NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
473371 |
2ju3   |
15429 | cing | 2-parsed | STAR | dihedral angle | 182 |
data_2ju3_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ju3
_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_2ju3 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ju3
_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 2ju3 "Master copy" parsed_2ju3
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ju3
_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 2ju3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ju3 1
1 2ju3.mr . . XML 2 peak "Not applicable" "Not applicable" 0 parsed_2ju3 1
1 2ju3.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 90 parsed_2ju3 1
1 2ju3.mr . . XPLOR/CNS 4 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2ju3 1
1 2ju3.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 182 parsed_2ju3 1
1 2ju3.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2ju3 1
1 2ju3.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ju3 1
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ju3
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.0 -74.0 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_2ju3 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.0 127.0 . . 2 . N . 2 . CA . 2 . C . 3 . N parsed_2ju3 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.0 -89.0 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2ju3 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.0 148.0 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2ju3 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -115.0 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2ju3 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 153.0 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2ju3 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.0 -92.0 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2ju3 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.0 133.0 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2ju3 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -61.0 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2ju3 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.0 147.0 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2ju3 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.0 -85.0 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2ju3 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.0 161.0 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2ju3 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -104.0 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2ju3 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.0 156.0 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2ju3 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.0 -89.0 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2ju3 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 161.0 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2ju3 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -58.0 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2ju3 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -34.0 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2ju3 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.0 -56.0 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2ju3 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.0 -29.0 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2ju3 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -62.0 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2ju3 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 -37.0 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2ju3 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.0 -60.0 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2ju3 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 -33.0 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2ju3 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -60.0 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2ju3 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.0 -33.0 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2ju3 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -63.0 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2ju3 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.0 -11.0 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2ju3 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.0 -72.0 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2ju3 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -14.0 18.0 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2ju3 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.0 -80.0 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2ju3 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 144.0 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2ju3 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -54.0 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2ju3 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.0 -23.0 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2ju3 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -57.0 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2ju3 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.0 -34.0 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2ju3 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -55.0 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2ju3 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -34.0 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2ju3 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -59.0 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2ju3 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -34.0 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2ju3 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.0 -59.0 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2ju3 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.0 -22.0 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2ju3 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.0 -70.0 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2ju3 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 137.0 