NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
540486 |
2leo   |
17719 | cing | 2-parsed | STAR | dihedral angle | 94 |
data_2leo_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2leo
_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_2leo 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2leo
_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 2leo "Master copy" parsed_2leo
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2leo
_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 2leo.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 2 distance NOE simple 824 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 3 distance NOE ambi 86 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 4 distance NOE simple 1288 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 5 distance NOE ambi 146 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 6 distance NOE simple 82 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 7 distance NOE ambi 8 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 8 distance "hydrogen bond" simple 26 parsed_2leo 1
1 2leo.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 94 parsed_2leo 1
1 2leo.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2leo 1
stop_
save_
save_CNS/XPLOR_dihedral_9
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2leo
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.54 -59.92 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2leo 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.06 -41.20 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2leo 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.14 -37.22 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2leo 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.61 -64.03 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2leo 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.34 -39.40 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2leo 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.44 -51.46 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2leo 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.26 -50.46 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2leo 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.66 -42.54 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2leo 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.10 -49.42 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2leo 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.75 -50.09 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2leo 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.75 -44.03 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2leo 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.11 -49.35 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2leo 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.42 -63.50 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2leo 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.10 -39.20 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2leo 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.64 -61.02 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2leo 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.15 -52.77 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2leo 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.20 -59.62 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2leo 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.03 -41.01 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2leo 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.99 -54.69 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2leo 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.90 -30.54 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2leo 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.62 -88.84 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2leo 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.06 -61.50 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2leo 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.14 -42.84 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2leo 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.58 -79.68 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2leo 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 46.14 74.34 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2leo 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.78 -71.26 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2leo 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.32 -58.78 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2leo 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.60 -36.08 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2leo 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.00 -24.68 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2leo 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.13 -52.55 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2leo 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.38 -57.26 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2leo 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.47 -53.35 . . 65 . C . 66 . N . 66 . CA . 