NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
516518 |
2k0j   |
cing | 2-parsed | STAR | entry | full | 443 |
data_2k0j_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k0j
_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_2k0j 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k0j
_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 2k0j "Master copy" parsed_2k0j
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k0j
_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 2k0j.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 67 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 73 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 86 parsed_2k0j 1
1 2k0j.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 217 parsed_2k0j 1
1 2k0j.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k0j 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_2k0j
_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 04-FEB-08 2K0J
*TITLE SOLUTION STRUCTURE OF CAM COMPLEXED TO DRP1P
*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: HUMAN;
*SOURCE 4 ORGANISM_TAXID: 9606;
*SOURCE 5 GENE: CALM1, CALM, CAM, CAM1;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET16B-CAM
*KEYWDS CALMODULIN, DRP1 PEPTIDE, ACETYLATION, CALCIUM, METHYLATION,
*KEYWDS 2 PHOSPHOPROTEIN, UBL CONJUGATION, STRUCTURAL GENOMICS,
*KEYWDS 3 SPINE2, STRUCTURAL PROTEOMICS IN EUROPE, SPINE, METAL
*KEYWDS 4 BINDING PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 1
*AUTHOR I.BERTINI, C.LUCHINAT, G.PARIGI, J.YUAN, STRUCTURAL
*AUTHOR 2 PROTEOMICS IN EUROPE (SPINE)
*REVDAT 1 10-MAR-09 2K0J 0
;
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 2
_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 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 3 and name HN ) 1.2300 0.0000
;
1 1 5 52 parsed_2k0j 1
2
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 4 and name HN ) 1.6480 0.0000
;
7 1 11 52 parsed_2k0j 1
3
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 5 and name HN ) 1.1400 0.0000
;
13 1 17 52 parsed_2k0j 1
4
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 6 and name HN ) 1.1450 0.0000
;
19 1 23 52 parsed_2k0j 1
5
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 7 and name HN ) 1.0130 0.0000
;
25 1 29 52 parsed_2k0j 1
6
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 8 and name HN ) 1.0960 0.0000
;
31 1 35 52 parsed_2k0j 1
7
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 9 and name HN ) 1.6530 0.0000
;
37 1 41 52 parsed_2k0j 1
8
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 10 and name HN ) 1.6080 0.0000
;
43 1 47 52 parsed_2k0j 1
9
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 11 and name HN ) 1.1570 0.0000
;
49 1 53 52 parsed_2k0j 1
10
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 12 and name HN ) 1.3000 0.0000
;
55 1 59 52 parsed_2k0j 1
11
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 13 and name HN ) 1.9280 0.0000
;
61 1 65 52 parsed_2k0j 1
12
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 14 and name HN ) 0.9610 0.0000
;
67 1 71 52 parsed_2k0j 1
13
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 15 and name HN ) 0.2660 0.0000
;
73 1 77 52 parsed_2k0j 1
14
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 16 and name HN ) 0.1510 0.0000
;
79 1 83 52 parsed_2k0j 1
15
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 18 and name HN ) -1.1700 0.0000
;
85 1 89 52 parsed_2k0j 1
16
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 25 and name HN ) -0.1750 0.0000
;
91 1 95 52 parsed_2k0j 1
17
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 37 and name HN ) -2.6650 0.0000
;
97 1 101 52 parsed_2k0j 1
18
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 38 and name HN ) -2.0970 0.0000
;
103 1 107 52 parsed_2k0j 1
19
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 40 and name HN ) -1.4270 0.0000
;
109 1 113 52 parsed_2k0j 1
20
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 41 and name HN ) -1.6260 0.0000
;
115 1 119 52 parsed_2k0j 1
21
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 42 and name HN ) -1.4350 0.0000
;
121 1 125 52 parsed_2k0j 1
22
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 44 and name HN ) -1.5230 0.0000
;
127 1 131 52 parsed_2k0j 1
23
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 45 and name HN ) -1.1720 0.0000
;
133 1 137 52 parsed_2k0j 1
24
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 46 and name HN ) -0.6640 0.0000
;
139 1 143 52 parsed_2k0j 1
25
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 47 and name HN ) -1.1640 0.0000
;
145 1 149 52 parsed_2k0j 1
26
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 50 and name HN ) -1.1570 0.0000
;
151 1 155 52 parsed_2k0j 1
27
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 77 and name HN ) 0.0170 0.0000
;
157 1 161 52 parsed_2k0j 1
28
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 78 and name HN ) 0.0000 0.0000
;
163 1 167 52 parsed_2k0j 1
29
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 79 and name HN ) 0.1080 0.0000
;
169 1 173 52 parsed_2k0j 1
30
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 80 and name HN ) -0.2600 0.0000
;
175 1 179 52 parsed_2k0j 1
31
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 81 and name HN ) -0.1810 0.0000
;
181 1 185 52 parsed_2k0j 1
32
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 82 and name HN ) -0.1180 0.0000
;
187 1 191 52 parsed_2k0j 1
33
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 83 and name HN ) -0.2600 0.0000
;
193 1 197 52 parsed_2k0j 1
34
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 84 and name HN ) -0.4080 0.0000
;
199 1 203 52 parsed_2k0j 1
35
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 85 and name HN ) -0.3470 0.0000
;
205 1 209 52 parsed_2k0j 1
36
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 86 and name HN ) -0.2730 0.0000
;
211 1 215 52 parsed_2k0j 1
37
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 87 and name HN ) -0.5180 0.0000
;
217 1 221 52 parsed_2k0j 1
38
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 88 and name HN ) -0.6090 0.0000
;
223 1 227 52 parsed_2k0j 1
39
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 89 and name HN ) -0.5120 0.0000
;
229 1 233 52 parsed_2k0j 1
40
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 90 and name HN ) -0.4750 0.0000
;
235 1 239 52 parsed_2k0j 1
41
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 91 and name HN ) -0.6500 0.0000
;
241 1 245 52 parsed_2k0j 1
42
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 92 and name HN ) -0.6120 0.0000
;
247 1 251 52 parsed_2k0j 1
43
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 93 and name HN ) -0.5040 0.0000
;
253 1 257 52 parsed_2k0j 1
44
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 94 and name HN ) -0.4670 0.0000
;
259 1 263 52 parsed_2k0j 1
45
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 95 and name HN ) -0.3890 0.0000
;
265 1 269 52 parsed_2k0j 1
46
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 96 and name HN ) -0.3750 0.0000
;
271 1 275 52 parsed_2k0j 1
47
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 97 and name HN ) -0.3160 0.0000
;
277 1 281 52 parsed_2k0j 1
48
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 98 and name HN ) -0.2950 0.0000
;
283 1 287 52 parsed_2k0j 1
49
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 99 and name HN ) -0.2560 0.0000
;
289 1 293 52 parsed_2k0j 1
50
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 100 and name HN ) -0.2740 0.0000
;
295 1 299 52 parsed_2k0j 1
51
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 101 and name HN ) -0.3130 0.0000
;
301 1 305 52 parsed_2k0j 1
52
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 102 and name HN ) -0.2480 0.0000
;
307 1 311 52 parsed_2k0j 1
53
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 103 and name HN ) -0.2840 0.0000
;
313 1 317 52 parsed_2k0j 1
54
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 104 and name HN ) -0.3610 0.0000
;
319 1 323 52 parsed_2k0j 1
55
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 105 and name HN ) -0.3790 0.0000
;
325 1 329 52 parsed_2k0j 1
56
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 107 and name HN ) -0.4930 0.0000
;
331 1 335 52 parsed_2k0j 1
57
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 108 and name HN ) -0.5990 0.0000
;
337 1 341 52 parsed_2k0j 1
58
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 109 and name HN ) -0.6200 0.0000
;
343 1 347 52 parsed_2k0j 1
59
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 110 and name HN ) -0.6570 0.0000
;
349 1 353 52 parsed_2k0j 1
60
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 111 and name HN ) -0.8640 0.0000
;
355 1 359 52 parsed_2k0j 1
61
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 112 and name HN ) -1.0460 0.0000
;
361 1 365 52 parsed_2k0j 1
62
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 113 and name HN ) -1.0380 0.0000
;
367 1 371 52 parsed_2k0j 1
63
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 114 and name HN ) -0.7880 0.0000
;
373 1 377 52 parsed_2k0j 1
64
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 115 and name HN ) -0.4300 0.0000
;
379 1 383 52 parsed_2k0j 1
65
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 116 and name HN ) -0.3850 0.0000
;
385 1 389 52 parsed_2k0j 1
66
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 117 and name HN ) -0.1940 0.0000
;
391 1 395 52 parsed_2k0j 1
67
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 118 and name HN ) -0.1800 0.0000
;
397 1 401 52 parsed_2k0j 1
68
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 119 and name HN ) -0.1320 0.0000
;
403 1 407 52 parsed_2k0j 1
69
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 120 and name HN ) -0.1150 0.0000
;
409 1 413 52 parsed_2k0j 1
70
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 121 and name HN ) -0.1970 0.0000
;
415 1 419 52 parsed_2k0j 1
71
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 122 and name HN ) -0.1550 0.0000
;
421 1 425 52 parsed_2k0j 1
72
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 123 and name HN ) -0.1130 0.0000
;
427 1 431 52 parsed_2k0j 1
73
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 124 and name HN ) -0.1320 0.0000
