NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
50438 |
2k0y   |
15659 | cing | 2-parsed | STAR | entry | full | 128 |
data_2k0y_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k0y
_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_2k0y 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k0y
_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 2k0y "Master copy" parsed_2k0y
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k0y
_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 2k0y.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k0y 1
1 2k0y.mr . . unknown 2 distance NOE ambi 0 parsed_2k0y 1
1 2k0y.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 128 parsed_2k0y 1
1 2k0y.mr . . XPLOR/CNS 4 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2k0y 1
1 2k0y.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k0y 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2k0y
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER TRANSPORT PROTEIN 15-FEB-08 2K0Y
*TITLE THE ACTINORHODIN APO ACYL CARRIER PROTEIN FROM S. COELICOLOR
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: ACTINORHODIN POLYKETIDE SYNTHASE ACYL CARRIER
*COMPND 3 PROTEIN;
*COMPND 4 CHAIN: A;
*COMPND 5 SYNONYM: ACP, ACTI ORF3;
*COMPND 6 ENGINEERED: YES;
*COMPND 7 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR;
*SOURCE 3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 4 EXPRESSION_SYSTEM_STRAIN: BL21;
*SOURCE 5 EXPRESSION_SYSTEM_VARIANT: DE3;
*SOURCE 6 EXPRESSION_SYSTEM_VECTOR: PET11C;
*SOURCE 7 OTHER_DETAILS: ACTINORHODIN ACYL CARRIER PROTEIN (ACT ACP)
*SOURCE 8 FROM S. COELICOLOR WAS HETEROLOGOUSLY OVEREXPRESSED IN
*SOURCE 9 ITS APO FORM IN E. COLI BL21 (DE3) CELLS. THESE CELLS
*SOURCE 10 CONTAINED THE PLASMID PET11C C17S ACT ACP (COURTESY OF
*SOURCE 11 DR. TOM NICHOLSON). THIS IPTG INDUCIBLE VECTOR IS BOTH
*SOURCE 12 EASIER TO USE AND MORE RELIABLE THAN THE HEAT INDUCIBLE
*SOURCE 13 PT7-7 VERSION ORIGINALLY CONSTRUCTED.
*KEYWDS ACYL CARRIER PROTEIN, ACTINORHODIN, POLYKETIDE, ANTIBIOTIC,
*KEYWDS 2 ANTIBIOTIC BIOSYNTHESIS, PHOSPHOPANTETHEINE, TRANSPORT
*KEYWDS 3 PROTEIN
*EXPDTA NMR, 20 STRUCTURES
*AUTHOR M.P.CRUMP, S.E.EVANS, W.CHRISTOPHER
*REVDAT 2 02-DEC-08 2K0Y 1
*REVDAT 1 16-SEP-08 2K0Y 0
;
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k0y
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -72 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_2k0y 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129 -33 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2k0y 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139 -59 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2k0y 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81 -41 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2k0y 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82 -42 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2k0y 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88 -48 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2k0y 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2k0y 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2k0y 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79 -39 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2k0y 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2k0y 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2k0y 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2k0y 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2k0y 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103 -43 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2k0y 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169 -13 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2k0y 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -39 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2k0y 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2k0y 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138 -50 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2k0y 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149 -29 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2k0y 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143 -31 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2k0y 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2k0y 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2k0y 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89 -49 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2k0y 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -70 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2k0y 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55 111 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2k0y 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152 -52 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2k0y 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78 -38 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2k0y 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82 -42 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2k0y 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2k0y 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2k0y 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2k0y 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88 -48 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2k0y 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87 -47 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2k0y 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82 -42 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2k0y 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81 -41 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2k0y 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2k0y 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2k0y 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2k0y 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_2k0y 