NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
545592 |
2ls7   |
18412 | cing | 2-parsed | STAR | dipolar coupling | 63 |
data_2ls7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ls7
_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_2ls7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ls7
_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 2ls7 "Master copy" parsed_2ls7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ls7
_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 2ls7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ls7 1
1 2ls7.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 3 distance NOE simple 1907 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 63 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 63 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 6 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 8 distance "hydrogen bond" simple 0 parsed_2ls7 1
1 2ls7.mr . . XPLOR/CNS 9 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2ls7 1
1 2ls7.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ls7 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2ls7
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . 11.5040 11.0040 12.0040 . . . 2 . N . 2 . HN parsed_2ls7 1
2 . . . . . . . . . . . . . . . . -1.5000 -2.0000 -1.0000 . . . 3 . N . 3 . HN parsed_2ls7 1
3 . . . . . . . . . . . . . . . . 5.5020 5.0020 6.0020 . . . 4 . N . 4 . HN parsed_2ls7 1
4 . . . . . . . . . . . . . . . . 6.5010 6.0010 7.0010 . . . 5 . N . 5 . HN parsed_2ls7 1
5 . . . . . . . . . . . . . . . . -3.5010 -4.0010 -3.0010 . . . 6 . N . 6 . HN parsed_2ls7 1
6 . . . . . . . . . . . . . . . . 3.5000 3.0000 4.0000 . . . 7 . N . 7 . HN parsed_2ls7 1
7 . . . . . . . . . . . . . . . . 8.5020 8.0020 9.0020 . . . 8 . N . 8 . HN parsed_2ls7 1
8 . . . . . . . . . . . . . . . . 0.0000 -0.5000 0.5000 . . . 9 . N . 9 . HN parsed_2ls7 1
9 . . . . . . . . . . . . . . . . 1.0010 0.5010 1.5010 . . . 10 . N . 10 . HN parsed_2ls7 1
10 . . . . . . . . . . . . . . . . 4.5010 4.0010 5.0010 . . . 11 . N . 11 . HN parsed_2ls7 1
11 . . . . . . . . . . . . . . . . 1.5000 1.0000 2.0000 . . . 12 . N . 12 . HN parsed_2ls7 1
12 . . . . . . . . . . . . . . . . -2.0000 -2.5000 -1.5000 . . . 17 . N . 17 . HN parsed_2ls7 1
13 . . . . . . . . . . . . . . . . -1.0000 -1.5000 -0.5000 . . . 18 . N . 18 . HN parsed_2ls7 1
14 . . . . . . . . . . . . . . . . 4.5010 4.0010 5.0010 . . . 19 . N . 19 . HN parsed_2ls7 1
15 . . . . . . . . . . . . . . . . 0.5000 0.0000 1.0000 . . . 20 . N . 20 . HN parsed_2ls7 1
16 . . . . . . . . . . . . . . . . -0.5000 -1.0000 0.0000 . . . 21 . N . 21 . HN parsed_2ls7 1
17 . . . . . . . . . . . . . . . . -1.5000 -2.0000 -1.0000 . . . 22 . N . 22 . HN parsed_2ls7 1
18 . . . . . . . . . . . . . . . . 3.5010 3.0010 4.0010 . . . 23 . N . 23 . HN parsed_2ls7 1
19 . . . . . . . . . . . . . . . . -6.0010 -6.5010 -5.5010 . . . 24 . N . 24 . HN parsed_2ls7 1
20 . . . . . . . . . . . . . . . . 1.0000 0.5000 1.5000 . . . 25 . N . 25 . HN parsed_2ls7 1
21 . . . . . . . . . . . . . . . . -1.5010 -2.0010 -1.0010 . . . 26 . N . 26 . HN parsed_2ls7 1
22 . . . . . . . . . . . . . . . . 0.0000 -0.5000 0.5000 . . . 27 . N . 27 . HN parsed_2ls7 1
23 . . . . . . . . . . . . . . . . 5.0020 4.5020 5.5020 . . . 33 . N . 33 . HN parsed_2ls7 1
24 . . . . . . . . . . . . . . . . 0.5000 0.0000 1.0000 . . . 34 . N . 34 . HN parsed_2ls7 1
25 . . . . . . . . . . . . . . . . 4.0010 3.5010 4.5010 . . . 35 . N . 35 . HN parsed_2ls7 1
26 . . . . . . . . . . . . . . . . 4.5020 4.0020 5.0020 . . . 36 . N . 36 . HN parsed_2ls7 1
27 . . . . . . . . . . . . . . . . -5.0010 -5.5010 -4.5010 . . . 37 . N . 37 . HN parsed_2ls7 1
28 . . . . . . . . . . . . . . . . 1.5010 1.0010 2.0010 . . . 38 . N . 38 . HN parsed_2ls7 1
29 . . . . . . . . . . . . . . . . -4.0010 -4.5010 -3.5010 . . . 42 . N . 42 . HN parsed_2ls7 1
30 . . . . . . . . . . . . . . . . -1.5000 -2.0000 -1.0000 . . . 43 . N . 43 . HN parsed_2ls7 1
31 . . . . . . . . . . . . . . . . -1.5010 -2.0010 -1.0010 . . . 44 . N . 44 . HN parsed_2ls7 1
32 . . . . . . . . . . . . . . . . 2.0010 1.5010 2.5010 . . . 45 . N . 45 . HN parsed_2ls7 1
33 . . . . . . . . . . . . . . . . -2.5010 -3.0010 -2.0010 . . . 46 . N . 46 . HN parsed_2ls7 1
34 . . . . . . . . . . . . . . . . -2.5010 -3.0010 -2.0010 . . . 47 . N . 47 . HN parsed_2ls7 1
35 . . . . . . . . . . . . . . . . 3.0000 2.5000 3.5000 . . . 48 . N . 48 . HN parsed_2ls7 1