;
433 1 437 52 parsed_2k0j 1
74
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 125 and name HN ) -0.1890 0.0000
;
439 1 443 52 parsed_2k0j 1
75
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 126 and name HN ) -0.1140 0.0000
;
445 1 449 52 parsed_2k0j 1
76
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 127 and name HN ) -0.0800 0.0000
;
451 1 455 52 parsed_2k0j 1
77
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 128 and name HN ) -0.1000 0.0000
;
457 1 461 52 parsed_2k0j 1
78
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 129 and name HN ) -0.1200 0.0000
;
463 1 467 52 parsed_2k0j 1
79
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 130 and name HN ) -0.0870 0.0000
;
469 1 473 52 parsed_2k0j 1
80
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 131 and name HN ) -0.0800 0.0000
;
475 1 479 52 parsed_2k0j 1
81
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 132 and name HN ) -0.0790 0.0000
;
481 1 485 52 parsed_2k0j 1
82
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 133 and name HN ) -0.0940 0.0000
;
487 1 491 52 parsed_2k0j 1
83
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 134 and name HN ) -0.1200 0.0000
;
493 1 497 52 parsed_2k0j 1
84
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 135 and name HN ) -0.1600 0.0000
;
499 1 503 52 parsed_2k0j 1
85
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 136 and name HN ) -0.2260 0.0000
;
505 1 509 52 parsed_2k0j 1
86
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 137 and name HN ) -0.1860 0.0000
;
511 1 515 52 parsed_2k0j 1
87
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 138 and name HN ) -0.2060 0.0000
;
517 1 521 52 parsed_2k0j 1
88
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 139 and name HN ) -0.1550 0.0000
;
523 1 527 52 parsed_2k0j 1
89
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 140 and name HN ) -0.1440 0.0000
;
529 1 533 52 parsed_2k0j 1
90
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 141 and name HN ) -0.1870 0.0000
;
535 1 539 52 parsed_2k0j 1
91
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 142 and name HN ) -0.1870 0.0000
;
541 1 545 52 parsed_2k0j 1
92
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 143 and name HN ) -0.1230 0.0000
;
547 1 551 52 parsed_2k0j 1
93
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 144 and name HN ) -0.1080 0.0000
;
553 1 557 52 parsed_2k0j 1
94
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 145 and name HN ) -0.1110 0.0000
;
559 1 563 52 parsed_2k0j 1
95
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 146 and name HN ) 0.0040 0.0000
;
565 1 569 52 parsed_2k0j 1
96
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 147 and name HN ) 0.0020 0.0000
;
571 1 575 52 parsed_2k0j 1
97
;
assign ( resid 989 and name OO )
( resid 989 and name Z )
( resid 989 and name X )
( resid 989 and name Y )
( resid 148 and name HN ) 0.1210 0.0000
;
577 1 581 52 parsed_2k0j 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 2
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_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 ) 0.8630 0.0000
;
1 1 5 52 parsed_2k0j 2
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 ) 1.3710 0.0000
;
7 1 11 52 parsed_2k0j 2
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 ) 1.0690 0.0000
;
13 1 17 52 parsed_2k0j 2
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 ) 1.2270 0.0000
;
19 1 23 52 parsed_2k0j 2
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 ) 1.1390 0.0000
;
25 1 29 52 parsed_2k0j 2
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 ) 1.2130 0.0000
;
31 1 35 52 parsed_2k0j 2
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 ) 1.8320 0.0000
;
37 1 41 52 parsed_2k0j 2
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 ) 1.9850 0.0000
;
43 1 47 52 parsed_2k0j 2
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 ) 1.5120 0.0000
;
49 1 53 52 parsed_2k0j 2
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 ) 1.7740 0.0000
;
55 1 59 52 parsed_2k0j 2
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 ) 2.8340 0.0000
;
61 1 65 52 parsed_2k0j 2
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 ) 1.9930 0.0000
;
67 1 71 52 parsed_2k0j 2
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 ) 1.2730 0.0000
;
73 1 77 52 parsed_2k0j 2
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 ) 1.9270 0.0000
;
79 1 83 52 parsed_2k0j 2
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 ) 2.1490 0.0000
;
85 1 89 52 parsed_2k0j 2
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 ) 0.4950 0.0000
;
91 1 95 52 parsed_2k0j 2
17
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 19 and name HN ) -0.5480 0.0000
;
97 1 101 52 parsed_2k0j 2
18
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 20 and name HN ) -0.5600 0.0000
;
103 1 107 52 parsed_2k0j 2
19
;
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 ) -1.9590 0.0000
;
109 1 113 52 parsed_2k0j 2
20
;
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 ) -1.4510 0.0000
;
115 1 119 52 parsed_2k0j 2
21
;
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 ) -1.3490 0.0000
;
121 1 125 52 parsed_2k0j 2
22
;
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 ) -1.0900 0.0000
;
127 1 131 52 parsed_2k0j 2
23
;
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 ) -1.3160 0.0000
;
133 1 137 52 parsed_2k0j 2
24
;
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 ) -1.2740 0.0000
;
139 1 143 52 parsed_2k0j 2
25
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 44 and name HN ) -1.3570 0.0000
;
145 1 149 52 parsed_2k0j 2
26
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 45 and name HN ) -0.8050 0.0000
;
151 1 155 52 parsed_2k0j 2
27
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 46 and name HN ) -0.4220 0.0000
;
157 1 161 52 parsed_2k0j 2
28
;
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 ) -1.3750 0.0000
;
163 1 167 52 parsed_2k0j 2
29
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 50 and name HN ) -1.5770 0.0000
;
169 1 173 52 parsed_2k0j 2
30
;
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 ) -0.8290 0.0000
;
175 1 179 52 parsed_2k0j 2
31
;
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 ) -0.7520 0.0000
;
181 1 185 52 parsed_2k0j 2
32
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 78 and name HN ) -0.8480 0.0000
;
187 1 191 52 parsed_2k0j 2
33
;
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 ) -0.6710 0.0000
;
193 1 197 52 parsed_2k0j 2
34
;
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 ) -0.4900 0.0000
;
199 1 203 52 parsed_2k0j 2
35
;
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 ) -0.3070 0.0000
;
205 1 209 52 parsed_2k0j 2
36
;
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 ) -0.3990 0.0000
;
211 1 215 52 parsed_2k0j 2
37
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 84 and name HN ) -0.6570 0.0000
;
217 1 221 52 parsed_2k0j 2
38
;
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 ) -0.4980 0.0000
;
223 1 227 52 parsed_2k0j 2
39
;
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 ) -0.3930 0.0000
;
229 1 233 52 parsed_2k0j 2
40
;
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 ) -0.6350 0.0000
;
235 1 239 52 parsed_2k0j 2
41
;
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 ) -0.6800 0.0000
;
241 1 245 52 parsed_2k0j 2
42
;
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 ) -0.4960 0.0000
;
247 1 251 52 parsed_2k0j 2
43
;
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 ) -0.4890 0.0000
;
253 1 257 52 parsed_2k0j 2
44
;
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 ) -0.6050 0.0000
;
259 1 263 52 parsed_2k0j 2
45
;
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 ) -0.5250 0.0000
;
265 1 269 52 parsed_2k0j 2
46
;
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 ) -0.4300 0.0000
;
271 1 275 52 parsed_2k0j 2
47
;
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 ) -0.3670 0.0000
;
277 1 281 52 parsed_2k0j 2
48
;
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 ) -0.3180 0.0000
;
283 1 287 52 parsed_2k0j 2
49
;
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 ) -0.3300 0.0000
;
289 1 293 52 parsed_2k0j 2
50
;
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 ) -0.2650 0.0000
;
295 1 299 52 parsed_2k0j 2
51
;
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 ) -0.2710 0.0000
;
301 1 305 52 parsed_2k0j 2
52
;
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 ) -0.2230 0.0000
;
307 1 311 52 parsed_2k0j 2
53
;
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 ) -0.2070 0.0000
;
313 1 317 52 parsed_2k0j 2
54
;
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 ) -0.2320 0.0000
;
319 1 323 52 parsed_2k0j 2
55
;
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 ) -0.1290 0.0000
;
325 1 329 52 parsed_2k0j 2
56
;
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 ) -0.1710 0.0000
;
331 1 335 52 parsed_2k0j 2
57
;
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 ) -0.2240 0.0000
;
337 1 341 52 parsed_2k0j 2
58
;
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 ) -0.2410 0.0000
;
343 1 347 52 parsed_2k0j 2
59
;
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 ) -0.2150 0.0000
;
349 1 353 52 parsed_2k0j 2
60
;
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 ) -0.2900 0.0000
;
355 1 359 52 parsed_2k0j 2
61
;
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 ) -0.3750 0.0000
;
361 1 365 52 parsed_2k0j 2
62
;
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 ) -0.3340 0.0000
;
367 1 371 52 parsed_2k0j 2
63
;
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 ) -0.3320 0.0000
;
373 1 377 52 parsed_2k0j 2
64
;
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 ) -0.4950 0.0000
;
379 1 383 52 parsed_2k0j 2
65
;
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 ) -0.5710 0.0000
;
385 1 389 52 parsed_2k0j 2
66
;
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 ) -0.4940 0.0000
;
391 1 395 52 parsed_2k0j 2
67
;
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 ) -0.2680 0.0000
;
397 1 401 52 parsed_2k0j 2
68
;
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 ) -0.0130 0.0000
;
403 1 407 52 parsed_2k0j 2
69
;
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 ) -0.0900 0.0000