66 . C parsed_2leo 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.20 -59.82 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2leo 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.71 -51.75 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2leo 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.23 -55.57 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2leo 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.10 -55.36 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2leo 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.94 -56.24 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2leo 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.82 -50.82 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2leo 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.45 -65.21 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2leo 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.62 -57.56 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2leo 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.65 -106.29 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2leo 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.71 -58.67 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2leo 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.72 -73.40 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2leo 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -186.66 -133.42 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2leo 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.67 -39.71 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2leo 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.50 157.00 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2leo 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.28 175.64 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2leo 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.99 176.07 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2leo 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.70 148.26 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2leo 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.28 65.30 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2leo 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.70 -22.70 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2leo 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.99 -15.87 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2leo 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.22 13.60 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2leo 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.43 -15.55 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2leo 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.04 43.54 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2leo 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 41.19 174.61 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2leo 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.64 160.00 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2leo 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.04 -10.74 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2leo 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.52 18.94 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2leo 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.90 176.20 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2leo 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.75 153.19 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2leo 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.78 166.90 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2leo 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97.79 183.15 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2leo 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.80 179.54 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2leo 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.19 16.63 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2leo 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.46 155.22 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2leo 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.88 144.72 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2leo 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 71.09 161.99 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2leo 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.11 180.97 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2leo 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.71 179.97 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2leo 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.23 159.43 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2leo 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.65 20.31 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2leo 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.86 33.52 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2leo 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21.39 47.31 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2leo 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.89 152.71 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2leo 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.09 146.23 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2leo 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.53 2.07 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2leo 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.00 -27.04 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2leo 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.27 -18.37 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2leo 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.85 -30.73 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2leo 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.62 -41.24 . . 