Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
|
|
540796 | 2rse RC | 11471 | cing | 2-parsed | STAR | entry | full |
data_2rse_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2rse
_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_2rse 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2rse
_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 2rse "Master copy" parsed_2rse
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2rse
_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 2rse.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2rse 1
1 2rse.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2rse 1
1 2rse.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2rse 1
1 2rse.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2rse 1
1 2rse.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2rse 1
1 2rse.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2rse 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_2rse
_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 ISOMERASE/TRANSFERASE 25-JAN-12 2RSE
*TITLE NMR STRUCTURE OF FKBP12-MTOR FRB DOMAIN-RAPAMYCIN COMPLEX STRUCTURE
*TITLE 2 DETERMINED BASED ON PCS
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP1A;
*COMPND 3 CHAIN: A;
*COMPND 4 SYNONYM: PPIASE FKBP1A, 12 KDA FK506-BINDING PROTEIN, 12 KDA FKBP,
*COMPND 5 FKBP-12, FK506-BINDING PROTEIN 1A, FKBP-1A, IMMUNOPHILIN FKBP12,
*COMPND 6 ROTAMASE;
*COMPND 7 EC: 5.2.1.8;
*COMPND 8 ENGINEERED: YES;
*COMPND 9 MOL_ID: 2;
*COMPND 10 MOLECULE: SERINE/THREONINE-PROTEIN KINASE MTOR;
*COMPND 11 CHAIN: B;
*COMPND 12 FRAGMENT: UNP RESIDUES 2019-2112;
*COMPND 13 SYNONYM: FK506-BINDING PROTEIN 12-RAPAMYCIN COMPLEX-ASSOCIATED
*COMPND 14 PROTEIN 1, FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN, MAMMALIAN
*COMPND 15 TARGET OF RAPAMYCIN, MTOR, MECHANISTIC TARGET OF RAPAMYCIN, RAPAMYCIN
*COMPND 16 AND FKBP12 TARGET 1, RAPAMYCIN TARGET PROTEIN 1;
*COMPND 17 EC: 2.7.11.1;
*COMPND 18 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 3 ORGANISM_COMMON: HUMAN;
*SOURCE 4 ORGANISM_TAXID: 9606;
*SOURCE 5 GENE: FKBP1A, FKBP1, FKBP12;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PGBHPS;
*SOURCE 9 MOL_ID: 2;
*SOURCE 10 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 11 ORGANISM_COMMON: HUMAN;
*SOURCE 12 ORGANISM_TAXID: 9606;
*SOURCE 13 GENE: MTOR, FRAP, FRAP1, FRAP2, RAFT1, RAPT1;
*SOURCE 14 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 15 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 16 EXPRESSION_SYSTEM_VECTOR: PGBHPS
*KEYWDS FKBP12, RAPAMYCIN, FK506, LANTHANIDE, PCS, ISOMERASE-TRANSFERASE
*KEYWDS 2 COMPLEX
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR Y.KOBASHIGAWA, M.USHIO, T.SAIO, F.INAGAKI
*REVDAT 1 30-MAY-12 2RSE 0
;
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2rse
_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 600 and name OO)
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(resid 600 and name X)
(resid 600 and name Y)
(resid 3 and name HN) -0.964 0.001
;
1 1 5 41 parsed_2rse 1
2
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 4 and name HN) -0.367 0.001
;
6 1 10 41 parsed_2rse 1
3
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 5 and name HN) -0.668 0.001
;
11 1 15 41 parsed_2rse 1
4
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 7 and name HN) -0.228 0.001
;
16 1 20 41 parsed_2rse 1
5
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 8 and name HN) -0.154 0.001
;
21 1 25 41 parsed_2rse 1
6
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 21 and name HN) -0.058 0.001
;
26 1 30 42 parsed_2rse 1
7
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 22 and name HN) -0.106 0.001
;
31 1 35 42 parsed_2rse 1
8
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 23 and name HN) -0.112 0.001
;
36 1 40 42 parsed_2rse 1
9
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 24 and name HN) -0.186 0.001
;
41 1 45 42 parsed_2rse 1
10
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 25 and name HN) -0.238 0.001
;
46 1 50 42 parsed_2rse 1
11
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 26 and name HN) -0.34 0.001
;
51 1 55 41 parsed_2rse 1
12
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 27 and name HN) -0.551 0.001
;
56 1 60 42 parsed_2rse 1
13
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 28 and name HN) -0.652 0.001
;
61 1 65 42 parsed_2rse 1
14
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 46 and name HN) -0.213 0.001
;
66 1 70 42 parsed_2rse 1
15
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 47 and name HN) -0.167 0.001
;
71 1 75 42 parsed_2rse 1
16
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 48 and name HN) -0.141 0.001
;
76 1 80 42 parsed_2rse 1
17
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 49 and name HN) -0.103 0.001
;
81 1 85 42 parsed_2rse 1
18
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 56 and name HN) -0.272 0.001
;
86 1 90 42 parsed_2rse 1
19
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 57 and name HN) -0.169 0.001
;
91 1 95 42 parsed_2rse 1
20
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 58 and name HN) -0.299 0.001