;
409 1 413 52 parsed_2k0j 2
70
;
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 ) 0.0040 0.0000
;
415 1 419 52 parsed_2k0j 2
71
;
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 ) -0.0190 0.0000
;
421 1 425 52 parsed_2k0j 2
72
;
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 ) 0.0080 0.0000
;
427 1 431 52 parsed_2k0j 2
73
;
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 ) 0.0270 0.0000
;
433 1 437 52 parsed_2k0j 2
74
;
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 ) -0.0100 0.0000
;
439 1 443 52 parsed_2k0j 2
75
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 122 and name HN ) -0.0090 0.0000
;
445 1 449 52 parsed_2k0j 2
76
;
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 ) 0.0190 0.0000
;
451 1 455 52 parsed_2k0j 2
77
;
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 ) 0.0060 0.0000
;
457 1 461 52 parsed_2k0j 2
78
;
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 ) -0.0230 0.0000
;
463 1 467 52 parsed_2k0j 2
79
;
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 ) 0.0020 0.0000
;
469 1 473 52 parsed_2k0j 2
80
;
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 ) 0.0040 0.0000
;
475 1 479 52 parsed_2k0j 2
81
;
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 ) -0.0120 0.0000
;
481 1 485 52 parsed_2k0j 2
82
;
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 ) -0.0080 0.0000
;
487 1 491 52 parsed_2k0j 2
83
;
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 ) -0.0540 0.0000
;
493 1 497 52 parsed_2k0j 2
84
;
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 ) -0.0610 0.0000
;
499 1 503 52 parsed_2k0j 2
85
;
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 ) -0.0360 0.0000
;
505 1 509 52 parsed_2k0j 2
86
;
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 ) -0.0800 0.0000
;
511 1 515 52 parsed_2k0j 2
87
;
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 ) -0.0610 0.0000
;
517 1 521 52 parsed_2k0j 2
88
;
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 ) -0.0940 0.0000
;
523 1 527 52 parsed_2k0j 2
89
;
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 ) -0.1650 0.0000
;
529 1 533 52 parsed_2k0j 2
90
;
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 ) -0.1500 0.0000
;
535 1 539 52 parsed_2k0j 2
91
;
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 ) -0.2000 0.0000
;
541 1 545 52 parsed_2k0j 2
92
;
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 ) -0.1560 0.0000
;
547 1 551 52 parsed_2k0j 2
93
;
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 ) -0.1290 0.0000
;
553 1 557 52 parsed_2k0j 2
94
;
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 ) -0.1490 0.0000
;
559 1 563 52 parsed_2k0j 2
95
;
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 ) -0.1880 0.0000
;
565 1 569 52 parsed_2k0j 2
96
;
assign ( resid 979 and name OO )
( resid 979 and name Z )
( resid 979 and name X )
( resid 979 and name Y )
( resid 143 and name HN ) -0.1300 0.0000
;
571 1 575 52 parsed_2k0j 2
97
;
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 ) -0.0790 0.0000
;
577 1 581 52 parsed_2k0j 2
98
;
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 ) -0.0940 0.0000
;
583 1 587 52 parsed_2k0j 2
99
;
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 ) -0.0600 0.0000
;
589 1 593 52 parsed_2k0j 2
100
;
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 ) -0.0220 0.0000
;
595 1 599 52 parsed_2k0j 2
101
;
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 ) 0.1080 0.0000
;
601 1 605 52 parsed_2k0j 2
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 3
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 ) -0.6330 0.0000
;
1 1 5 52 parsed_2k0j 3
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 ) -0.8610 0.0000
;
7 1 11 52 parsed_2k0j 3
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 ) -0.6530 0.0000
;
13 1 17 52 parsed_2k0j 3
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 ) -0.7330 0.0000
;
19 1 23 52 parsed_2k0j 3
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 ) -0.6580 0.0000
;
25 1 29 52 parsed_2k0j 3
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 ) -0.6830 0.0000
;
31 1 35 52 parsed_2k0j 3
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 ) -1.0800 0.0000
;
37 1 41 52 parsed_2k0j 3
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 ) -1.1300 0.0000
;
43 1 47 52 parsed_2k0j 3
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 ) -0.8850 0.0000
;
49 1 53 52 parsed_2k0j 3
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 ) -1.0950 0.0000
;
55 1 59 52 parsed_2k0j 3
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 ) -1.7220 0.0000
;
61 1 65 52 parsed_2k0j 3
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 ) -1.1900 0.0000
;
67 1 71 52 parsed_2k0j 3
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 ) -0.7890 0.0000
;
73 1 77 52 parsed_2k0j 3
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 ) -1.2830 0.0000
;
79 1 83 52 parsed_2k0j 3
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 ) -1.5690 0.0000
;
85 1 89 52 parsed_2k0j 3
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 ) -0.5710 0.0000
;
91 1 95 52 parsed_2k0j 3
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 ) -0.0200 0.0000
;
97 1 101 52 parsed_2k0j 3
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 ) -0.7490 0.0000
;
103 1 107 52 parsed_2k0j 3
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 ) -0.1790 0.0000
;
109 1 113 52 parsed_2k0j 3
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 ) -0.7840 0.0000
;
115 1 119 52 parsed_2k0j 3
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 ) -1.5040 0.0000
;
121 1 125 52 parsed_2k0j 3
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 ) -2.3790 0.0000
;
127 1 131 52 parsed_2k0j 3
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 ) 1.9490 0.0000
;
133 1 137 52 parsed_2k0j 3
24
;
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 ) 2.9030 0.0000
;
139 1 143 52 parsed_2k0j 3
25
;
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 ) 1.6630 0.0000
;
145 1 149 52 parsed_2k0j 3
26
;
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 ) 1.6310 0.0000
;
151 1 155 52 parsed_2k0j 3
27
;
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 ) 1.9270 0.0000
;
157 1 161 52 parsed_2k0j 3
28
;
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 ) 1.2600 0.0000
;
163 1 167 52 parsed_2k0j 3
29
;
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 ) 0.9030 0.0000
;
169 1 173 52 parsed_2k0j 3
30
;
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 ) 0.8960 0.0000
;
175 1 179 52 parsed_2k0j 3
31
;
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 ) 0.7590 0.0000
;
181 1 185 52 parsed_2k0j 3
32
;
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 ) 0.9480 0.0000
;
187 1 191 52 parsed_2k0j 3
33
;
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 ) 0.9870 0.0000
;
193 1 197 52 parsed_2k0j 3
34
;
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 ) 1.1940 0.0000
;
199 1 203 52 parsed_2k0j 3
35
;
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 ) 0.7740 0.0000
;
205 1 209 52 parsed_2k0j 3
36
;
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 ) 0.7010 0.0000
;
211 1 215 52 parsed_2k0j 3
37
;
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 ) 1.2560 0.0000
;
217 1 221 52 parsed_2k0j 3
38
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 48 and name HN ) 2.1700 0.0000
;
223 1 227 52 parsed_2k0j 3
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 ) 2.2580 0.0000
;
229 1 233 52 parsed_2k0j 3
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 ) 2.3130 0.0000
;
235 1 239 52 parsed_2k0j 3
41
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 72 and name HN ) 1.3340 0.0000
;
241 1 245 52 parsed_2k0j 3
42
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 73 and name HN ) 0.3390 0.0000
;
247 1 251 52 parsed_2k0j 3
43
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 74 and name HN ) 1.0270 0.0000
;
253 1 257 52 parsed_2k0j 3
44
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 75 and name HN ) 1.5620 0.0000
;
259 1 263 52 parsed_2k0j 3
45
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 76 and name HN ) 0.7580 0.0000
;
265 1 269 52 parsed_2k0j 3
46
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 77 and name HN ) 0.6060 0.0000
;
271 1 275 52 parsed_2k0j 3
47
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 78 and name HN ) 0.6770 0.0000
;
277 1 281 52 parsed_2k0j 3
48
;
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 ) 0.6270 0.0000
;
283 1 287 52 parsed_2k0j 3
49
;
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 ) 0.4300 0.0000
;
289 1 293 52 parsed_2k0j 3
50
;
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 ) 0.2880 0.0000
;
295 1 299 52 parsed_2k0j 3
51
;
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 ) 0.3490 0.0000
;
301 1 305 52 parsed_2k0j 3
52
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 83 and name HN ) 0.4170 0.0000
;
307 1 311 52 parsed_2k0j 3
53
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 84 and name HN ) 0.4060 0.0000
;
313 1 317 52 parsed_2k0j 3
54
;
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 ) 0.4040 0.0000
;
319 1 323 52 parsed_2k0j 3
55
;
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 ) 0.4390 0.0000
;
325 1 329 52 parsed_2k0j 3
56
;
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 ) 0.4300 0.0000
;
331 1 335 52 parsed_2k0j 3
57
;
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 ) 0.4960 0.0000
;
337 1 341 52 parsed_2k0j 3
58
;
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 ) 0.4010 0.0000
;
343 1 347 52 parsed_2k0j 3
59
;
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 ) 0.4360 0.0000
;
349 1 353 52 parsed_2k0j 3
60
;
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 ) 0.4800 0.0000
;
355 1 359 52 parsed_2k0j 3
61
;
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 ) 0.3950 0.0000
;
361 1 365 52 parsed_2k0j 3
62
;
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 ) 0.3770 0.0000
;
367 1 371 52 parsed_2k0j 3
63
;
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 ) 0.2670 0.0000
;
373 1 377 52 parsed_2k0j 3
64
;
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 ) 0.2250 0.0000
;
379 1 383 52 parsed_2k0j 3
65
;
