NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
532790 |
2k61   |
15852 | cing | 2-parsed | STAR | entry | full | 443 |
data_2k61_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k61
_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_2k61 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k61
_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 2k61 "Master copy" parsed_2k61
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k61
_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 2k61.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 229 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 59 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 66 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 89 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k61 1
1 2k61.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k61 1
1 2k61.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k61 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_2k61
_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 METAL BINDING PROTEIN 02-JUL-08 2K61
*TITLE SOLUTION STRUCTURE OF CAM COMPLEXED TO DAPK PEPTIDE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: CALMODULIN;
*COMPND 3 CHAIN: A;
*COMPND 4 SYNONYM: CAM;
*COMPND 5 ENGINEERED: YES;
*COMPND 6 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 3 ORGANISM_COMMON: MAN;
*SOURCE 4 ORGANISM_TAXID: 9606;
*SOURCE 5 GENE: CALM1, CALM, CAM, CAM1, CALM2, CAM2, CAMB, CALM3,
*SOURCE 6 CALML2, CAM3, CAMC, CAMIII;
*SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 9 EXPRESSION_SYSTEM_VECTOR: PET16B-CAM
*KEYWDS CALMODULIN, DAPK PEPTIDE, ACETYLATION, CALCIUM, METHYLATION,
*KEYWDS 2 PHOSPHOPROTEIN, UBL CONJUGATION, METAL BINDING PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 1
*AUTHOR I.BERTINI, C.LUCHINAT, G.PARIGI, J.YUAN
*REVDAT 1 05-MAY-09 2K61 0
;
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k61
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.4 -50.8 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2k61 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.3 185.5 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2k61 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.5 -46.5 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2k61 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.3 -26.9 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2k61 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.6 -47.4 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2k61 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 -25.8 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2k61 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -50.6 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2k61 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.0 -13.8 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2k61 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.1 -53.1 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2k61 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.6 -21.8 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2k61 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.3 -49.7 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2k61 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 -23.8 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2k61 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -53.1 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2k61 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.7 -28.1 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2k61 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.4 -55.2 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2k61 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.2 -5.4 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2k61 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -52.9 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2k61 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.1 -19.3 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2k61 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.9 -53.7 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2k61 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.9 -15.7 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2k61 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.2 -46.8 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2k61 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 -27.4 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2k61 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -44.0 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2k61 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.4 -36.4 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2k61 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.7 -46.7 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2k61 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.3 -11.1 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2k61 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.9 -52.7 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2k61 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.3 5.5 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2k61 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.1 -30.3 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2k61 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -1.9 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2k61 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.4 -71.2 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2k61 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -7.4 24.2 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2k61 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.3 -55.5 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2k61 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.8 27.8 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2k61 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2k61 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2k61 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.9 -117.7 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2k61 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.8 184.8 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2k61 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.3 -77.7 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2k61 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.3 135.9 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2k61 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.8 -61.6 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2k61 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 159.9 185.7 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2k61 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.6 -48.4 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2k61 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.4 -26.2 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2k61 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.1 -50.9 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2k61 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.7 -28.9 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2k61 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.4 -51.8 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2k61 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -27.2 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2k61 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.3 -34.3 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2k61 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 4.5 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2k61 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.4 -54.2 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2k61 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 -26.8 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2k61 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -48.8 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2k61 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.4 -29.4 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2k61 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.8 -51.8 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2k61 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.1 -31.1 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2k61 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.8 -53.4 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2k61 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.4 -25.4 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2k61 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.2 -50.4 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2k61 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.5 -4.5 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2k61 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.2 -72.4 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2k61 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.6 181.2 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2k61 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.6 -46.6 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2k61 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 69.1 200.7 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2k61 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.7 -54.1 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2k61 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 144.7 182.7 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2k61 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.7 -46.7 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2k61 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.9 -27.7 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2k61 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.4 -45.4 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2k61 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.8 -17.2 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2k61 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.2 -50.6 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2k61 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.2 -13.2 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2k61 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.6 -47.0 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2k61 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.5 -22.9 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2k61 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.1 -49.7 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2k61 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.7 -15.3 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2k61 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.5 -53.9 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2k61 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.0 -24.8 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2k61 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.1 -54.5 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2k61 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.7 -27.3 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2k61 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.9 -53.7 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2k61 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.2 -27.8 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2k61 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.5 -45.5 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2k61 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.9 -24.7 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2k61 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.2 -47.0 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_2k61 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.5 -10.3 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_2k61 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.9 -80.7 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2k61 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -18.9 30.1 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2k61 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.4 -39.8 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2k61 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 77.1 178.7 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2k61 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.7 -70.9 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2k61 