36 . . . . . . . . . . . . . . . . 2.0000 1.5000 2.5000 . . . 49 . N . 49 . HN parsed_2ls7 1
37 . . . . . . . . . . . . . . . . 1.0000 0.5000 1.5000 . . . 50 . N . 50 . HN parsed_2ls7 1
38 . . . . . . . . . . . . . . . . -1.0000 -1.5000 -0.5000 . . . 51 . N . 51 . HN parsed_2ls7 1
39 . . . . . . . . . . . . . . . . 6.5010 6.0010 7.0010 . . . 61 . N . 61 . HN parsed_2ls7 1
40 . . . . . . . . . . . . . . . . 13.0030 12.5030 13.5030 . . . 62 . N . 62 . HN parsed_2ls7 1
41 . . . . . . . . . . . . . . . . 7.0020 6.5020 7.5020 . . . 63 . N . 63 . HN parsed_2ls7 1
42 . . . . . . . . . . . . . . . . 3.0000 2.5000 3.5000 . . . 64 . N . 64 . HN parsed_2ls7 1
43 . . . . . . . . . . . . . . . . 8.0030 7.5030 8.5030 . . . 65 . N . 65 . HN parsed_2ls7 1
44 . . . . . . . . . . . . . . . . 4.5010 4.0010 5.0010 . . . 66 . N . 66 . HN parsed_2ls7 1
45 . . . . . . . . . . . . . . . . 6.0010 5.5010 6.5010 . . . 67 . N . 67 . HN parsed_2ls7 1
46 . . . . . . . . . . . . . . . . 0.0000 -0.5000 0.5000 . . . 68 . N . 68 . HN parsed_2ls7 1
47 . . . . . . . . . . . . . . . . 11.0030 10.5030 11.5030 . . . 69 . N . 69 . HN parsed_2ls7 1
48 . . . . . . . . . . . . . . . . -6.5020 -7.0020 -6.0020 . . . 74 . N . 74 . HN parsed_2ls7 1
49 . . . . . . . . . . . . . . . . 4.0010 3.5010 4.5010 . . . 75 . N . 75 . HN parsed_2ls7 1
50 . . . . . . . . . . . . . . . . 6.5020 6.0020 7.0020 . . . 76 . N . 76 . HN parsed_2ls7 1
51 . . . . . . . . . . . . . . . . 5.5020 5.0020 6.0020 . . . 77 . N . 77 . HN parsed_2ls7 1
52 . . . . . . . . . . . . . . . . -1.5000 -2.0000 -1.0000 . . . 78 . N . 78 . HN parsed_2ls7 1
53 . . . . . . . . . . . . . . . . 4.5020 4.0020 5.0020 . . . 79 . N . 79 . HN parsed_2ls7 1
54 . . . . . . . . . . . . . . . . 5.0020 4.5020 5.5020 . . . 80 . N . 80 . HN parsed_2ls7 1
55 . . . . . . . . . . . . . . . . -1.0010 -1.5010 -0.5010 . . . 81 . N . 81 . HN parsed_2ls7 1
56 . . . . . . . . . . . . . . . . -5.0020 -5.5020 -4.5020 . . . 82 . N . 82 . HN parsed_2ls7 1
57 . . . . . . . . . . . . . . . . 1.5000 1.0000 2.0000 . . . 83 . N . 83 . HN parsed_2ls7 1
58 . . . . . . . . . . . . . . . . -0.5000 -1.0000 0.0000 . . . 84 . N . 84 . HN parsed_2ls7 1
59 . . . . . . . . . . . . . . . . 10.0030 9.5030 10.5030 . . . 85 . N . 85 . HN parsed_2ls7 1
60 . . . . . . . . . . . . . . . . 0.0000 -0.5000 0.5000 . . . 86 . N . 86 . HN parsed_2ls7 1
61 . . . . . . . . . . . . . . . . 9.0020 8.5020 9.5020 . . . 87 . N . 87 . HN parsed_2ls7 1
62 . . . . . . . . . . . . . . . . 2.0010 1.5010 2.5010 . . . 88 . N . 88 . HN parsed_2ls7 1
63 . . . . . . . . . . . . . . . . -1.0010 -1.5010 -0.5010 . . . 89 . N . 89 . HN parsed_2ls7 1
stop_
loop_
_RDC_constraint_comment_org.ID
_RDC_constraint_comment_org.Comment_text
_RDC_constraint_comment_org.Comment_begin_line
_RDC_constraint_comment_org.Comment_begin_column
_RDC_constraint_comment_org.Comment_end_line
_RDC_constraint_comment_org.Comment_end_column
_RDC_constraint_comment_org.Entry_ID
_RDC_constraint_comment_org.RDC_constraint_list_ID
1
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name N )
( resid 13 and name HN ) -4.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name N )
( resid 14 and name HN ) 0.5000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name N )
( resid 15 and name HN ) 16.5040 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name N )
( resid 16 and name HN ) 9.0030 0.5000 0.5000
;
77 1 77 1 parsed_2ls7 1
2
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name N )
( resid 28 and name HN ) 3.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name N )
( resid 29 and name HN ) 2.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name N )
( resid 30 and name HN ) 1.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name N )
( resid 31 and name HN ) 14.5040 0.5000 0.5000
;
182 1 182 1 parsed_2ls7 1
3
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name N )
( resid 39 and name HN ) 9.0030 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name N )
( resid 40 and name HN ) 14.0030 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name N )
( resid 41 and name HN ) 0.5000 0.5000 0.5000
;
252 1 252 1 parsed_2ls7 1
4
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name N )
( resid 52 and name HN ) 2.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name N )
( resid 53 and name HN ) 8.0020 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name N )
( resid 54 and name HN ) -10.0030 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name N )
