Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
51621 | 2k8s RC | 15347 | cing | 2-parsed | STAR | dihedral angle | 144 |
data_2k8s_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k8s
_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_2k8s 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k8s
_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 2k8s "Master copy" parsed_2k8s
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k8s
_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 2k8s.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k8s 1
1 2k8s.mr . . XPLOR/CNS 2 distance NOE simple 860 parsed_2k8s 1
1 2k8s.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 130 parsed_2k8s 1
1 2k8s.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 144 parsed_2k8s 1
1 2k8s.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k8s 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k8s
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.29 -95.29 . A 5 . C A 6 . N A 6 . CA A 6 . C parsed_2k8s 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.98 171.98 . A 6 . N A 6 . CA A 6 . C A 7 . N parsed_2k8s 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.5 -82.5 . A 6 . C A 7 . N A 7 . CA A 7 . C parsed_2k8s 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.52 173.52 . A 7 . N A 7 . CA A 7 . C A 8 . N parsed_2k8s 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.72 -79.72 . A 7 . C A 8 . N A 8 . CA A 8 . C parsed_2k8s 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.46 176.46 . A 8 . N A 8 . CA A 8 . C A 9 . N parsed_2k8s 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.62 -119.62 . A 8 . C A 9 . N A 9 . CA A 9 . C parsed_2k8s 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.72 190.72 . A 9 . N A 9 . CA A 9 . C A 10 . N parsed_2k8s 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96 -36 . A 13 . C A 14 . N A 14 . CA A 14 . C parsed_2k8s 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.16 -2.16 . A 14 . N A 14 . CA A 14 . C A 15 . N parsed_2k8s 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.55 -33.55 . A 14 . C A 15 . N A 15 . CA A 15 . C parsed_2k8s 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.25 -3.25 . A 15 . N A 15 . CA A 15 . C A 16 . N parsed_2k8s 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.39 -32.39 . A 15 . C A 16 . N A 16 . CA A 16 . C parsed_2k8s 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.9 -2.9 . A 16 . N A 16 . CA A 16 . C A 17 . N parsed_2k8s 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.73 -33.73 . A 16 . C A 17 . N A 17 . CA A 17 . C parsed_2k8s 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.46 -0.46 . A 17 . N A 17 . CA A 17 . C A 18 . N parsed_2k8s 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.57 -34.57 . A 17 . C A 18 . N A 18 . CA A 18 . C parsed_2k8s 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.96 0.04 . A 18 . N A 18 . CA A 18 . C A 19 . N parsed_2k8s 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.34 -30.34 . A 18 . C A 19 . N A 19 . CA A 19 . C parsed_2k8s 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.38 -4.38 . A 19 . N A 19 . CA A 19 . C A 20 . N parsed_2k8s 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.98 -38.98 . A 19 . C A 20 . N A 20 . CA A 20 . C parsed_2k8s 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.35 8.65 . A 20 . N A 20 . CA A 20 . C A 21 . N parsed_2k8s 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.74 -39.74 . A 21 . C A 22 . N A 22 . CA A 22 . C parsed_2k8s 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.19 5.81 . A 22 . N A 22 . CA A 22 . C A 23 . N parsed_2k8s 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.7 -80.7 . A 32 . C A 33 . N A 33 . CA A 33 . C parsed_2k8s 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.89 169.89 . A 33 . N A 33 . CA A 33 . C A 34 . N parsed_2k8s 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.37 -88.37 . A 33 . C A 34 . N A 34 . CA A 34 . C parsed_2k8s 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.88 164.88 . A 34 . N A 34 . CA A 34 . C A 35 . N parsed_2k8s 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.12 -67.12 . A 34 . C A 35 . N A 35 . CA A 35 . C parsed_2k8s 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.81 167.81 . A 35 . N A 35 . CA A 35 . C A 36 . N parsed_2k8s 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.03 -92.03 . A 35 . C A 36 . N A 36 . CA A 36 . C parsed_2k8s 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.6 165.6 . A 36 . N A 36 . CA A 36 . C A 37 . N parsed_2k8s 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.28 -29.28 . A 41 . C A 42 . N A 42 . CA A 42 . C parsed_2k8s 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.4 7.6 . A 42 . N A 42 . CA A 42 . C A 43 . N parsed_2k8s 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.57 -34.57 . A 42 . C A 43 . N A 43 . CA A 43 . C parsed_2k8s 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.68 6.32 . A 43 . N A 43 . CA A 43 . C A 44 . N parsed_2k8s 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.15 -49.15 . A 43 . C A 44 . N A 44 . CA A 44 . C parsed_2k8s 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.41 17.59 . A 44 . N A 44 . CA A 44 . C A 45 . N parsed_2k8s 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.51 -28.51 . A 44 . C A 45 . N A 45 . CA A 45 . C parsed_2k8s 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.25 -7.25 . A 45 . N A 45 . CA A 45 . C A 46 . N parsed_2k8s 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.29 -32.29 . A 45 . C A 46 . N A 46 . CA A 46 . C parsed_2k8s 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.18 1.82 . A 46 . N A 46 . CA A 46 . C A 47 . N parsed_2k8s 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.79 -34.79 . A 46 . C A 47 . N A 47 . CA A 47 . C parsed_2k8s 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.09 -4.09 . A 47 . N A 47 . CA A 47 . C A 48 . N parsed_2k8s 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.98 -33.98 . A 47 . C A 48 . N A 48 . CA A 48 . C parsed_2k8s 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.74 -0.74 . A 48 . N A 48 . CA A 48 . C A 49 . N parsed_2k8s 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.6 -33.6 . A 48 . C A 49 . N A 49 . CA A 49 . C parsed_2k8s 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.5 -0.5 . A 49 . N A 49 . CA A 49 . C A 50 . N parsed_2k8s 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.91 -35.91 . A 49 . C A 50 . N A 50 . CA A 50 . C parsed_2k8s 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.28 14.72 . A 50 . N A 50 . CA A 50 . C A 51 . N parsed_2k8s 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.82 -102.82 . A 57 . C A 58 . N A 58 . CA A 58 . C parsed_2k8s 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.26 180.26 . A 58 . N A 58 . CA A 58 . C A 59 . N parsed_2k8s 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.87 -96.87 . A 58 . C A 59 . N A 59 . CA A 59 . C parsed_2k8s 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.52 167.52 . A 59 . N A 59 . CA A 59 . C A 60 . N parsed_2k8s 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.56 -78.56 . A 59 . C A 60 . N A 60 . CA A 60 . C parsed_2k8s 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 88.9 168.9 . A 60 . N A 60 . CA A 60 . C A 61 . N parsed_2k8s 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.54 -90.54 . A 60 . C A 61 . N A 61 . CA A 61 . C parsed_2k8s 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 82.78 162.78 . A 61 . N A 61 . CA A 61 . C A 62 . N parsed_2k8s 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.99 -83.99 . A 63 . C A 64 . N A 64 . CA A 64 . C parsed_2k8s 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.78 191.78 . A 64 . N A 64 . CA A 64 . C A 65 . N parsed_2k8s 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.06 -77.06 . A 64 . C A 65 . N A 65 . CA A 65 . C parsed_2k8s 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.57 169.57 . A 65 . N A 65 . CA A 65 . C A 66 . N parsed_2k8s 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.56 -69.56 . A 65 . C A 66 . N A 66 . CA A 66 . C parsed_2k8s 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.09 164.09 . A 66 . N A 66 . CA A 66 . C A 67 . N parsed_2k8s 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.36 -79.36 . A 71 . C A 72 . N A 72 . CA A 72 . C parsed_2k8s 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.27 187.27 . A 72 . N A 72 . CA A 72 . C A 73 . N parsed_2k8s 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.94 -32.94 . A 73 . C A 74 . N A 74 . CA A 74 . C parsed_2k8s 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.22 12.78 . A 74 . N A 74 . CA A 74 . C A 75 . N parsed_2k8s 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.24 -32.24 . A 74 . C A 75 . N A 75 . CA A 75 . C parsed_2k8s 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.71 2.29 . A 75 . N A 75 . CA A 75 . C A 76 . N parsed_2k8s 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.19 -35.19 . A 75 . C A 76 . N A 76 . CA A 76 . C parsed_2k8s 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.96 7.04 . A 76 . N A 76 . CA A 76 . C A 77 . N parsed_2k8s 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.29 -95.29 . B 5 . C B 6 . N B 6 . CA B 6 . C parsed_2k8s 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.98 171.98 . B 6 . N B 6 . CA B 6 . C B 7 . N parsed_2k8s 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.5 -82.5 . B 6 . C B 7 . N B 7 . CA B 7 . C parsed_2k8s 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.52 173.52 . B 7 . N B 7 . CA B 7 . C B 8 . N parsed_2k8s 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.72 -79.72 . B 7 . C B 8 . N B 8 . CA B 8 . C parsed_2k8s 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.46 176.46 . B 8 . N B 8 . CA B 8 . C B 9 . N parsed_2k8s 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.62 -119.62 . B 8 . C B 9 . N B 9 . CA B 9 . C parsed_2k8s 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.72 190.72 . B 9 . N B 9 . CA B 9 . C B 10 . N parsed_2k8s 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96 -36 . B 13 . C B 14 . N B 14 . CA B 14 . C parsed_2k8s 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.16 -2.16 . B 14 . N B 14 . CA B 14 . C B 15 . N parsed_2k8s 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.55 -33.55 . B 14 . C B 15 . N B 15 . CA B 15 . C parsed_2k8s 