;
96 1 100 42 parsed_2rse 1
21
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 59 and name HN) -0.299 0.001
;
101 1 105 42 parsed_2rse 1
22
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 60 and name HN) -0.184 0.001
;
106 1 110 42 parsed_2rse 1
23
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 61 and name HN) -0.103 0.001
;
111 1 115 42 parsed_2rse 1
24
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 62 and name HN) -0.198 0.001
;
116 1 120 42 parsed_2rse 1
25
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 63 and name HN) -0.213 0.001
;
121 1 125 42 parsed_2rse 1
26
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 64 and name HN) -0.102 0.001
;
126 1 130 42 parsed_2rse 1
27
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 65 and name HN) -0.078 0.001
;
131 1 135 42 parsed_2rse 1
28
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 71 and name HN) -0.144 0.001
;
136 1 140 42 parsed_2rse 1
29
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 72 and name HN) -0.348 0.001
;
141 1 145 42 parsed_2rse 1
30
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 73 and name HN) -0.602 0.001
;
146 1 150 42 parsed_2rse 1
31
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 74 and name HN) -0.922 0.001
;
151 1 155 42 parsed_2rse 1
32
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 76 and name HN) -1.71 0.001
;
156 1 160 41 parsed_2rse 1
33
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 79 and name HN) -0.294 0.001
;
161 1 165 42 parsed_2rse 1
34
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 80 and name HN) -0.351 0.001
;
166 1 170 42 parsed_2rse 1
35
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 81 and name HN) -0.416 0.001
;
171 1 175 42 parsed_2rse 1
36
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 99 and name HN) -1.174 0.001
;
176 1 180 42 parsed_2rse 1
37
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 100 and name HN) -0.76 0.001
;
181 1 185 42 parsed_2rse 1
38
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 101 and name HN) -0.512 0.001
;
186 1 190 43 parsed_2rse 1
39
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 102 and name HN) -0.307 0.001
;
191 1 195 43 parsed_2rse 1
40
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 103 and name HN) -0.186 0.001
;
196 1 200 43 parsed_2rse 1
41
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 104 and name HN) -0.151 0.001
;
201 1 205 43 parsed_2rse 1
42
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 105 and name HN) -0.139 0.001
;
206 1 210 43 parsed_2rse 1
43
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 106 and name HN) -0.067 0.001
;
211 1 215 43 parsed_2rse 1
44
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 107 and name HN) -0.067 0.001
;
216 1 220 43 parsed_2rse 1
45
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 113 and name HN) -0.171 0.001
;
221 1 225 43 parsed_2rse 1
46
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 129 and name HN) -0.062 0.001
;
226 1 230 43 parsed_2rse 1
47
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 130 and name HN) -0.06 0.001
;
231 1 235 42 parsed_2rse 1
48
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 133 and name HN) -0.078 0.001
;
236 1 240 43 parsed_2rse 1
49
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 135 and name HN) -0.005 0.001
;
241 1 245 43 parsed_2rse 1
50
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 137 and name HN) -0.032 0.001
;
246 1 250 43 parsed_2rse 1
51
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 140 and name HN) -0.016 0.001
;
251 1 255 43 parsed_2rse 1
52
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 143 and name HN) -0.059 0.001
;
256 1 260 43 parsed_2rse 1
53
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 144 and name HN) -0.067 0.001
;
261 1 265 43 parsed_2rse 1
54
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 145 and name HN) -0.042 0.001
;
266 1 270 43 parsed_2rse 1
55
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 146 and name HN) -0.062 0.001
;
271 1 275 43 parsed_2rse 1
56
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 147 and name HN) -0.072 0.001
;
276 1 280 43 parsed_2rse 1
57
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 148 and name HN) -0.055 0.001
;
281 1 285 43 parsed_2rse 1
58
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 149 and name HN) -0.054 0.001
;
286 1 290 43 parsed_2rse 1
59
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 156 and name HN) -0.078 0.001
;
291 1 295 43 parsed_2rse 1
60
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 157 and name HN) -0.074 0.001
;
296 1 300 43 parsed_2rse 1
61
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 159 and name HN) -0.097 0.001
;
301 1 305 43 parsed_2rse 1
62
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 160 and name HN) -0.1 0.001
;
306 1 310 41 parsed_2rse 1
63
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 161 and name HN) -0.088 0.001
;
311 1 315 43 parsed_2rse 1
64
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 162 and name HN) -0.089 0.001