( resid 55 and name HN ) 2.5000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name N )
( resid 56 and name HN ) 1.5000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name N )
( resid 57 and name HN ) 4.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name N )
( resid 58 and name HN ) -4.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 59 and name N )
( resid 59 and name HN ) 4.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 60 and name N )
( resid 60 and name HN ) -12.0030 0.5000 0.5000
;
343 1 343 1 parsed_2ls7 1
5
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 70 and name N )
( resid 70 and name HN ) 7.0020 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 71 and name N )
( resid 71 and name HN ) -2.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 72 and name N )
( resid 72 and name HN ) 3.5010 0.5000 0.5000
;
469 1 469 1 parsed_2ls7 1
6
;
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 90 and name N )
( resid 90 and name HN ) 6.5020 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 91 and name N )
( resid 91 and name HN ) 2.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 92 and name N )
( resid 92 and name HN ) 3.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 93 and name N )
( resid 93 and name HN ) 3.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 94 and name N )
( resid 94 and name HN ) 4.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 95 and name N )
( resid 95 and name HN ) -0.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 96 and name N )
( resid 96 and name HN ) -2.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 97 and name N )
( resid 97 and name HN ) -1.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 98 and name N )
( resid 98 and name HN ) 0.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 99 and name N )
( resid 99 and name HN ) 0.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 100 and name N )
( resid 100 and name HN ) -1.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 101 and name N )
( resid 101 and name HN ) 0.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 102 and name N )
( resid 102 and name HN ) -1.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 106 and name N )
( resid 106 and name HN ) 3.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 107 and name N )
( resid 107 and name HN ) -6.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 108 and name N )
( resid 108 and name HN ) 0.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 109 and name N )
( resid 109 and name HN ) -3.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 110 and name N )
( resid 110 and name HN ) 1.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 111 and name N )
( resid 111 and name HN ) 2.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 112 and name N )
( resid 112 and name HN ) 2.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 113 and name N )
( resid 113 and name HN ) 0.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 114 and name N )
( resid 114 and name HN ) -1.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 116 and name N )
( resid 116 and name HN ) -0.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 117 and name N )
( resid 117 and name HN ) -1.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 118 and name N )
( resid 118 and name HN ) 0.0000 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 119 and name N )
( resid 119 and name HN ) 1.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 120 and name N )
( resid 120 and name HN ) -1.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 121 and name N )
( resid 121 and name HN ) -0.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 122 and name N )
( resid 122 and name HN ) -1.0010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 123 and name N )
( resid 123 and name HN ) -2.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 124 and name N )
( resid 124 and name HN ) 4.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 128 and name N )
( resid 128 and name HN ) 6.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 129 and name N )
( resid 129 and name HN ) 6.5010 0.5000 0.5000
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 130 and name N )
( resid 130 and name HN ) 2.5000 0.5000 0.5000
;
602 1 602 1 parsed_2ls7 1
stop_
save_
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