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.25 -3.25 . B 15 . N B 15 . CA B 15 . C B 16 . N parsed_2k8s 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.39 -32.39 . B 15 . C B 16 . N B 16 . CA B 16 . C parsed_2k8s 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.9 -2.9 . B 16 . N B 16 . CA B 16 . C B 17 . N parsed_2k8s 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.73 -33.73 . B 16 . C B 17 . N B 17 . CA B 17 . C parsed_2k8s 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.46 -0.46 . B 17 . N B 17 . CA B 17 . C B 18 . N parsed_2k8s 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.57 -34.57 . B 17 . C B 18 . N B 18 . CA B 18 . C parsed_2k8s 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.96 0.04 . B 18 . N B 18 . CA B 18 . C B 19 . N parsed_2k8s 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.34 -30.34 . B 18 . C B 19 . N B 19 . CA B 19 . C parsed_2k8s 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.38 -4.38 . B 19 . N B 19 . CA B 19 . C B 20 . N parsed_2k8s 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.98 -38.98 . B 19 . C B 20 . N B 20 . CA B 20 . C parsed_2k8s 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.35 8.65 . B 20 . N B 20 . CA B 20 . C B 21 . N parsed_2k8s 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.74 -39.74 . B 21 . C B 22 . N B 22 . CA B 22 . C parsed_2k8s 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.19 5.81 . B 22 . N B 22 . CA B 22 . C B 23 . N parsed_2k8s 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.7 -80.7 . B 32 . C B 33 . N B 33 . CA B 33 . C parsed_2k8s 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.89 169.89 . B 33 . N B 33 . CA B 33 . C B 34 . N parsed_2k8s 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.37 -88.37 . B 33 . C B 34 . N B 34 . CA B 34 . C parsed_2k8s 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.88 164.88 . B 34 . N B 34 . CA B 34 . C B 35 . N parsed_2k8s 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.12 -67.12 . B 34 . C B 35 . N B 35 . CA B 35 . C parsed_2k8s 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.81 167.81 . B 35 . N B 35 . CA B 35 . C B 36 . N parsed_2k8s 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.03 -92.03 . B 35 . C B 36 . N B 36 . CA B 36 . C parsed_2k8s 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.6 165.6 . B 36 . N B 36 . CA B 36 . C B 37 . N parsed_2k8s 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.28 -29.28 . B 41 . C B 42 . N B 42 . CA B 42 . C parsed_2k8s 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.4 7.6 . B 42 . N B 42 . CA B 42 . C B 43 . N parsed_2k8s 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.57 -34.57 . B 42 . C B 43 . N B 43 . CA B 43 . C parsed_2k8s 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.68 6.32 . B 43 . N B 43 . CA B 43 . C B 44 . N parsed_2k8s 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.15 -49.15 . B 43 . C B 44 . N B 44 . CA B 44 . C parsed_2k8s 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.41 17.59 . B 44 . N B 44 . CA B 44 . C B 45 . N parsed_2k8s 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.51 -28.51 . B 44 . C B 45 . N B 45 . CA B 45 . C parsed_2k8s 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.25 -7.25 . B 45 . N B 45 . CA B 45 . C B 46 . N parsed_2k8s 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.29 -32.29 . B 45 . C B 46 . N B 46 . CA B 46 . C parsed_2k8s 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.18 