NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
490770 |
2rqs   |
11080 | cing | 2-parsed | STAR | dihedral angle | 176 |
data_2rqs_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2rqs
_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_2rqs 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2rqs
_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 2rqs "Master copy" parsed_2rqs
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2rqs
_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 2rqs.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2rqs 1
1 2rqs.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 176 parsed_2rqs 1
1 2rqs.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 0 parsed_2rqs 1
1 2rqs.mr . . XPLOR/CNS 4 distance NOE ambi 0 parsed_2rqs 1
1 2rqs.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2rqs 1
stop_
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2rqs
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.89 -30.89 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_2rqs 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.37 183.37 . . 2 . N . 2 . CA . 2 . C . 3 . N parsed_2rqs 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.5 -10.1 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_2rqs 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.5 149.5 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_2rqs 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.52 152.52 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_2rqs 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.37 58.63 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_2rqs 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.3 -62.3 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2rqs 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.4 164.8 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2rqs 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.09 -51.09 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2rqs 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.12 47.88 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2rqs 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.56 -50.56 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2rqs 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.16 14.84 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2rqs 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.4 -85.8 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2rqs 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.2 176.8 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2rqs 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.6 -111.6 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2rqs 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.9 173.1 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2rqs 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.6 -77.2 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2rqs 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 75.315 135.315 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2rqs 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.0 -118.2 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2rqs 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.5 178.7 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2rqs 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.9 -99.1 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2rqs 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 163.2 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2rqs 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.8 -107.0 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2rqs 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132.1 166.9 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2rqs 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.3 -106.1 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2rqs 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.5 154.1 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2rqs 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.5 -99.5 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2rqs 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 167.8 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2rqs 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.4 -65.4 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2rqs 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.5 195.5 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2rqs 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.11 -65.11 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2rqs 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.46 -13.46 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2rqs 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.5 -72.5 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2rqs 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 3.20 77.80 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2rqs 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.80 -47.80 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2rqs 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.88 -26.88 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2rqs 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.9 -68.7 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2rqs 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.0 31.8 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2rqs 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.70 -48.70 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2rqs 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.00 -19.00 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2rqs 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.76 -44.76 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2rqs 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.82 -19.82 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2rqs 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2rqs 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.6 -30.0 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2rqs 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.7 -37.9 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2rqs 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.8 17.4 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2rqs 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.0 -47.0 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2rqs 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.7 -4.5 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2rqs 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.8 -38.4 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2rqs 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -0.7 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2rqs 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.7 -51.7 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2rqs 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.0 -26.4 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2rqs 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -58.6 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2rqs 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.1 -23.7 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2rqs 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.2 -53.0 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2rqs 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.9 -21.3 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2rqs 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.9 -51.9 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2rqs 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.8 -9.8 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2rqs 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.72 -10.72 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2rqs 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 73.40 157.40 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2rqs 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.49 -60.49 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2rqs 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.50 -28.50 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2rqs 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.39 -51.39 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2rqs 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.20 -34.20 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2rqs 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.55 -31.55 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2rqs 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.8 -53.6 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2rqs 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.3 -28.3 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2rqs 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.90 -52.90 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2rqs 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.93 -33.93 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2rqs 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.1 -39.1 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2rqs 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -24.9 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2rqs 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.3 -38.1 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2rqs 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.9 11.3 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2rqs 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.36 -58.36 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2rqs 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -15.74 48.26 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2rqs 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.96 -64.96 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2rqs 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.75 190.75 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2rqs 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.36 -26.36 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2rqs 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.52 58.48 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2rqs 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.55 -46.55 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2rqs 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 49.49 133.49 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2rqs 