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.6 24.8 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2k61 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.3 -55.5 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2k61 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.8 27.8 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2k61 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2k61 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2k61 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.4 -102.4 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2k61 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139.5 176.7 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2k61 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -89.2 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2k61 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.7 158.9 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2k61 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.6 -73.2 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2k61 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 56.5 238.7 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2k61 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.0 -44.8 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2k61 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.3 -36.7 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2k61 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.1 -45.3 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2k61 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.8 -23.6 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2k61 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.8 -50.8 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2k61 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.1 -35.3 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2k61 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.5 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2k61 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.1 -25.3 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2k61 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -52.9 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2k61 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.5 -32.5 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2k61 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -48.2 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2k61 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.1 -16.9 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2k61 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -48.6 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2k61 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.1 -19.1 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2k61 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.2 -50.2 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2k61 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.7 -28.7 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2k61 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.6 -41.2 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2k61 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.6 -7.8 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2k61 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.0 -41.0 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2k61 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.2 35.0 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_2k61 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.7 -50.7 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2k61 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.8 -25.8 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2k61 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.9 -44.7 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_2k61 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.3 -17.9 . . 83 . N . 83 . CA . 83 . C . 84 . N parsed_2k61 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.8 -55.0 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_2k61 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.3 -26.7 . . 84 . N . 84 . CA . 84 . C . 85 . N parsed_2k61 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.7 -54.9 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_2k61 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.8 -14.8 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_2k61 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -49.8 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_2k61 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.0 -17.6 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_2k61 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.2 -46.6 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_2k61 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 -24.0 . . 87 . N . 87 . CA . 87 . C . 88 . N parsed_2k61 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.9 -54.9 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2k61 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.7 -18.3 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_2k61 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.8 -48.0 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_2k61 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -10.0 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_2k61 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.9 -49.1 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2k61 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.3 -16.3 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_2k61 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.6 -51.8 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_2k61 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.9 11.5 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_2k61 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.1 -30.3 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2k61 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -1.9 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2k61 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.7 -72.5 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_2k61 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -7.7 21.9 . . 95 . N . 95 . CA . 95 . C . 96 . N parsed_2k61 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_2k61 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 98 . N . 98 . CA . 98 . C . 99 . N parsed_2k61 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.6 -117.4 . . 98 . C . 99 . N . 99 . CA . 99 . C parsed_2k61 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.9 185.3 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_2k61 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.1 -86.1 . . 99 . C . 100 . N . 100 . CA . 100 . C parsed_2k61 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.8 136.2 . . 100 . N . 100 . CA . 100 . C . 101 . N parsed_2k61 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.9 -62.3 . . 100 . C . 101 . N . 101 . CA . 101 . C parsed_2k61 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.9 194.7 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_2k61 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.8 -41.0 . . 101 . C . 102 . N . 102 . CA . 102 . C parsed_2k61 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.8 -19.8 . . 102 . N . 102 . CA . 102 . C . 103 . N parsed_2k61 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.1 -53.1 . . 102 . C . 103 . N . 103 . CA . 103 . C parsed_2k61 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.7 -25.9 . . 103 . N . 103 . CA . 103 . C . 104 . N parsed_2k61 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.6 -51.8 . . 103 . C . 104 . N . 104 . CA . 104 . C parsed_2k61 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.7 -25.3 . . 104 . N . 104 . CA . 104 . C . 105 . N parsed_2k61 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -53.3 . . 104 . C . 105 . N . 105 . CA . 105 . C parsed_2k61 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.2 -25.2 . . 105 . N . 105 . CA . 105 . C . 106 . N parsed_2k61 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.3 -54.3 . . 105 . C . 106 . N . 106 . CA . 106 . C parsed_2k61 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.3 -30.3 . . 106 . N . 106 . CA . 106 . C . 107 . N parsed_2k61 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.1 -45.5 . . 106 . C . 107 . N . 107 . CA . 107 . C parsed_2k61 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.7 -21.7 . . 107 . N . 107 . CA . 107 . C . 108 . N parsed_2k61 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.4 -54.4 . . 107 . C . 108 . N . 108 . CA . 108 . C parsed_2k61 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 -32.0 . . 108 . N . 108 . CA . 108 . C . 109 . N parsed_2k61 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.9 -53.9 . . 108 . C . 109 . N . 109 . CA . 109 . C parsed_2k61 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.8 -24.2 . . 109 . N . 109 . CA . 109 . C . 110 . N parsed_2k61 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.6 -53.4 . . 109 . C . 110 . N . 110 . CA . 110 . C parsed_2k61 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.6 -20.2 . . 110 . N . 110 . CA . 110 . C . 111 . N parsed_2k61 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.4 -54.4 . . 110 . C . 111 . N . 111 . CA . 111 . C parsed_2k61 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.8 -17.8 . . 111 . N . 111 . CA . 111 . C . 112 . N parsed_2k61 1
175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 64.8 114.6 . . 112 . C . 113 . N . 113 . CA . 113 . C parsed_2k61 1
176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.5 46.1 . . 113 . N . 113 . CA . 113 . C . 114 . N parsed_2k61 1
177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.3 -43.1 . . 113 . C . 114 . N . 114 . CA . 114 . C parsed_2k61 1
178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.2 164.8 . . 114 . N . 114 . CA . 114 . C . 115 . N parsed_2k61 1
179 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.6 -85.4 . . 114 . C . 115 . N . 115 . CA . 115 . C parsed_2k61 1
180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 83.6 133.8 . . 115 . N . 115 . CA . 115 . C . 116 . N parsed_2k61 1
181 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.6 -56.6 . . 115 . C . 116 . N . 116 . CA . 116 . C parsed_2k61 1
182 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.1 162.1 . . 116 . N . 116 . CA . 116 . C . 117 . N parsed_2k61 1
183 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.2 -67.8 . . 116 . C . 117 . N . 117 . CA . 117 . C parsed_2k61 1
184 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 155.4 179.4 . . 117 . N . 117 . CA . 117 . C . 118 . N parsed_2k61 1
185 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -48.4 . . 117 . C . 118 . N . 118 . CA . 118 . C parsed_2k61 1
186 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.9 -25.1 . . 118 . N . 118 . CA . 118 . C . 119 . N parsed_2k61 1
187 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.1 -47.3 . . 118 . C . 119 . N . 119 . CA . 119 . C parsed_2k61 1
188 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.0 -30.0 . . 119 . N . 119 . CA . 119 . C . 120 . N parsed_2k61 1
189 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.7 -53.3 . . 119 . C . 120 . N . 120 . CA . 120 . C parsed_2k61 1
190 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.1 -20.3 . . 120 . N . 120 . CA . 120 . C . 121 . N parsed_2k61 1
191 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.9 -50.1 . . 120 . C . 121 . N . 121 . CA . 121 . C parsed_2k61 1
192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.6 -25.4 . . 121 . N . 121 . CA . 121 . C . 122 . N parsed_2k61 1
193 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.6 -51.0 . . 121 . C . 122 . N . 122 . CA . 122 . C parsed_2k61 1
194 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.0 -25.0 . . 122 . N . 122 . CA . 122 . C . 123 . N parsed_2k61 1
195 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.9 -51.9 . . 122 . C . 123 . N . 123 . CA . 123 . C parsed_2k61 1
196 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.2 -33.2 . . 123 . N . 123 . CA . 123 . C . 124 . N parsed_2k61 1
197 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.5 -48.5 . . 123 . C . 124 . N . 124 . CA . 124 . C parsed_2k61 1
198 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.1 -31.1 . . 124 . N . 124 . CA . 124 . C . 125 . N parsed_2k61 1