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2ju3 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.0 -106.0 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2ju3 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 152.0 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2ju3 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.0 -101.0 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2ju3 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 147.0 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2ju3 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -99.0 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2ju3 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 143.0 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2ju3 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.0 -92.0 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2ju3 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 141.0 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2ju3 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.0 -83.0 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2ju3 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 137.0 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2ju3 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -85.0 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2ju3 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 145.0 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2ju3 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.0 -79.0 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2ju3 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.0 132.0 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2ju3 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.0 -78.0 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2ju3 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 140.0 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2ju3 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -104.0 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2ju3 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 137.0 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2ju3 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -91.0 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2ju3 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 153.0 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2ju3 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.0 -98.0 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2ju3 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.0 135.0 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2ju3 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.0 -84.0 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2ju3 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 133.0 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2ju3 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -100.0 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2ju3 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.0 156.0 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2ju3 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.0 -83.0 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2ju3 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 133.0 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2ju3 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -64.0 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_2ju3 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.0 140.0 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_2ju3 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -83.0 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2ju3 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 157.0 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2ju3 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.0 -91.0 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2ju3 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 141.0 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2ju3 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -90.0 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2ju3 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.0 138.0 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2ju3 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.0 -88.0 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2ju3 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.0 139.0 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2ju3 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.0 -115.0 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2ju3 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.0 164.0 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2ju3 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.0 -100.0 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2ju3 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 143.0 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2ju3 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.0 -111.0 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2ju3 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 159.0 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2ju3 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.0 -90.0 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2ju3 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 136.0 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2ju3 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.0 -104.0 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2ju3 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 142.0 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2ju3 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -75.0 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2ju3 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 132.0 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2ju3 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -87.0 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2ju3 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.0 157.0 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2ju3 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -93.0 