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 ) 0.2330 0.0000
;
385 1 389 52 parsed_2k0j 3
66
;
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 ) 0.1870 0.0000
;
391 1 395 52 parsed_2k0j 3
67
;
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 ) 0.1830 0.0000
;
397 1 401 52 parsed_2k0j 3
68
;
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 ) 0.1790 0.0000
;
403 1 407 52 parsed_2k0j 3
69
;
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 ) 0.1430 0.0000
;
409 1 413 52 parsed_2k0j 3
70
;
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 ) 0.1720 0.0000
;
415 1 419 52 parsed_2k0j 3
71
;
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 ) 0.0930 0.0000
;
421 1 425 52 parsed_2k0j 3
72
;
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 ) 0.1130 0.0000
;
427 1 431 52 parsed_2k0j 3
73
;
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 ) 0.1580 0.0000
;
433 1 437 52 parsed_2k0j 3
74
;
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 ) 0.1430 0.0000
;
439 1 443 52 parsed_2k0j 3
75
;
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 ) 0.1240 0.0000
;
445 1 449 52 parsed_2k0j 3
76
;
assign ( resid 999 and name OO )
( resid 999 and name Z )
( resid 999 and name X )
( resid 999 and name Y )
( resid 107 and name HN ) 0.1660 0.0000
;
451 1 455 52 parsed_2k0j 3
77
;
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
;
457 1 461 52 parsed_2k0j 3
78
;
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 ) 0.2100 0.0000
;
463 1 467 52 parsed_2k0j 3
79
;
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 ) 0.1590 0.0000
;
469 1 473 52 parsed_2k0j 3
80
;
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 ) 0.2610 0.0000
;
475 1 479 52 parsed_2k0j 3
81
;
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 ) 0.3270 0.0000
;
481 1 485 52 parsed_2k0j 3
82
;
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 ) 0.2010 0.0000
;
487 1 491 52 parsed_2k0j 3
83
;
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 ) 0.0910 0.0000
;
493 1 497 52 parsed_2k0j 3
84
;
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 ) -0.0920 0.0000
;
499 1 503 52 parsed_2k0j 3
85
;
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 ) -0.0120 0.0000
;
505 1 509 52 parsed_2k0j 3
86
;
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 ) -0.0660 0.0000
;
511 1 515 52 parsed_2k0j 3
87
;
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 ) -0.0190 0.0000
;
517 1 521 52 parsed_2k0j 3
88
;
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 ) -0.0120 0.0000
;
523 1 527 52 parsed_2k0j 3
89
;
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 ) -0.0250 0.0000
;
529 1 533 52 parsed_2k0j 3
90
;
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 ) 0.0020 0.0000
;
535 1 539 52 parsed_2k0j 3
91
;
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 ) 0.0160 0.0000
;
541 1 545 52 parsed_2k0j 3
92
;
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 ) -0.0170 0.0000
;
547 1 551 52 parsed_2k0j 3
93
;
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 ) 0.0210 0.0000
;
553 1 557 52 parsed_2k0j 3
94
;
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 ) 0.0380 0.0000
;
559 1 563 52 parsed_2k0j 3
95
;
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 ) 0.0190 0.0000
;
565 1 569 52 parsed_2k0j 3
96
;
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 ) -0.0110 0.0000
;
571 1 575 52 parsed_2k0j 3
97
;
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 ) 0.0230 0.0000
;
577 1 581 52 parsed_2k0j 3
98
;
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 ) 0.0250 0.0000
;
583 1 587 52 parsed_2k0j 3
99
;
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 ) 0.0550 0.0000
;
589 1 593 52 parsed_2k0j 3
100
;
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 ) 0.0790 0.0000
;
595 1 599 52 parsed_2k0j 3
101
;
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 ) 0.0350 0.0000
;
601 1 605 52 parsed_2k0j 3
102
;
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 ) 0.0590 0.0000
;
607 1 611 52 parsed_2k0j 3
103
;
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 ) 0.0300 0.0000
;
613 1 617 52 parsed_2k0j 3
104
;
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 ) 0.0750 0.0000
;
619 1 623 52 parsed_2k0j 3
105
;
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 ) 0.1120 0.0000
;
625 1 629 52 parsed_2k0j 3
106
;
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 ) 0.1160 0.0000
;
631 1 635 52 parsed_2k0j 3
107
;
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 ) 0.1430 0.0000
;
637 1 641 52 parsed_2k0j 3
108
;
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 ) 0.1370 0.0000
;
643 1 647 52 parsed_2k0j 3
109
;
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 ) 0.1200 0.0000
;
649 1 653 52 parsed_2k0j 3
110
;
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 ) 0.1450 0.0000
;
655 1 659 52 parsed_2k0j 3
111
;
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 ) 0.1390 0.0000
;
661 1 665 52 parsed_2k0j 3
112
;
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 ) 0.0910 0.0000
;
667 1 671 52 parsed_2k0j 3
113
;
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 ) 0.0840 0.0000
;
673 1 677 52 parsed_2k0j 3
114
;
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 ) 0.1200 0.0000
;
679 1 683 52 parsed_2k0j 3
115
;
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 ) 0.0870 0.0000
;
685 1 689 52 parsed_2k0j 3
116
;
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 ) 0.0170 0.0000
;
691 1 695 52 parsed_2k0j 3
117
;
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 ) -0.0430 0.0000
;
697 1 701 52 parsed_2k0j 3
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 4
_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 . . . . . . . . . . . . . . . . 4.8950 . . . . . 7 . N . 7 . HN parsed_2k0j 4
2 . . . . . . . . . . . . . . . . -3.2600 . . . . . 8 . N . 8 . HN parsed_2k0j 4
3 . . . . . . . . . . . . . . . . 2.4830 . . . . . 9 . N . 9 . HN parsed_2k0j 4
4 . . . . . . . . . . . . . . . . 11.0680 . . . . . 10 . N . 10 . HN parsed_2k0j 4
5 . . . . . . . . . . . . . . . . -0.0710 . . . . . 11 . N . 11 . HN parsed_2k0j 4
6 . . . . . . . . . . . . . . . . -5.1000 . . . . . 12 . N . 12 . HN parsed_2k0j 4
7 . . . . . . . . . . . . . . . . 11.8480 . . . . . 13 . N . 13 . HN parsed_2k0j 4
8 . . . . . . . . . . . . . . . . 1.5600 . . . . . 14 . N . 14 . HN parsed_2k0j 4
9 . . . . . . . . . . . . . . . . -1.6310 . . . . . 15 . N . 15 . HN parsed_2k0j 4
10 . . . . . . . . . . . . . . . . 5.1080 . . . . . 18 . N . 18 . HN parsed_2k0j 4
11 . . . . . . . . . . . . . . . . -15.1120 . . . . . 37 . N . 37 . HN parsed_2k0j 4
12 . . . . . . . . . . . . . . . . -27.7410 . . . . . 38 . N . 38 . HN parsed_2k0j 4
13 . . . . . . . . . . . . . . . . 0.6390 . . . . . 40 . N . 40 . HN parsed_2k0j 4
14 . . . . . . . . . . . . . . . . 1.8540 . . . . . 41 . N . 41 . HN parsed_2k0j 4
15 . . . . . . . . . . . . . . . . 5.1000 . . . . . 44 . N . 44 . HN parsed_2k0j 4
16 . . . . . . . . . . . . . . . . -1.8500 . . . . . 45 . N . 45 . HN parsed_2k0j 4
17 . . . . . . . . . . . . . . . . -10.2800 . . . . . 46 . N . 46 . HN parsed_2k0j 4
18 . . . . . . . . . . . . . . . . -16.1770 . . . . . 47 . N . 47 . HN parsed_2k0j 4
19 . . . . . . . . . . . . . . . . -15.2540 . . . . . 50 . N . 50 . HN parsed_2k0j 4
20 . . . . . . . . . . . . . . . . -6.3850 . . . . . 86 . N . 86 . HN parsed_2k0j 4
21 . . . . . . . . . . . . . . . . 0.0000 . . . . . 89 . N . 89 . HN parsed_2k0j 4
22 . . . . . . . . . . . . . . . . -10.4290 . . . . . 90 . N . 90 . HN parsed_2k0j 4
23 . . . . . . . . . . . . . . . . -10.9970 . . . . . 91 . N . 91 . HN parsed_2k0j 4
24 . . . . . . . . . . . . . . . . -1.5600 . . . . . 92 . N . 92 . HN parsed_2k0j 4
25 . . . . . . . . . . . . . . . . 11.9190 . . . . . 94 . N . 94 . HN parsed_2k0j 4
26 . . . . . . . . . . . . . . . . 23.4840 . . . . . 95 . N . 95 . HN parsed_2k0j 4
27 . . . . . . . . . . . . . . . . -1.2770 . . . . . 97 . N . 97 . HN parsed_2k0j 4
28 . . . . . . . . . . . . . . . . 0.4250 . . . . . 98 . N . 98 . HN parsed_2k0j 4
29 . . . . . . . . . . . . . . . . 10.2160 . . . . . 99 . N . 99 . HN parsed_2k0j 4
30 . . . . . . . . . . . . . . . . 9.7910 . . . . . 100 . N . 100 . HN parsed_2k0j 4
31 . . . . . . . . . . . . . . . . 21.0720 . . . . . 101 . N . 101 . HN parsed_2k0j 4
32 . . . . . . . . . . . . . . . . -10.5000 . . . . . 102 . N . 102 . HN parsed_2k0j 4
33 . . . . . . . . . . . . . . . . -20.1490 . . . . . 103 . N . 103 . HN parsed_2k0j 4
34 . . . . . . . . . . . . . . . . -0.7800 . . . . . 104 . N . 104 . HN parsed_2k0j 4
35 . . . . . . . . . . . . . . . . -1.7020 . . . . . 105 . N . 105 . HN parsed_2k0j 4
36 . . . . . . . . . . . . . . . . -17.9500 . . . . . 106 . N . 106 . HN parsed_2k0j 4
37 . . . . . . . . . . . . . . . . -10.3580 . . . . . 107 . N . 107 . HN parsed_2k0j 4
38 . . . . . . . . . . . . . . . . -1.9860 . . . . . 108 . N . 108 . HN parsed_2k0j 4
39 . . . . . . . . . . . . . . . . -10.6420 . . . . . 109 . N . 109 . HN parsed_2k0j 4
40 . . . . . . . . . . . . . . . . -20.5040 . . . . . 110 . N . 110 . HN parsed_2k0j 4
41 . . . . . . . . . . . . . . . . -7.7330 . . . . . 111 . N . 111 . HN parsed_2k0j 4
42 . . . . . . . . . . . . . . . . -1.6310 . . . . . 112 . N . 112 . HN parsed_2k0j 4
43 . . . . . . . . . . . . . . . . -5.3920 . . . . . 117 . N . 117 . HN parsed_2k0j 4
44 . . . . . . . . . . . . . . . . 1.5600 . . . . . 119 . N . 119 . HN parsed_2k0j 4
45 . . . . . . . . . . . . . . . . 7.3070 . . . . . 120 . N . 120 . HN parsed_2k0j 4
46 . . . . . . . . . . . . . . . . -0.4250 . . . . . 121 . N . 121 . HN parsed_2k0j 4
47 . . . . . . . . . . . . . . . . 1.9150 . . . . . 122 . N . 122 . HN parsed_2k0j 4
48 . . . . . . . . . . . . . . . . 3.7600 . . . . . 123 . N . 123 . HN parsed_2k0j 4
49 . . . . . . . . . . . . . . . . 4.1150 . . . . . 124 . N . 124 . HN parsed_2k0j 4
50 . . . . . . . . . . . . . . . . 1.7730 . . . . . 125 . N . 125 . HN parsed_2k0j 4
51 . . . . . . . . . . . . . . . . 5.3920 . . . . . 126 . N . 126 . HN parsed_2k0j 4
52 . . . . . . . . . . . . . . . . 8.3720 . . . . . 127 . N . 127 . HN parsed_2k0j 4
53 . . . . . . . . . . . . . . . . -0.2830 . . . . . 128 . N . 128 . HN parsed_2k0j 4
54 . . . . . . . . . . . . . . . . 4.9660 . . . . . 129 . N . 129 . HN parsed_2k0j 4