1.82 . B 46 . N B 46 . CA B 46 . C B 47 . N parsed_2k8s 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.79 -34.79 . B 46 . C B 47 . N B 47 . CA B 47 . C parsed_2k8s 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.09 -4.09 . B 47 . N B 47 . CA B 47 . C B 48 . N parsed_2k8s 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.98 -33.98 . B 47 . C B 48 . N B 48 . CA B 48 . C parsed_2k8s 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.74 -0.74 . B 48 . N B 48 . CA B 48 . C B 49 . N parsed_2k8s 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.6 -33.6 . B 48 . C B 49 . N B 49 . CA B 49 . C parsed_2k8s 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.5 -0.5 . B 49 . N B 49 . CA B 49 . C B 50 . N parsed_2k8s 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.91 -35.91 . B 49 . C B 50 . N B 50 . CA B 50 . C parsed_2k8s 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.28 14.72 . B 50 . N B 50 . CA B 50 . C B 51 . N parsed_2k8s 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.82 -102.82 . B 57 . C B 58 . N B 58 . CA B 58 . C parsed_2k8s 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.26 180.26 . B 58 . N B 58 . CA B 58 . C B 59 . N parsed_2k8s 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.87 -96.87 . B 58 . C B 59 . N B 59 . CA B 59 . C parsed_2k8s 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.52 167.52 . B 59 . N B 59 . CA B 59 . C B 60 . N parsed_2k8s 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.56 -78.56 . B 59 . C B 60 . N B 60 . CA B 60 . C parsed_2k8s 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 88.9 168.9 . B 60 . N B 60 . CA B 60 . C B 61 . N parsed_2k8s 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.54 -90.54 . B 60 . C B 61 . N B 61 . CA B 61 . C parsed_2k8s 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 82.78 162.78 . B 61 . N B 61 . CA B 61 . C B 62 . N parsed_2k8s 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.99 -83.99 . B 63 . C B 64 . N B 64 . CA B 64 . C parsed_2k8s 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.78 191.78 . B 64 . N B 64 . CA B 64 . C B 65 . N parsed_2k8s 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.06 -77.06 . B 64 . C B 65 . N B 65 . CA B 65 . C parsed_2k8s 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.57 169.57 . B 65 . N B 65 . CA B 65 . C B 66 . N parsed_2k8s 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.56 -69.56 . B 65 . C B 66 . N B 66 . CA B 66 . C parsed_2k8s 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.09 164.09 . B 66 . N B 66 . CA B 66 . C B 67 . N parsed_2k8s 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.36 -79.36 . B 71 . C B 72 . N B 72 . CA B 72 . C parsed_2k8s 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.27 187.27 . B 72 . N B 72 . CA B 72 . C B 73 . N parsed_2k8s 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.94 -32.94 . B 73 . C B 74 . N B 74 . CA B 74 . C parsed_2k8s 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.22 12.78 . B 74 . N B 74 . CA B 74 . C B 75 . N parsed_2k8s 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.24 -32.24 . B 74 . C B 75 . N B 75 . CA B 75 . C parsed_2k8s 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.71 2.29 . B 75 . N B 75 . CA B 75 . C B 76 . N parsed_2k8s 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.19 -35.19 . B 75 . C B 76 . N B 76 . CA B 76 . C parsed_2k8s 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.96 7.04 . B 76 . N B 76 . CA B 76 . C B 77 . N parsed_2k8s 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 RESTRAINTS" 1 1 1 28 parsed_2k8s 1