199 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.4 -54.2 . . 124 . C . 125 . N . 125 . CA . 125 . C parsed_2k61 1
200 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.3 -30.3 . . 125 . N . 125 . CA . 125 . C . 126 . N parsed_2k61 1
201 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -49.8 . . 125 . C . 126 . N . 126 . CA . 126 . C parsed_2k61 1
202 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.9 -10.3 . . 126 . N . 126 . CA . 126 . C . 127 . N parsed_2k61 1
203 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.1 -30.1 . . 126 . C . 127 . N . 127 . CA . 127 . C parsed_2k61 1
204 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.0 0.6 . . 127 . N . 127 . CA . 127 . C . 128 . N parsed_2k61 1
205 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -107.1 -31.3 . . 129 . C . 130 . N . 130 . CA . 130 . C parsed_2k61 1
206 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.5 -16.5 . . 130 . N . 130 . CA . 130 . C . 131 . N parsed_2k61 1
207 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.1 -70.1 . . 130 . C . 131 . N . 131 . CA . 131 . C parsed_2k61 1
208 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 24.3 . . 131 . N . 131 . CA . 131 . C . 132 . N parsed_2k61 1
209 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 133 . C . 134 . N . 134 . CA . 134 . C parsed_2k61 1
210 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 134 . N . 134 . CA . 134 . C . 135 . N parsed_2k61 1
211 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.7 -117.1 . . 134 . C . 135 . N . 135 . CA . 135 . C parsed_2k61 1
212 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.7 185.3 . . 135 . N . 135 . CA . 135 . C . 136 . N parsed_2k61 1
213 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.4 -94.6 . . 135 . C . 136 . N . 136 . CA . 136 . C parsed_2k61 1
214 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.5 136.7 . . 136 . N . 136 . CA . 136 . C . 137 . N parsed_2k61 1
215 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -47.0 . . 137 . C . 138 . N . 138 . CA . 138 . C parsed_2k61 1
216 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.4 -31.6 . . 138 . N . 138 . CA . 138 . C . 139 . N parsed_2k61 1
217 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -48.4 . . 138 . C . 139 . N . 139 . CA . 139 . C parsed_2k61 1
218 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.1 -14.1 . . 139 . N . 139 . CA . 139 . C . 140 . N parsed_2k61 1
219 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -58.6 . . 139 . C . 140 . N . 140 . CA . 140 . C parsed_2k61 1
220 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.1 -17.7 . . 140 . N . 140 . CA . 140 . C . 141 . N parsed_2k61 1
221 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -52.9 . . 140 . C . 141 . N . 141 . CA . 141 . C parsed_2k61 1
222 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 -35.8 . . 141 . N . 141 . CA . 141 . C . 142 . N parsed_2k61 1
223 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.6 -53.6 . . 141 . C . 142 . N . 142 . CA . 142 . C parsed_2k61 1
224 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.6 -30.8 . . 142 . N . 142 . CA . 142 . C . 143 . N parsed_2k61 1
225 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.7 -53.7 . . 142 . C . 143 . N . 143 . CA . 143 . C parsed_2k61 1
226 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.0 -18.6 . . 143 . N . 143 . CA . 143 . C . 144 . N parsed_2k61 1
227 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.6 . . 143 . C . 144 . N . 144 . CA . 144 . C parsed_2k61 1
228 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.4 11.2 . . 144 . N . 144 . CA . 144 . C . 145 . N parsed_2k61 1
229 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.7 -15.7 . . 146 . C . 147 . N . 147 . CA . 147 . C parsed_2k61 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . -14.6860 . . . . . 5 . N . 5 . HN parsed_2k61 1
2 . . . . . . . . . . . . . . . . 9.2940 . . . . . 6 . N . 6 . HN parsed_2k61 1
3 . . . . . . . . . . . . . . . . 4.6110 . . . . . 7 . N . 7 . HN parsed_2k61 1
4 . . . . . . . . . . . . . . . . -5.3920 . . . . . 8 . N . 8 . HN parsed_2k61 1
5 . . . . . . . . . . . . . . . . 7.3070 . . . . . 9 . N . 9 . HN parsed_2k61 1
6 . . . . . . . . . . . . . . . . 9.6490 . . . . . 10 . N . 10 . HN parsed_2k61 1
7 . . . . . . . . . . . . . . . . 2.0570 . . . . . 12 . N . 12 . HN parsed_2k61 1
8 . . . . . . . . . . . . . . . . 14.9700 . . . . . 13 . N . 13 . HN parsed_2k61 1
9 . . . . . . . . . . . . . . . . 5.6050 . . . . . 14 . N . 14 . HN parsed_2k61 1
10 . . . . . . . . . . . . . . . . -1.9860 . . . . . 15 . N . 15 . HN parsed_2k61 1
11 . . . . . . . . . . . . . . . . 7.8040 . . . . . 16 . N . 16 . HN parsed_2k61 1
12 . . . . . . . . . . . . . . . . 14.4730 . . . . . 17 . N . 17 . HN parsed_2k61 1
13 . . . . . . . . . . . . . . . . -21.8520 . . . . . 37 . N . 37 . HN parsed_2k61 1
14 . . . . . . . . . . . . . . . . -23.7680 . . . . . 38 . N . 38 . HN parsed_2k61 1
15 . . . . . . . . . . . . . . . . -9.0100 . . . . . 40 . N . 40 . HN parsed_2k61 1
16 . . . . . . . . . . . . . . . . -21.9940 . . . . . 76 . N . 76 . HN parsed_2k61 1
17 . . . . . . . . . . . . . . . . -5.3210 . . . . . 83 . N . 83 . HN parsed_2k61 1
18 . . . . . . . . . . . . . . . . -2.4120 . . . . . 85 . N . 85 . HN parsed_2k61 1
19 . . . . . . . . . . . . . . . . -2.9790 . . . . . 86 . N . 86 . HN parsed_2k61 1
20 . . . . . . . . . . . . . . . . -9.0100 . . . . . 87 . N . 87 . HN parsed_2k61 1
21 . . . . . . . . . . . . . . . . 0.7800 . . . . . 88 . N . 88 . HN parsed_2k61 1
22 . . . . . . . . . . . . . . . . -2.9080 . . . . . 89 . N . 89 . HN parsed_2k61 1
23 . . . . . . . . . . . . . . . . -6.7400 . . . . . 90 . N . 90 . HN parsed_2k61 1
24 . . . . . . . . . . . . . . . . 2.0570 . . . . . 91 . N . 91 . HN parsed_2k61 1
25 . . . . . . . . . . . . . . . . 13.6220 . . . . . 94 . N . 94 . HN parsed_2k61 1
26 . . . . . . . . . . . . . . . . 25.1870 . . . . . 95 . N . 95 . HN parsed_2k61 1
27 . . . . . . . . . . . . . . . . -9.0100 . . . . . 96 . N . 96 . HN parsed_2k61 1
28 . . . . . . . . . . . . . . . . -3.8310 . . . . . 97 . N . 97 . HN parsed_2k61 1
29 . . . . . . . . . . . . . . . . -12.9120 . . . . . 98 . N . 98 . HN parsed_2k61 1
30 . . . . . . . . . . . . . . . . 15.1120 . . . . . 99 . N . 99 . HN parsed_2k61 1
31 . . . . . . . . . . . . . . . . 10.2870 . . . . . 100 . N . 100 . HN parsed_2k61 1
32 . . . . . . . . . . . . . . . . 23.9100 . . . . . 101 . N . 101 . HN parsed_2k61 1
33 . . . . . . . . . . . . . . . . -12.0610 . . . . . 102 . N . 102 . HN parsed_2k61 1
34 . . . . . . . . . . . . . . . . -20.6460 . . . . . 103 . N . 103 . HN parsed_2k61 1
35 . . . . . . . . . . . . . . . . -19.3690 . . . . . 106 . N . 106 . HN parsed_2k61 1
36 . . . . . . . . . . . . . . . . -13.1960 . . . . . 108 . N . 108 . HN parsed_2k61 1
37 . . . . . . . . . . . . . . . . -14.8290 . . . . . 109 . N . 109 . HN parsed_2k61 1
38 . . . . . . . . . . . . . . . . -17.1700 . . . . . 111 . N . 111 . HN parsed_2k61 1
39 . . . . . . . . . . . . . . . . -9.2940 . . . . . 112 . N . 112 . HN parsed_2k61 1
40 . . . . . . . . . . . . . . . . -3.9020 . . . . . 114 . N . 114 . HN parsed_2k61 1
41 . . . . . . . . . . . . . . . . 6.5980 . . . . . 117 . N . 117 . HN parsed_2k61 1
42 . . . . . . . . . . . . . . . . -7.8750 . . . . . 119 . N . 119 . HN parsed_2k61 1
43 . . . . . . . . . . . . . . . . -3.4770 . . . . . 120 . N . 120 . HN parsed_2k61 1
44 . . . . . . . . . . . . . . . . -8.7970 . . . . . 123 . N . 123 . HN parsed_2k61 1
45 . . . . . . . . . . . . . . . . -7.2360 . . . . . 126 . N . 126 . HN parsed_2k61 1
46 . . . . . . . . . . . . . . . . -1.9150 . . . . . 128 . N . 128 . HN parsed_2k61 1
47 . . . . . . . . . . . . . . . . -5.7460 . . . . . 129 . N . 129 . HN parsed_2k61 1
48 . . . . . . . . . . . . . . . . 14.1900 . . . . . 131 . N . 131 . HN parsed_2k61 1
49 . . . . . . . . . . . . . . . . -17.5240 . . . . . 132 . N . 132 . HN parsed_2k61 1
50 . . . . . . . . . . . . . . . . -5.9590 . . . . . 133 . N . 133 . HN parsed_2k61 1
51 . . . . . . . . . . . . . . . . 5.9590 . . . . . 134 . N . 134 . HN parsed_2k61 1
52 . . . . . . . . . . . . . . . . -5.7460 . . . . . 135 . N . 135 . HN parsed_2k61 1
53 . . . . . . . . . . . . . . . . 7.3780 . . . . . 136 . N . 136 . HN parsed_2k61 1
54 . . . . . . . . . . . . . . . . 20.7880 . . . . . 137 . N . 137 . HN parsed_2k61 1
55 . . . . . . . . . . . . . . . . -14.5440 . . . . . 139 . N . 139 . HN parsed_2k61 1
56 . . . . . . . . . . . . . . . . -4.7530 . . . . . 140 . N . 140 . HN parsed_2k61 1
57 . . . . . . . . . . . . . . . . -14.8990 . . . . . 142 . N . 142 . HN parsed_2k61 1
58 . . . . . . . . . . . . . . . . -0.2840 . . . . . 143 . N . 143 . HN parsed_2k61 1
59 . . . . . . . . . . . . . . . . -18.9430 . . . . . 146 . N . 146 . HN parsed_2k61 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 2
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . 15.2540 . . . . . 5 . N . 5 . HN parsed_2k61 2
2 . . . . . . . . . . . . . . . . -5.9590 . . . . . 6 . N . 6 . HN parsed_2k61 2
3 . . . . . . . . . . . . . . . . -6.1720 . . . . . 7 . N . 7 . HN parsed_2k61 2
4 . . . . . . . . . . . . . . . . 0.1420 . . . . . 8 . N . 8 . HN parsed_2k61 2
5 . . . . . . . . . . . . . . . . -5.0370 . . . . . 9 . N . 9 . HN parsed_2k61 2
6 . . . . . . . . . . . . . . . . -9.2940 . . . . . 10 . N . 10 . HN parsed_2k61 2
7 . . . . . . . . . . . . . . . . -4.8240 . . . . . 11 . N . 11 . HN parsed_2k61 2
8 . . . . . . . . . . . . . . . . -9.8620 . . . . . 13 . N . 13 . HN parsed_2k61 2
9 . . . . . . . . . . . . . . . . -5.6050 . . . . . 14 . N . 14 . HN parsed_2k61 2
10 . . . . . . . . . . . . . . . . -4.3980 . . . . . 15 . N . 15 . HN parsed_2k61 2
11 . . . . . . . . . . . . . . . . -3.9730 . . . . . 18 . N . 18 . HN parsed_2k61 2
12 . . . . . . . . . . . . . . . . -10.2160 . . . . . 20 . N . 20 . HN parsed_2k61 2
13 . . . . . . . . . . . . . . . . -11.2810 . . . . . 22 . N . 22 . HN parsed_2k61 2
14 . . . . . . . . . . . . . . . . 12.0610 . . . . . 23 . N . 23 . HN parsed_2k61 2
15 . . . . . . . . . . . . . . . . 14.8990 . . . . . 31 . N . 31 . HN parsed_2k61 2
16 . . . . . . . . . . . . . . . . 5.8170 . . . . . 32 . N . 32 . HN parsed_2k61 2
17 . . . . . . . . . . . . . . . . 8.1590 . . . . . 33 . N . 33 . HN parsed_2k61 2
18 . . . . . . . . . . . . . . . . 13.5510 . . . . . 35 . N . 35 . HN parsed_2k61 2
19 . . . . . . . . . . . . . . . . 11.9190 . . . . . 36 . N . 36 . HN parsed_2k61 2
20 . . . . . . . . . . . . . . . . 14.8280 . . . . . 37 . N . 37 . HN parsed_2k61 2
21 . . . . . . . . . . . . . . . . 3.0500 . . . . . 40 . N . 40 . HN parsed_2k61 2
22 . . . . . . . . . . . . . . . . -3.9730 . . . . . 44 . N . 44 . HN parsed_2k61 2
23 . . . . . . . . . . . . . . . . -2.9080 . . . . . 45 . N . 45 . HN parsed_2k61 2
24 . . . . . . . . . . . . . . . . 3.8310 . . . . . 46 . N . 46 . HN parsed_2k61 2
25 . . . . . . . . . . . . . . . . 5.0370 . . . . . 47 . N . 47 . HN parsed_2k61 2
26 . . . . . . . . . . . . . . . . -2.1280 . . . . . 49 . N . 49 . HN parsed_2k61 2
27 . . . . . . . . . . . . . . . . 9.5070 . . . . . 50 . N . 50 . HN parsed_2k61 2
28 . . . . . . . . . . . . . . . . -0.0000 . . . . . 51 . N . 51 . HN parsed_2k61 2
29 . . . . . . . . . . . . . . . . -2.0570 . . . . . 85 . N . 85 . HN parsed_2k61 2
30 . . . . . . . . . . . . . . . . -2.9790 . . . . . 86 . N . 86 . HN parsed_2k61 2
31 . . . . . . . . . . . . . . . . -3.1210 . . . . . 88 . N . 88 . HN parsed_2k61 2
32 . . . . . . . . . . . . . . . . -2.7670 . . . . . 89 . N . 89 . HN parsed_2k61 2
33 . . . . . . . . . . . . . . . . -3.7600 . . . . . 90 . N . 90 . HN parsed_2k61 2
34 . . . . . . . . . . . . . . . . -4.0440 . . . . . 91 . N . 91 . HN parsed_2k61 2
35 . . . . . . . . . . . . . . . . -7.3070 . . . . . 94 . N . 94 . HN parsed_2k61 2
36 . . . . . . . . . . . . . . . . -15.1830 . . . . . 95 . N . 95 . HN parsed_2k61 2
37 . . . . . . . . . . . . . . . . 8.0880 . . . . . 96 . N . 96 . HN parsed_2k61 2
38 . . . . . . . . . . . . . . . . 3.6180 . . . . . 97 . N . 97 . HN parsed_2k61 2
39 . . . . . . . . . . . . . . . . 9.4360 . . . . . 98 . N . 98 . HN parsed_2k61 2
40 . . . . . . . . . . . . . . . . -9.2940 . . . . . 99 . N . 99 . HN parsed_2k61 2
41 . . . . . . . . . . . . . . . . -6.3850 . . . . . 100 . N . 100 . HN parsed_2k61 2
42 . . . . . . . . . . . . . . . . -13.2670 . . . . . 101 . N . 101 . HN parsed_2k61 2
43 . . . . . . . . . . . . . . . . 11.7060 . . . . . 102 . N . 102 . HN parsed_2k61 2
44 . . . . . . . . . . . . . . . . 14.1190 . . . . . 103 . N . 103 . HN parsed_2k61 2
45 . . . . . . . . . . . . . . . . 11.5640 . . . . . 108 . N . 108 . HN parsed_2k61 2
46 . . . . . . . . . . . . . . . . 13.4800 . . . . . 109 . N . 109 . HN parsed_2k61 2