55 . . . . . . . . . . . . . . . . 19.5820 . . . . . 131 . N . 131 . HN parsed_2k0j 4
56 . . . . . . . . . . . . . . . . -18.0210 . . . . . 132 . N . 132 . HN parsed_2k0j 4
57 . . . . . . . . . . . . . . . . -3.1920 . . . . . 134 . N . 134 . HN parsed_2k0j 4
58 . . . . . . . . . . . . . . . . 9.7200 . . . . . 135 . N . 135 . HN parsed_2k0j 4
59 . . . . . . . . . . . . . . . . 14.7570 . . . . . 136 . N . 136 . HN parsed_2k0j 4
60 . . . . . . . . . . . . . . . . -11.8480 . . . . . 138 . N . 138 . HN parsed_2k0j 4
61 . . . . . . . . . . . . . . . . -21.9230 . . . . . 140 . N . 140 . HN parsed_2k0j 4
62 . . . . . . . . . . . . . . . . -12.5580 . . . . . 141 . N . 141 . HN parsed_2k0j 4
63 . . . . . . . . . . . . . . . . -21.4260 . . . . . 142 . N . 142 . HN parsed_2k0j 4
64 . . . . . . . . . . . . . . . . -27.2440 . . . . . 143 . N . 143 . HN parsed_2k0j 4
65 . . . . . . . . . . . . . . . . -13.3380 . . . . . 144 . N . 144 . HN parsed_2k0j 4
66 . . . . . . . . . . . . . . . . -16.3180 . . . . . 145 . N . 145 . HN parsed_2k0j 4
67 . . . . . . . . . . . . . . . . -23.2710 . . . . . 146 . N . 146 . HN parsed_2k0j 4
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 5
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . 4.1150 . . . . . 7 . N . 7 . HN parsed_2k0j 5
2 . . . . . . . . . . . . . . . . 0.7090 . . . . . 8 . N . 8 . HN parsed_2k0j 5
3 . . . . . . . . . . . . . . . . 4.4690 . . . . . 9 . N . 9 . HN parsed_2k0j 5
4 . . . . . . . . . . . . . . . . 7.7330 . . . . . 10 . N . 10 . HN parsed_2k0j 5
5 . . . . . . . . . . . . . . . . 0.9220 . . . . . 11 . N . 11 . HN parsed_2k0j 5
6 . . . . . . . . . . . . . . . . -1.0640 . . . . . 12 . N . 12 . HN parsed_2k0j 5
7 . . . . . . . . . . . . . . . . 9.9330 . . . . . 13 . N . 13 . HN parsed_2k0j 5
8 . . . . . . . . . . . . . . . . 5.2500 . . . . . 14 . N . 14 . HN parsed_2k0j 5
9 . . . . . . . . . . . . . . . . 4.3270 . . . . . 15 . N . 15 . HN parsed_2k0j 5
10 . . . . . . . . . . . . . . . . 12.9830 . . . . . 17 . N . 17 . HN parsed_2k0j 5
11 . . . . . . . . . . . . . . . . 3.1210 . . . . . 18 . N . 18 . HN parsed_2k0j 5
12 . . . . . . . . . . . . . . . . 0.9930 . . . . . 19 . N . 19 . HN parsed_2k0j 5
13 . . . . . . . . . . . . . . . . 3.7600 . . . . . 20 . N . 20 . HN parsed_2k0j 5
14 . . . . . . . . . . . . . . . . -20.2200 . . . . . 37 . N . 37 . HN parsed_2k0j 5
15 . . . . . . . . . . . . . . . . -23.5550 . . . . . 38 . N . 38 . HN parsed_2k0j 5
16 . . . . . . . . . . . . . . . . -7.0240 . . . . . 39 . N . 39 . HN parsed_2k0j 5
17 . . . . . . . . . . . . . . . . -11.1390 . . . . . 40 . N . 40 . HN parsed_2k0j 5
18 . . . . . . . . . . . . . . . . -1.7020 . . . . . 41 . N . 41 . HN parsed_2k0j 5
19 . . . . . . . . . . . . . . . . -2.2700 . . . . . 44 . N . 44 . HN parsed_2k0j 5
20 . . . . . . . . . . . . . . . . 2.3410 . . . . . 45 . N . 45 . HN parsed_2k0j 5
21 . . . . . . . . . . . . . . . . -3.6890 . . . . . 46 . N . 46 . HN parsed_2k0j 5
22 . . . . . . . . . . . . . . . . -9.8620 . . . . . 47 . N . 47 . HN parsed_2k0j 5
23 . . . . . . . . . . . . . . . . -7.8750 . . . . . 50 . N . 50 . HN parsed_2k0j 5
24 . . . . . . . . . . . . . . . . -4.2570 . . . . . 86 . N . 86 . HN parsed_2k0j 5
25 . . . . . . . . . . . . . . . . -3.6890 . . . . . 89 . N . 89 . HN parsed_2k0j 5
26 . . . . . . . . . . . . . . . . -3.7600 . . . . . 90 . N . 90 . HN parsed_2k0j 5
27 . . . . . . . . . . . . . . . . -6.8110 . . . . . 91 . N . 91 . HN parsed_2k0j 5
28 . . . . . . . . . . . . . . . . -3.8310 . . . . . 92 . N . 92 . HN parsed_2k0j 5
29 . . . . . . . . . . . . . . . . 8.2300 . . . . . 94 . N . 94 . HN parsed_2k0j 5
30 . . . . . . . . . . . . . . . . 22.9160 . . . . . 95 . N . 95 . HN parsed_2k0j 5
31 . . . . . . . . . . . . . . . . -9.3650 . . . . . 97 . N . 97 . HN parsed_2k0j 5
32 . . . . . . . . . . . . . . . . -0.9220 . . . . . 98 . N . 98 . HN parsed_2k0j 5
33 . . . . . . . . . . . . . . . . 10.0030 . . . . . 99 . N . 99 . HN parsed_2k0j 5
34 . . . . . . . . . . . . . . . . 8.8680 . . . . . 100 . N . 100 . HN parsed_2k0j 5
35 . . . . . . . . . . . . . . . . 24.1930 . . . . . 101 . N . 101 . HN parsed_2k0j 5
36 . . . . . . . . . . . . . . . . -6.4560 . . . . . 102 . N . 102 . HN parsed_2k0j 5
37 . . . . . . . . . . . . . . . . -18.9400 . . . . . 103 . N . 103 . HN parsed_2k0j 5
38 . . . . . . . . . . . . . . . . -4.3900 . . . . . 104 . N . 104 . HN parsed_2k0j 5
39 . . . . . . . . . . . . . . . . -0.6300 . . . . . 105 . N . 105 . HN parsed_2k0j 5
40 . . . . . . . . . . . . . . . . -15.4670 . . . . . 106 . N . 106 . HN parsed_2k0j 5
41 . . . . . . . . . . . . . . . . -14.3310 . . . . . 107 . N . 107 . HN parsed_2k0j 5
42 . . . . . . . . . . . . . . . . -3.5470 . . . . . 108 . N . 108 . HN parsed_2k0j 5
43 . . . . . . . . . . . . . . . . -7.9460 . . . . . 109 . N . 109 . HN parsed_2k0j 5
44 . . . . . . . . . . . . . . . . -20.0780 . . . . . 110 . N . 110 . HN parsed_2k0j 5
45 . . . . . . . . . . . . . . . . -16.0340 . . . . . 111 . N . 111 . HN parsed_2k0j 5
46 . . . . . . . . . . . . . . . . 2.3410 . . . . . 112 . N . 112 . HN parsed_2k0j 5
47 . . . . . . . . . . . . . . . . -1.7020 . . . . . 117 . N . 117 . HN parsed_2k0j 5
48 . . . . . . . . . . . . . . . . -7.2360 . . . . . 119 . N . 119 . HN parsed_2k0j 5
49 . . . . . . . . . . . . . . . . -1.1350 . . . . . 120 . N . 120 . HN parsed_2k0j 5
50 . . . . . . . . . . . . . . . . -2.6250 . . . . . 121 . N . 121 . HN parsed_2k0j 5
51 . . . . . . . . . . . . . . . . -4.4690 . . . . . 122 . N . 122 . HN parsed_2k0j 5
52 . . . . . . . . . . . . . . . . -4.8240 . . . . . 123 . N . 123 . HN parsed_2k0j 5
53 . . . . . . . . . . . . . . . . -0.2120 . . . . . 124 . N . 124 . HN parsed_2k0j 5
54 . . . . . . . . . . . . . . . . -3.4050 . . . . . 125 . N . 125 . HN parsed_2k0j 5
55 . . . . . . . . . . . . . . . . -6.4560 . . . . . 126 . N . 126 . HN parsed_2k0j 5
56 . . . . . . . . . . . . . . . . 3.9730 . . . . . 127 . N . 127 . HN parsed_2k0j 5
57 . . . . . . . . . . . . . . . . -0.7800 . . . . . 128 . N . 128 . HN parsed_2k0j 5
58 . . . . . . . . . . . . . . . . -4.7530 . . . . . 129 . N . 129 . HN parsed_2k0j 5
59 . . . . . . . . . . . . . . . . 24.1230 . . . . . 131 . N . 131 . HN parsed_2k0j 5
60 . . . . . . . . . . . . . . . . -9.2230 . . . . . 132 . N . 132 . HN parsed_2k0j 5
61 . . . . . . . . . . . . . . . . -1.4890 . . . . . 133 . N . 133 . HN parsed_2k0j 5
62 . . . . . . . . . . . . . . . . 0.3540 . . . . . 134 . N . 134 . HN parsed_2k0j 5
63 . . . . . . . . . . . . . . . . 0.4250 . . . . . 135 . N . 135 . HN parsed_2k0j 5
64 . . . . . . . . . . . . . . . . 12.2740 . . . . . 136 . N . 136 . HN parsed_2k0j 5
65 . . . . . . . . . . . . . . . . -16.6020 . . . . . 138 . N . 138 . HN parsed_2k0j 5
66 . . . . . . . . . . . . . . . . -22.1360 . . . . . 139 . N . 139 . HN parsed_2k0j 5
67 . . . . . . . . . . . . . . . . -11.7770 . . . . . 140 . N . 140 . HN parsed_2k0j 5
68 . . . . . . . . . . . . . . . . -11.2810 . . . . . 141 . N . 141 . HN parsed_2k0j 5
69 . . . . . . . . . . . . . . . . -20.5040 . . . . . 142 . N . 142 . HN parsed_2k0j 5
70 . . . . . . . . . . . . . . . . -22.2780 . . . . . 143 . N . 143 . HN parsed_2k0j 5
71 . . . . . . . . . . . . . . . . -9.5780 . . . . . 144 . N . 144 . HN parsed_2k0j 5
72 . . . . . . . . . . . . . . . . -19.6530 . . . . . 145 . N . 145 . HN parsed_2k0j 5
73 . . . . . . . . . . . . . . . . -15.0410 . . . . . 146 . N . 146 . HN parsed_2k0j 5
stop_
save_
save_CNS/XPLOR_dipolar_coupling_7
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k0j
_RDC_constraint_list.ID 6
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 7
_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 . . . . . . . . . . . . . . . . -3.9730 . . . . . 7 . N . 7 . HN parsed_2k0j 6
2 . . . . . . . . . . . . . . . . 1.7730 . . . . . 8 . N . 8 . HN parsed_2k0j 6
3 . . . . . . . . . . . . . . . . -4.5400 . . . . . 9 . N . 9 . HN parsed_2k0j 6
4 . . . . . . . . . . . . . . . . -6.4560 . . . . . 10 . N . 10 . HN parsed_2k0j 6
5 . . . . . . . . . . . . . . . . -3.6890 . . . . . 11 . N . 11 . HN parsed_2k0j 6
6 . . . . . . . . . . . . . . . . -2.5540 . . . . . 12 . N . 12 . HN parsed_2k0j 6
7 . . . . . . . . . . . . . . . . -5.9590 . . . . . 13 . N . 13 . HN parsed_2k0j 6
8 . . . . . . . . . . . . . . . . -6.5980 . . . . . 14 . N . 14 . HN parsed_2k0j 6
9 . . . . . . . . . . . . . . . . -5.8880 . . . . . 15 . N . 15 . HN parsed_2k0j 6
10 . . . . . . . . . . . . . . . . -6.4560 . . . . . 17 . N . 17 . HN parsed_2k0j 6
11 . . . . . . . . . . . . . . . . -5.5340 . . . . . 18 . N . 18 . HN parsed_2k0j 6
12 . . . . . . . . . . . . . . . . -4.6820 . . . . . 19 . N . 19 . HN parsed_2k0j 6
13 . . . . . . . . . . . . . . . . -6.0300 . . . . . 20 . N . 20 . HN parsed_2k0j 6
14 . . . . . . . . . . . . . . . . -6.4560 . . . . . 21 . N . 21 . HN parsed_2k0j 6
15 . . . . . . . . . . . . . . . . -10.9970 . . . . . 22 . N . 22 . HN parsed_2k0j 6
16 . . . . . . . . . . . . . . . . 11.7770 . . . . . 23 . N . 23 . HN parsed_2k0j 6
17 . . . . . . . . . . . . . . . . 10.5000 . . . . . 24 . N . 24 . HN parsed_2k0j 6
18 . . . . . . . . . . . . . . . . 9.3650 . . . . . 31 . N . 31 . HN parsed_2k0j 6
19 . . . . . . . . . . . . . . . . 6.9530 . . . . . 32 . N . 32 . HN parsed_2k0j 6
20 . . . . . . . . . . . . . . . . 11.3520 . . . . . 33 . N . 33 . HN parsed_2k0j 6
21 . . . . . . . . . . . . . . . . 17.5240 . . . . . 34 . N . 34 . HN parsed_2k0j 6
22 . . . . . . . . . . . . . . . . 10.1450 . . . . . 35 . N . 35 . HN parsed_2k0j 6
23 . . . . . . . . . . . . . . . . 10.8550 . . . . . 36 . N . 36 . HN parsed_2k0j 6
24 . . . . . . . . . . . . . . . . 17.5950 . . . . . 37 . N . 37 . HN parsed_2k0j 6
25 . . . . . . . . . . . . . . . . 14.6860 . . . . . 38 . N . 38 . HN parsed_2k0j 6
26 . . . . . . . . . . . . . . . . 4.1150 . . . . . 39 . N . 39 . HN parsed_2k0j 6
27 . . . . . . . . . . . . . . . . 5.0370 . . . . . 40 . N . 40 . HN parsed_2k0j 6
28 . . . . . . . . . . . . . . . . 5.8170 . . . . . 41 . N . 41 . HN parsed_2k0j 6
29 . . . . . . . . . . . . . . . . -1.4190 . . . . . 44 . N . 44 . HN parsed_2k0j 6
30 . . . . . . . . . . . . . . . . -4.6820 . . . . . 45 . N . 45 . HN parsed_2k0j 6
31 . . . . . . . . . . . . . . . . 3.6890 . . . . . 46 . N . 46 . HN parsed_2k0j 6
