2 -80.0 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_5j6z 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.2 147.2 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_5j6z 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.4 -110.4 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_5j6z 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.9 166.3 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_5j6z 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.8 -30.8 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_5j6z 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.4 176.4 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_5j6z 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.6 -112.0 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_5j6z 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.5 173.5 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_5j6z 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173.8 -112.6 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_5j6z 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.7 155.7 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_5j6z 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.7 -79.7 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_5j6z 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.6 142.4 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_5j6z 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.3 -57.9 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_5j6z 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.2 147.2 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_5j6z 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.4 -87.4 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_5j6z 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.8 189.0 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_5j6z 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.1 -56.7 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_5j6z 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 173.4 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_5j6z 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.4 -44.2 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_5j6z 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.2 170.0 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_5j6z 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -37.1 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_5j6z 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.5 159.5 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_5j6z 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 46.2 135.4 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_5j6z 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.5 48.1 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_5j6z 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -47.2 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_5j6z 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.9 157.9 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_5j6z 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.2 -58.0 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_5j6z 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.9 145.9 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_5j6z 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.8 -83.8 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_5j6z 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.9 162.3 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_5j6z 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.0 -104.6 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_5j6z 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.3 169.9 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_5j6z 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -99.4 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_5j6z 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.2 156.6 . . 84 . N . 84 . CA . 84 . C . 85 . N parsed_5j6z 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.6 -89.6 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_5j6z 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.0 141.0 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_5j6z 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.5 -87.5 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_5j6z 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.7 146.7 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_5j6z 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.8 -80.0 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_5j6z 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.8 148.0 . . 87 . N . 87 . CA . 87 . C . 