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89 -49 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2k0y 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117 -77 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2k0y 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 45 93 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2k0y 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167 -95 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2k0y 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141 -65 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2k0y 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154 -54 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2k0y 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2k0y 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77 -37 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2k0y 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2k0y 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2k0y 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87 -47 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2k0y 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161 -57 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2k0y 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81 -41 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2k0y 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2k0y 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2k0y 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2k0y 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82 -42 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2k0y 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2k0y 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87 -47 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_2k0y 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -44 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2k0y 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81 -41 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2k0y 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89 -49 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2k0y 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2k0y 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2k0y 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105 -45 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_2k0y 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108 148 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_2k0y 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124 164 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2k0y 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 149 189 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2k0y 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54 -14 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2k0y 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60 -20 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2k0y 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -18 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2k0y 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64 -24 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2k0y 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 -25 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2k0y 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2k0y 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66 -26 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2k0y 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57 -17 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2k0y 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 -17 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2k0y 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53 -13 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2k0y 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63 -3 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2k0y 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 81 189 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2k0y 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99 203 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2k0y 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54 2 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2k0y 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69 39 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2k0y 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94 202 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2k0y 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123 183 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2k0y 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52 -12 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2k0y 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64 -24 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2k0y 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49 -9 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2k0y 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24 32 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2k0y 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22 50 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2k0y 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102 162 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2k0y 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59 -19 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2k0y 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64 -24 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2k0y 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58 -18 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2k0y 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63 -23 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2k0y 