;
316 1 320 43 parsed_2rse 1
65
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 163 and name HN) -0.104 0.001
;
321 1 325 43 parsed_2rse 1
66
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 164 and name HN) -0.096 0.001
;
326 1 330 43 parsed_2rse 1
67
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 166 and name HN) -0.097 0.001
;
331 1 335 43 parsed_2rse 1
68
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 168 and name HN) -0.086 0.001
;
336 1 340 43 parsed_2rse 1
69
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 173 and name HN) -0.087 0.001
;
341 1 345 43 parsed_2rse 1
70
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 174 and name HN) -0.064 0.001
;
346 1 350 43 parsed_2rse 1
71
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 175 and name HN) -0.056 0.001
;
351 1 355 43 parsed_2rse 1
72
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 178 and name HN) -0.098 0.001
;
356 1 360 43 parsed_2rse 1
73
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 179 and name HN) -0.103 0.001
;
361 1 365 43 parsed_2rse 1
74
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 180 and name HN) -0.124 0.001
;
366 1 370 43 parsed_2rse 1
75
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 183 and name HN) -0.244 0.001
;
371 1 375 43 parsed_2rse 1
76
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 185 and name HN) -0.206 0.001
;
376 1 380 43 parsed_2rse 1
77
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 186 and name HN) -0.183 0.001
;
381 1 385 43 parsed_2rse 1
78
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 187 and name HN) -0.202 0.001
;
386 1 390 43 parsed_2rse 1
79
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 189 and name HN) -0.143 0.001
;
391 1 395 43 parsed_2rse 1
80
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 190 and name HN) -0.126 0.001
;
396 1 400 43 parsed_2rse 1
81
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
(resid 192 and name HN) -0.119 0.001
;
401 1 405 43 parsed_2rse 1
82
;
assign (resid 600 and name OO)
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(resid 193 and name HN) -0.091 0.001
;
406 1 410 43 parsed_2rse 1
83
;
assign (resid 600 and name OO)
(resid 600 and name Z)
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;
411 1 415 43 parsed_2rse 1
84
;
assign (resid 600 and name OO)
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;
416 1 420 43 parsed_2rse 1
85
;
assign (resid 600 and name OO)
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;
421 1 425 43 parsed_2rse 1
86
;
assign (resid 600 and name OO)
(resid 600 and name Z)
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(resid 600 and name Y)
(resid 197 and name HN) -0.079 0.001
;
426 1 430 43 parsed_2rse 1
87
;
assign (resid 600 and name OO)
(resid 600 and name Z)
(resid 600 and name X)
(resid 600 and name Y)
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;
431 1 435 43 parsed_2rse 1
88
;
assign (resid 600 and name OO)
(resid 600 and name Z)
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(resid 600 and name Y)
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;
436 1 440 43 parsed_2rse 1
89
;
assign (resid 600 and name OO)
(resid 600 and name Z)
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(resid 200 and name HN) -0.167 0.001
;
441 1 445 43 parsed_2rse 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2rse
_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 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 3 and name HN) -2.135 0.001
;
1 1 5 41 parsed_2rse 2
2
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 5 and name HN) -2.011 0.001
;
6 1 10 41 parsed_2rse 2
3
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 7 and name HN) -0.946 0.001
;
11 1 15 41 parsed_2rse 2
4
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 8 and name HN) -0.697 0.001
;
16 1 20 41 parsed_2rse 2
5
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 21 and name HN) -0.138 0.001
;
21 1 25 42 parsed_2rse 2
6
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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(resid 22 and name HN) -0.219 0.001
;
26 1 30 42 parsed_2rse 2
7
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 23 and name HN) -0.254 0.001
;
31 1 35 42 parsed_2rse 2
8
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 24 and name HN) -0.321 0.001
;
36 1 40 42 parsed_2rse 2
9
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 25 and name HN) -0.44 0.001
;
41 1 45 41 parsed_2rse 2
10
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
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(resid 26 and name HN) -0.478 0.001
;
46 1 50 42 parsed_2rse 2
11
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 27 and name HN) -0.775 0.001
;
51 1 55 42 parsed_2rse 2
12
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 28 and name HN) -0.751 0.001
;
56 1 60 42 parsed_2rse 2
13
;
assign (resid 500 and name OO)
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(resid 46 and name HN) -0.324 0.001
;
61 1 65 42 parsed_2rse 2
14
;
assign (resid 500 and name OO)
