NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
52525 |
2kjr   |
16338 | cing | 2-parsed | STAR | dihedral angle | 112 |
data_2kjr_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kjr
_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_2kjr 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kjr
_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 2kjr "Master copy" parsed_2kjr
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kjr
_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 2kjr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kjr 1
1 2kjr.mr . . XPLOR/CNS 2 distance NOE simple 1362 parsed_2kjr 1
1 2kjr.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 112 parsed_2kjr 1
1 2kjr.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_2kjr 1
1 2kjr.mr . . XPLOR/CNS 5 "chemical shift" "Not applicable" "Not applicable" 0 parsed_2kjr 1
1 2kjr.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kjr 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2kjr
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.69 -100.69 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2kjr 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.67 187.67 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2kjr 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.07 -102.07 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2kjr 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.99 180.99 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2kjr 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142 -82 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2kjr 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.99 162.99 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2kjr 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -164.85 -104.85 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2kjr 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132.64 192.64 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2kjr 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.73 -82.73 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2kjr 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.02 171.02 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2kjr 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.74 -95.74 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2kjr 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.11 155.11 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2kjr 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.81 -89.81 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2kjr 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.06 186.06 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2kjr 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.76 -91.76 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2kjr 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132.32 192.32 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2kjr 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.4 -44.4 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2kjr 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.34 167.34 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2kjr 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.36 -86.36 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2kjr 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.72 162.72 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2kjr 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.48 -75.48 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2kjr 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.58 155.58 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2kjr 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.51 -54.51 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2kjr 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.6 159.6 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2kjr 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.67 -70.67 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2kjr 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.27 158.27 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2kjr 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.26 -91.26 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2kjr 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.45 168.45 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2kjr 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.96 -27.96 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2kjr 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.36 1.64 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2kjr 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.34 -61.34 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2kjr 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.01 28.99 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2kjr 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.1 -61.1 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2kjr 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.46 193.46 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2kjr 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.49 -30.49 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2kjr 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.01 -7.01 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2kjr 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.74 -30.74 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2kjr 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.28 -11.28 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2kjr 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.55 -35.55 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2kjr 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.56 -8.56 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2kjr 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.53 -35.53 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2kjr 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.19 -13.19 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2kjr 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.33 -29.33 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2kjr 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.5 -10.5 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2kjr 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.88 -34.88 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2kjr 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.97 -11.97 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2kjr 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.45 -35.45 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2kjr 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.49 -15.49 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2kjr 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.62 -34.62 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2kjr 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.71 -7.71 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2kjr 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.15 -35.15 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2kjr 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.36 -12.36 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2kjr 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.06 -35.06 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2kjr 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.11 -9.11 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2kjr 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.93 -51.93 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2kjr 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.63 -3.63 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2kjr 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.28 -79.28 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2kjr 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.2 14.8 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2kjr 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 54.38 114.38 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2kjr 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -21.1 38.9 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2kjr 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.46 -34.46 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2kjr 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.38 6.62 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2kjr 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.89 -35.89 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2kjr 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.87 5.13 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2kjr 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.12 -83.12 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2kjr 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.43 168.43 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2kjr 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.44 -71.44 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2kjr 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.3 158.3 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2kjr 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.49 -93.49 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2kjr 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.96 176.96 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2kjr 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.89 -74.89 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2kjr 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.68 156.68 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2kjr 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.04 -83.04 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2kjr 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97.46 157.46 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2kjr 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.89 -96.89 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2kjr 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.95 140.95 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2kjr 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 41.08 101.08 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2kjr 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.94 -92.94 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2kjr 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.19 -87.19 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2kjr 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.9 158.9 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2kjr 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.88 -63.88 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2kjr 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.24 153.24 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2kjr 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.19 -65.19 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2kjr 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.21 -9.21 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2kjr 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.91 -66.91 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2kjr 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.62 165.62 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2kjr 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.66 -34.66 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2kjr 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.06 2.94 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_2kjr 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.48 -57.48 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2kjr 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.6 24.4 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_2kjr 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.49 -67.49 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_2kjr 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.74 171.74 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2kjr 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.82 -59.82 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2kjr 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.09 185.09 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2kjr 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.77 -25.77 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2kjr 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.23 -7.23 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_2kjr 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.79 -50.79 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2kjr 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.19 7.81 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2kjr 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.5 -61.5 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2kjr 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.87 178.87 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_2kjr 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.31 -96.31 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_2kjr 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.25 164.25 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_2kjr 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.33 -77.33 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_2kjr 