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61 -21 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2k0y 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59 -19 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2k0y 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2k0y 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61 -21 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2k0y 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2k0y 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64 -24 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2k0y 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2k0y 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61 -21 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2k0y 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 -25 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_2k0y 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52 -12 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2k0y 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -23 29 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2k0y 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -7 69 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2k0y 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136 176 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2k0y 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104 160 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2k0y 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97 165 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2k0y 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114 154 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2k0y 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -2 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2k0y 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55 -15 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2k0y 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63 -15 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2k0y 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54 2 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2k0y 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131 179 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2k0y 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52 -12 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2k0y 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 -25 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2k0y 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58 -18 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2k0y 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61 -21 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2k0y 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_2k0y 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58 -18 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_2k0y 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60 -20 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2k0y 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2k0y 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55 -15 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_2k0y 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61 -21 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2k0y 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62 -22 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_2k0y 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70 -6 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2k0y 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66 18 . . 83 . N . 83 . CA . 83 . C . 84 . N parsed_2k0y 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
;
Phi and Psi backbone angles predicted by talos and used as input for ARIA 1.2
phi and psi dihedral restraint file generated by Talos2Aria.py
TALOS filename:
/home/chsee/structure_calcs/apo/pred.tab
settings: min phiError=20.0, min psiError=20.0, errorFactor=2.0
Talos derived phi restraint:
;
1 1 11 31 parsed_2k0y 1
2 "Talos derived phi restraint:" 18 1 18 31 parsed_2k0y 1
3 "Talos derived phi restraint:" 25 1 25 31 parsed_2k0y 1
4 "Talos derived phi restraint:" 32 1 32 31 parsed_2k0y 1
5 "Talos derived phi restraint:" 39 1 39 31 parsed_2k0y 1
6 "Talos derived phi restraint:" 46 1 46 31 parsed_2k0y 1
7 "Talos derived phi restraint:" 53 1 53 31 parsed_2k0y 1
8 "Talos derived phi restraint:" 60 1 60 31 parsed_2k0y 1
9 "Talos derived phi restraint:" 67 1 67 31 parsed_2k0y 1
10 "Talos derived phi restraint:" 74 1 74 31 parsed_2k0y 1
11 "Talos derived phi restraint:" 81 1 81 31 parsed_2k0y 1
12 "Talos derived phi restraint:" 88 1 88 31 parsed_2k0y 1
13 "Talos derived phi restraint:" 95 1 95 31 parsed_2k0y 1
14 "Talos derived phi restraint:" 102 1 102 31 parsed_2k0y 1
15 "Talos derived phi restraint:" 109 1 109 31 parsed_2k0y 1
16 "Talos derived phi restraint:" 116 1 116 31 parsed_2k0y 1
17 "Talos derived phi restraint:" 123 1 123 31 parsed_2k0y 1
18 "Talos derived phi restraint:" 130 1 130 31 parsed_2k0y 1
19 "Talos derived phi restraint:" 137 1 137 31 parsed_2k0y 1
20 "Talos derived phi restraint:" 144 1 144 31 parsed_2k0y 1
21 "Talos derived phi restraint:" 151 1 151 31 parsed_2k0y 1
22 "Talos derived phi restraint:" 158 1 158 31 parsed_2k0y 1
23 "Talos derived phi restraint:" 165 1 165 31 parsed_2k0y 1
24 "Talos derived phi restraint:" 172 1 172 31 parsed_2k0y 1
25 "Talos derived phi restraint:" 179 1 179 31 parsed_2k0y 1
26 "Talos derived phi restraint:" 186 1 186 31 parsed_2k0y 1
27 "Talos derived phi restraint:" 193 1 193 31 parsed_2k0y 1
28 "Talos derived phi restraint:" 200 1 200 31 parsed_2k0y 1
29 "Talos derived phi restraint:" 207 1 207 31 parsed_2k0y 1
30 "Talos derived phi restraint:" 214 1 214 31 parsed_2k0y 1
31 "Talos derived phi restraint:" 221 1 221 31 parsed_2k0y 1
32 "Talos derived phi restraint:" 228 1 228 31 parsed_2k0y 1