88 . N parsed_5j6z 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.7 -72.1 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_5j6z 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.7 140.5 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_5j6z 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.5 -60.5 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_5j6z 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142.0 182.0 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_5j6z 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.1 -43.1 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_5j6z 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.8 -4.8 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_5j6z 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.8 -68.0 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_5j6z 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.6 17.4 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_5j6z 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 69.9 109.9 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_5j6z 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -21.3 18.7 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_5j6z 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.6 -49.6 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_5j6z 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.7 162.5 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_5j6z 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.6 -83.0 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_5j6z 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.3 162.3 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_5j6z 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.7 -99.1 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_5j6z 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.8 172.4 . . 95 . N . 95 . CA . 95 . C . 96 . N parsed_5j6z 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.1 -90.7 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_5j6z 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.1 148.1 . . 96 . N . 96 . CA . 96 . C . 97 . N parsed_5j6z 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.9 -93.1 . . 96 . C . 97 . N . 97 . CA . 97 . C parsed_5j6z 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.4 149.4 . . 97 . N . 97 . CA . 97 . C . 98 . N parsed_5j6z 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.8 -79.4 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_5j6z 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 156.0 . . 98 . N . 98 . CA . 98 . C . 99 . N parsed_5j6z 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -176.1 -128.9 . . 98 . C . 99 . N . 99 . CA . 99 . C parsed_5j6z 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 141.3 181.3 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_5j6z 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.8 -81.4 . . 99 . C . 100 . N . 100 . CA . 100 . C parsed_5j6z 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.6 169.6 . . 100 . N . 100 . CA . 100 . C . 101 . N parsed_5j6z 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.4 -129.4 . . 100 . C . 101 . N . 101 . CA . 101 . C parsed_5j6z 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.8 176.8 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_5j6z 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 "8 D -91.268 2.015 10.292 25.701 0.422 0.648 25 16 Strong" 3 1 3 73 parsed_5j6z 1
2 "9 A -72.090 139.729 20.414 23.797 0.615 0.610 25 15 Strong" 9 1 9 73 parsed_5j6z 1
3 "10 P -64.063 145.959 7.818 12.100 0.782 0.639 25 12 Strong" 15 1 15 73 parsed_5j6z 1
4 "12 D -106.485 143.059 34.728 13.478 0.487 0.738 25 13 Strong" 21 1 21 73 parsed_5j6z 1
5 "13 P -63.386 140.846 8.183 12.235 0.401 0.767 25 16 Strong" 27 1 27 73 parsed_5j6z 1
6 "14 T -126.103 145.414 13.018 15.397 0.391 0.801 25 16 Strong" 33 1 33 73 parsed_5j6z 1
7 "15 V -117.433 131.287 12.355 5.744 0.397 0.815 25 18 Strong" 39 1 39 73 parsed_5j6z 1
8 "16 D -119.703 150.884 19.064 14.329 0.493 0.794 25 15 Strong" 45 1 45 73 parsed_5j6z 1
9 "20 D -61.777 -32.974 7.654 9.498 0.413 0.862 25 16 Strong" 51 1 51 73 parsed_5j6z 1
10 "21 T -128.371 9.310 10.677 14.098 0.286 0.890 25 18 Strong" 57 1 57 73 parsed_5j6z 1
11 "22 S -132.183 144.525 15.339 14.842 0.202 0.899 25 16 Strong" 63 1 63 73 parsed_5j6z 1
12 "23 I -137.161 150.154 7.919 9.079 0.162 0.896 25 16 Strong" 69 1 69 73 parsed_5j6z 1
13 "24 V -116.672 126.685 9.621 6.651 0.194 0.884 25 16 Strong" 75 1 75 73 parsed_5j6z 1
14 "25 V -110.837 127.236 7.836 6.624 0.179 0.877 25 18 Strong" 81 1 81 73 parsed_5j6z 1
15 "26 R -128.907 148.476 16.262 11.528 0.241 0.846 25 18 Strong" 87 1 87 73 parsed_5j6z 1
16 "27 W -134.397 152.766 31.922 13.695 0.404 0.810 25 18 Strong" 93 1 93 73 parsed_5j6z 1