2 "PHI for ILE 6" 3 1 3 16 parsed_2k8s 1
3 "PSI for ILE 6" 7 1 7 16 parsed_2k8s 1
4 "PHI for PHE 7" 11 1 11 16 parsed_2k8s 1
5 "PSI for PHE 7" 15 1 15 16 parsed_2k8s 1
6 "PHI for TYR 8" 19 1 19 16 parsed_2k8s 1
7 "PSI for TYR 8" 23 1 23 16 parsed_2k8s 1
8 "PHI for HIS 9" 27 1 27 16 parsed_2k8s 1
9 "PSI for HIS 9" 31 1 31 16 parsed_2k8s 1
10 "PHI for VAL 14" 35 1 35 17 parsed_2k8s 1
11 "PSI for VAL 14" 39 1 39 17 parsed_2k8s 1
12 "PHI for CYS 15" 43 1 43 17 parsed_2k8s 1
13 "PSI for CYS 15" 47 1 47 17 parsed_2k8s 1
14 "PHI for VAL 16" 51 1 51 17 parsed_2k8s 1
15 "PSI for VAL 16" 55 1 55 17 parsed_2k8s 1
16 "PHI for SER 17" 59 1 59 17 parsed_2k8s 1
17 "PSI for SER 17" 63 1 63 17 parsed_2k8s 1
18 "PHI for ALA 18" 67 1 67 17 parsed_2k8s 1
19 "PSI for ALA 18" 71 1 71 17 parsed_2k8s 1
20 "PHI for GLU 19" 75 1 75 17 parsed_2k8s 1
21 "PSI for GLU 19" 79 1 79 17 parsed_2k8s 1
22 "PHI for GLN 20" 83 1 83 17 parsed_2k8s 1
23 "PSI for GLN 20" 87 1 87 17 parsed_2k8s 1
24 "PHI for VAL 22" 91 1 91 17 parsed_2k8s 1
25 "PSI for VAL 22" 95 1 95 17 parsed_2k8s 1
26 "PHI for VAL 33" 99 1 99 17 parsed_2k8s 1
27 "PSI for VAL 33" 103 1 103 17 parsed_2k8s 1
28 "PHI for GLU 34" 107 1 107 17 parsed_2k8s 1
29 "PSI for GLU 34" 111 1 111 17 parsed_2k8s 1
30 "PHI for ILE 35" 115 1 115 17 parsed_2k8s 1
31 "PSI for ILE 35" 119 1 119 17 parsed_2k8s 1
32 "PHI for VAL 36" 123 1 123 17 parsed_2k8s 1
33 "PSI for VAL 36" 127 1 127 17 parsed_2k8s 1
34 "PHI for LYS 42" 131 1 131 17 parsed_2k8s 1
35 "PSI for LYS 42" 135 1 135 17 parsed_2k8s 1
36 "PHI for ALA 43" 139 1 139 17 parsed_2k8s 1
37 "PSI for ALA 43" 143 1 143 17 parsed_2k8s 1
38 "PHI for ARG 44" 147 1 147 17 parsed_2k8s 1
39 "PSI for ARG 44" 151 1 151 17 parsed_2k8s 1
40 "PHI for ILE 45" 155 1 155 17 parsed_2k8s 1
41 "PSI for ILE 45" 159 1 159 17 parsed_2k8s 1
42 "PHI for ALA 46" 163 1 163 17 parsed_2k8s 1
43 "PSI for ALA 46" 167 1 167 17 parsed_2k8s 1
44 "PHI for GLU 47" 171 1 171 17 parsed_2k8s 1
45 "PSI for GLU 47" 175 1 175 17 parsed_2k8s 1
46 "PHI for ALA 48" 179 1 179 17 parsed_2k8s 1
47 "PSI for ALA 48" 183 1 183 17 parsed_2k8s 1
48 "PHI for GLU 49" 187 1 187 17 parsed_2k8s 1
49 "PSI for GLU 49" 191 1 191 17 parsed_2k8s 1
50 "PHI for LYS 50" 195 1 195 17 parsed_2k8s 1
51 "PSI for LYS 50" 199 1 199 17 parsed_2k8s 1
52 "PHI for ALA 58" 203 1 203 17 parsed_2k8s 1
53 "PSI for ALA 58" 207 1 207 17 parsed_2k8s 1
54 "PHI for LEU 59" 211 1 211 17 parsed_2k8s 1
55 "PSI for LEU 59" 215 1 215 17 parsed_2k8s 1
56 "PHI for VAL 60" 219 1 219 17 parsed_2k8s 1
57 "PSI for VAL 60" 223 1 223 17 parsed_2k8s 1
58 "PHI for ILE 61" 227 1 227 17 parsed_2k8s 1
59 "PSI for ILE 61" 231 1 231 17 parsed_2k8s 1
60 "PHI for ALA 64" 235 1 235 17 parsed_2k8s 1
61 "PSI for ALA 64" 239 1 239 17 parsed_2k8s 1
62 "PHI for ALA 65" 243 1 243 17 parsed_2k8s 1
63 "PSI for ALA 65" 247 1 247 17 parsed_2k8s 1
64 "PHI for PHE 66" 251 1 251 17 parsed_2k8s 1
65 "PSI for PHE 66" 255 1 255 17 parsed_2k8s 1
66 "PHI for ALA 72" 259 1 259 17 parsed_2k8s 1
67 "PSI for ALA 72" 263 1 263 17 parsed_2k8s 1
68 "PHI for ILE 74" 267 1 267 17 parsed_2k8s 1
69 "PSI for ILE 74" 271 1 271 17 parsed_2k8s 1
70 "PHI for ASP 75" 275 1 275 17 parsed_2k8s 1
71 "PSI for ASP 75" 279 1 279 17 parsed_2k8s 1
72 "PHI for ASP 76" 283 1 283 17 parsed_2k8s 1
73 "PSI for ASP 76" 287 1 287 17 parsed_2k8s 1