33 "Talos derived phi restraint:" 235 1 235 31 parsed_2k0y 1
34 "Talos derived phi restraint:" 242 1 242 31 parsed_2k0y 1
35 "Talos derived phi restraint:" 249 1 249 31 parsed_2k0y 1
36 "Talos derived phi restraint:" 256 1 256 31 parsed_2k0y 1
37 "Talos derived phi restraint:" 263 1 263 31 parsed_2k0y 1
38 "Talos derived phi restraint:" 270 1 270 31 parsed_2k0y 1
39 "Talos derived phi restraint:" 277 1 277 31 parsed_2k0y 1
40 "Talos derived phi restraint:" 284 1 284 31 parsed_2k0y 1
41 "Talos derived phi restraint:" 291 1 291 31 parsed_2k0y 1
42 "Talos derived phi restraint:" 298 1 298 31 parsed_2k0y 1
43 "Talos derived phi restraint:" 305 1 305 31 parsed_2k0y 1
44 "Talos derived phi restraint:" 312 1 312 31 parsed_2k0y 1
45 "Talos derived phi restraint:" 319 1 319 31 parsed_2k0y 1
46 "Talos derived phi restraint:" 326 1 326 31 parsed_2k0y 1
47 "Talos derived phi restraint:" 333 1 333 31 parsed_2k0y 1
48 "Talos derived phi restraint:" 340 1 340 31 parsed_2k0y 1
49 "Talos derived phi restraint:" 347 1 347 31 parsed_2k0y 1
50 "Talos derived phi restraint:" 354 1 354 31 parsed_2k0y 1
51 "Talos derived phi restraint:" 361 1 361 31 parsed_2k0y 1
52 "Talos derived phi restraint:" 368 1 368 31 parsed_2k0y 1
53 "Talos derived phi restraint:" 375 1 375 31 parsed_2k0y 1
54 "Talos derived phi restraint:" 382 1 382 31 parsed_2k0y 1
55 "Talos derived phi restraint:" 389 1 389 31 parsed_2k0y 1
56 "Talos derived phi restraint:" 396 1 396 31 parsed_2k0y 1
57 "Talos derived phi restraint:" 403 1 403 31 parsed_2k0y 1
58 "Talos derived phi restraint:" 410 1 410 31 parsed_2k0y 1
59 "Talos derived phi restraint:" 417 1 417 31 parsed_2k0y 1
60 "Talos derived phi restraint:" 424 1 424 31 parsed_2k0y 1
61 "Talos derived phi restraint:" 431 1 431 31 parsed_2k0y 1
62 "Talos derived phi restraint:" 438 1 438 31 parsed_2k0y 1
63 "Talos derived phi restraint:" 445 1 445 31 parsed_2k0y 1
64 "Talos derived phi restraint:" 452 1 452 31 parsed_2k0y 1
65 "Talos derived psi restraint:" 459 1 459 31 parsed_2k0y 1
66 "Talos derived psi restraint:" 466 1 466 31 parsed_2k0y 1
67 "Talos derived psi restraint:" 473 1 473 31 parsed_2k0y 1
68 "Talos derived psi restraint:" 480 1 480 31 parsed_2k0y 1
69 "Talos derived psi restraint:" 487 1 487 31 parsed_2k0y 1
70 "Talos derived psi restraint:" 494 1 494 31 parsed_2k0y 1
71 "Talos derived psi restraint:" 501 1 501 31 parsed_2k0y 1
72 "Talos derived psi restraint:" 508 1 508 31 parsed_2k0y 1
73 "Talos derived psi restraint:" 515 1 515 31 parsed_2k0y 1
74 "Talos derived psi restraint:" 522 1 522 31 parsed_2k0y 1
75 "Talos derived psi restraint:" 529 1 529 31 parsed_2k0y 1
76 "Talos derived psi restraint:" 536 1 536 31 parsed_2k0y 1
77 "Talos derived psi restraint:" 543 1 543 31 parsed_2k0y 1
78 "Talos derived psi restraint:" 550 1 550 31 parsed_2k0y 1
79 "Talos derived psi restraint:" 557 1 557 31 parsed_2k0y 1
80 "Talos derived psi restraint:" 564 1 564 31 parsed_2k0y 1
81 "Talos derived psi restraint:" 571 1 571 31 parsed_2k0y 1
82 "Talos derived psi restraint:" 578 1 578 31 parsed_2k0y 1
83 "Talos derived psi restraint:" 585 1 585 31 parsed_2k0y 1
84 "Talos derived psi restraint:" 592 1 592 31 parsed_2k0y 1
85 "Talos derived psi restraint:" 599 1 599 31 parsed_2k0y 1
86 "Talos derived psi restraint:" 606 1 606 31 parsed_2k0y 1
87 "Talos derived psi restraint:" 613 1 613 31 parsed_2k0y 1
88 "Talos derived psi restraint:" 620 1 620 31 parsed_2k0y 1
89 "Talos derived psi restraint:" 627 1 627 31 parsed_2k0y 1
90 "Talos derived psi restraint:" 634 1 634 31 parsed_2k0y 1
91 "Talos derived psi restraint:" 641 1 641 31 parsed_2k0y 1
92 "Talos derived psi restraint:" 648 1 648 31 parsed_2k0y 1
93 "Talos derived psi restraint:" 655 1 655 31 parsed_2k0y 1
94 "Talos derived psi restraint:" 662 1 662 31 parsed_2k0y 1
95 "Talos derived psi restraint:" 669 1 669 31 parsed_2k0y 1
96 "Talos derived psi restraint:" 676 1 676 31 parsed_2k0y 1
97 "Talos derived psi restraint:" 683 1 683 31 parsed_2k0y 1
98 "Talos derived psi restraint:" 690 1 690 31 parsed_2k0y 1
99 "Talos derived psi restraint:" 697 1 697 31 parsed_2k0y 1
100 "Talos derived psi restraint:" 704 1 704 31 parsed_2k0y 1
101 "Talos derived psi restraint:" 711 1 711 31 parsed_2k0y 1
102 "Talos derived psi restraint:" 718 1 718 31 parsed_2k0y 1
103 "Talos derived psi restraint:" 725 1 725 31 parsed_2k0y 1
104 "Talos derived psi restraint:" 732 1 732 31 parsed_2k0y 1
105 "Talos derived psi restraint:" 739 1 739 31 parsed_2k0y 1
106 "Talos derived psi restraint:" 746 1 746 31 parsed_2k0y 1
107 "Talos derived psi restraint:" 753 1 753 31 parsed_2k0y 1
108 "Talos derived psi restraint:" 760 1 760 31 parsed_2k0y 1
109 "Talos derived psi restraint:" 767 1 767 31 parsed_2k0y 1
110 "Talos derived psi restraint:" 774 1 774 31 parsed_2k0y 1
111 "Talos derived psi restraint:" 781 1 781 31 parsed_2k0y 1
112 "Talos derived psi restraint:" 788 1 788 31 parsed_2k0y 1
113 "Talos derived psi restraint:" 795 1 795 31 parsed_2k0y 1
114 "Talos derived psi restraint:" 802 1 802 31 parsed_2k0y 1
115 "Talos derived psi restraint:" 809 1 809 31 parsed_2k0y 1
116 "Talos derived psi restraint:" 816 1 816 31 parsed_2k0y 1
117 "Talos derived psi restraint:" 823 1 823 31 parsed_2k0y 1
118 "Talos derived psi restraint:" 830 1 830 31 parsed_2k0y 1
119 "Talos derived psi restraint:" 837 1 837 31 parsed_2k0y 1
120 "Talos derived psi restraint:" 844 1 844 31 parsed_2k0y 1
121 "Talos derived psi restraint:" 851 1 851 31 parsed_2k0y 1
122 "Talos derived psi restraint:" 858 1 858 31 parsed_2k0y 1
123 "Talos derived psi restraint:" 865 1 865 31 parsed_2k0y 1
124 "Talos derived psi restraint:" 872 1 872 31 parsed_2k0y 1
125 "Talos derived psi restraint:" 879 1 879 31 parsed_2k0y 1
126 "Talos derived psi restraint:" 886 1 886 31 parsed_2k0y 1
127 "Talos derived psi restraint:" 893 1 893 31 parsed_2k0y 1
128 "Talos derived psi restraint:" 900 1 900 31 parsed_2k0y 1
stop_
save_
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