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -182.6 -64.0 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2rqs 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.6 179.8 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2rqs 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.24 -12.24 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2rqs 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.47 30.53 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2rqs 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.00 -52.00 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2rqs 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.27 21.73 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2rqs 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.44 -50.44 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2rqs 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.34 -21.34 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2rqs 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.48 -68.48 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2rqs 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.49 1.51 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2rqs 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.51 -104.51 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2rqs 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1.66 23.66 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2rqs 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.82 83.82 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2rqs 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7.02 71.02 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2rqs 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.09 -51.09 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2rqs 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.76 38.24 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2rqs 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.01 117.01 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2rqs 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -191.33 -83.33 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2rqs 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.54 -54.54 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2rqs 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.72 175.72 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2rqs 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.57 -92.57 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2rqs 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.19 195.19 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2rqs 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.2 -76.8 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2rqs 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.9 185.5 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2rqs 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.35 -9.35 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2rqs 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.12 184.12 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2rqs 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 46.68 146.68 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2rqs 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.66 36.34 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2rqs 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.76 -51.76 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2rqs 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.53 55.47 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2rqs 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.24 -91.24 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2rqs 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.07 174.07 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2rqs 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.29 -30.29 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2rqs 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.78 176.78 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2rqs 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -56.6 . . 65 . C . 66 . N . 66 . CA . 66 . C parsed_2rqs 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.8 -27.8 . . 66 . N . 66 . CA . 66 . C . 67 . N parsed_2rqs 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.1 -41.9 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2rqs 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.4 -16.4 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2rqs 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.86 -54.86 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2rqs 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.25 -30.25 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2rqs 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.68 -54.68 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2rqs 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.23 -30.23 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2rqs 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.6 -52.4 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2rqs 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 -26.4 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2rqs 