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(resid 47 and name HN) -0.242 0.001
;
66 1 70 42 parsed_2rse 2
15
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
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(resid 48 and name HN) -0.236 0.001
;
71 1 75 42 parsed_2rse 2
16
;
assign (resid 500 and name OO)
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;
76 1 80 42 parsed_2rse 2
17
;
assign (resid 500 and name OO)
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;
81 1 85 42 parsed_2rse 2
18
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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;
86 1 90 42 parsed_2rse 2
19
;
assign (resid 500 and name OO)
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;
91 1 95 42 parsed_2rse 2
20
;
assign (resid 500 and name OO)
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;
96 1 100 42 parsed_2rse 2
21
;
assign (resid 500 and name OO)
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;
101 1 105 42 parsed_2rse 2
22
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
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(resid 61 and name HN) -0.303 0.001
;
106 1 110 42 parsed_2rse 2
23
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 62 and name HN) -0.532 0.001
;
111 1 115 42 parsed_2rse 2
24
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 64 and name HN) -0.376 0.001
;
116 1 120 42 parsed_2rse 2
25
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 65 and name HN) -0.455 0.001
;
121 1 125 42 parsed_2rse 2
26
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 71 and name HN) -0.577 0.001
;
126 1 130 42 parsed_2rse 2
27
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
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(resid 72 and name HN) -0.859 0.001
;
131 1 135 42 parsed_2rse 2
28
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 74 and name HN) -1.598 0.001
;
136 1 140 42 parsed_2rse 2
29
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 76 and name HN) -2.102 0.001
;
141 1 145 42 parsed_2rse 2
30
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 79 and name HN) 0.276 0.001
;
146 1 150 41 parsed_2rse 2
31
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 80 and name HN) -0.103 0.001
;
151 1 155 42 parsed_2rse 2
32
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 81 and name HN) -0.196 0.001
;
156 1 160 42 parsed_2rse 2
33
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 99 and name HN) -1.647 0.001
;
161 1 165 42 parsed_2rse 2
34
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 100 and name HN) -1.084 0.001
;
166 1 170 43 parsed_2rse 2
35
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 101 and name HN) -0.953 0.001
;
171 1 175 43 parsed_2rse 2
36
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 102 and name HN) -0.579 0.001
;
176 1 180 43 parsed_2rse 2
37
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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;
181 1 185 43 parsed_2rse 2
38
;
assign (resid 500 and name OO)
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;
186 1 190 43 parsed_2rse 2
39
;
assign (resid 500 and name OO)
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;
191 1 195 43 parsed_2rse 2
40
;
assign (resid 500 and name OO)
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;
196 1 200 43 parsed_2rse 2
41
;
assign (resid 500 and name OO)
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;
201 1 205 43 parsed_2rse 2
42
;
assign (resid 500 and name OO)
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;
206 1 210 43 parsed_2rse 2
43
;
assign (resid 500 and name OO)
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;
211 1 215 43 parsed_2rse 2
44
;
assign (resid 500 and name OO)
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;
216 1 220 43 parsed_2rse 2
45
;
assign (resid 500 and name OO)
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;
221 1 225 43 parsed_2rse 2
46
;
assign (resid 500 and name OO)
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;
226 1 230 42 parsed_2rse 2
47
;
assign (resid 500 and name OO)
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;
231 1 235 43 parsed_2rse 2
48
;
assign (resid 500 and name OO)
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;
236 1 240 43 parsed_2rse 2
49
;
assign (resid 500 and name OO)
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;
241 1 245 43 parsed_2rse 2
50
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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;
246 1 250 43 parsed_2rse 2
51
;
assign (resid 500 and name OO)
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;
251 1 255 43 parsed_2rse 2
52
;
assign (resid 500 and name OO)
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;
256 1 260 43 parsed_2rse 2
53
;
assign (resid 500 and name OO)
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;
261 1 265 42 parsed_2rse 2
54
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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;
266 1 270 43 parsed_2rse 2
55
;
assign (resid 500 and name OO)
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;