47 . . . . . . . . . . . . . . . . 16.4600 . . . . . 111 . N . 111 . HN parsed_2k61 2
48 . . . . . . . . . . . . . . . . 7.8750 . . . . . 112 . N . 112 . HN parsed_2k61 2
49 . . . . . . . . . . . . . . . . 4.4690 . . . . . 114 . N . 114 . HN parsed_2k61 2
50 . . . . . . . . . . . . . . . . -3.4050 . . . . . 117 . N . 117 . HN parsed_2k61 2
51 . . . . . . . . . . . . . . . . -3.6890 . . . . . 118 . N . 118 . HN parsed_2k61 2
52 . . . . . . . . . . . . . . . . 4.6110 . . . . . 119 . N . 119 . HN parsed_2k61 2
53 . . . . . . . . . . . . . . . . 0.6380 . . . . . 120 . N . 120 . HN parsed_2k61 2
54 . . . . . . . . . . . . . . . . -1.2060 . . . . . 124 . N . 124 . HN parsed_2k61 2
55 . . . . . . . . . . . . . . . . 2.4830 . . . . . 126 . N . 126 . HN parsed_2k61 2
56 . . . . . . . . . . . . . . . . -2.2700 . . . . . 128 . N . 128 . HN parsed_2k61 2
57 . . . . . . . . . . . . . . . . 3.5470 . . . . . 129 . N . 129 . HN parsed_2k61 2
58 . . . . . . . . . . . . . . . . 8.2300 . . . . . 132 . N . 132 . HN parsed_2k61 2
59 . . . . . . . . . . . . . . . . 0.2830 . . . . . 133 . N . 133 . HN parsed_2k61 2
60 . . . . . . . . . . . . . . . . -5.3920 . . . . . 134 . N . 134 . HN parsed_2k61 2
61 . . . . . . . . . . . . . . . . 4.5400 . . . . . 135 . N . 135 . HN parsed_2k61 2
62 . . . . . . . . . . . . . . . . -3.6180 . . . . . 136 . N . 136 . HN parsed_2k61 2
63 . . . . . . . . . . . . . . . . -9.0810 . . . . . 137 . N . 137 . HN parsed_2k61 2
64 . . . . . . . . . . . . . . . . 14.7570 . . . . . 139 . N . 139 . HN parsed_2k61 2
65 . . . . . . . . . . . . . . . . 1.2060 . . . . . 140 . N . 140 . HN parsed_2k61 2
66 . . . . . . . . . . . . . . . . 10.7130 . . . . . 146 . N . 146 . HN parsed_2k61 2
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 3
_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 . . . . . . . . . . . . . . . . 4.7530 . . . . . 5 . N . 5 . HN parsed_2k61 3
2 . . . . . . . . . . . . . . . . -1.7730 . . . . . 6 . N . 6 . HN parsed_2k61 3
3 . . . . . . . . . . . . . . . . -1.9860 . . . . . 7 . N . 7 . HN parsed_2k61 3
4 . . . . . . . . . . . . . . . . 1.5600 . . . . . 8 . N . 8 . HN parsed_2k61 3
5 . . . . . . . . . . . . . . . . -0.2830 . . . . . 9 . N . 9 . HN parsed_2k61 3
6 . . . . . . . . . . . . . . . . -4.9660 . . . . . 10 . N . 10 . HN parsed_2k61 3
7 . . . . . . . . . . . . . . . . -1.9150 . . . . . 11 . N . 11 . HN parsed_2k61 3
8 . . . . . . . . . . . . . . . . -3.4050 . . . . . 13 . N . 13 . HN parsed_2k61 3
9 . . . . . . . . . . . . . . . . -2.4830 . . . . . 15 . N . 15 . HN parsed_2k61 3
10 . . . . . . . . . . . . . . . . -1.7020 . . . . . 16 . N . 16 . HN parsed_2k61 3
11 . . . . . . . . . . . . . . . . -4.4690 . . . . . 17 . N . 17 . HN parsed_2k61 3
12 . . . . . . . . . . . . . . . . -3.1920 . . . . . 18 . N . 18 . HN parsed_2k61 3
13 . . . . . . . . . . . . . . . . -1.5600 . . . . . 19 . N . 19 . HN parsed_2k61 3
14 . . . . . . . . . . . . . . . . -3.1210 . . . . . 20 . N . 20 . HN parsed_2k61 3
15 . . . . . . . . . . . . . . . . -2.9790 . . . . . 21 . N . 21 . HN parsed_2k61 3
16 . . . . . . . . . . . . . . . . -4.0440 . . . . . 22 . N . 22 . HN parsed_2k61 3
17 . . . . . . . . . . . . . . . . 1.2770 . . . . . 23 . N . 23 . HN parsed_2k61 3
18 . . . . . . . . . . . . . . . . 6.9530 . . . . . 25 . N . 25 . HN parsed_2k61 3
19 . . . . . . . . . . . . . . . . -1.7020 . . . . . 26 . N . 26 . HN parsed_2k61 3
20 . . . . . . . . . . . . . . . . -2.6960 . . . . . 28 . N . 28 . HN parsed_2k61 3
21 . . . . . . . . . . . . . . . . 1.4890 . . . . . 29 . N . 29 . HN parsed_2k61 3
22 . . . . . . . . . . . . . . . . 5.6050 . . . . . 30 . N . 30 . HN parsed_2k61 3
23 . . . . . . . . . . . . . . . . 7.4490 . . . . . 31 . N . 31 . HN parsed_2k61 3
24 . . . . . . . . . . . . . . . . 1.9860 . . . . . 32 . N . 32 . HN parsed_2k61 3
25 . . . . . . . . . . . . . . . . 0.4960 . . . . . 33 . N . 33 . HN parsed_2k61 3
26 . . . . . . . . . . . . . . . . 5.1790 . . . . . 36 . N . 36 . HN parsed_2k61 3
27 . . . . . . . . . . . . . . . . 2.8380 . . . . . 37 . N . 37 . HN parsed_2k61 3
28 . . . . . . . . . . . . . . . . 4.3270 . . . . . 38 . N . 38 . HN parsed_2k61 3
29 . . . . . . . . . . . . . . . . -2.3410 . . . . . 40 . N . 40 . HN parsed_2k61 3
30 . . . . . . . . . . . . . . . . -4.5400 . . . . . 44 . N . 44 . HN parsed_2k61 3
31 . . . . . . . . . . . . . . . . -0.0700 . . . . . 45 . N . 45 . HN parsed_2k61 3
32 . . . . . . . . . . . . . . . . 2.8380 . . . . . 46 . N . 46 . HN parsed_2k61 3
33 . . . . . . . . . . . . . . . . 3.4760 . . . . . 47 . N . 47 . HN parsed_2k61 3
34 . . . . . . . . . . . . . . . . 1.7020 . . . . . 49 . N . 49 . HN parsed_2k61 3
35 . . . . . . . . . . . . . . . . 4.8950 . . . . . 50 . N . 50 . HN parsed_2k61 3
36 . . . . . . . . . . . . . . . . 2.2700 . . . . . 51 . N . 51 . HN parsed_2k61 3
37 . . . . . . . . . . . . . . . . -1.4890 . . . . . 52 . N . 52 . HN parsed_2k61 3
38 . . . . . . . . . . . . . . . . 3.4050 . . . . . 53 . N . 53 . HN parsed_2k61 3
39 . . . . . . . . . . . . . . . . 6.1720 . . . . . 54 . N . 54 . HN parsed_2k61 3
40 . . . . . . . . . . . . . . . . 0.6380 . . . . . 69 . N . 69 . HN parsed_2k61 3
41 . . . . . . . . . . . . . . . . 0.7800 . . . . . 70 . N . 70 . HN parsed_2k61 3
42 . . . . . . . . . . . . . . . . -1.4890 . . . . . 71 . N . 71 . HN parsed_2k61 3
43 . . . . . . . . . . . . . . . . 2.1280 . . . . . 73 . N . 73 . HN parsed_2k61 3
44 . . . . . . . . . . . . . . . . -0.4250 . . . . . 74 . N . 74 . HN parsed_2k61 3
45 . . . . . . . . . . . . . . . . -1.2770 . . . . . 75 . N . 75 . HN parsed_2k61 3
46 . . . . . . . . . . . . . . . . 3.9020 . . . . . 76 . N . 76 . HN parsed_2k61 3
47 . . . . . . . . . . . . . . . . 0.7800 . . . . . 83 . N . 83 . HN parsed_2k61 3
48 . . . . . . . . . . . . . . . . 0.1410 . . . . . 84 . N . 84 . HN parsed_2k61 3
49 . . . . . . . . . . . . . . . . -1.5600 . . . . . 85 . N . 85 . HN parsed_2k61 3
50 . . . . . . . . . . . . . . . . -0.3540 . . . . . 87 . N . 87 . HN parsed_2k61 3
51 . . . . . . . . . . . . . . . . -0.9930 . . . . . 88 . N . 88 . HN parsed_2k61 3
52 . . . . . . . . . . . . . . . . -1.4890 . . . . . 89 . N . 89 . HN parsed_2k61 3
53 . . . . . . . . . . . . . . . . 0.3540 . . . . . 90 . N . 90 . HN parsed_2k61 3
54 . . . . . . . . . . . . . . . . -0.4960 . . . . . 91 . N . 91 . HN parsed_2k61 3
55 . . . . . . . . . . . . . . . . -2.8380 . . . . . 94 . N . 94 . HN parsed_2k61 3
56 . . . . . . . . . . . . . . . . -4.6110 . . . . . 95 . N . 95 . HN parsed_2k61 3
57 . . . . . . . . . . . . . . . . 2.5540 . . . . . 96 . N . 96 . HN parsed_2k61 3
58 . . . . . . . . . . . . . . . . -0.1410 . . . . . 97 . N . 97 . HN parsed_2k61 3
59 . . . . . . . . . . . . . . . . 1.3480 . . . . . 98 . N . 98 . HN parsed_2k61 3
60 . . . . . . . . . . . . . . . . -2.6250 . . . . . 99 . N . 99 . HN parsed_2k61 3
61 . . . . . . . . . . . . . . . . -2.6250 . . . . . 100 . N . 100 . HN parsed_2k61 3
62 . . . . . . . . . . . . . . . . -3.4760 . . . . . 101 . N . 101 . HN parsed_2k61 3
63 . . . . . . . . . . . . . . . . 3.7600 . . . . . 102 . N . 102 . HN parsed_2k61 3
64 . . . . . . . . . . . . . . . . 4.3270 . . . . . 104 . N . 104 . HN parsed_2k61 3
65 . . . . . . . . . . . . . . . . 3.5470 . . . . . 105 . N . 105 . HN parsed_2k61 3
66 . . . . . . . . . . . . . . . . 5.8880 . . . . . 106 . N . 106 . HN parsed_2k61 3
67 . . . . . . . . . . . . . . . . 2.9080 . . . . . 108 . N . 108 . HN parsed_2k61 3
68 . . . . . . . . . . . . . . . . 5.1790 . . . . . 109 . N . 109 . HN parsed_2k61 3
69 . . . . . . . . . . . . . . . . 4.5400 . . . . . 111 . N . 111 . HN parsed_2k61 3
70 . . . . . . . . . . . . . . . . 1.5600 . . . . . 114 . N . 114 . HN parsed_2k61 3
71 . . . . . . . . . . . . . . . . -0.7800 . . . . . 117 . N . 117 . HN parsed_2k61 3
72 . . . . . . . . . . . . . . . . -3.1920 . . . . . 118 . N . 118 . HN parsed_2k61 3
73 . . . . . . . . . . . . . . . . -0.4250 . . . . . 119 . N . 119 . HN parsed_2k61 3
74 . . . . . . . . . . . . . . . . -4.1860 . . . . . 121 . N . 121 . HN parsed_2k61 3
75 . . . . . . . . . . . . . . . . -2.7670 . . . . . 124 . N . 124 . HN parsed_2k61 3
76 . . . . . . . . . . . . . . . . -1.2770 . . . . . 126 . N . 126 . HN parsed_2k61 3
77 . . . . . . . . . . . . . . . . -2.9790 . . . . . 128 . N . 128 . HN parsed_2k61 3
78 . . . . . . . . . . . . . . . . -0.4960 . . . . . 129 . N . 129 . HN parsed_2k61 3
79 . . . . . . . . . . . . . . . . -3.0500 . . . . . 131 . N . 131 . HN parsed_2k61 3
80 . . . . . . . . . . . . . . . . 2.3410 . . . . . 132 . N . 132 . HN parsed_2k61 3
81 . . . . . . . . . . . . . . . . 1.9860 . . . . . 133 . N . 133 . HN parsed_2k61 3
82 . . . . . . . . . . . . . . . . -0.9930 . . . . . 134 . N . 134 . HN parsed_2k61 3
83 . . . . . . . . . . . . . . . . -0.7090 . . . . . 135 . N . 135 . HN parsed_2k61 3
84 . . . . . . . . . . . . . . . . -2.6250 . . . . . 136 . N . 136 . HN parsed_2k61 3
85 . . . . . . . . . . . . . . . . -2.7670 . . . . . 137 . N . 137 . HN parsed_2k61 3
86 . . . . . . . . . . . . . . . . 5.4630 . . . . . 139 . N . 139 . HN parsed_2k61 3
87 . . . . . . . . . . . . . . . . 2.3410 . . . . . 140 . N . 140 . HN parsed_2k61 3
88 . . . . . . . . . . . . . . . . 4.3980 . . . . . 142 . N . 142 . HN parsed_2k61 3
89 . . . . . . . . . . . . . . . . 4.1150 . . . . . 146 . N . 146 . HN parsed_2k61 3
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 4
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 3 and name HN ) 0.8350 0.0000
;
1 1 5 52 parsed_2k61 4
2
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 4 and name HN ) 1.2330 0.0000
;
7 1 11 52 parsed_2k61 4
3
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 5 and name HN ) 0.8960 0.0000
;
13 1 17 52 parsed_2k61 4
4
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 6 and name HN ) 1.2620 0.0000
;
19 1 23 52 parsed_2k61 4
5
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 7 and name HN ) 0.9460 0.0000
;
25 1 29 52 parsed_2k61 4
6
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 8 and name HN ) 0.9570 0.0000
;
31 1 35 52 parsed_2k61 4
7
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 9 and name HN ) 1.4790 0.0000
;
37 1 41 52 parsed_2k61 4
8
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 10 and name HN ) 1.6060 0.0000
;
43 1 47 52 parsed_2k61 4
9
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 11 and name HN ) 1.1470 0.0000
;
49 1 53 52 parsed_2k61 4
10
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 12 and name HN ) 1.3170 0.0000
;
55 1 59 52 parsed_2k61 4
11
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 13 and name HN ) 2.2280 0.0000
;
61 1 65 52 parsed_2k61 4
12
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 14 and name HN ) 1.5120 0.0000
;
67 1 71 52 parsed_2k61 4
13
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 15 and name HN ) 0.7600 0.0000
;
73 1 77 52 parsed_2k61 4
14
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 16 and name HN ) 1.2390 0.0000
;
79 1 83 52 parsed_2k61 4
15
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 17 and name HN ) 1.5870 0.0000
;
85 1 89 52 parsed_2k61 4
16
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 18 and name HN ) 0.1090 0.0000
;
91 1 95 52 parsed_2k61 4
17
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 37 and name HN ) -1.9370 0.0000
;
97 1 101 52 parsed_2k61 4
18
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 38 and name HN ) -1.4550 0.0000
;
103 1 107 52 parsed_2k61 4
19
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 39 and name HN ) -1.3580 0.0000
;
109 1 113 52 parsed_2k61 4
20
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 40 and name HN ) -1.0670 0.0000
;
115 1 119 52 parsed_2k61 4
21
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 41 and name HN ) -1.3120 0.0000
;
121 1 125 52 parsed_2k61 4
22
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 42 and name HN ) -1.2480 0.0000
;
127 1 131 52 parsed_2k61 4
23
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 47 and name HN ) -1.1390 0.0000
;
133 1 137 52 parsed_2k61 4
24
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 76 and name HN ) -0.9240 0.0000
;
139 1 143 52 parsed_2k61 4
25
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 77 and name HN ) -0.6550 0.0000
;
145 1 149 52 parsed_2k61 4
26
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 79 and name HN ) -0.5110 0.0000
;
151 1 155 52 parsed_2k61 4
27
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 80 and name HN ) -0.4370 0.0000
;
157 1 161 52 parsed_2k61 4
28
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 81 and name HN ) -0.4470 0.0000
;
163 1 167 52 parsed_2k61 4
29
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 82 and name HN ) -0.3670 0.0000
;
169 1 173 52 parsed_2k61 4