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2ju3 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 143.0 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2ju3 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.0 -90.0 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2ju3 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 142.0 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2ju3 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.00 -87.00 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2ju3 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.00 148.00 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2ju3 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.000 -62.000 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2ju3 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -28.00 -4.00 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2ju3 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -69.0 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_2ju3 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.0 151.0 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2ju3 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.0 -79.0 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2ju3 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.0 140.0 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2ju3 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -67.0 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2ju3 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 138.0 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2ju3 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -111.0 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2ju3 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.0 160.0 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_2ju3 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.0 -85.0 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2ju3 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 135.0 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2ju3 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.0 -83.0 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_2ju3 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 132.0 . . 83 . N . 83 . CA . 83 . C . 84 . N parsed_2ju3 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -94.0 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_2ju3 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.0 159.0 . . 84 . N . 84 . CA . 84 . C . 85 . N parsed_2ju3 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.0 -87.0 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_2ju3 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 135.0 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_2ju3 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.0 -87.0 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_2ju3 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 144.0 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_2ju3 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.0 -112.0 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_2ju3 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 157.0 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_2ju3 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.0 -115.0 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2ju3 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 151.0 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_2ju3 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.0 -102.0 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_2ju3 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 143.0 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_2ju3 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -95.0 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_2ju3 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.00 140.00 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_2ju3 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.0 -98.0 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2ju3 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 151.0 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2ju3 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -90.0 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_2ju3 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 146.0 . . 98 . N . 98 . CA . 98 . C . 99 . N parsed_2ju3 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.0 -88.0 . . 98 . C . 99 . N . 99 . CA . 99 . C parsed_2ju3 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 135.0 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_2ju3 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.0 -97.0 . . 99 . C . 100 . N . 100 . CA . 100 . C parsed_2ju3 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 141.0 . . 100 . N . 100 . CA . 100 . C . 101 . N parsed_2ju3 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.00 -94.00 . . 100 . C . 101 . N . 101 . CA . 101 . C parsed_2ju3 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 138.0 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_2ju3 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -97.0 . . 101 . C . 102 . N . 102 . CA . 102 . C parsed_2ju3 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 132.0 . . 102 . N . 102 . CA . 102 . C . 103 . N parsed_2ju3 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.0 -95.0 . . 102 . C . 103 . N . 103 . CA . 103 . C parsed_2ju3 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 149.0 . . 103 . N . 103 . CA . 103 . C . 104 . N parsed_2ju3 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -87.0 . . 103 . C . 104 . N . 104 . CA . 104 . C parsed_2ju3 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.0 131.0 . . 104 . N . 104 . CA . 104 . C . 105 . N parsed_2ju3 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -67.0 . . 104 . C . 105 . N . 105 . CA . 105 . C parsed_2ju3 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.0 155.0 . . 105 . N . 105 . CA . 105 . C . 106 . N parsed_2ju3 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.0 -96.0 . . 107 . C . 108 . N . 108 . CA . 108 . C parsed_2ju3 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 156.0 . . 