66 . N . 66 . CA . 66 . C . 67 . N parsed_2leo 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.72 -26.84 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2leo 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.85 -32.01 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2leo 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.07 -34.55 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2leo 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.71 -28.89 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2leo 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.25 -24.83 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2leo 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.60 -3.00 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2leo 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.48 38.46 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2leo 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.75 -11.01 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_2leo 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.40 180.08 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2leo 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.86 149.28 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_2leo 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.74 -15.30 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2leo 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.75 185.53 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_2leo 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.18 167.60 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2leo 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 "1. K 28 Phi -96.73 +/- 36.81 (-133.54 to -59.92)" 1 1 1 51 parsed_2leo 1
2 "2. K 29 Phi -110.63 +/- 69.43 (-180.05 to -41.20)" 6 1 6 52 parsed_2leo 1
3 "3. V 30 Phi -96.18 +/- 58.96 (-155.13 to -37.22)" 11 1 11 51 parsed_2leo 1
4 "4. D 31 Phi -99.32 +/- 35.29 (-134.62 to -64.03)" 16 1 16 51 parsed_2leo 1
5 "5. c 32 Phi -98.37 +/- 58.97 (-157.34 to -39.40)" 21 1 21 51 parsed_2leo 1
6 "6. S 33 Phi -59.95 +/- 8.49 (-68.44 to -51.46)" 26 1 26 49 parsed_2leo 1
7 "7. I 34 Phi -69.36 +/- 18.90 (-88.26 to -50.46)" 31 1 31 50 parsed_2leo 1
8 "8. Y 35 Phi -80.10 +/- 37.56 (-117.66 to -42.53)" 36 1 36 51 parsed_2leo 1
9 "9. K 36 Phi -65.26 +/- 15.84 (-81.10 to -49.42)" 41 1 41 50 parsed_2leo 1
10 "10. K 37 Phi -88.92 +/- 38.83 (-127.75 to -50.10)" 46 1 46 52 parsed_2leo 1
11 "11. Y 38 Phi -101.89 +/- 57.86 (-159.74 to -44.03)" 51 1 51 53 parsed_2leo 1
12
;
12. P 39 Phi -61.81 +/- 13.13 (-74.94 to -48.68)
assign (resid 38 and name C) (resid 39 and name N)
(resid 39 and name CA) (resid 39 and name C) 1.0 -61.81 13.13 2
13. V 40 Phi -62.23 +/- 12.88 (-75.11 to -49.35)
;
56 1 61 51 parsed_2leo 1
13 "14. V 41 Phi -90.96 +/- 27.46 (-118.43 to -63.50)" 66 1 66 52 parsed_2leo 1
14 "15. A 42 Phi -81.65 +/- 42.45 (-124.10 to -39.20)" 71 1 71 52 parsed_2leo 1
15 "16. I 43 Phi -92.83 +/- 31.81 (-124.65 to -61.02)" 76 1 76 52 parsed_2leo 1
16
;
17. P 44 Phi -72.42 +/- 13.48 (-85.90 to -58.94)
assign (resid 43 and name C) (resid 44 and name N)
(resid 44 and name CA) (resid 44 and name C) 1.0 -72.42 13.48 2
18. c 45 Phi -90.46 +/- 37.69 (-128.15 to -52.77)
;
81 1 86 52 parsed_2leo 1
17
;
19. P 46 Phi -69.24 +/- 21.99 (-91.23 to -47.25)
assign (resid 45 and name C) (resid 46 and name N)
(resid 46 and name CA) (resid 46 and name C) 1.0 -69.24 21.99 2
20. I 47 Phi -97.41 +/- 37.79 (-135.20 to -59.61)
;
91 1 96 52 parsed_2leo 1
18 "21. T 48 Phi -87.02 +/- 46.01 (-133.04 to -41.01)" 101 1 101 52 parsed_2leo 1
19 "22. Y 49 Phi -94.34 +/- 39.65 (-133.98 to -54.69)" 106 1 106 52 parsed_2leo 1
20 "23. L 50 Phi -95.72 +/- 65.18 (-160.89 to -30.54)" 111 1 111 52 parsed_2leo 1
21
;
24. P 51 Phi -74.81 +/- 35.12 (-109.94 to -39.69)
assign (resid 50 and name C) (resid 51 and name N)
(resid 51 and name CA) (resid 51 and name C) 1.0 -74.81 35.12 2
25. V 52 Phi -124.73 +/- 35.89 (-160.62 to -88.84)
;
116 1 121 53 parsed_2leo 1
22 "26. c 53 Phi -98.78 +/- 37.28 (-136.05 to -61.50)" 126 1 126 52 parsed_2leo 1
23 "27. S 55 Phi -60.99 +/- 18.15 (-79.14 to -42.83)" 131 1 131 51 parsed_2leo 1
24 "28. D 56 Phi -97.63 +/- 17.95 (-115.58 to -79.69)" 136 1 136 52 parsed_2leo 1
25 "29. Y 57 Phi 60.24 +/- 14.10 (46.13 to 74.34)" 141 1 141 48 parsed_2leo 1
26 "30. I 58 Phi -103.02 +/- 31.76 (-134.78 to -71.27)" 146 1 146 53 parsed_2leo 1
27 "31. T 59 Phi -74.55 +/- 15.77 (-90.32 to -58.78)" 151 1 151 51 parsed_2leo 1
28 "32. G 61 Phi -67.34 +/- 31.26 (-98.61 to -36.08)" 156 1 156 51 parsed_2leo 1
29 "33. E 63 Phi -68.84 +/- 44.16 (-112.99 to -24.68)" 161 1 161 52 parsed_2leo 1