74 "PHI for ILE 6" 291 1 291 16 parsed_2k8s 1
75 "PSI for ILE 6" 295 1 295 16 parsed_2k8s 1
76 "PHI for PHE 7" 299 1 299 16 parsed_2k8s 1
77 "PSI for PHE 7" 303 1 303 16 parsed_2k8s 1
78 "PHI for TYR 8" 307 1 307 16 parsed_2k8s 1
79 "PSI for TYR 8" 311 1 311 16 parsed_2k8s 1
80 "PHI for HIS 9" 315 1 315 16 parsed_2k8s 1
81 "PSI for HIS 9" 319 1 319 16 parsed_2k8s 1
82 "PHI for VAL 14" 323 1 323 17 parsed_2k8s 1
83 "PSI for VAL 14" 327 1 327 17 parsed_2k8s 1
84 "PHI for CYS 15" 331 1 331 17 parsed_2k8s 1
85 "PSI for CYS 15" 335 1 335 17 parsed_2k8s 1
86 "PHI for VAL 16" 339 1 339 17 parsed_2k8s 1
87 "PSI for VAL 16" 343 1 343 17 parsed_2k8s 1
88 "PHI for SER 17" 347 1 347 17 parsed_2k8s 1
89 "PSI for SER 17" 351 1 351 17 parsed_2k8s 1
90 "PHI for ALA 18" 355 1 355 17 parsed_2k8s 1
91 "PSI for ALA 18" 359 1 359 17 parsed_2k8s 1
92 "PHI for GLU 19" 363 1 363 17 parsed_2k8s 1
93 "PSI for GLU 19" 367 1 367 17 parsed_2k8s 1
94 "PHI for GLN 20" 371 1 371 17 parsed_2k8s 1
95 "PSI for GLN 20" 375 1 375 17 parsed_2k8s 1
96 "PHI for VAL 22" 379 1 379 17 parsed_2k8s 1
97 "PSI for VAL 22" 383 1 383 17 parsed_2k8s 1
98 "PHI for VAL 33" 387 1 387 17 parsed_2k8s 1
99 "PSI for VAL 33" 391 1 391 17 parsed_2k8s 1
100 "PHI for GLU 34" 395 1 395 17 parsed_2k8s 1
101 "PSI for GLU 34" 399 1 399 17 parsed_2k8s 1
102 "PHI for ILE 35" 403 1 403 17 parsed_2k8s 1
103 "PSI for ILE 35" 407 1 407 17 parsed_2k8s 1
104 "PHI for VAL 36" 411 1 411 17 parsed_2k8s 1
105 "PSI for VAL 36" 415 1 415 17 parsed_2k8s 1
106 "PHI for LYS 42" 419 1 419 17 parsed_2k8s 1
107 "PSI for LYS 42" 423 1 423 17 parsed_2k8s 1
108 "PHI for ALA 43" 427 1 427 17 parsed_2k8s 1
109 "PSI for ALA 43" 431 1 431 17 parsed_2k8s 1
110 "PHI for ARG 44" 435 1 435 17 parsed_2k8s 1
111 "PSI for ARG 44" 439 1 439 17 parsed_2k8s 1
112 "PHI for ILE 45" 443 1 443 17 parsed_2k8s 1
113 "PSI for ILE 45" 447 1 447 17 parsed_2k8s 1
114 "PHI for ALA 46" 451 1 451 17 parsed_2k8s 1
115 "PSI for ALA 46" 455 1 455 17 parsed_2k8s 1
116 "PHI for GLU 47" 459 1 459 17 parsed_2k8s 1
117 "PSI for GLU 47" 463 1 463 17 parsed_2k8s 1
118 "PHI for ALA 48" 467 1 467 17 parsed_2k8s 1
119 "PSI for ALA 48" 471 1 471 17 parsed_2k8s 1
120 "PHI for GLU 49" 475 1 475 17 parsed_2k8s 1
121 "PSI for GLU 49" 479 1 479 17 parsed_2k8s 1
122 "PHI for LYS 50" 483 1 483 17 parsed_2k8s 1
123 "PSI for LYS 50" 487 1 487 17 parsed_2k8s 1
124 "PHI for ALA 58" 491 1 491 17 parsed_2k8s 1
125 "PSI for ALA 58" 495 1 495 17 parsed_2k8s 1
126 "PHI for LEU 59" 499 1 499 17 parsed_2k8s 1
127 "PSI for LEU 59" 503 1 503 17 parsed_2k8s 1
128 "PHI for VAL 60" 507 1 507 17 parsed_2k8s 1
129 "PSI for VAL 60" 511 1 511 17 parsed_2k8s 1
130 "PHI for ILE 61" 515 1 515 17 parsed_2k8s 1
131 "PSI for ILE 61" 519 1 519 17 parsed_2k8s 1
132 "PHI for ALA 64" 523 1 523 17 parsed_2k8s 1
133 "PSI for ALA 64" 527 1 527 17 parsed_2k8s 1
134 "PHI for ALA 65" 531 1 531 17 parsed_2k8s 1
135 "PSI for ALA 65" 535 1 535 17 parsed_2k8s 1
136 "PHI for PHE 66" 539 1 539 17 parsed_2k8s 1
137 "PSI for PHE 66" 543 1 543 17 parsed_2k8s 1
138 "PHI for ALA 72" 547 1 547 17 parsed_2k8s 1
139 "PSI for ALA 72" 551 1 551 17 parsed_2k8s 1
140 "PHI for ILE 74" 555 1 555 17 parsed_2k8s 1
141 "PSI for ILE 74" 559 1 559 17 parsed_2k8s 1
142 "PHI for ASP 75" 563 1 563 17 parsed_2k8s 1
143 "PSI for ASP 75" 567 1 567 17 parsed_2k8s 1
144 "PHI for ASP 76" 571 1 571 17 parsed_2k8s 1
145 "PSI for ASP 76" 575 1 575 17 parsed_2k8s 1
stop_
save_