30
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 83 and name HN ) -0.4750 0.0000
;
175 1 179 52 parsed_2k61 4
31
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 85 and name HN ) -0.4870 0.0000
;
181 1 185 52 parsed_2k61 4
32
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 86 and name HN ) -0.4560 0.0000
;
187 1 191 52 parsed_2k61 4
33
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 87 and name HN ) -0.5640 0.0000
;
193 1 197 52 parsed_2k61 4
34
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 88 and name HN ) -0.6040 0.0000
;
199 1 203 52 parsed_2k61 4
35
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 89 and name HN ) -0.4730 0.0000
;
205 1 209 52 parsed_2k61 4
36
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 90 and name HN ) -0.5220 0.0000
;
211 1 215 52 parsed_2k61 4
37
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 91 and name HN ) -0.5970 0.0000
;
217 1 221 52 parsed_2k61 4
38
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 92 and name HN ) -0.4970 0.0000
;
223 1 227 52 parsed_2k61 4
39
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 93 and name HN ) -0.4290 0.0000
;
229 1 233 52 parsed_2k61 4
40
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 94 and name HN ) -0.3870 0.0000
;
235 1 239 52 parsed_2k61 4
41
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 95 and name HN ) -0.3330 0.0000
;
241 1 245 52 parsed_2k61 4
42
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 96 and name HN ) -0.3380 0.0000
;
247 1 251 52 parsed_2k61 4
43
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 97 and name HN ) -0.3040 0.0000
;
253 1 257 52 parsed_2k61 4
44
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 98 and name HN ) -0.2780 0.0000
;
259 1 263 52 parsed_2k61 4
45
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 99 and name HN ) -0.2370 0.0000
;
265 1 269 52 parsed_2k61 4
46
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 100 and name HN ) -0.2160 0.0000
;
271 1 275 52 parsed_2k61 4
47
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 101 and name HN ) -0.2490 0.0000
;
277 1 281 52 parsed_2k61 4
48
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 102 and name HN ) -0.1650 0.0000
;
283 1 287 52 parsed_2k61 4
49
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 103 and name HN ) -0.1920 0.0000
;
289 1 293 52 parsed_2k61 4
50
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 104 and name HN ) -0.2200 0.0000
;
295 1 299 52 parsed_2k61 4
51
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 105 and name HN ) -0.2000 0.0000
;
301 1 305 52 parsed_2k61 4
52
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 106 and name HN ) -0.2100 0.0000
;
307 1 311 52 parsed_2k61 4
53
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 107 and name HN ) 0.0020 0.0000
;
313 1 317 52 parsed_2k61 4
54
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 108 and name HN ) -0.3600 0.0000
;
319 1 323 52 parsed_2k61 4
55
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 109 and name HN ) -0.3250 0.0000
;
325 1 329 52 parsed_2k61 4
56
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 110 and name HN ) -0.3050 0.0000
;
331 1 335 52 parsed_2k61 4
57
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 111 and name HN ) -0.4410 0.0000
;
337 1 341 52 parsed_2k61 4
58
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 112 and name HN ) -0.4690 0.0000
;
343 1 347 52 parsed_2k61 4
59
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 113 and name HN ) -0.3550 0.0000
;
349 1 353 52 parsed_2k61 4
60
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 114 and name HN ) -0.2210 0.0000
;
355 1 359 52 parsed_2k61 4
61
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 115 and name HN ) -0.0220 0.0000
;
361 1 365 52 parsed_2k61 4
62
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 116 and name HN ) -0.0880 0.0000
;
367 1 371 52 parsed_2k61 4
63
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 117 and name HN ) -0.0170 0.0000
;
373 1 377 52 parsed_2k61 4
64
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 118 and name HN ) -0.0430 0.0000
;
379 1 383 52 parsed_2k61 4
65
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 119 and name HN ) -0.0260 0.0000
;
385 1 389 52 parsed_2k61 4
66
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 120 and name HN ) -0.0210 0.0000
;
391 1 395 52 parsed_2k61 4
67
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 121 and name HN ) -0.0470 0.0000
;
397 1 401 52 parsed_2k61 4
68
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 123 and name HN ) -0.0590 0.0000
;
403 1 407 52 parsed_2k61 4
69
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 124 and name HN ) -0.0760 0.0000
;
409 1 413 52 parsed_2k61 4
70
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 125 and name HN ) -0.0990 0.0000
;
415 1 419 52 parsed_2k61 4
71
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 126 and name HN ) -0.0680 0.0000
;
421 1 425 52 parsed_2k61 4
72
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 127 and name HN ) -0.0380 0.0000
;
427 1 431 52 parsed_2k61 4
73
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 128 and name HN ) -0.0740 0.0000
;
433 1 437 52 parsed_2k61 4
74
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 129 and name HN ) -0.0820 0.0000
;
439 1 443 52 parsed_2k61 4
75
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 130 and name HN ) -0.0930 0.0000
;
445 1 449 52 parsed_2k61 4
76
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 131 and name HN ) -0.0900 0.0000
;
451 1 455 52 parsed_2k61 4
77
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 132 and name HN ) -0.0730 0.0000
;
457 1 461 52 parsed_2k61 4
78
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 133 and name HN ) -0.1120 0.0000
;
463 1 467 52 parsed_2k61 4
79
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 134 and name HN ) -0.1010 0.0000
;
469 1 473 52 parsed_2k61 4
80
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 135 and name HN ) -0.1170 0.0000
;
475 1 479 52 parsed_2k61 4
81
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 136 and name HN ) -0.1740 0.0000
;
481 1 485 52 parsed_2k61 4
82
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 137 and name HN ) -0.1690 0.0000
;
487 1 491 52 parsed_2k61 4
83
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 138 and name HN ) -0.2040 0.0000
;
493 1 497 52 parsed_2k61 4
84
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 139 and name HN ) -0.1800 0.0000
;
499 1 503 52 parsed_2k61 4
85
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 140 and name HN ) -0.1580 0.0000
;
505 1 509 52 parsed_2k61 4
86
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 141 and name HN ) -0.1880 0.0000
;
511 1 515 52 parsed_2k61 4
87
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 142 and name HN ) -0.1900 0.0000
;
517 1 521 52 parsed_2k61 4
88
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 144 and name HN ) -0.1040 0.0000
;
523 1 527 52 parsed_2k61 4
89
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 145 and name HN ) -0.1450 0.0000
;
529 1 533 52 parsed_2k61 4
90
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 146 and name HN ) -0.1080 0.0000
;
535 1 539 52 parsed_2k61 4
91
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 147 and name HN ) -0.0770 0.0000
;
541 1 545 52 parsed_2k61 4
92
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 148 and name HN ) -0.0070 0.0000
;
547 1 551 52 parsed_2k61 4
stop_
save_
save_CNS/XPLOR_dipolar_coupling_7
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 5
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 7
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 3 and name HN ) -0.6390 0.0000
;
1 1 5 52 parsed_2k61 5
2
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 4 and name HN ) -0.8060 0.0000
;
7 1 11 52 parsed_2k61 5
3
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 5 and name HN ) -0.5720 0.0000
;
13 1 17 52 parsed_2k61 5
4
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 6 and name HN ) -0.4330 0.0000
;
19 1 23 52 parsed_2k61 5
5
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 7 and name HN ) -0.5490 0.0000
;
25 1 29 52 parsed_2k61 5
6
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 8 and name HN ) -0.5780 0.0000
;
31 1 35 52 parsed_2k61 5
7
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 9 and name HN ) -0.9370 0.0000
;
37 1 41 52 parsed_2k61 5
8
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 10 and name HN ) -0.9210 0.0000
;
43 1 47 52 parsed_2k61 5
9
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 11 and name HN ) -0.6990 0.0000
;
49 1 53 52 parsed_2k61 5
10
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 12 and name HN ) -0.8980 0.0000
;
55 1 59 52 parsed_2k61 5
11
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 13 and name HN ) -1.3770 0.0000
;
61 1 65 52 parsed_2k61 5
12
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 14 and name HN ) -0.8810 0.0000
;
67 1 71 52 parsed_2k61 5
13
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 15 and name HN ) -0.4490 0.0000
;
73 1 77 52 parsed_2k61 5
14
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 16 and name HN ) -0.8160 0.0000
;
79 1 83 52 parsed_2k61 5
15
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 17 and name HN ) -1.0820 0.0000
;
85 1 89 52 parsed_2k61 5
16
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 18 and name HN ) -0.2230 0.0000
;
91 1 95 52 parsed_2k61 5
17
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 19 and name HN ) 0.3760 0.0000
;
97 1 101 52 parsed_2k61 5
18
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 20 and name HN ) -0.4010 0.0000
;
103 1 107 52 parsed_2k61 5
19
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 21 and name HN ) -0.0240 0.0000
;
109 1 113 52 parsed_2k61 5
20
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 22 and name HN ) -0.7590 0.0000
;
115 1 119 52 parsed_2k61 5
21
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 23 and name HN ) -1.3980 0.0000
;
121 1 125 52 parsed_2k61 5
22
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 24 and name HN ) -2.3490 0.0000
;
127 1 131 52 parsed_2k61 5
23
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 30 and name HN ) 1.8550 0.0000
;
133 1 137 52 parsed_2k61 5
24
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 31 and name HN ) 2.1630 0.0000
;
139 1 143 52 parsed_2k61 5
25
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 33 and name HN ) 2.8030 0.0000
;
145 1 149 52 parsed_2k61 5
26
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 34 and name HN ) 1.6540 0.0000
;
151 1 155 52 parsed_2k61 5
27
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 35 and name HN ) 1.6850 0.0000
;
157 1 161 52 parsed_2k61 5
28
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 36 and name HN ) 1.9800 0.0000
;
163 1 167 52 parsed_2k61 5
29
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 37 and name HN ) 1.2640 0.0000
;
169 1 173 52 parsed_2k61 5
30
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 38 and name HN ) 0.6820 0.0000
;
175 1 179 52 parsed_2k61 5
31
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 39 and name HN ) 0.9300 0.0000
;
181 1 185 52 parsed_2k61 5
32
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 40 and name HN ) 0.7900 0.0000
;
187 1 191 52 parsed_2k61 5
33
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 41 and name HN ) 0.9720 0.0000
;
193 1 197 52 parsed_2k61 5
34
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 42 and name HN ) 1.0030 0.0000
;
199 1 203 52 parsed_2k61 5
35
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 44 and name HN ) 1.1920 0.0000
;
205 1 209 52 parsed_2k61 5
36
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 45 and name HN ) 0.5510 0.0000
;
211 1 215 52 parsed_2k61 5
37
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 46 and name HN ) 0.7080 0.0000
;
217 1 221 52 parsed_2k61 5
38
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 47 and name HN ) 1.2350 0.0000
;
223 1 227 52 parsed_2k61 5
39
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 49 and name HN ) 2.1440 0.0000
;
229 1 233 52 parsed_2k61 5
40
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 50 and name HN ) 2.2460 0.0000
;
235 1 239 52 parsed_2k61 5
41
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 79 and name HN ) 0.3320 0.0000
;
241 1 245 52 parsed_2k61 5
42
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 80 and name HN ) 0.4370 0.0000
;
247 1 251 52 parsed_2k61 5
43
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 81 and name HN ) 0.2940 0.0000
;
253 1 257 52 parsed_2k61 5
44