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.52 156.52 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_2kjr 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.65 -87.65 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2kjr 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.27 160.27 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_2kjr 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.76 -73.76 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_2kjr 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.15 154.15 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_2kjr 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.51 -80.51 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_2kjr 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.06 158.06 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_2kjr 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.21 -67.21 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2kjr 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 86.98 146.98 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2kjr 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
;
Talos dihedral restraints
PHI for PHE 15
;
1 1 3 17 parsed_2kjr 1
2 "PSI for PHE 15" 7 1 7 17 parsed_2kjr 1
3 "PHI for ILE 16" 11 1 11 17 parsed_2kjr 1
4 "PSI for ILE 16" 15 1 15 17 parsed_2kjr 1
5 "PHI for LYS 17" 19 1 19 17 parsed_2kjr 1
6 "PSI for LYS 17" 23 1 23 17 parsed_2kjr 1
7 "PHI for VAL 18" 27 1 27 17 parsed_2kjr 1
8 "PSI for VAL 18" 31 1 31 17 parsed_2kjr 1
9 "PHI for ASN 19" 35 1 35 17 parsed_2kjr 1
10 "PSI for ASN 19" 39 1 39 17 parsed_2kjr 1
11 "PHI for VAL 20" 43 1 43 17 parsed_2kjr 1
12 "PSI for VAL 20" 47 1 47 17 parsed_2kjr 1
13 "PHI for SER 21" 51 1 51 17 parsed_2kjr 1
14 "PSI for SER 21" 55 1 55 17 parsed_2kjr 1
15 "PHI for ASN 22" 59 1 59 17 parsed_2kjr 1
16 "PSI for ASN 22" 63 1 63 17 parsed_2kjr 1
17 "PHI for ALA 27" 67 1 67 17 parsed_2kjr 1
18 "PSI for ALA 27" 71 1 71 17 parsed_2kjr 1
19 "PHI for VAL 28" 75 1 75 17 parsed_2kjr 1
20 "PSI for VAL 28" 79 1 79 17 parsed_2kjr 1
21 "PHI for ALA 29" 83 1 83 17 parsed_2kjr 1
22 "PSI for ALA 29" 87 1 87 17 parsed_2kjr 1
23 "PHI for VAL 32" 91 1 91 17 parsed_2kjr 1
24 "PSI for VAL 32" 95 1 95 17 parsed_2kjr 1
25 "PHI for LYS 33" 99 1 99 17 parsed_2kjr 1
26 "PSI for LYS 33" 103 1 103 17 parsed_2kjr 1
27 "PHI for LEU 34" 107 1 107 17 parsed_2kjr 1
28 "PSI for LEU 34" 111 1 111 17 parsed_2kjr 1
29 "PHI for LYS 36" 115 1 115 17 parsed_2kjr 1
30 "PSI for LYS 36" 119 1 119 17 parsed_2kjr 1
31 "PHI for ASP 37" 123 1 123 17 parsed_2kjr 1
32 "PSI for ASP 37" 127 1 127 17 parsed_2kjr 1
33 "PHI for THR 39" 131 1 131 17 parsed_2kjr 1
34 "PSI for THR 39" 135 1 135 17 parsed_2kjr 1
35 "PHI for VAL 40" 139 1 139 17 parsed_2kjr 1
36 "PSI for VAL 40" 143 1 143 17 parsed_2kjr 1
37 "PHI for ALA 41" 147 1 147 17 parsed_2kjr 1
38 "PSI for ALA 41" 151 1 151 17 parsed_2kjr 1
39 "PHI for GLN 42" 155 1 155 17 parsed_2kjr 1
40 "PSI for GLN 42" 159 1 159 17 parsed_2kjr 1
41 "PHI for LEU 43" 163 1 163 17 parsed_2kjr 1
42 "PSI for LEU 43" 167 1 167 17 parsed_2kjr 1
43 "PHI for LYS 44" 171 1 171 17 parsed_2kjr 1
44 "PSI for LYS 44" 175 1 175 17 parsed_2kjr 1
45 "PHI for THR 45" 179 1 179 17 parsed_2kjr 1
46 "PSI for THR 45" 183 1 183 17 parsed_2kjr 1
47 "PHI for LYS 46" 187 1 187 17 parsed_2kjr 1
48 "PSI for LYS 46" 191 1 191 17 parsed_2kjr 1
49 "PHI for LEU 47" 195 1 195 17 parsed_2kjr 1
50 "PSI for LEU 47" 199 1 199 17 parsed_2kjr 1
51 "PHI for GLU 48" 203 1 203 17 parsed_2kjr 1
52 "PSI for GLU 48" 207 1 207 17 parsed_2kjr 1
53 "PHI for ILE 49" 211 1 211 17 parsed_2kjr 1
54 "PSI for ILE 49" 215 1 215 17 parsed_2kjr 1
55 "PHI for LEU 50" 219 1 219 17 parsed_2kjr 1
56 "PSI for LEU 50" 223 1 223 17 parsed_2kjr 1
57 "PHI for THR 51" 227 1 227 17 parsed_2kjr 1
58 "PSI for THR 51" 231 1 231 17 parsed_2kjr 1
59 "PHI for GLY 52" 235 1 235 17 parsed_2kjr 1
60 "PSI for GLY 52" 239 1 239 17 parsed_2kjr 1
61 "PHI for ALA 55" 243 1 243 17 parsed_2kjr 1
62 "PSI for ALA 55" 247 1 247 17 parsed_2kjr 1
63 "PHI for GLY 56" 251 1 251 17 parsed_2kjr 1
64 "PSI for GLY 56" 255 1 255 17 parsed_2kjr 1
65 "PHI for LYS 59" 259 1 259 17 parsed_2kjr 1
66 "PSI for LYS 59" 263 1 263 17 parsed_2kjr 1
67 "PHI for VAL 60" 267 1 267 17 parsed_2kjr 1
68 "PSI for VAL 60" 271 1 271 17 parsed_2kjr 1
69 "PHI for GLN 61" 275 1 275 17 parsed_2kjr 1
70 "PSI for GLN 61" 279 1 279 17 parsed_2kjr 1
71 "PHI for VAL 62" 283 1 283 17 parsed_2kjr 1
72 "PSI for VAL 62" 287 1 287 17 parsed_2kjr 1
73 "PHI for PHE 63" 291 1 291 17 parsed_2kjr 1
74 "PSI for PHE 63" 295 1 295 17 parsed_2kjr 1
75 "PHI for LYS 64" 299 1 299 17 parsed_2kjr 1
76 "PSI for LYS 64" 303 1 303 17 parsed_2kjr 1
77 "PHI for GLY 65" 307 1 307 17 parsed_2kjr 1
78 "PSI for GLY 65" 311 1 311 17 parsed_2kjr 1
79
;
PHI for ASP 66
assign (resid 65 and name C ) (resid 66 and name N )
(resid 66 and name CA ) (resid 66 and name C ) 1.0 -97.56 30 2
PSI for ASP 66
assign (resid 66 and name N ) (resid 66 and name CA )
(resid 66 and name C ) (resid 67 and name N ) 1.0 5.44 30 2
PHI for THR 67
;
315 1 323 17 parsed_2kjr 1
80 "PSI for THR 67" 327 1 327 17 parsed_2kjr 1
81 "PHI for CYS 68" 331 1 331 17 parsed_2kjr 1
82 "PSI for CYS 68" 335 1 335 17 parsed_2kjr 1
83 "PHI for VAL 69" 339 1 339 17 parsed_2kjr 1
84 "PSI for VAL 69" 343 1 343 17 parsed_2kjr 1
85 "PHI for ASN 74" 347 1 347 17 parsed_2kjr 1
86 "PSI for ASN 74" 351 1 351 17 parsed_2kjr 1
87 "PHI for ASN 75" 355 1 355 17 parsed_2kjr 1
88 "PSI for ASN 75" 359 1 359 17 parsed_2kjr 1
89 "PHI for ASP 76" 363 1 363 17 parsed_2kjr 1
90 "PSI for ASP 76" 367 1 367 17 parsed_2kjr 1
91 "PHI for ALA 77" 371 1 371 17 parsed_2kjr 1
92 "PSI for ALA 77" 375 1 375 17 parsed_2kjr 1
93 "PHI for GLN 78" 379 1 379 17 parsed_2kjr 1
94 "PSI for GLN 78" 383 1 383 17 parsed_2kjr 1
95 "PHI for LEU 79" 387 1 387 17 parsed_2kjr 1
96 "PSI for LEU 79" 391 1 391 17 parsed_2kjr 1
97 "PHI for GLY 80" 395 1 395 17 parsed_2kjr 1
98 "PSI for GLY 80" 399 1 399 17 parsed_2kjr 1
99 "PHI for LEU 88" 403 1 403 17 parsed_2kjr 1
100 "PSI for LEU 88" 407 1 407 17 parsed_2kjr 1
101 "PHI for ARG 89" 411 1 411 17 parsed_2kjr 1
102 "PSI for ARG 89" 415 1 415 17 parsed_2kjr 1
103 "PHI for LEU 90" 419 1 419 17 parsed_2kjr 1
104 "PSI for LEU 90" 423 1 423 17 parsed_2kjr 1
105 "PHI for HIS 91" 427 1 427 17 parsed_2kjr 1
106 "PSI for HIS 91" 431 1 431 17 parsed_2kjr 1
107 "PHI for VAL 92" 435 1 435 17 parsed_2kjr 1
108 "PSI for VAL 92" 439 1 439 17 parsed_2kjr 1
109 "PHI for VAL 93" 443 1 443 17 parsed_2kjr 1
110 "PSI for VAL 93" 447 1 447 17 parsed_2kjr 1
111 "PHI for ASP 94" 451 1 451 17 parsed_2kjr 1
112 "PSI for ASP 94" 455 1 455 17 parsed_2kjr 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 5:36:59 PM GMT (wattos1)