108 . N . 108 . CA . 108 . C . 109 . N parsed_2ju3 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -120.0 . . 108 . C . 109 . N . 109 . CA . 109 . C parsed_2ju3 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 155.0 . . 109 . N . 109 . CA . 109 . C . 110 . N parsed_2ju3 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.0 -87.0 . . 109 . C . 110 . N . 110 . CA . 110 . C parsed_2ju3 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.0 135.0 . . 110 . N . 110 . CA . 110 . C . 111 . N parsed_2ju3 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -96.0 . . 110 . C . 111 . N . 111 . CA . 111 . C parsed_2ju3 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 143.0 . . 111 . N . 111 . CA . 111 . C . 112 . N parsed_2ju3 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.0 -98.0 . . 111 . C . 112 . N . 112 . CA . 112 . C parsed_2ju3 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 135.0 . . 112 . N . 112 . CA . 112 . C . 113 . N parsed_2ju3 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -106.0 . . 112 . C . 113 . N . 113 . CA . 113 . C parsed_2ju3 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 153.0 . . 113 . N . 113 . CA . 113 . C . 114 . N parsed_2ju3 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -99.0 . . 113 . C . 114 . N . 114 . CA . 114 . C parsed_2ju3 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 136.0 . . 114 . N . 114 . CA . 114 . C . 115 . N parsed_2ju3 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.0 -81.0 . . 114 . C . 115 . N . 115 . CA . 115 . C parsed_2ju3 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 144.0 . . 115 . N . 115 . CA . 115 . C . 116 . N parsed_2ju3 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -73.0 . . 117 . C . 118 . N . 118 . CA . 118 . C parsed_2ju3 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 135.0 . . 118 . N . 118 . CA . 118 . C . 119 . N parsed_2ju3 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.0 -89.0 . . 118 . C . 119 . N . 119 . CA . 119 . C parsed_2ju3 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.0 141.0 . . 119 . N . 119 . CA . 119 . C . 120 . N parsed_2ju3 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -98.0 . . 119 . C . 120 . N . 120 . CA . 120 . C parsed_2ju3 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 136.0 . . 120 . N . 120 . CA . 120 . C . 121 . N parsed_2ju3 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -95.0 . . 120 . C . 121 . N . 121 . CA . 121 . C parsed_2ju3 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.0 156.0 . . 121 . N . 121 . CA . 121 . C . 122 . N parsed_2ju3 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -102.0 . . 121 . C . 122 . N . 122 . CA . 122 . C parsed_2ju3 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.0 145.0 . . 122 . N . 122 . CA . 122 . C . 123 . N parsed_2ju3 1
175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.0 -98.0 . . 122 . C . 123 . N . 123 . CA . 123 . C parsed_2ju3 1
176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 133.0 . . 123 . N . 123 . CA . 123 . C . 124 . N parsed_2ju3 1
177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -100.0 . . 123 . C . 124 . N . 124 . CA . 124 . C parsed_2ju3 1
178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 155.0 . . 124 . N . 124 . CA . 124 . C . 125 . N parsed_2ju3 1
179 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -98.0 . . 124 . C . 125 . N . 125 . CA . 125 . C parsed_2ju3 1
180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 154.0 . . 125 . N . 125 . CA . 125 . C . 126 . N parsed_2ju3 1
181 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 125 . C . 126 . N . 126 . CA . 126 . C parsed_2ju3 1
182 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 155.0 . . 126 . N . 126 . CA . 126 . C . 127 . N parsed_2ju3 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 angle from TALOS" 1 1 1 29 parsed_2ju3 1
2
;
assign (resid 2 and name C) (resid 3 and name N)
(resid 3 and name CA) (resid 3 and name C) 1.0 -175.0 160.0 2
assign (resid 3 and name N) (resid 3 and name CA)
(resid 3 and name C) (resid 4 and name N) 1.0 -115.0 150.0 2
assign (resid 3 and name C) (resid 4 and name N)
(resid 4 and name CA) (resid 4 and name C) 1.0 -55.0 150.0 2
assign (resid 4 and name N) (resid 4 and name CA)
(resid 4 and name C) (resid 5 and name N) 1.0 160.0 35.0 2
assign (resid 4 and name C) (resid 5 and name N)
(resid 5 and name CA) (resid 5 and name C) 1.0 -180.0 165.0 2
assign (resid 5 and name N) (resid 5 and name CA)
(resid 5 and name C) (resid 6 and name N) 1.0 -180.0 145.0 2
;
8 1 24 93 parsed_2ju3 1
3
;
assign (resid 9 and name C) (resid 10 and name N)
(resid 10 and name CA) (resid 10 and name C) 1.0 -106.220 11.150 2
assign (resid 10 and name N) (resid 10 and name CA)
(resid 10 and name C) (resid 11 and name N) 1.0 152.870 17.830 2
;
50 1 54 96 parsed_2ju3 1
4
;
assign (resid 13 and name C) (resid 14 and name N)
(resid 14 and name CA) (resid 14 and name C) 1.0 -180.0 155.0 2
assign (resid 14 and name N) (resid 14 and name CA)
(resid 14 and name C) (resid 15 and name N) 1.0 -125.0 160.0 2
;
74 1 78 93 parsed_2ju3 1
5
;
assign (resid 15 and name C) (resid 16 and name N)
(resid 16 and name CA) (resid 16 and name C) 1.0 -170.0 135.0 2
assign (resid 16 and name N) (resid 16 and name CA)
(resid 16 and name C) (resid 17 and name N) 1.0 -145.0 110.0 2
;
86 1 90 93 parsed_2ju3 1
6
;
assign (resid 22 and name C) (resid 23 and name N)
(resid 23 and name CA) (resid 23 and name C) 1.0 -180.0 165.0 2
assign (resid 23 and name N) (resid 23 and name CA)
(resid 23 and name C) (resid 24 and name N) 1.0 -120.0 165.0 2
;
128 1 132 93 parsed_2ju3 1
7
;
assign (resid 24 and name C) (resid 25 and name N)
(resid 25 and name CA) (resid 25 and name C) 1.0 -80.110 30.970 2
assign (resid 25 and name N) (resid 25 and name CA)
(resid 25 and name C) (resid 26 and name N) 1.0 136.040 21.36 2
;
140 1 144 93 parsed_2ju3 1
8
;
assign (resid 30 and name C) (resid 31 and name N)
(resid 31 and name CA) (resid 31 and name C) 1.0 -68.520 13.840 2
assign (resid 31 and name N) (resid 31 and name CA)
(resid 31 and name C) (resid 32 and name N) 1.0 -29.530 16.150 2
assign (resid 31 and name C) (resid 32 and name N)
(resid 32 and name CA) (resid 32 and name C) 1.0 -180.0 155.0 2