32 . . . . . . . . . . . . . . . . -0.1410 . . . . . 47 . N . 47 . HN parsed_2k0j 6
33 . . . . . . . . . . . . . . . . -4.5400 . . . . . 48 . N . 48 . HN parsed_2k0j 6
34 . . . . . . . . . . . . . . . . -1.4890 . . . . . 49 . N . 49 . HN parsed_2k0j 6
35 . . . . . . . . . . . . . . . . 14.5440 . . . . . 72 . N . 72 . HN parsed_2k0j 6
36 . . . . . . . . . . . . . . . . 12.7000 . . . . . 73 . N . 73 . HN parsed_2k0j 6
37 . . . . . . . . . . . . . . . . 4.0440 . . . . . 74 . N . 74 . HN parsed_2k0j 6
38 . . . . . . . . . . . . . . . . -3.3340 . . . . . 89 . N . 89 . HN parsed_2k0j 6
39 . . . . . . . . . . . . . . . . -3.9730 . . . . . 90 . N . 90 . HN parsed_2k0j 6
40 . . . . . . . . . . . . . . . . 0.7090 . . . . . 91 . N . 91 . HN parsed_2k0j 6
41 . . . . . . . . . . . . . . . . -3.3340 . . . . . 92 . N . 92 . HN parsed_2k0j 6
42 . . . . . . . . . . . . . . . . -2.9080 . . . . . 94 . N . 94 . HN parsed_2k0j 6
43 . . . . . . . . . . . . . . . . -12.7000 . . . . . 95 . N . 95 . HN parsed_2k0j 6
44 . . . . . . . . . . . . . . . . 8.7260 . . . . . 97 . N . 97 . HN parsed_2k0j 6
45 . . . . . . . . . . . . . . . . 1.6310 . . . . . 98 . N . 98 . HN parsed_2k0j 6
46 . . . . . . . . . . . . . . . . -6.2430 . . . . . 99 . N . 99 . HN parsed_2k0j 6
47 . . . . . . . . . . . . . . . . -4.9660 . . . . . 100 . N . 100 . HN parsed_2k0j 6
48 . . . . . . . . . . . . . . . . -13.6930 . . . . . 101 . N . 101 . HN parsed_2k0j 6
49 . . . . . . . . . . . . . . . . 4.3980 . . . . . 102 . N . 102 . HN parsed_2k0j 6
50 . . . . . . . . . . . . . . . . 15.1830 . . . . . 103 . N . 103 . HN parsed_2k0j 6
51 . . . . . . . . . . . . . . . . 4.5400 . . . . . 104 . N . 104 . HN parsed_2k0j 6
52 . . . . . . . . . . . . . . . . 1.3480 . . . . . 105 . N . 105 . HN parsed_2k0j 6
53 . . . . . . . . . . . . . . . . 9.1520 . . . . . 106 . N . 106 . HN parsed_2k0j 6
54 . . . . . . . . . . . . . . . . 11.9190 . . . . . 107 . N . 107 . HN parsed_2k0j 6
55 . . . . . . . . . . . . . . . . 1.8440 . . . . . 108 . N . 108 . HN parsed_2k0j 6
56 . . . . . . . . . . . . . . . . 4.9660 . . . . . 109 . N . 109 . HN parsed_2k0j 6
57 . . . . . . . . . . . . . . . . 14.7570 . . . . . 110 . N . 110 . HN parsed_2k0j 6
58 . . . . . . . . . . . . . . . . 7.9460 . . . . . 111 . N . 111 . HN parsed_2k0j 6
59 . . . . . . . . . . . . . . . . -2.3410 . . . . . 112 . N . 112 . HN parsed_2k0j 6
60 . . . . . . . . . . . . . . . . 2.4830 . . . . . 117 . N . 117 . HN parsed_2k0j 6
61 . . . . . . . . . . . . . . . . 3.8310 . . . . . 119 . N . 119 . HN parsed_2k0j 6
62 . . . . . . . . . . . . . . . . -0.3540 . . . . . 120 . N . 120 . HN parsed_2k0j 6
63 . . . . . . . . . . . . . . . . -2.9790 . . . . . 121 . N . 121 . HN parsed_2k0j 6
64 . . . . . . . . . . . . . . . . -0.9930 . . . . . 122 . N . 122 . HN parsed_2k0j 6
65 . . . . . . . . . . . . . . . . 2.7670 . . . . . 123 . N . 123 . HN parsed_2k0j 6
66 . . . . . . . . . . . . . . . . -3.4050 . . . . . 124 . N . 124 . HN parsed_2k0j 6
67 . . . . . . . . . . . . . . . . -2.9790 . . . . . 125 . N . 125 . HN parsed_2k0j 6
68 . . . . . . . . . . . . . . . . 1.1350 . . . . . 126 . N . 126 . HN parsed_2k0j 6
69 . . . . . . . . . . . . . . . . -3.3340 . . . . . 127 . N . 127 . HN parsed_2k0j 6
70 . . . . . . . . . . . . . . . . -3.9730 . . . . . 128 . N . 128 . HN parsed_2k0j 6
71 . . . . . . . . . . . . . . . . 2.5540 . . . . . 129 . N . 129 . HN parsed_2k0j 6
72 . . . . . . . . . . . . . . . . -10.9260 . . . . . 131 . N . 131 . HN parsed_2k0j 6
73 . . . . . . . . . . . . . . . . 10.2870 . . . . . 132 . N . 132 . HN parsed_2k0j 6
74 . . . . . . . . . . . . . . . . -5.0370 . . . . . 133 . N . 133 . HN parsed_2k0j 6
75 . . . . . . . . . . . . . . . . -3.9020 . . . . . 134 . N . 134 . HN parsed_2k0j 6
76 . . . . . . . . . . . . . . . . 0.2830 . . . . . 135 . N . 135 . HN parsed_2k0j 6
77 . . . . . . . . . . . . . . . . -7.9460 . . . . . 136 . N . 136 . HN parsed_2k0j 6
78 . . . . . . . . . . . . . . . . 13.9060 . . . . . 138 . N . 138 . HN parsed_2k0j 6
79 . . . . . . . . . . . . . . . . 15.0410 . . . . . 139 . N . 139 . HN parsed_2k0j 6
80 . . . . . . . . . . . . . . . . 8.3720 . . . . . 140 . N . 140 . HN parsed_2k0j 6
81 . . . . . . . . . . . . . . . . 11.5640 . . . . . 141 . N . 141 . HN parsed_2k0j 6
82 . . . . . . . . . . . . . . . . 16.9570 . . . . . 142 . N . 142 . HN parsed_2k0j 6
83 . . . . . . . . . . . . . . . . 11.9190 . . . . . 143 . N . 143 . HN parsed_2k0j 6
84 . . . . . . . . . . . . . . . . 6.8110 . . . . . 144 . N . 144 . HN parsed_2k0j 6
85 . . . . . . . . . . . . . . . . 14.9700 . . . . . 145 . N . 145 . HN parsed_2k0j 6
86 . . . . . . . . . . . . . . . . 9.3650 . . . . . 146 . N . 146 . HN parsed_2k0j 6
stop_
save_
save_CNS/XPLOR_dihedral_8
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k0j
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 8
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.8 -47.0 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2k0j 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 153.0 182.4 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2k0j 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.1 -48.1 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2k0j 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.0 -26.4 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2k0j 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.1 -47.3 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2k0j 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.9 -30.9 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2k0j 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.1 -51.1 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2k0j 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 -12.0 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2k0j 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.8 -52.8 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2k0j 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.5 -26.1 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2k0j 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.5 -48.5 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2k0j 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.4 -23.0 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2k0j 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.4 -54.2 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2k0j 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.1 -28.5 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2k0j 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.4 -55.4 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2k0j 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.1 -4.5 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2k0j 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.3 -53.5 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2k0j 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.7 -19.3 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2k0j 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.7 -53.5 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2k0j 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.5 -15.1 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2k0j 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.1 -48.1 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2k0j 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.9 -36.9 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2k0j 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.0 -50.0 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2k0j 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.9 -23.7 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2k0j 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.9 -53.9 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2k0j 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.4 -11.2 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2k0j 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.1 -30.3 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2k0j 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -1.9 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2k0j 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.5 -70.9 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2k0j 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.6 26.4 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2k0j 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.3 -55.5 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2k0j 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.8 27.8 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2k0j 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2k0j 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2k0j 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.0 -122.0 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2k0j 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.9 175.3 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2k0j 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.2 -78.4 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2k0j 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.3 136.7 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2k0j 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.1 -58.7 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2k0j 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 159.7 185.9 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2k0j 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.6 -48.4 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2k0j 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.4 -26.2 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2k0j 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.9 -49.9 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2k0j 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.7 -14.1 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2k0j 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.9 -48.9 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2k0j 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.0 -27.2 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2k0j 