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 82 and name HN ) 0.2500 0.0000
;
259 1 263 52 parsed_2k61 5
45
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 85 and name HN ) 0.3580 0.0000
;
265 1 269 52 parsed_2k61 5
46
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 86 and name HN ) 0.3400 0.0000
;
271 1 275 52 parsed_2k61 5
47
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 87 and name HN ) 0.4900 0.0000
;
277 1 281 52 parsed_2k61 5
48
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 88 and name HN ) 0.4850 0.0000
;
283 1 287 52 parsed_2k61 5
49
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 89 and name HN ) 0.3630 0.0000
;
289 1 293 52 parsed_2k61 5
50
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 90 and name HN ) 0.3950 0.0000
;
295 1 299 52 parsed_2k61 5
51
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 91 and name HN ) 0.4550 0.0000
;
301 1 305 52 parsed_2k61 5
52
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 92 and name HN ) 0.3610 0.0000
;
307 1 311 52 parsed_2k61 5
53
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 93 and name HN ) 0.3120 0.0000
;
313 1 317 52 parsed_2k61 5
54
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 94 and name HN ) 0.2710 0.0000
;
319 1 323 52 parsed_2k61 5
55
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 95 and name HN ) 0.2360 0.0000
;
325 1 329 52 parsed_2k61 5
56
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 96 and name HN ) 0.2480 0.0000
;
331 1 335 52 parsed_2k61 5
57
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 97 and name HN ) 0.2040 0.0000
;
337 1 341 52 parsed_2k61 5
58
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 98 and name HN ) 0.1950 0.0000
;
343 1 347 52 parsed_2k61 5
59
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 99 and name HN ) 0.1840 0.0000
;
349 1 353 52 parsed_2k61 5
60
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 100 and name HN ) 0.1700 0.0000
;
355 1 359 52 parsed_2k61 5
61
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 101 and name HN ) 0.1620 0.0000
;
361 1 365 52 parsed_2k61 5
62
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 102 and name HN ) 0.0970 0.0000
;
367 1 371 52 parsed_2k61 5
63
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 103 and name HN ) 0.1030 0.0000
;
373 1 377 52 parsed_2k61 5
64
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 104 and name HN ) 0.1330 0.0000
;
379 1 383 52 parsed_2k61 5
65
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 105 and name HN ) 0.1730 0.0000
;
385 1 389 52 parsed_2k61 5
66
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 106 and name HN ) 0.1250 0.0000
;
391 1 395 52 parsed_2k61 5
67
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 108 and name HN ) 0.2480 0.0000
;
397 1 401 52 parsed_2k61 5
68
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 109 and name HN ) 0.1870 0.0000
;
403 1 407 52 parsed_2k61 5
69
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 110 and name HN ) 0.1530 0.0000
;
409 1 413 52 parsed_2k61 5
70
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 111 and name HN ) 0.2470 0.0000
;
415 1 419 52 parsed_2k61 5
71
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 112 and name HN ) 0.2650 0.0000
;
421 1 425 52 parsed_2k61 5
72
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 113 and name HN ) 0.1610 0.0000
;
427 1 431 52 parsed_2k61 5
73
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 114 and name HN ) 0.0650 0.0000
;
433 1 437 52 parsed_2k61 5
74
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 115 and name HN ) -0.0660 0.0000
;
439 1 443 52 parsed_2k61 5
75
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 116 and name HN ) 0.0060 0.0000
;
445 1 449 52 parsed_2k61 5
76
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 117 and name HN ) -0.0150 0.0000
;
451 1 455 52 parsed_2k61 5
77
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 118 and name HN ) 0.0020 0.0000
;
457 1 461 52 parsed_2k61 5
78
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 119 and name HN ) 0.0010 0.0000
;
463 1 467 52 parsed_2k61 5
79
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 120 and name HN ) -0.0090 0.0000
;
469 1 473 52 parsed_2k61 5
80
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 121 and name HN ) 0.0140 0.0000
;
475 1 479 52 parsed_2k61 5
81
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 122 and name HN ) 0.0360 0.0000
;
481 1 485 52 parsed_2k61 5
82
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 123 and name HN ) 0.0090 0.0000
;
487 1 491 52 parsed_2k61 5
83
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 124 and name HN ) 0.0340 0.0000
;
493 1 497 52 parsed_2k61 5
84
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 125 and name HN ) 0.0200 0.0000
;
499 1 503 52 parsed_2k61 5
85
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 126 and name HN ) 0.0210 0.0000
;
505 1 509 52 parsed_2k61 5
86
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 127 and name HN ) 0.0410 0.0000
;
511 1 515 52 parsed_2k61 5
87
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 128 and name HN ) 0.1030 0.0000
;
517 1 521 52 parsed_2k61 5
88
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 129 and name HN ) 0.0660 0.0000
;
523 1 527 52 parsed_2k61 5
89
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 130 and name HN ) 0.0750 0.0000
;
529 1 533 52 parsed_2k61 5
90
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 131 and name HN ) 0.0040 0.0000
;
535 1 539 52 parsed_2k61 5
91
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 132 and name HN ) 0.0560 0.0000
;
541 1 545 52 parsed_2k61 5
92
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 133 and name HN ) 0.0570 0.0000
;
547 1 551 52 parsed_2k61 5
93
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 134 and name HN ) 0.0520 0.0000
;
553 1 557 52 parsed_2k61 5
94
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 135 and name HN ) 0.0870 0.0000
;
559 1 563 52 parsed_2k61 5
95
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 136 and name HN ) 0.1350 0.0000
;
565 1 569 52 parsed_2k61 5
96
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 137 and name HN ) 0.1240 0.0000
;
571 1 575 52 parsed_2k61 5
97
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 138 and name HN ) 0.1760 0.0000
;
577 1 581 52 parsed_2k61 5
98
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 139 and name HN ) 0.1520 0.0000
;
583 1 587 52 parsed_2k61 5
99
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 140 and name HN ) 0.1240 0.0000
;
589 1 593 52 parsed_2k61 5
100
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 141 and name HN ) 0.1540 0.0000
;
595 1 599 52 parsed_2k61 5
101
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 142 and name HN ) 0.1650 0.0000
;
601 1 605 52 parsed_2k61 5
102
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 143 and name HN ) 0.1030 0.0000
;
607 1 611 52 parsed_2k61 5
103
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 144 and name HN ) 0.1830 0.0000
;
613 1 617 52 parsed_2k61 5
104
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 145 and name HN ) 0.1260 0.0000
;
619 1 623 52 parsed_2k61 5
105
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 146 and name HN ) 0.1090 0.0000
;
625 1 629 52 parsed_2k61 5
106
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 147 and name HN ) 0.0700 0.0000
;
631 1 635 52 parsed_2k61 5
107
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 148 and name HN ) 0.0150 0.0000
;
637 1 641 52 parsed_2k61 5
stop_
save_
save_CNS/XPLOR_dipolar_coupling_8
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k61
_RDC_constraint_list.ID 6
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 8
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 3 and name HN ) -0.2760 0.0000
;
1 1 5 52 parsed_2k61 6
2
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 4 and name HN ) -0.3160 0.0000
;
7 1 11 52 parsed_2k61 6
3
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 5 and name HN ) -0.2260 0.0000
;
13 1 17 52 parsed_2k61 6
4
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 6 and name HN ) 0.0110 0.0000
;
19 1 23 52 parsed_2k61 6
5
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 7 and name HN ) -0.1720 0.0000
;
25 1 29 52 parsed_2k61 6
6
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 8 and name HN ) -0.2060 0.0000
;
31 1 35 52 parsed_2k61 6
7
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 9 and name HN ) -0.3210 0.0000
;
37 1 41 52 parsed_2k61 6
8
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 10 and name HN ) -0.2650 0.0000
;
43 1 47 52 parsed_2k61 6
9
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 11 and name HN ) -0.1970 0.0000
;
49 1 53 52 parsed_2k61 6
10
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 12 and name HN ) -0.2750 0.0000
;
55 1 59 52 parsed_2k61 6
11
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 13 and name HN ) -0.3460 0.0000
;
61 1 65 52 parsed_2k61 6
12
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 14 and name HN ) -0.1650 0.0000
;
67 1 71 52 parsed_2k61 6
13
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 15 and name HN ) 0.0040 0.0000
;
73 1 77 52 parsed_2k61 6
14
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 16 and name HN ) -0.0070 0.0000
;
79 1 83 52 parsed_2k61 6
15
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 17 and name HN ) 0.0390 0.0000
;
85 1 89 52 parsed_2k61 6
16
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 18 and name HN ) 0.2350 0.0000
;
91 1 95 52 parsed_2k61 6
17
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 19 and name HN ) 0.5640 0.0000
;
97 1 101 52 parsed_2k61 6
18
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 20 and name HN ) 0.4940 0.0000
;
103 1 107 52 parsed_2k61 6
19
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 21 and name HN ) 0.5290 0.0000
;
109 1 113 52 parsed_2k61 6
20
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 22 and name HN ) 0.1320 0.0000
;
115 1 119 52 parsed_2k61 6
21
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 23 and name HN ) -0.1050 0.0000
;
121 1 125 52 parsed_2k61 6
22
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 24 and name HN ) -0.4490 0.0000
;
127 1 131 52 parsed_2k61 6
23
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 25 and name HN ) -0.9090 0.0000
;
133 1 137 52 parsed_2k61 6
24
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 26 and name HN ) -1.2030 0.0000
;
139 1 143 52 parsed_2k61 6
25
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 28 and name HN ) 2.4530 0.0000
;
145 1 149 52 parsed_2k61 6
26
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 29 and name HN ) 2.5720 0.0000
;
151 1 155 52 parsed_2k61 6
27
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 30 and name HN ) 1.3490 0.0000
;
157 1 161 52 parsed_2k61 6
28
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 31 and name HN ) 1.5250 0.0000
;
163 1 167 52 parsed_2k61 6
29
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 32 and name HN ) 2.1090 0.0000
;
169 1 173 52 parsed_2k61 6
30
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 33 and name HN ) 1.4260 0.0000
;
175 1 179 52 parsed_2k61 6
31
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 34 and name HN ) 0.9260 0.0000
;
181 1 185 52 parsed_2k61 6
32
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 35 and name HN ) 0.9170 0.0000
;
187 1 191 52 parsed_2k61 6
33
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 36 and name HN ) 0.9410 0.0000
;
193 1 197 52 parsed_2k61 6
34
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 37 and name HN ) 0.5680 0.0000
;
199 1 203 52 parsed_2k61 6
35
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 38 and name HN ) 0.4810 0.0000
;
205 1 209 52 parsed_2k61 6
36
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 39 and name HN ) 0.4440 0.0000
;
211 1 215 52 parsed_2k61 6
37
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 40 and name HN ) 0.3520 0.0000
;
217 1 221 52 parsed_2k61 6
38
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 41 and name HN ) 0.4260 0.0000
;
223 1 227 52 parsed_2k61 6
39
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 42 and name HN ) 0.3860 0.0000
;
229 1 233 52 parsed_2k61 6
40
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 44 and name HN ) 0.4650 0.0000
;
235 1 239 52 parsed_2k61 6
41
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 45 and name HN ) 0.1730 0.0000
;
241 1 245 52 parsed_2k61 6
42
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 46 and name HN ) 0.3470 0.0000
;
247 1 251 52 parsed_2k61 6
43
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 47 and name HN ) 0.4860 0.0000