271 1 275 43 parsed_2rse 2
56
;
assign (resid 500 and name OO)
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;
276 1 280 43 parsed_2rse 2
57
;
assign (resid 500 and name OO)
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;
281 1 285 43 parsed_2rse 2
58
;
assign (resid 500 and name OO)
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;
286 1 290 43 parsed_2rse 2
59
;
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;
291 1 295 43 parsed_2rse 2
60
;
assign (resid 500 and name OO)
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;
296 1 300 43 parsed_2rse 2
61
;
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;
301 1 305 43 parsed_2rse 2
62
;
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;
306 1 310 43 parsed_2rse 2
63
;
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;
311 1 315 43 parsed_2rse 2
64
;
assign (resid 500 and name OO)
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;
316 1 320 41 parsed_2rse 2
65
;
assign (resid 500 and name OO)
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;
321 1 325 43 parsed_2rse 2
66
;
assign (resid 500 and name OO)
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;
326 1 330 43 parsed_2rse 2
67
;
assign (resid 500 and name OO)
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331 1 335 41 parsed_2rse 2
68
;
assign (resid 500 and name OO)
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;
336 1 340 43 parsed_2rse 2
69
;
assign (resid 500 and name OO)
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;
341 1 345 43 parsed_2rse 2
70
;
assign (resid 500 and name OO)
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;
346 1 350 43 parsed_2rse 2
71
;
assign (resid 500 and name OO)
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;
351 1 355 43 parsed_2rse 2
72
;
assign (resid 500 and name OO)
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;
356 1 360 43 parsed_2rse 2
73
;
assign (resid 500 and name OO)
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;
361 1 365 43 parsed_2rse 2
74
;
assign (resid 500 and name OO)
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;
366 1 370 43 parsed_2rse 2
75
;
assign (resid 500 and name OO)
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;
371 1 375 43 parsed_2rse 2
76
;
assign (resid 500 and name OO)
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;
376 1 380 43 parsed_2rse 2
77
;
assign (resid 500 and name OO)
(resid 500 and name Z)
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;
381 1 385 43 parsed_2rse 2
78
;
assign (resid 500 and name OO)
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;
386 1 390 43 parsed_2rse 2
79
;
assign (resid 500 and name OO)
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;
391 1 395 43 parsed_2rse 2
80
;
assign (resid 500 and name OO)
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;
396 1 400 43 parsed_2rse 2
81
;
assign (resid 500 and name OO)
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;
401 1 405 43 parsed_2rse 2
82
;
assign (resid 500 and name OO)
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;
406 1 410 43 parsed_2rse 2
83
;
assign (resid 500 and name OO)
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411 1 415 43 parsed_2rse 2
84
;
assign (resid 500 and name OO)
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416 1 420 43 parsed_2rse 2
85
;
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421 1 425 42 parsed_2rse 2
86
;
assign (resid 500 and name OO)
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426 1 430 43 parsed_2rse 2
87
;
assign (resid 500 and name OO)
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431 1 435 43 parsed_2rse 2
88
;
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;
436 1 440 43 parsed_2rse 2
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2rse
_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 800 and name OO)
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(resid 800 and name Y)
(resid 3 and name HN) -1.05 0.001
;
1 1 5 40 parsed_2rse 3
2
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 4 and name HN) -0.679 0.001
;
6 1 10 41 parsed_2rse 3
3
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 5 and name HN) -1.008 0.001
;
11 1 15 41 parsed_2rse 3
4
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 7 and name HN) -0.3 0.001
;
16 1 20 39 parsed_2rse 3
5
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 8 and name HN) -0.153 0.001
;
21 1 25 41 parsed_2rse 3
6
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 21 and name HN) -0.058 0.001
;
26 1 30 42 parsed_2rse 3
7
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 22 and name HN) -0.109 0.001
;
31 1 35 42 parsed_2rse 3
8
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 23 and name HN) -0.122 0.001
;
36 1 40 42 parsed_2rse 3
9
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 24 and name HN) -0.186 0.001
;
41 1 45 42 parsed_2rse 3
10
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 25 and name HN) -0.241 0.001
;
46 1 50 42 parsed_2rse 3
11
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 26 and name HN) -0.334 0.001