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.7 -54.1 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2rqs 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.8 -9.6 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2rqs 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.4 -48.6 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2rqs 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.1 -14.1 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2rqs 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.5 -27.9 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2rqs 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.4 16.2 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2rqs 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.02 -56.02 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2rqs 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.31 24.69 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2rqs 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.38 -43.38 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2rqs 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.06 -59.06 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2rqs 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.90 -26.90 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2rqs 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.01 97.01 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2rqs 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.85 79.15 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2rqs 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.97 -81.97 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2rqs 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.98 175.98 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_2rqs 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.41 -80.41 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2rqs 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.29 164.29 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2rqs 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.7 -106.7 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2rqs 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.7 163.9 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_2rqs 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.96 -50.96 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2rqs 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.26 172.26 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2rqs 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.94 -29.94 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_2rqs 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.62 187.62 . . 83 . N . 83 . CA . 83 . C . 84 . N parsed_2rqs 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.8 -103.0 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_2rqs 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.7 178.1 . . 84 . N . 84 . CA . 84 . C . 85 . N parsed_2rqs 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.7 -91.9 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_2rqs 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.3 153.1 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_2rqs 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173.4 -90.8 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_2rqs 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.2 188.4 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_2rqs 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.33 -26.33 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_2rqs 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.25 29.75 . . 87 . N . 87 . CA . 87 . C . 88 . N parsed_2rqs 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.74 -52.74 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2rqs 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.75 43.25 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_2rqs 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.83 192.83 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_2rqs 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -174.06 -66.06 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_2rqs 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.93 -74.93 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_2rqs 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.35 182.35 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_2rqs 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.96 -73.96 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2rqs 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.71 169.71 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_2rqs 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.1 -6.1 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_2rqs 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.7 153.1 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_2rqs 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.5 -101.9 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_2rqs 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.8 153.8 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_2rqs 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.1 -90.3 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2rqs 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.1 132.1 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2rqs 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.6 -59.0 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_2rqs 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.9 146.5 . . 95 . N . 95 . CA . 95 . C . 96 . N parsed_2rqs 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.4 -95.2 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_2rqs 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.5 157.5 . . 96 . N . 96 . CA . 96 . C . 97 . N parsed_2rqs 1