;
253 1 257 52 parsed_2k61 6
44
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 49 and name HN ) 0.8980 0.0000
;
259 1 263 52 parsed_2k61 6
45
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 50 and name HN ) 0.7490 0.0000
;
265 1 269 52 parsed_2k61 6
46
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 51 and name HN ) 1.4650 0.0000
;
271 1 275 52 parsed_2k61 6
47
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 52 and name HN ) 3.2200 0.0000
;
277 1 281 52 parsed_2k61 6
48
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 53 and name HN ) 1.9030 0.0000
;
283 1 287 52 parsed_2k61 6
49
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 54 and name HN ) 1.3750 0.0000
;
289 1 293 52 parsed_2k61 6
50
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 69 and name HN ) -1.7490 0.0000
;
295 1 299 52 parsed_2k61 6
51
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 70 and name HN ) -1.8970 0.0000
;
301 1 305 52 parsed_2k61 6
52
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 71 and name HN ) -1.0210 0.0000
;
307 1 311 52 parsed_2k61 6
53
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 72 and name HN ) -0.0130 0.0000
;
313 1 317 52 parsed_2k61 6
54
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 73 and name HN ) -0.3730 0.0000
;
319 1 323 52 parsed_2k61 6
55
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 74 and name HN ) -0.3130 0.0000
;
325 1 329 52 parsed_2k61 6
56
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 75 and name HN ) 0.0680 0.0000
;
331 1 335 52 parsed_2k61 6
57
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 76 and name HN ) -0.0320 0.0000
;
337 1 341 52 parsed_2k61 6
58
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 77 and name HN ) -0.0540 0.0000
;
343 1 347 52 parsed_2k61 6
59
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 79 and name HN ) -0.0160 0.0000
;
349 1 353 52 parsed_2k61 6
60
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 79 and name HN ) -0.0160 0.0000
;
355 1 359 52 parsed_2k61 6
61
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 80 and name HN ) 0.0910 0.0000
;
361 1 365 52 parsed_2k61 6
62
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 81 and name HN ) 0.0180 0.0000
;
367 1 371 52 parsed_2k61 6
63
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 82 and name HN ) 0.0180 0.0000
;
373 1 377 52 parsed_2k61 6
64
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 83 and name HN ) 0.0520 0.0000
;
379 1 383 52 parsed_2k61 6
65
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 84 and name HN ) 0.1010 0.0000
;
385 1 389 52 parsed_2k61 6
66
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 85 and name HN ) 0.0890 0.0000
;
391 1 395 52 parsed_2k61 6
67
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 86 and name HN ) 0.0840 0.0000
;
397 1 401 52 parsed_2k61 6
68
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 87 and name HN ) 0.1560 0.0000
;
403 1 407 52 parsed_2k61 6
69
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 88 and name HN ) 0.1620 0.0000
;
409 1 413 52 parsed_2k61 6
70
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 89 and name HN ) 0.1130 0.0000
;
415 1 419 52 parsed_2k61 6
71
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 90 and name HN ) 0.1330 0.0000
;
421 1 425 52 parsed_2k61 6
72
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 91 and name HN ) 0.1670 0.0000
;
427 1 431 52 parsed_2k61 6
73
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 92 and name HN ) 0.1320 0.0000
;
433 1 437 52 parsed_2k61 6
74
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 93 and name HN ) 0.1130 0.0000
;
439 1 443 52 parsed_2k61 6
75
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 94 and name HN ) 0.1270 0.0000
;
445 1 449 52 parsed_2k61 6
76
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 95 and name HN ) 0.1040 0.0000
;
451 1 455 52 parsed_2k61 6
77
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 96 and name HN ) 0.0990 0.0000
;
457 1 461 52 parsed_2k61 6
78
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 97 and name HN ) 0.0790 0.0000
;
463 1 467 52 parsed_2k61 6
79
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 98 and name HN ) 0.0720 0.0000
;
469 1 473 52 parsed_2k61 6
80
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 99 and name HN ) 0.0670 0.0000
;
475 1 479 52 parsed_2k61 6
81
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 100 and name HN ) 0.0660 0.0000
;
481 1 485 52 parsed_2k61 6
82
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 101 and name HN ) 0.0780 0.0000
;
487 1 491 52 parsed_2k61 6
83
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 102 and name HN ) 0.0550 0.0000
;
493 1 497 52 parsed_2k61 6
84
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 103 and name HN ) 0.0270 0.0000
;
499 1 503 52 parsed_2k61 6
85
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 104 and name HN ) 0.0800 0.0000
;
505 1 509 52 parsed_2k61 6
86
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 105 and name HN ) 0.0850 0.0000
;
511 1 515 52 parsed_2k61 6
87
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 106 and name HN ) 0.0780 0.0000
;
517 1 521 52 parsed_2k61 6
88
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 108 and name HN ) 0.1300 0.0000
;
523 1 527 52 parsed_2k61 6
89
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 109 and name HN ) 0.1140 0.0000
;
529 1 533 52 parsed_2k61 6
90
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 110 and name HN ) 0.1180 0.0000
;
535 1 539 52 parsed_2k61 6
91
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 111 and name HN ) 0.1690 0.0000
;
541 1 545 52 parsed_2k61 6
92
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 112 and name HN ) 0.1910 0.0000
;
547 1 551 52 parsed_2k61 6
93
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 113 and name HN ) 0.1680 0.0000
;
553 1 557 52 parsed_2k61 6
94
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 114 and name HN ) 0.1140 0.0000
;
559 1 563 52 parsed_2k61 6
95
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 115 and name HN ) 0.0370 0.0000
;
565 1 569 52 parsed_2k61 6
96
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 116 and name HN ) 0.0620 0.0000
;
571 1 575 52 parsed_2k61 6
97
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 117 and name HN ) 0.0270 0.0000
;
577 1 581 52 parsed_2k61 6
98
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 118 and name HN ) 0.0290 0.0000
;
583 1 587 52 parsed_2k61 6
99
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 119 and name HN ) 0.0190 0.0000
;
589 1 593 52 parsed_2k61 6
100
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 120 and name HN ) -0.0040 0.0000
;
595 1 599 52 parsed_2k61 6
101
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 121 and name HN ) 0.0300 0.0000
;
601 1 605 52 parsed_2k61 6
102
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 122 and name HN ) 0.0380 0.0000
;
607 1 611 52 parsed_2k61 6
103
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 123 and name HN ) 0.0300 0.0000
;
613 1 617 52 parsed_2k61 6
104
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 124 and name HN ) 0.0350 0.0000
;
619 1 623 52 parsed_2k61 6
105
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 125 and name HN ) 0.0140 0.0000
;
625 1 629 52 parsed_2k61 6
106
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 126 and name HN ) 0.0310 0.0000
;
631 1 635 52 parsed_2k61 6
107
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 127 and name HN ) 0.0330 0.0000
;
637 1 641 52 parsed_2k61 6
108
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 128 and name HN ) 0.0360 0.0000
;
643 1 647 52 parsed_2k61 6
109
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 129 and name HN ) 0.0300 0.0000
;
649 1 653 52 parsed_2k61 6
110
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 130 and name HN ) 0.0370 0.0000
;
655 1 659 52 parsed_2k61 6
111
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 131 and name HN ) 0.0290 0.0000
;
661 1 665 52 parsed_2k61 6
112
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 132 and name HN ) 0.0220 0.0000
;
667 1 671 52 parsed_2k61 6
113
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 133 and name HN ) 0.0030 0.0000
;
673 1 677 52 parsed_2k61 6
114
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 134 and name HN ) 0.0270 0.0000
;
679 1 683 52 parsed_2k61 6
115
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 135 and name HN ) 0.0390 0.0000
;
685 1 689 52 parsed_2k61 6
116
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 136 and name HN ) 0.0610 0.0000
;
691 1 695 52 parsed_2k61 6
117
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 137 and name HN ) 0.0470 0.0000
;
697 1 701 52 parsed_2k61 6
118
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 138 and name HN ) 0.0600 0.0000
;
703 1 707 52 parsed_2k61 6
119
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 139 and name HN ) 0.0480 0.0000
;
709 1 713 52 parsed_2k61 6
120
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 140 and name HN ) 0.0600 0.0000
;
715 1 719 52 parsed_2k61 6
121
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 141 and name HN ) 0.0660 0.0000
;
721 1 725 52 parsed_2k61 6
122
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 142 and name HN ) 0.0710 0.0000
;
727 1 731 52 parsed_2k61 6
123
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 143 and name HN ) 0.0280 0.0000
;
733 1 737 52 parsed_2k61 6
124
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 144 and name HN ) 0.0510 0.0000
;
739 1 743 52 parsed_2k61 6
125
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 145 and name HN ) 0.0430 0.0000
;
745 1 749 52 parsed_2k61 6
126
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 146 and name HN ) 0.0360 0.0000
;
751 1 755 52 parsed_2k61 6
127
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 147 and name HN ) 0.0110 0.0000
;
757 1 761 52 parsed_2k61 6
128
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 148 and name HN ) 0.0040 0.0000
;
763 1 767 52 parsed_2k61 6
129
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 3 and name N ) -0.1950 0.0000
;
769 1 773 52 parsed_2k61 6
130
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 4 and name N ) -0.2530 0.0000
;
775 1 779 52 parsed_2k61 6
131
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 5 and name N ) -0.2790 0.0000
;
781 1 785 52 parsed_2k61 6
132
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 6 and name N ) -0.3900 0.0000
;
787 1 791 52 parsed_2k61 6
133
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 7 and name N ) -0.2220 0.0000
;
793 1 797 52 parsed_2k61 6
134
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 8 and name N ) -0.3440 0.0000
;
799 1 803 52 parsed_2k61 6
135
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 9 and name N ) -0.4840 0.0000
;
805 1 809 52 parsed_2k61 6
136
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 10 and name N ) -0.3450 0.0000
;
811 1 815 52 parsed_2k61 6
137
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 11 and name N ) -0.2450 0.0000
;
817 1 821 52 parsed_2k61 6
138
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 12 and name N ) -0.6170 0.0000
;
823 1 827 52 parsed_2k61 6
139
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 13 and name N ) -0.6080 0.0000
;
829 1 833 52 parsed_2k61 6
140
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 14 and name N ) -0.2490 0.0000
;
835 1 839 52 parsed_2k61 6
141
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 15 and name N ) -0.0690 0.0000
;
841 1 845 52 parsed_2k61 6
142
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 16 and name N ) -0.0490 0.0000
;
847 1 851 52 parsed_2k61 6
143
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 17 and name N ) 0.1360 0.0000
;
853 1 857 52 parsed_2k61 6
144
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 18 and name N ) 0.2030 0.0000
;
859 1 863 52 parsed_2k61 6
145
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 19 and name N ) 0.2580 0.0000
;
865 1 869 52 parsed_2k61 6
146
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 20 and name N ) 0.5260 0.0000
;
871 1 875 52 parsed_2k61 6
147
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 21 and name N ) 0.2080 0.0000
;
877 1 881 52 parsed_2k61 6
148
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 22 and name N ) -0.0630 0.0000
;
883 1 887 52 parsed_2k61 6
149
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 23 and name N ) -0.3910 0.0000
;
889 1 893 52 parsed_2k61 6
150
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 24 and name N ) -0.5620 0.0000
;
895 1 899 52 parsed_2k61 6
151