assign (resid 32 and name N) (resid 32 and name CA)
(resid 32 and name C) (resid 33 and name N) 1.0 0.0 115.0 2
assign (resid 32 and name C) (resid 33 and name N)
(resid 33 and name CA) (resid 33 and name C) 1.0 -64.060 13.130 2
assign (resid 33 and name N) (resid 33 and name CA)
(resid 33 and name C) (resid 34 and name N) 1.0 -30.660 8.830 2
assign (resid 33 and name C) (resid 34 and name N)
(resid 34 and name CA) (resid 34 and name C) 1.0 -100.0 75.0 2
assign (resid 34 and name N) (resid 34 and name CA)
(resid 34 and name C) (resid 35 and name N) 1.0 -45.0 60.0 2
;
176 1 198 93 parsed_2ju3 1
9
;
assign (resid 35 and name C) (resid 36 and name N)
(resid 36 and name CA) (resid 36 and name C) 1.0 -95.160 19.910 2
assign (resid 36 and name N) (resid 36 and name CA)
(resid 36 and name C) (resid 37 and name N) 1.0 119.080 17.990 2
assign (resid 36 and name C) (resid 37 and name N)
(resid 37 and name CA) (resid 37 and name C) 1.0 -180.0 165.0 2
assign (resid 37 and name N) (resid 37 and name CA)
(resid 37 and name C) (resid 38 and name N) 1.0 -180.0 165.0 2
;
206 1 216 93 parsed_2ju3 1
10
;
assign (resid 44 and name C) (resid 45 and name N)
(resid 45 and name CA) (resid 45 and name C) 1.0 -180.0 165.0 2
assign (resid 45 and name N) (resid 45 and name CA)
(resid 45 and name C) (resid 46 and name N) 1.0 -180.0 165.0 2
assign (resid 45 and name C) (resid 46 and name N)
(resid 46 and name CA) (resid 46 and name C) 1.0 -180.0 155.0 2
assign (resid 46 and name N) (resid 46 and name CA)
(resid 46 and name C) (resid 47 and name N) 1.0 -125.0 130.0 2
;
260 1 270 93 parsed_2ju3 1
11
;
assign (resid 54 and name C) (resid 55 and name N)
(resid 55 and name CA) (resid 55 and name C) 1.0 -180.0 165.0 2
assign (resid 55 and name N) (resid 55 and name CA)
(resid 55 and name C) (resid 56 and name N) 1.0 -180.0 165.0 2
assign (resid 55 and name C) (resid 56 and name N)
(resid 56 and name CA) (resid 56 and name C) 1.0 -180.0 155.0 2
assign (resid 56 and name N) (resid 56 and name CA)
(resid 56 and name C) (resid 57 and name N) 1.0 -55.0 160.0 2
;
320 1 330 93 parsed_2ju3 1
12
;
assign (resid 64 and name C) (resid 65 and name N)
(resid 65 and name CA) (resid 65 and name C) 1.0 -75.0 50.0 2
assign (resid 65 and name N) (resid 65 and name CA)
(resid 65 and name C) (resid 66 and name N) 1.0 160.0 35.0 2
assign (resid 65 and name C) (resid 66 and name N)
(resid 66 and name CA) (resid 66 and name C) 1.0 -180.0 155.0 2
assign (resid 66 and name N) (resid 66 and name CA)
(resid 66 and name C) (resid 67 and name N) 1.0 0.0 125.0 2
;
380 1 390 93 parsed_2ju3 1
13
;
assign (resid 72 and name C) (resid 73 and name N)
(resid 73 and name CA) (resid 73 and name C) 1.0 -101.180 24.330 2
assign (resid 73 and name N) (resid 73 and name CA)
(resid 73 and name C) (resid 74 and name N) 1.0 147.410 26.910 2
;
428 1 432 94 parsed_2ju3 1
14
;
assign (resid 74 and name C) (resid 75 and name N)
(resid 75 and name CA) (resid 75 and name C) 1.0 -180.0 155.0 2
assign (resid 75 and name N) (resid 75 and name CA)
(resid 75 and name C) (resid 76 and name N) 1.0 -5.0 100.0 2
assign (resid 75 and name C) (resid 76 and name N)
(resid 76 and name CA) (resid 76 and name C) 1.0 -180.0 155.0 2
assign (resid 76 and name N) (resid 76 and name CA)
(resid 76 and name C) (resid 77 and name N) 1.0 0.0 135.0 2
;
440 1 450 93 parsed_2ju3 1
15
;
assign (resid 78 and name C) (resid 79 and name N)
(resid 79 and name CA) (resid 79 and name C) 1.0 -127.980 8.950 2
assign (resid 79 and name N) (resid 79 and name CA)
(resid 79 and name C) (resid 80 and name N) 1.0 150.470 15.350 2
;
464 1 468 95 parsed_2ju3 1
16
;
assign (resid 86 and name C) (resid 87 and name N)
(resid 87 and name CA) (resid 87 and name C) 1.0 -180.0 165.0 2
assign (resid 87 and name N) (resid 87 and name CA)
(resid 87 and name C) (resid 88 and name N) 1.0 -180.0 165.0 2
assign (resid 87 and name C) (resid 88 and name N)
(resid 88 and name CA) (resid 88 and name C) 1.0 -180.0 155.0 2
assign (resid 88 and name N) (resid 88 and name CA)
(resid 88 and name C) (resid 89 and name N) 1.0 60.0 165.0 2
assign (resid 88 and name C) (resid 89 and name N)
(resid 89 and name CA) (resid 89 and name C) 1.0 -175.0 150.0 2
assign (resid 89 and name N) (resid 89 and name CA)
(resid 89 and name C) (resid 90 and name N) 1.0 -115.0 160.0 2
;
512 1 528 93 parsed_2ju3 1
17
;
assign (resid 94 and name C) (resid 95 and name N)
(resid 95 and name CA) (resid 95 and name C) 1.0 -116.410 25.120 2
assign (resid 95 and name N) (resid 95 and name CA)
(resid 95 and name C) (resid 96 and name N) 1.0 144.130 24.930 2
assign (resid 95 and name C) (resid 96 and name N)
(resid 96 and name CA) (resid 96 and name C) 1.0 -180.0 155.0 2
assign (resid 96 and name N) (resid 96 and name CA)
(resid 96 and name C) (resid 97 and name N) 1.0 -125.0 130.0 2
assign (resid 96 and name C) (resid 97 and name N)
(resid 97 and name CA) (resid 97 and name C) 1.0 -180.0 165.0 2
assign (resid 97 and name N) (resid 97 and name CA)
(resid 97 and name C) (resid 98 and name N) 1.0 -180.0 165.0 2
;
560 1 576 93 parsed_2ju3 1
18
;
assign (resid 105 and name C) (resid 106 and name N)
(resid 106 and name CA) (resid 106 and name C) 1.0 -180.0 165.0 2
assign (resid 106 and name N) (resid 106 and name CA)
(resid 106 and name C) (resid 107 and name N) 1.0 -180.0 165.0 2
assign (resid 106 and name C) (resid 107 and name N)
(resid 107 and name CA) (resid 107 and name C) 1.0 -180.0 155.0 2
assign (resid 107 and name N) (resid 107 and name CA)
(resid 107 and name C) (resid 108 and name N) 1.0 60.0 165.0 2
;
626 1 636 93 parsed_2ju3 1
19
;
assign (resid 115 and name C) (resid 116 and name N)
(resid 116 and name CA) (resid 116 and name C) 1.0 -180.0 165.0 2
assign (resid 116 and name N) (resid 116 and name CA)
(resid 116 and name C) (resid 117 and name N) 1.0 -180.0 165.0 2
assign (resid 116 and name C) (resid 117 and name N)
(resid 117 and name CA) (resid 117 and name C) 1.0 -165.0 130.0 2
assign (resid 117 and name N) (resid 117 and name CA)
(resid 117 and name C) (resid 118 and name N) 1.0 -50.0 55.0 2
;
686 1 696 93 parsed_2ju3 1
20
;
assign (resid 126 and name C) (resid 127 and name N)
(resid 127 and name CA) (resid 127 and name C) 1.0 -90.0 45.0 2
;
752 1 753 93 parsed_2ju3 1
stop_
save_
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