175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.7 -88.5 . . 96 . C . 97 . N . 97 . CA . 97 . C parsed_2rqs 1
176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.3 179.9 . . 97 . N . 97 . CA . 97 . C . 98 . N parsed_2rqs 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
;
and now old ones after 03... + PREDITOR
P2 phi
;
1 1 3 9 parsed_2rqs 1
2 "P2 psi" 9 1 9 9 parsed_2rqs 1
3 "phi residue 3" 15 1 15 21 parsed_2rqs 1
4 "psi residue 3" 18 1 18 21 parsed_2rqs 1
5 "G4 phi" 21 1 21 10 parsed_2rqs 1
6 "G4 psi" 27 1 27 11 parsed_2rqs 1
7 "phi residue 5" 33 1 33 21 parsed_2rqs 1
8 "psi residue 5" 36 1 36 21 parsed_2rqs 1
9 "A7 phi" 39 1 39 9 parsed_2rqs 1
10 "A7 psi" 45 1 45 9 parsed_2rqs 1
11 "D8 phi" 51 1 51 9 parsed_2rqs 1
12 "D8 psi" 57 1 57 9 parsed_2rqs 1
13 "phi residue 9" 63 1 63 21 parsed_2rqs 1
14 "psi residue 9" 66 1 66 21 parsed_2rqs 1
15 "phi residue 10" 69 1 69 21 parsed_2rqs 1
16 "psi residue 10" 72 1 72 21 parsed_2rqs 1
17 "phi residue 11" 75 1 75 21 parsed_2rqs 1
18 "psi residue 11 ! changed!!!!!!!!!!!!!!!!!!!!!!!" 78 1 78 54 parsed_2rqs 1
19 "phi residue 12" 81 1 81 21 parsed_2rqs 1
20 "psi residue 12" 84 1 84 21 parsed_2rqs 1
21 "phi residue 13" 87 1 87 21 parsed_2rqs 1
22 "psi residue 13" 90 1 90 21 parsed_2rqs 1
23 "phi residue 14" 93 1 93 21 parsed_2rqs 1
24 "psi residue 14" 96 1 96 21 parsed_2rqs 1
25 "phi residue 15" 99 1 99 21 parsed_2rqs 1
26 "psi residue 15" 102 1 102 21 parsed_2rqs 1
27 "phi residue 16" 105 1 105 21 parsed_2rqs 1
28 "psi residue 16" 108 1 108 21 parsed_2rqs 1
29 "phi residue 17" 111 1 111 21 parsed_2rqs 1
30 "psi residue 17" 114 1 114 21 parsed_2rqs 1
31 "K18 phi" 117 1 117 10 parsed_2rqs 1
32 "K18 psi" 123 1 123 10 parsed_2rqs 1
33 "phi residue 19" 129 1 129 21 parsed_2rqs 1
34 "psi residue 19 ! changed !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!" 132 1 132 62 parsed_2rqs 1
35 "Q20 phi" 135 1 135 10 parsed_2rqs 1
36 "Q20 psi" 141 1 141 10 parsed_2rqs 1
37 "phi residue 21" 147 1 147 21 parsed_2rqs 1
38 "psi residue 21" 150 1 150 21 parsed_2rqs 1
39 "E22 phi" 153 1 153 10 parsed_2rqs 1
40 "E22 psi" 159 1 159 10 parsed_2rqs 1
41 "A23 phi" 165 1 165 10 parsed_2rqs 1
42 "A23 psi" 171 1 171 10 parsed_2rqs 1
43 "phi residue 24" 177 1 177 21 parsed_2rqs 1
44 "psi residue 24" 180 1 180 21 parsed_2rqs 1
45 "phi residue 25" 183 1 183 21 parsed_2rqs 1
46 "psi residue 25" 186 1 186 21 parsed_2rqs 1
47 "phi residue 26" 189 1 189 21 parsed_2rqs 1
48 "psi residue 26" 192 1 192 21 parsed_2rqs 1
49 "phi residue 27" 195 1 195 21 parsed_2rqs 1
50 "psi residue 27" 198 1 198 21 parsed_2rqs 1
51 "phi residue 28" 201 1 201 21 parsed_2rqs 1
52 "psi residue 28" 204 1 204 21 parsed_2rqs 1
53 "phi residue 29" 207 1 207 21 parsed_2rqs 1
54 "psi residue 29" 210 1 210 21 parsed_2rqs 1
55 "phi residue 30" 213 1 213 21 parsed_2rqs 1
56 "psi residue 30" 216 1 216 21 parsed_2rqs 1
57 "phi residue 31" 219 1 219 21 parsed_2rqs 1
58 "psi residue 31" 222 1 222 21 parsed_2rqs 1
59
;
A32 phi OUT
assign
(resid 31 and name C )
(resid 32 and name N )
(resid 32 and name CA )
(resid 32 and name C ) 1 -84.45 30.00 2
A32 psi OUT
assign
(resid 32 and name N )
(resid 32 and name CA )
(resid 32 and name C )
(resid 33 and name N ) 1 -1.47 32.00 2
G33 phi OUT
assign
(resid 32 and name C )
(resid 33 and name N )
(resid 33 and name CA )
(resid 33 and name C ) 1 -105.66 47.00 2
;
225 1 242 64 parsed_2rqs 1
60
;
E34 phi OUT
assign
(resid 33 and name C )
(resid 34 and name N )
(resid 34 and name CA )
(resid 34 and name C ) 1 -65.48 40.00 2
;
249 1 254 63 parsed_2rqs 1
61 "K35 phi" 261 1 261 10 parsed_2rqs 1
62
;
K35 psi OUT
assign
(resid 35 and name N )
(resid 35 and name CA )
(resid 35 and name C )
(resid 36 and name N ) 1 -6.04 32.00 2
F36 phi OUT
assign
(resid 35 and name C )
(resid 36 and name N )
(resid 36 and name CA )
(resid 36 and name C ) 1 -59.22 10.00 2
F36 psi
;
267 1 279 10 parsed_2rqs 1
63 "G37 phi" 285 1 285 10 parsed_2rqs 1
64 "G37 psi" 291 1 291 11 parsed_2rqs 1
65
;
K38 phi
assign
(resid 37 and name C )
(resid 38 and name N )
(resid 38 and name CA )
(resid 38 and name C ) 1 -66.44 10.00 2
K38 psi
;
297 1 303 10 parsed_2rqs 1
66 "phi residue 39" 309 1 309 21 parsed_2rqs 1
67 "psi residue 39" 312 1 312 21 parsed_2rqs 1
68 "A40 phi" 315 1 315 10 parsed_2rqs 1
69 "A40 psi" 321 1 321 10 parsed_2rqs 1
70 "phi residue 41" 327 1 327 21 parsed_2rqs 1
71 "psi residue 41" 330 1 330 21 parsed_2rqs 1
72 "phi residue 42" 333 1 333 21 parsed_2rqs 1
73 "psi residue 42" 336 1 336 21 parsed_2rqs 1
74 "L43 phi" 339 1 339 10 parsed_2rqs 1
75 "L43 psi" 345 1 345 10 parsed_2rqs 1
76 "S44 phi" 351 1 351 10 parsed_2rqs 1
77 "S44 psi" 357 1 357 10 parsed_2rqs 1
78 "I45 phi" 363 1 363 10 parsed_2rqs 1
79 "I45 psi" 369 1 369 10 parsed_2rqs 1
80 "D46 phi" 375 1 375 10 parsed_2rqs 1