17 "28 S -81.135 140.462 15.198 14.040 0.534 0.748 25 18 Strong" 99 1 99 73 parsed_5j6z 1
18 "29 R -69.254 140.697 8.542 11.136 0.893 0.706 25 15 Strong" 105 1 105 73 parsed_5j6z 1
19 "42 I -89.145 117.534 11.052 8.349 0.279 0.687 25 16 Strong" 111 1 111 73 parsed_5j6z 1
20 "43 S -81.567 -36.562 8.177 10.187 0.199 0.787 25 18 Strong" 117 1 117 73 parsed_5j6z 1
21 "44 K -159.183 158.886 6.871 7.193 0.165 0.875 25 18 Strong" 123 1 123 73 parsed_5j6z 1
22 "45 Y -121.835 143.734 10.171 8.195 0.175 0.911 25 18 Strong" 129 1 129 73 parsed_5j6z 1
23 "46 I -113.526 127.959 8.853 9.115 0.213 0.923 25 18 Strong" 135 1 135 73 parsed_5j6z 1
24 "47 L -117.076 132.176 8.468 9.031 0.250 0.927 25 18 Strong" 141 1 141 73 parsed_5j6z 1
25 "48 R -124.031 139.158 9.280 8.628 0.314 0.921 25 18 Strong" 147 1 147 73 parsed_5j6z 1
26 "49 W -130.478 150.894 17.285 11.196 0.482 0.904 25 18 Strong" 153 1 153 73 parsed_5j6z 1
27 "50 R -138.134 141.425 18.751 30.535 0.715 0.876 25 15 Strong" 159 1 159 73 parsed_5j6z 1
28 "51 P -59.379 136.451 7.924 9.020 0.547 0.835 25 15 Strong" 165 1 165 73 parsed_5j6z 1
29 "52 K -58.617 -28.745 4.895 7.343 0.563 0.811 25 15 Strong" 171 1 171 73 parsed_5j6z 1
30 "53 N -71.538 -14.863 6.342 6.968 0.504 0.788 25 18 Strong" 177 1 177 73 parsed_5j6z 1
31 "58 W -70.517 138.284 10.463 11.137 0.784 0.727 25 18 Strong" 183 1 183 73 parsed_5j6z 1
32 "60 E -137.287 144.704 11.359 9.165 0.314 0.859 25 18 Strong" 189 1 189 73 parsed_5j6z 1
33 "61 A -137.976 138.102 11.015 12.096 0.342 0.869 25 18 Strong" 195 1 195 73 parsed_5j6z 1
34 "62 T -103.597 127.150 11.798 6.944 0.388 0.863 25 18 Strong" 201 1 201 73 parsed_5j6z 1
35 "63 I -130.383 141.082 9.227 12.601 0.658 0.842 25 16 Strong" 207 1 207 73 parsed_5j6z 1
36 "64 P -60.804 146.375 8.935 9.313 1.066 0.788 10 15 Generous" 213 1 213 75 parsed_5j6z 1
37 "69 S -143.776 153.521 15.909 7.077 0.740 0.897 25 18 Strong" 219 1 219 73 parsed_5j6z 1
38 "70 Y -143.212 135.675 15.311 10.014 0.739 0.897 25 18 Strong" 225 1 225 73 parsed_5j6z 1
39 "71 T -99.698 120.961 7.355 10.723 0.636 0.886 25 18 Strong" 231 1 231 73 parsed_5j6z 1
40 "72 I -83.596 127.202 12.872 9.110 0.560 0.864 25 18 Strong" 237 1 237 73 parsed_5j6z 1
41 "73 K -120.360 155.440 16.520 16.783 0.581 0.820 25 17 Strong" 243 1 243 73 parsed_5j6z 1
42 "75 L -79.887 148.171 11.583 12.588 0.548 0.736 25 17 Strong" 249 1 249 73 parsed_5j6z 1
43 "76 K -91.782 146.581 23.804 11.713 0.421 0.723 25 12 Strong" 255 1 255 73 parsed_5j6z 1
44 "77 P -57.080 139.492 5.890 9.514 0.279 0.660 25 9 Strong" 261 1 261 73 parsed_5j6z 1
45 "78 G 90.850 -3.683 14.854 17.265 0.278 0.605 10 9 Generous" 267 1 267 75 parsed_5j6z 1
46 "79 V -92.103 137.854 22.445 9.469 0.275 0.629 25 13 Strong" 273 1 273 73 parsed_5j6z 1
47 "80 V -84.082 125.924 13.035 7.679 0.355 0.689 25 16 Strong" 279 1 279 73 parsed_5j6z 1
48 "81 Y -106.816 138.096 11.488 12.098 0.422 0.780 25 16 Strong" 285 1 285 73 parsed_5j6z 1
49 "82 E -128.793 139.148 12.077 15.375 0.326 0.857 25 17 Strong" 291 1 291 73 parsed_5j6z 1
50 "84 Q -124.694 135.402 12.641 10.619 0.233 0.898 25 17 Strong" 297 1 297 73 parsed_5j6z 1
51 "85 L -109.562 121.003 8.302 9.106 0.166 0.897 25 18 Strong" 303 1 303 73 parsed_5j6z 1
52 "86 I -107.524 126.746 8.002 6.105 0.205 0.883 25 18 Strong" 309 1 309 73 parsed_5j6z 1
53 "87 S -107.384 124.406 13.706 11.788 0.194 0.839 25 18 Strong" 315 1 315 73 parsed_5j6z 1
54 "88 I -92.921 118.131 10.377 11.179 0.205 0.808 25 18 Strong" 321 1 321 73 parsed_5j6z 1
55 "89 Q -80.520 162.010 9.243 8.937 0.229 0.789 25 18 Strong" 327 1 327 73 parsed_5j6z 1
56 "90 Q -63.088 -24.771 4.781 5.168 0.184 0.762 25 18 Strong" 333 1 333 73 parsed_5j6z 1
57 "91 Y -88.364 -2.612 10.213 9.930 0.298 0.734 25 17 Strong" 339 1 339 73 parsed_5j6z 1
58 "92 G 89.854 -1.288 6.636 7.336 0.165 0.741 25 17 Strong" 345 1 345 73 parsed_5j6z 1
59 "93 H -69.566 141.604 6.727 10.441 0.170 0.784 25 17 Strong" 351 1 351 73 parsed_5j6z 1
60 "94 Q -113.827 142.285 15.412 8.754 0.208 0.836 25 18 Strong" 357 1 357 73 parsed_5j6z 1
61 "95 E -134.870 143.647 17.884 14.396 0.189 0.832 25 18 Strong" 363 1 363 73 parsed_5j6z 1
62 "96 V -114.912 128.079 12.090 7.526 0.206 0.834 25 16 Strong" 369 1 369 73 parsed_5j6z 1
63 "97 T -120.000 129.406 13.468 9.629 0.239 0.840 25 16 Strong" 375 1 375 73 parsed_5j6z 1
64 "98 R -106.076 136.021 13.365 9.390 0.260 0.874 25 16 Strong" 381 1 381 73 parsed_5j6z 1
65 "99 F -152.533 161.273 11.811 9.294 0.306 0.895 25 18 Strong" 387 1 387 73 parsed_5j6z 1
66 "100 D -114.139 149.581 16.372 9.311 0.384 0.894 25 18 Strong" 393 1 393 73 parsed_5j6z 1
67 "101 F -149.378 156.829 9.634 9.093 0.538 0.890 25 12 Strong" 399 1 399 73 parsed_5j6z 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 3: abana_talosn_081414.tbl" 1 1 1 44 parsed_5j6z 1
stop_
save_
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