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.2 -52.2 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2k0j 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.3 -17.7 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2k0j 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.3 -55.3 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2k0j 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.4 -26.2 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2k0j 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.4 -54.0 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2k0j 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.6 -30.2 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2k0j 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.3 -50.3 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2k0j 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.4 -28.2 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2k0j 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.9 -53.3 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2k0j 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.9 -27.3 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2k0j 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.2 -50.4 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2k0j 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.5 -4.5 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2k0j 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.1 -55.3 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2k0j 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.5 179.7 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2k0j 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.9 -51.3 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2k0j 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 144.2 184.4 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2k0j 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.7 -47.7 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2k0j 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.1 -24.9 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2k0j 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.6 -44.8 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2k0j 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.3 -16.1 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2k0j 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -48.8 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2k0j 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.6 -27.8 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2k0j 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.4 -48.0 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2k0j 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.8 -29.8 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2k0j 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.9 -51.3 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2k0j 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.3 -15.7 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2k0j 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.2 -46.0 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2k0j 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.1 -22.5 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2k0j 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -56.0 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2k0j 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.4 -22.2 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2k0j 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.9 -54.7 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2k0j 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.3 -23.7 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2k0j 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -39.2 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2k0j 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.3 -23.1 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2k0j 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.5 -50.3 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_2k0j 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.1 -9.5 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_2k0j 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.4 -94.4 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2k0j 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -19.3 31.7 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2k0j 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.9 -46.3 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2k0j 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 81.7 178.3 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2k0j 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.7 -70.9 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2k0j 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.6 24.8 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2k0j 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.3 -55.5 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2k0j 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.8 27.8 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2k0j 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65.4 101.4 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2k0j 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.3 20.7 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2k0j 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.1 -101.3 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2k0j 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.3 183.5 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2k0j 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.7 -89.1 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2k0j 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.1 153.1 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2k0j 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.5 -46.5 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2k0j 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.9 -26.1 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2k0j 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -50.5 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2k0j 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -35.0 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2k0j 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.4 -47.4 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2k0j 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.4 -26.0 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_2k0j 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.6 -50.0 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_2k0j 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.3 -27.1 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_2k0j 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.3 -48.5 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_2k0j 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.1 -15.9 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_2k0j 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.7 -51.9 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2k0j 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.4 -22.8 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2k0j 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.7 -43.9 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2k0j 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.0 -20.0 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2k0j 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.3 -45.1 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2k0j 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.6 -30.8 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2k0j 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -40.6 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2k0j 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.7 1.9 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_2k0j 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.9 -47.7 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2k0j 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.8 -6.6 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_2k0j 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.8 -51.2 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_2k0j 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 -23.0 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_2k0j 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.3 -47.5 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_2k0j 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.7 -17.1 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_2k0j 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.1 -51.1 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_2k0j 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.2 -30.4 . . 87 . N . 87 . CA . 87 . C . 88 . N parsed_2k0j 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.6 -54.6 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2k0j 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.2 -9.8 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_2k0j 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -50.2 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_2k0j 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.2 -34.4 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_2k0j 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.9 -47.7 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_2k0j 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.1 11.3 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_2k0j 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.3 -48.9 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2k0j 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.9 -16.7 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_2k0j 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.0 -50.0 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_2k0j 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -2.0 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_2k0j 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.1 -30.3 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2k0j 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -1.9 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2k0j 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.8 -69.4 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_2k0j 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.2 25.8 . . 