81 "D46 psi" 381 1 381 10 parsed_2rqs 1
82 "phi residue 47" 387 1 387 21 parsed_2rqs 1
83 "psi residue 47" 390 1 390 21 parsed_2rqs 1
84 "G48 phi" 393 1 393 10 parsed_2rqs 1
85 "G48 psi" 399 1 399 10 parsed_2rqs 1
86 "S49 phi" 405 1 405 10 parsed_2rqs 1
87 "S49 psi" 411 1 411 10 parsed_2rqs 1
88 "A50 phi" 417 1 417 10 parsed_2rqs 1
89 "A50 psi" 423 1 423 10 parsed_2rqs 1
90 "K51 phi" 429 1 429 10 parsed_2rqs 1
91 "K51 psi" 435 1 435 10 parsed_2rqs 1
92 "R52 phi" 441 1 441 10 parsed_2rqs 1
93 "R52 psi" 447 1 447 10 parsed_2rqs 1
94 "D53 phi" 453 1 453 10 parsed_2rqs 1
95 "D53 psi" 459 1 459 11 parsed_2rqs 1
96
;
G54 phi OUT
assign
(resid 53 and name C )
(resid 54 and name N )
(resid 54 and name CA )
(resid 54 and name C ) 1 -68.33 40.00 2
G54 psi OUT
assign
(resid 54 and name N )
(resid 54 and name CA )
(resid 54 and name C )
(resid 55 and name N ) 1 -12.85 42.00 2
S55 phi
;
465 1 477 10 parsed_2rqs 1
97
;
S55 psi OUT
assign
(resid 55 and name N )
(resid 55 and name CA )
(resid 55 and name C )
(resid 56 and name N ) 1 -13.14 42.00 2
L56 phi OUT
assign
(resid 55 and name C )
(resid 56 and name N )
(resid 56 and name CA )
(resid 56 and name C ) 1 -89.39 40.00 2
L56 psi
;
483 1 495 10 parsed_2rqs 1
98 "G57 phi" 501 1 501 10 parsed_2rqs 1
99 "G57 psi" 507 1 507 10 parsed_2rqs 1
100 "Y58 phi" 513 1 513 10 parsed_2rqs 1
101 "Y58 psi" 519 1 519 10 parsed_2rqs 1
102 "F59 phi" 525 1 525 10 parsed_2rqs 1
103 "F59 psi" 531 1 531 10 parsed_2rqs 1
104 "phi residue 60" 537 1 537 21 parsed_2rqs 1
105 "psi residue 60" 540 1 540 21 parsed_2rqs 1
106 "R61 phi" 543 1 543 10 parsed_2rqs 1
107 "R61 psi" 549 1 549 10 parsed_2rqs 1
108 "G62 phi" 555 1 555 10 parsed_2rqs 1
109 "G62 psi" 561 1 561 10 parsed_2rqs 1
110 "K63 phi" 567 1 567 10 parsed_2rqs 1
111 "K63 psi" 573 1 573 10 parsed_2rqs 1
112 "M64 phi" 579 1 579 10 parsed_2rqs 1
113 "M64 psi" 585 1 585 10 parsed_2rqs 1
114 "V65 phi" 591 1 591 10 parsed_2rqs 1
115 "V65 psi" 597 1 597 10 parsed_2rqs 1
116 "phi residue 66" 603 1 603 21 parsed_2rqs 1
117 "psi residue 66" 606 1 606 21 parsed_2rqs 1
118 "phi residue 67" 609 1 609 21 parsed_2rqs 1
119 "psi residue 67" 612 1 612 21 parsed_2rqs 1
120 "F68 phi" 615 1 615 10 parsed_2rqs 1
121 "F68 psi" 621 1 621 10 parsed_2rqs 1
122 "E69 phi" 627 1 627 10 parsed_2rqs 1
123 "E69 psi" 633 1 633 10 parsed_2rqs 1
124 "phi residue 70" 639 1 639 21 parsed_2rqs 1
125 "psi residue 70" 642 1 642 21 parsed_2rqs 1
126 "phi residue 71" 645 1 645 21 parsed_2rqs 1
127 "psi residue 71" 648 1 648 21 parsed_2rqs 1
128 "phi residue 72" 651 1 651 21 parsed_2rqs 1
129 "psi residue 72" 654 1 654 21 parsed_2rqs 1
130 "phi residue 73" 657 1 657 21 parsed_2rqs 1
131 "psi residue 73" 660 1 660 21 parsed_2rqs 1
132 "R74 phi" 663 1 663 10 parsed_2rqs 1
133 "R74 psi" 669 1 669 10 parsed_2rqs 1
134 "L75 phi" 675 1 675 10 parsed_2rqs 1
135
;
L75 psi OUT
assign
(resid 75 and name N )
(resid 75 and name CA )
(resid 75 and name C )
(resid 76 and name N ) 1 141.68 32.00 2
Q76 phi
;
681 1 687 10 parsed_2rqs 1
136
;
Q76 psi OUT
assign
(resid 76 and name N )
(resid 76 and name CA )
(resid 76 and name C )
(resid 77 and name N ) 1 142.40 32.00 2
V77 phi OUT
assign
(resid 76 and name C )
(resid 77 and name N )
(resid 77 and name CA )
(resid 77 and name C ) 1 -57.84 10.00 2
V77 psi
;
693 1 705 10 parsed_2rqs 1
137 "G78 phi" 711 1 711 10 parsed_2rqs 1
138 "G78 psi" 717 1 717 10 parsed_2rqs 1
139 "E79 phi" 723 1 723 10 parsed_2rqs 1
140 "E79 psi" 729 1 729 10 parsed_2rqs 1
141 "V80 phi" 735 1 735 10 parsed_2rqs 1
142 "V80 psi" 741 1 741 10 parsed_2rqs 1
143 "phi residue 81" 747 1 747 21 parsed_2rqs 1
144 "psi residue 81" 750 1 750 21 parsed_2rqs 1
145 "E82 phi" 753 1 753 10 parsed_2rqs 1
146 "E82 psi" 759 1 759 11 parsed_2rqs 1
147 "P83 phi" 765 1 765 10 parsed_2rqs 1
148 "P83 psi" 771 1 771 10 parsed_2rqs 1
149 "phi residue 84" 777 1 777 21 parsed_2rqs 1
150 "psi residue 84" 780 1 780 21 parsed_2rqs 1
151 "phi residue 85" 783 1 783 21 parsed_2rqs 1
152 "psi residue 85" 786 1 786 21 parsed_2rqs 1
153 "phi residue 86" 789 1 789 21 parsed_2rqs 1
154 "psi residue 86" 792 1 792 21 parsed_2rqs 1
155 "E87 phi" 795 1 795 10 parsed_2rqs 1
156 "E87 psi" 801 1 801 10 parsed_2rqs 1
157 "F88 phi" 807 1 807 10 parsed_2rqs 1
158 "F88 psi" 813 1 813 10 parsed_2rqs 1
159 "G89 phi" 819 1 819 10 parsed_2rqs 1
160 "G89 psi" 825 1 825 10 parsed_2rqs 1
161 "Y90 phi" 831 1 831 10 parsed_2rqs 1
162 "Y90 psi" 837 1 837 10 parsed_2rqs 1
163 "H91 phi" 843 1 843 10 parsed_2rqs 1
164 "H91 psi" 849 1 849 10 parsed_2rqs 1
165 "phi residue 92" 855 1 855 21 parsed_2rqs 1
166 "psi residue 92" 858 1 858 21 parsed_2rqs 1
167 "phi residue 93" 861 1 861 21 parsed_2rqs 1
168 "psi residue 93" 864 1 864 21 parsed_2rqs 1
169 "phi residue 94" 867 1 867 21 parsed_2rqs 1
170 "psi residue 94" 870 1 870 21 parsed_2rqs 1
171 "phi residue 95" 873 1 873 21 parsed_2rqs 1
172 "psi residue 95" 876 1 876 21 parsed_2rqs 1
173 "phi residue 96" 879 1 879 21 parsed_2rqs 1
174 "psi residue 96 ! CHANGED !!!!!!!!!!!!!!!!!!!" 882 1 882 51 parsed_2rqs 1
175 "phi residue 97" 885 1 885 21 parsed_2rqs 1
176 "psi residue 97" 888 1 888 21 parsed_2rqs 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 "G33 psi" 243 2 243 8 parsed_2rqs 1
2 "E34 psi" 255 2 255 8 parsed_2rqs 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 3:12:08 AM GMT (wattos1)