30 "34. c 64 Phi -64.34 +/- 11.79 (-76.12 to -52.55)" 166 1 166 51 parsed_2leo 1
31 "35. H 65 Phi -65.32 +/- 8.06 (-73.38 to -57.26)" 171 1 171 50 parsed_2leo 1
32 "36. L 66 Phi -61.41 +/- 8.06 (-69.47 to -53.35)" 176 1 176 50 parsed_2leo 1
33 "37. c 67 Phi -66.01 +/- 6.19 (-72.20 to -59.81)" 181 1 181 50 parsed_2leo 1
34 "38. T 68 Phi -62.73 +/- 10.98 (-73.71 to -51.75)" 186 1 186 51 parsed_2leo 1
35 "39. E 69 Phi -63.40 +/- 7.83 (-71.22 to -55.57)" 191 1 191 50 parsed_2leo 1
36 "40. S 70 Phi -66.23 +/- 10.87 (-77.10 to -55.37)" 196 1 196 51 parsed_2leo 1
37 "41. L 71 Phi -65.09 +/- 8.85 (-73.94 to -56.24)" 201 1 201 50 parsed_2leo 1
38 "42. K 72 Phi -66.32 +/- 15.50 (-81.82 to -50.82)" 206 1 206 51 parsed_2leo 1
39 "43. S 73 Phi -98.33 +/- 33.12 (-131.45 to -65.22)" 211 1 211 52 parsed_2leo 1
40 "44. R 76 Phi -84.09 +/- 26.53 (-110.62 to -57.56)" 216 1 216 52 parsed_2leo 1
41 "45. Q 78 Phi -121.47 +/- 15.18 (-136.65 to -106.29)" 221 1 221 54 parsed_2leo 1
42 "46. F 79 Phi -79.19 +/- 20.52 (-99.71 to -58.67)" 226 1 226 51 parsed_2leo 1
43 "47. L 80 Phi -95.06 +/- 21.66 (-116.72 to -73.40)" 231 1 231 52 parsed_2leo 1
44 "48. H 81 Phi -160.04 +/- 26.62 (-186.66 to -133.42)" 236 1 236 54 parsed_2leo 1
45 "49. D 82 Phi -75.19 +/- 35.48 (-110.67 to -39.71)" 241 1 241 52 parsed_2leo 1
46 "50. K 28 Psi 126.75 +/- 30.25 (96.50 to 157.00)" 247 1 247 50 parsed_2leo 1
47 "51. K 29 Psi 144.96 +/- 30.68 (114.28 to 175.63)" 252 1 252 51 parsed_2leo 1
48 "52. V 30 Psi 135.03 +/- 41.04 (93.99 to 176.07)" 257 1 257 50 parsed_2leo 1
49 "53. D 31 Psi 121.48 +/- 26.78 (94.70 to 148.26)" 262 1 262 50 parsed_2leo 1
50 "54. c 32 Psi 2.01 +/- 63.29 (-61.28 to 65.31)" 267 1 267 48 parsed_2leo 1
51 "55. S 33 Psi -39.20 +/- 16.50 (-55.70 to -22.71)" 272 1 272 51 parsed_2leo 1
52 "56. I 34 Psi -32.93 +/- 17.06 (-49.99 to -15.88)" 277 1 277 51 parsed_2leo 1
53 "57. Y 35 Psi -25.31 +/- 38.91 (-64.22 to 13.60)" 282 1 282 50 parsed_2leo 1
54 "58. K 36 Psi -32.49 +/- 16.94 (-49.44 to -15.55)" 287 1 287 51 parsed_2leo 1
55 "59. K 37 Psi -7.25 +/- 50.79 (-58.04 to 43.54)" 292 1 292 49 parsed_2leo 1
56 "60. Y 38 Psi 107.90 +/- 66.71 (41.19 to 174.60)" 297 1 297 50 parsed_2leo 1
57 "61. P 39 Psi 143.32 +/- 16.68 (126.64 to 160.00)" 302 1 302 51 parsed_2leo 1
58 "62. V 40 Psi -25.89 +/- 15.15 (-41.04 to -10.75)" 307 1 307 51 parsed_2leo 1
59 "63. V 41 Psi -2.79 +/- 21.73 (-24.52 to 18.95)" 312 1 312 49 parsed_2leo 1
60 "64. A 42 Psi 135.55 +/- 40.65 (94.89 to 176.20)" 317 1 317 50 parsed_2leo 1
61 "65. I 43 Psi 125.97 +/- 27.22 (98.75 to 153.19)" 322 1 322 50 parsed_2leo 1
62 "66. P 44 Psi 151.34 +/- 15.56 (135.78 to 166.90)" 327 1 327 51 parsed_2leo 1
63 "67. c 45 Psi 140.47 +/- 42.68 (97.79 to 183.15)" 332 1 332 50 parsed_2leo 1
64 "68. P 46 Psi 155.67 +/- 23.87 (131.81 to 179.54)" 337 1 337 51 parsed_2leo 1
65 "69. I 47 Psi -22.78 +/- 39.41 (-62.19 to 16.63)" 342 1 342 50 parsed_2leo 1
66 "70. T 48 Psi 135.34 +/- 19.88 (115.46 to 155.23)" 347 1 347 51 parsed_2leo 1
67 "71. Y 49 Psi 121.80 +/- 22.92 (98.87 to 144.72)" 352 1 352 50 parsed_2leo 1
68 "72. L 50 Psi 116.54 +/- 45.45 (71.09 to 161.99)" 357 1 357 50 parsed_2leo 1
69 "73. P 51 Psi 150.04 +/- 30.93 (119.11 to 180.96)" 362 1 362 51 parsed_2leo 1
70 "74. V 52 Psi 156.84 +/- 23.13 (133.71 to 179.97)" 367 1 367 51 parsed_2leo 1
71 "75. c 53 Psi 122.33 +/- 37.10 (85.22 to 159.43)" 372 1 372 50 parsed_2leo 1
72 "76. S 55 Psi -21.17 +/- 41.48 (-62.65 to 20.31)" 377 1 377 50 parsed_2leo 1
73 "77. D 56 Psi 14.33 +/- 19.19 (-4.86 to 33.53)" 382 1 382 48 parsed_2leo 1
74 "78. Y 57 Psi 34.35 +/- 12.96 (21.39 to 47.31)" 387 1 387 48 parsed_2leo 1
75 "79. I 58 Psi 128.30 +/- 24.41 (103.89 to 152.70)" 392 1 392 51 parsed_2leo 1
76 "80. T 59 Psi 127.16 +/- 19.07 (108.09 to 146.23)" 397 1 397 51 parsed_2leo 1
77 "81. G 61 Psi -27.23 +/- 29.30 (-56.53 to 2.08)" 402 1 402 49 parsed_2leo 1
78 "82. E 63 Psi -40.52 +/- 13.48 (-54.00 to -27.04)" 407 1 407 51 parsed_2leo 1
79 "83. c 64 Psi -38.82 +/- 20.45 (-59.27 to -18.37)" 412 1 412 51 parsed_2leo 1
80 "84. H 65 Psi -39.79 +/- 9.06 (-48.84 to -30.73)" 417 1 417 50 parsed_2leo 1
81 "85. L 66 Psi -44.93 +/- 3.69 (-48.63 to -41.24)" 422 1 422 50 parsed_2leo 1
82 "86. c 67 Psi -37.28 +/- 10.44 (-47.72 to -26.84)" 427 1 427 51 parsed_2leo 1
83 "87. T 68 Psi -42.93 +/- 10.92 (-53.85 to -32.02)" 432 1 432 51 parsed_2leo 1
84 "88. E 69 Psi -41.31 +/- 6.76 (-48.07 to -34.54)" 437 1 437 50 parsed_2leo 1
85 "89. S 70 Psi -43.80 +/- 14.91 (-58.71 to -28.90)" 442 1 442 51 parsed_2leo 1
86 "90. L 71 Psi -39.04 +/- 14.21 (-53.26 to -24.83)" 447 1 447 51 parsed_2leo 1
87 "91. K 72 Psi -35.30 +/- 32.30 (-67.59 to -3.00)" 452 1 452 50 parsed_2leo 1
88 "92. S 73 Psi -6.01 +/- 44.47 (-50.48 to 38.46)" 457 1 457 49 parsed_2leo 1
89 "93. R 76 Psi -36.38 +/- 25.37 (-61.75 to -11.00)" 462 1 462 51 parsed_2leo 1
90 "94. Q 78 Psi 148.74 +/- 31.34 (117.40 to 180.07)" 467 1 467 51 parsed_2leo 1
91 "95. F 79 Psi 127.57 +/- 21.71 (105.85 to 149.28)" 472 1 472 51 parsed_2leo 1
92 "96. L 80 Psi -40.52 +/- 25.22 (-65.74 to -15.30)" 477 1 477 51 parsed_2leo 1
93 "97. H 81 Psi 156.14 +/- 29.39 (126.76 to 185.53)" 482 1 482 51 parsed_2leo 1
94 "98. D 82 Psi 139.89 +/- 27.71 (112.18 to 167.59)" 487 1 487 51 parsed_2leo 1
stop_
save_
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