95 . N . 95 . CA . 95 . C . 96 . N parsed_2k0j 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_2k0j 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 98 . N . 98 . CA . 98 . C . 99 . N parsed_2k0j 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.1 -120.1 . . 98 . C . 99 . N . 99 . CA . 99 . C parsed_2k0j 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.0 177.2 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_2k0j 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.0 -80.2 . . 99 . C . 100 . N . 100 . CA . 100 . C parsed_2k0j 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.8 136.4 . . 100 . N . 100 . CA . 100 . C . 101 . N parsed_2k0j 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.4 -47.4 . . 100 . C . 101 . N . 101 . CA . 101 . C parsed_2k0j 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 151.8 188.4 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_2k0j 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.7 -40.9 . . 101 . C . 102 . N . 102 . CA . 102 . C parsed_2k0j 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.1 -20.3 . . 102 . N . 102 . CA . 102 . C . 103 . N parsed_2k0j 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -50.5 . . 102 . C . 103 . N . 103 . CA . 103 . C parsed_2k0j 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.7 -22.9 . . 103 . N . 103 . CA . 103 . C . 104 . N parsed_2k0j 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.9 -51.9 . . 103 . C . 104 . N . 104 . CA . 104 . C parsed_2k0j 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.4 -23.6 . . 104 . N . 104 . CA . 104 . C . 105 . N parsed_2k0j 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.6 -52.8 . . 104 . C . 105 . N . 105 . CA . 105 . C parsed_2k0j 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.3 -29.3 . . 105 . N . 105 . CA . 105 . C . 106 . N parsed_2k0j 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.7 -55.7 . . 105 . C . 106 . N . 106 . CA . 106 . C parsed_2k0j 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.1 -24.5 . . 106 . N . 106 . CA . 106 . C . 107 . N parsed_2k0j 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.7 -54.5 . . 106 . C . 107 . N . 107 . CA . 107 . C parsed_2k0j 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.6 -22.8 . . 107 . N . 107 . CA . 107 . C . 108 . N parsed_2k0j 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -54.0 . . 107 . C . 108 . N . 108 . CA . 108 . C parsed_2k0j 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.2 -31.6 . . 108 . N . 108 . CA . 108 . C . 109 . N parsed_2k0j 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.5 -52.9 . . 108 . C . 109 . N . 109 . CA . 109 . C parsed_2k0j 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.6 -22.8 . . 109 . N . 109 . CA . 109 . C . 110 . N parsed_2k0j 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.3 -52.7 . . 109 . C . 110 . N . 110 . CA . 110 . C parsed_2k0j 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.2 -20.0 . . 110 . N . 110 . CA . 110 . C . 111 . N parsed_2k0j 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.4 -54.4 . . 110 . C . 111 . N . 111 . CA . 111 . C parsed_2k0j 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.8 -17.8 . . 111 . N . 111 . CA . 111 . C . 112 . N parsed_2k0j 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.6 -57.6 . . 113 . C . 114 . N . 114 . CA . 114 . C parsed_2k0j 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.6 166.2 . . 114 . N . 114 . CA . 114 . C . 115 . N parsed_2k0j 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.3 -56.5 . . 115 . C . 116 . N . 116 . CA . 116 . C parsed_2k0j 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 164.6 . . 116 . N . 116 . CA . 116 . C . 117 . N parsed_2k0j 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.0 -44.4 . . 116 . C . 117 . N . 117 . CA . 117 . C parsed_2k0j 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 153.5 181.3 . . 117 . N . 117 . CA . 117 . C . 118 . N parsed_2k0j 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.7 -47.7 . . 117 . C . 118 . N . 118 . CA . 118 . C parsed_2k0j 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.3 -28.1 . . 118 . N . 118 . CA . 118 . C . 119 . N parsed_2k0j 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.2 -51.4 . . 118 . C . 119 . N . 119 . CA . 119 . C parsed_2k0j 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.0 -26.6 . . 119 . N . 119 . CA . 119 . C . 120 . N parsed_2k0j 1
175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.5 -53.1 . . 119 . C . 120 . N . 120 . CA . 120 . C parsed_2k0j 1
176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.5 -24.1 . . 120 . N . 120 . CA . 120 . C . 121 . N parsed_2k0j 1
177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.0 -53.4 . . 120 . C . 121 . N . 121 . CA . 121 . C parsed_2k0j 1
178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.6 -29.8 . . 121 . N . 121 . CA . 121 . C . 122 . N parsed_2k0j 1
179 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -49.2 . . 121 . C . 122 . N . 122 . CA . 122 . C parsed_2k0j 1
180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.5 -15.5 . . 122 . N . 122 . CA . 122 . C . 123 . N parsed_2k0j 1
181 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.1 -54.5 . . 122 . C . 123 . N . 123 . CA . 123 . C parsed_2k0j 1
182 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.2 -32.2 . . 123 . N . 123 . CA . 123 . C . 124 . N parsed_2k0j 1
183 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.7 -51.7 . . 123 . C . 124 . N . 124 . CA . 124 . C parsed_2k0j 1
184 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.7 -32.7 . . 124 . N . 124 . CA . 124 . C . 125 . N parsed_2k0j 1
185 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.9 -55.7 . . 124 . C . 125 . N . 125 . CA . 125 . C parsed_2k0j 1
186 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.7 -24.3 . . 125 . N . 125 . CA . 125 . C . 126 . N parsed_2k0j 1
187 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.7 -46.9 . . 125 . C . 126 . N . 126 . CA . 126 . C parsed_2k0j 1
188 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -27.6 . . 126 . N . 126 . CA . 126 . C . 127 . N parsed_2k0j 1
189 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.9 -41.7 . . 126 . C . 127 . N . 127 . CA . 127 . C parsed_2k0j 1
190 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.4 0.8 . . 127 . N . 127 . CA . 127 . C . 128 . N parsed_2k0j 1
191 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.5 -43.9 . . 128 . C . 129 . N . 129 . CA . 129 . C parsed_2k0j 1
192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 74.9 191.3 . . 129 . N . 129 . CA . 129 . C . 130 . N parsed_2k0j 1
193 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.6 -71.6 . . 130 . C . 131 . N . 131 . CA . 131 . C parsed_2k0j 1
194 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -8.8 24.8 . . 131 . N . 131 . CA . 131 . C . 132 . N parsed_2k0j 1
195 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 67.8 104.2 . . 133 . C . 134 . N . 134 . CA . 134 . C parsed_2k0j 1
196 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.7 16.9 . . 134 . N . 134 . CA . 134 . C . 135 . N parsed_2k0j 1
197 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.7 -117.1 . . 134 . C . 135 . N . 135 . CA . 135 . C parsed_2k0j 1
198 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.7 185.3 . . 135 . N . 135 . CA . 135 . C . 136 . N parsed_2k0j 1
199 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.5 -95.5 . . 135 . C . 136 . N . 136 . CA . 136 . C parsed_2k0j 1
200 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.7 138.1 . . 136 . N . 136 . CA . 136 . C . 137 . N parsed_2k0j 1
201 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.8 -67.6 . . 136 . C . 137 . N . 137 . CA . 137 . C parsed_2k0j 1
202 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.8 219.8 . . 137 . N . 137 . CA . 137 . C . 138 . N parsed_2k0j 1
203 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.1 -46.5 . . 137 . C . 138 . N . 138 . CA . 138 . C parsed_2k0j 1
204 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.4 -32.0 . . 138 . N . 138 . CA . 138 . C . 139 . N parsed_2k0j 1
205 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -48.4 . . 138 . C . 139 . N . 139 . CA . 139 . C parsed_2k0j 1
206 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.1 -14.1 . . 139 . N . 139 . CA . 139 . C . 140 . N parsed_2k0j 1
207 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -58.6 . . 139 . C . 140 . N . 140 . CA . 140 . C parsed_2k0j 1
208 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.1 -17.7 . . 140 . N . 140 . CA . 140 . C . 141 . N parsed_2k0j 1
209 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.9 -55.9 . . 140 . C . 141 . N . 141 . CA . 141 . C parsed_2k0j 1
210 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.3 -35.3 . . 141 . N . 141 . CA . 141 . C . 142 . N parsed_2k0j 1
211 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.7 -49.5 . . 141 . C . 142 . N . 142 . CA . 142 . C parsed_2k0j 1
212 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.3 -30.5 . . 142 . N . 142 . CA . 142 . C . 143 . N parsed_2k0j 1
213 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -52.9 . . 142 . C . 143 . N . 143 . CA . 143 . C parsed_2k0j 1
214 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -5.0 . . 143 . N . 143 . CA . 143 . C . 144 . N parsed_2k0j 1
215 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.5 -43.5 . . 143 . C . 144 . N . 144 . CA . 144 . C parsed_2k0j 1
216 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.8 21.6 . . 144 . N . 144 . CA . 144 . C . 145 . N parsed_2k0j 1
217 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.7 -15.7 . . 146 . C . 147 . N . 147 . CA . 147 . C parsed_2k0j 1
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