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 25 and name N ) -1.4440 0.0000
;
901 1 905 52 parsed_2k61 6
152
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 26 and name N ) -3.0590 0.0000
;
907 1 911 52 parsed_2k61 6
153
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 28 and name N ) 3.6220 0.0000
;
913 1 917 52 parsed_2k61 6
154
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 29 and name N ) 3.0290 0.0000
;
919 1 923 52 parsed_2k61 6
155
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 30 and name N ) 1.0770 0.0000
;
925 1 929 52 parsed_2k61 6
156
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 31 and name N ) 0.9330 0.0000
;
931 1 935 52 parsed_2k61 6
157
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 32 and name N ) 1.7340 0.0000
;
937 1 941 52 parsed_2k61 6
158
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 33 and name N ) 1.4430 0.0000
;
943 1 947 52 parsed_2k61 6
159
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 34 and name N ) 0.7970 0.0000
;
949 1 953 52 parsed_2k61 6
160
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 35 and name N ) 0.6390 0.0000
;
955 1 959 52 parsed_2k61 6
161
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 36 and name N ) 0.7810 0.0000
;
961 1 965 52 parsed_2k61 6
162
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 37 and name N ) 0.4430 0.0000
;
967 1 971 52 parsed_2k61 6
163
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 38 and name N ) 0.5200 0.0000
;
973 1 977 52 parsed_2k61 6
164
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 39 and name N ) 0.1080 0.0000
;
979 1 983 52 parsed_2k61 6
165
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 40 and name N ) 0.2510 0.0000
;
985 1 989 52 parsed_2k61 6
166
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 41 and name N ) 0.1370 0.0000
;
991 1 995 52 parsed_2k61 6
167
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 42 and name N ) 0.3940 0.0000
;
997 1 1001 52 parsed_2k61 6
168
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 44 and name N ) 0.3120 0.0000
;
1003 1 1007 52 parsed_2k61 6
169
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 45 and name N ) 0.3970 0.0000
;
1009 1 1013 52 parsed_2k61 6
170
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 46 and name N ) 0.6390 0.0000
;
1015 1 1019 52 parsed_2k61 6
171
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 47 and name N ) 0.6750 0.0000
;
1021 1 1025 52 parsed_2k61 6
172
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 49 and name N ) 1.4500 0.0000
;
1027 1 1031 52 parsed_2k61 6
173
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 50 and name N ) 0.7350 0.0000
;
1033 1 1037 52 parsed_2k61 6
174
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 51 and name N ) 1.5330 0.0000
;
1039 1 1043 52 parsed_2k61 6
175
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 52 and name N ) 3.9380 0.0000
;
1045 1 1049 52 parsed_2k61 6
176
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 53 and name N ) 2.6650 0.0000
;
1051 1 1055 52 parsed_2k61 6
177
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 54 and name N ) 1.2350 0.0000
;
1057 1 1061 52 parsed_2k61 6
178
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 69 and name N ) -0.9960 0.0000
;
1063 1 1067 52 parsed_2k61 6
179
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 70 and name N ) -1.7850 0.0000
;
1069 1 1073 52 parsed_2k61 6
180
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 71 and name N ) -1.2230 0.0000
;
1075 1 1079 52 parsed_2k61 6
181
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 72 and name N ) -0.1600 0.0000
;
1081 1 1085 52 parsed_2k61 6
182
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 73 and name N ) -0.6290 0.0000
;
1087 1 1091 52 parsed_2k61 6
183
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 74 and name N ) 0.1410 0.0000
;
1093 1 1097 52 parsed_2k61 6
184
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 75 and name N ) 0.2170 0.0000
;
1099 1 1103 52 parsed_2k61 6
185
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 76 and name N ) -0.1890 0.0000
;
1105 1 1109 52 parsed_2k61 6
186
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 77 and name N ) -0.4160 0.0000
;
1111 1 1115 52 parsed_2k61 6
187
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 79 and name N ) 0.0350 0.0000
;
1117 1 1121 52 parsed_2k61 6
188
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 80 and name N ) 0.1810 0.0000
;
1123 1 1127 52 parsed_2k61 6
189
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 81 and name N ) -0.0130 0.0000
;
1129 1 1133 52 parsed_2k61 6
190
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 82 and name N ) -0.0470 0.0000
;
1135 1 1139 52 parsed_2k61 6
191
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 83 and name N ) 0.2060 0.0000
;
1141 1 1145 52 parsed_2k61 6
192
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 84 and name N ) 0.1720 0.0000
;
1147 1 1151 52 parsed_2k61 6
193
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 85 and name N ) -0.0600 0.0000
;
1153 1 1157 52 parsed_2k61 6
194
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 86 and name N ) -0.0260 0.0000
;
1159 1 1163 52 parsed_2k61 6
195
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 87 and name N ) -0.0720 0.0000
;
1165 1 1169 52 parsed_2k61 6
196
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 88 and name N ) 0.0060 0.0000
;
1171 1 1175 52 parsed_2k61 6
197
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 89 and name N ) 0.0960 0.0000
;
1177 1 1181 52 parsed_2k61 6
198
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 90 and name N ) 0.1230 0.0000
;
1183 1 1187 52 parsed_2k61 6
199
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 91 and name N ) 0.0730 0.0000
;
1189 1 1193 52 parsed_2k61 6
200
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 92 and name N ) 0.0040 0.0000
;
1195 1 1199 52 parsed_2k61 6
201
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 93 and name N ) 0.0310 0.0000
;
1201 1 1205 52 parsed_2k61 6
202
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 94 and name N ) -0.0490 0.0000
;
1207 1 1211 52 parsed_2k61 6
203
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 95 and name N ) -0.0140 0.0000
;
1213 1 1217 52 parsed_2k61 6
204
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 96 and name N ) 0.0290 0.0000
;
1219 1 1223 52 parsed_2k61 6
205
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 97 and name N ) -0.0590 0.0000
;
1225 1 1229 52 parsed_2k61 6
206
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 98 and name N ) -0.0190 0.0000
;
1231 1 1235 52 parsed_2k61 6
207
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 99 and name N ) -0.1090 0.0000
;
1237 1 1241 52 parsed_2k61 6
208
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 100 and name N ) 0.0070 0.0000
;
1243 1 1247 52 parsed_2k61 6
209
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 101 and name N ) -0.0110 0.0000
;
1249 1 1253 52 parsed_2k61 6
210
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 102 and name N ) 0.0380 0.0000
;
1255 1 1259 52 parsed_2k61 6
211
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 103 and name N ) 0.1990 0.0000
;
1261 1 1265 52 parsed_2k61 6
212
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 104 and name N ) 0.0590 0.0000
;
1267 1 1271 52 parsed_2k61 6
213
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 105 and name N ) 0.0940 0.0000
;
1273 1 1277 52 parsed_2k61 6
214
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 106 and name N ) 0.0420 0.0000
;
1279 1 1283 52 parsed_2k61 6
215
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 108 and name N ) -0.0030 0.0000
;
1285 1 1289 52 parsed_2k61 6
216
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 109 and name N ) 0.0680 0.0000
;
1291 1 1295 52 parsed_2k61 6
217
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 110 and name N ) -0.0120 0.0000
;
1297 1 1301 52 parsed_2k61 6
218
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 111 and name N ) 0.2130 0.0000
;
1303 1 1307 52 parsed_2k61 6
219
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 112 and name N ) 0.2570 0.0000
;
1309 1 1313 52 parsed_2k61 6
220
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 113 and name N ) 0.2090 0.0000
;
1315 1 1319 52 parsed_2k61 6
221
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 114 and name N ) 0.0030 0.0000
;
1321 1 1325 52 parsed_2k61 6
222
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 115 and name N ) -0.0570 0.0000
;
1327 1 1331 52 parsed_2k61 6
223
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 116 and name N ) 0.0060 0.0000
;
1333 1 1337 52 parsed_2k61 6
224
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 117 and name N ) -0.0840 0.0000
;
1339 1 1343 52 parsed_2k61 6
225
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 118 and name N ) -0.0800 0.0000
;
1345 1 1349 52 parsed_2k61 6
226
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 119 and name N ) 0.0370 0.0000
;
1351 1 1355 52 parsed_2k61 6
227
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 120 and name N ) 0.0040 0.0000
;
1357 1 1361 52 parsed_2k61 6
228
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 121 and name N ) -0.2250 0.0000
;
1363 1 1367 52 parsed_2k61 6
229
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 122 and name N ) -0.8880 0.0000
;
1369 1 1373 52 parsed_2k61 6
230
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 123 and name N ) 0.1830 0.0000
;
1375 1 1379 52 parsed_2k61 6
231
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 124 and name N ) -0.0380 0.0000
;
1381 1 1385 52 parsed_2k61 6
232
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 125 and name N ) -0.0600 0.0000
;
1387 1 1391 52 parsed_2k61 6
233
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 126 and name N ) -0.1220 0.0000
;
1393 1 1397 52 parsed_2k61 6
234
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 127 and name N ) -0.0330 0.0000
;
1399 1 1403 52 parsed_2k61 6
235
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 128 and name N ) -0.0090 0.0000
;
1405 1 1409 52 parsed_2k61 6
236
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 129 and name N ) 0.0530 0.0000
;
1411 1 1415 52 parsed_2k61 6
237
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 130 and name N ) -0.0710 0.0000
;
1417 1 1421 52 parsed_2k61 6
238
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 131 and name N ) -0.0540 0.0000
;
1423 1 1427 52 parsed_2k61 6
239
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 132 and name N ) -0.0280 0.0000
;
1429 1 1433 52 parsed_2k61 6
240
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 133 and name N ) -0.0850 0.0000
;
1435 1 1439 52 parsed_2k61 6
241
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 134 and name N ) -0.1180 0.0000
;
1441 1 1445 52 parsed_2k61 6
242
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 135 and name N ) -0.0510 0.0000
;
1447 1 1451 52 parsed_2k61 6
243
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 136 and name N ) -0.0430 0.0000
;
1453 1 1457 52 parsed_2k61 6
244
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 137 and name N ) -0.0510 0.0000
;
1459 1 1463 52 parsed_2k61 6
245
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 138 and name N ) -0.0870 0.0000
;
1465 1 1469 52 parsed_2k61 6
246
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 139 and name N ) -0.0250 0.0000
;
1471 1 1475 52 parsed_2k61 6
247
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 140 and name N ) -0.0490 0.0000
;
1477 1 1481 52 parsed_2k61 6
248
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 141 and name N ) 0.0000 0.0000
;
1483 1 1487 52 parsed_2k61 6
249
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 142 and name N ) 0.0710 0.0000
;
1489 1 1493 52 parsed_2k61 6
250
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 143 and name N ) -0.0430 0.0000
;
1495 1 1499 52 parsed_2k61 6
251
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 144 and name N ) 0.0000 0.0000
;
1501 1 1505 52 parsed_2k61 6
252
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 145 and name N ) -0.1100 0.0000
;
1507 1 1511 52 parsed_2k61 6
253
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 146 and name N ) -0.0090 0.0000
;
1513 1 1517 52 parsed_2k61 6
254
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 147 and name N ) -0.0250 0.0000
;
1519 1 1523 52 parsed_2k61 6
255
;
assign ( resid 969 and name OO )
( resid 969 and name Z )
( resid 969 and name X )
( resid 969 and name Y )
( resid 148 and name N ) -0.0590 0.0000
;
1525 1 1529 52 parsed_2k61 6
stop_
save_
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