;
51 1 55 42 parsed_2rse 3
12
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 27 and name HN) -0.567 0.001
;
56 1 60 42 parsed_2rse 3
13
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 28 and name HN) -0.598 0.001
;
61 1 65 42 parsed_2rse 3
14
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 29 and name HN) -0.978 0.001
;
66 1 70 42 parsed_2rse 3
15
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 46 and name HN) -0.212 0.001
;
71 1 75 42 parsed_2rse 3
16
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 47 and name HN) -0.178 0.001
;
76 1 80 42 parsed_2rse 3
17
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 48 and name HN) -0.141 0.001
;
81 1 85 42 parsed_2rse 3
18
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 49 and name HN) -0.105 0.001
;
86 1 90 42 parsed_2rse 3
19
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 56 and name HN) -0.227 0.001
;
91 1 95 42 parsed_2rse 3
20
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 57 and name HN) -0.155 0.001
;
96 1 100 42 parsed_2rse 3
21
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 58 and name HN) -0.251 0.001
;
101 1 105 42 parsed_2rse 3
22
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 59 and name HN) -0.288 0.001
;
106 1 110 42 parsed_2rse 3
23
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 60 and name HN) -0.185 0.001
;
111 1 115 42 parsed_2rse 3
24
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 61 and name HN) -0.149 0.001
;
116 1 120 42 parsed_2rse 3
25
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 62 and name HN) -0.238 0.001
;
121 1 125 42 parsed_2rse 3
26
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 63 and name HN) -0.235 0.001
;
126 1 130 42 parsed_2rse 3
27
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 64 and name HN) -0.119 0.001
;
131 1 135 42 parsed_2rse 3
28
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 65 and name HN) -0.084 0.001
;
136 1 140 42 parsed_2rse 3
29
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 71 and name HN) -0.131 0.001
;
141 1 145 42 parsed_2rse 3
30
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 72 and name HN) -0.424 0.001
;
146 1 150 42 parsed_2rse 3
31
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 73 and name HN) -0.863 0.001
;
151 1 155 42 parsed_2rse 3
32
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 74 and name HN) -1.032 0.001
;
156 1 160 42 parsed_2rse 3
33
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 76 and name HN) -1.25 0.001
;
161 1 165 41 parsed_2rse 3
34
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 79 and name HN) -0.078 0.001
;
166 1 170 42 parsed_2rse 3
35
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 80 and name HN) -0.183 0.001
;
171 1 175 42 parsed_2rse 3
36
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 81 and name HN) -0.22 0.001
;
176 1 180 41 parsed_2rse 3
37
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 99 and name HN) -1.134 0.001
;
181 1 185 42 parsed_2rse 3
38
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 100 and name HN) -0.813 0.001
;
186 1 190 43 parsed_2rse 3
39
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 101 and name HN) -0.594 0.001
;
191 1 195 43 parsed_2rse 3
40
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 102 and name HN) -0.33 0.001
;
196 1 200 42 parsed_2rse 3
41
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 103 and name HN) -0.185 0.001
;
201 1 205 43 parsed_2rse 3
42
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 104 and name HN) -0.147 0.001
;
206 1 210 43 parsed_2rse 3
43
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 105 and name HN) -0.108 0.001
;
211 1 215 43 parsed_2rse 3
44
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 106 and name HN) -0.055 0.001
;
216 1 220 43 parsed_2rse 3
45
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 107 and name HN) -0.06 0.001
;
221 1 225 42 parsed_2rse 3
46
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 112 and name HN) -0.082 0.001
;
226 1 230 43 parsed_2rse 3
47
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 113 and name HN) -0.122 0.001
;
231 1 235 43 parsed_2rse 3
48
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 130 and name HN) -0.057 0.001
;
236 1 240 43 parsed_2rse 3
49
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 133 and name HN) -0.037 0.001
;
241 1 245 43 parsed_2rse 3
50
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 135 and name HN) 0.005 0.001
;
246 1 250 42 parsed_2rse 3
51
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 137 and name HN) -0.006 0.001
;
251 1 255 43 parsed_2rse 3
52
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 138 and name HN) -0.07 0.001
;
256 1 260 42 parsed_2rse 3
53
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 139 and name HN) 0.022 0.001
;
261 1 265 42 parsed_2rse 3
54
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 140 and name HN) -0.003 0.001
;
266 1 270 43 parsed_2rse 3
55
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 143 and name HN) -0.048 0.001
;
271 1 275 43 parsed_2rse 3
56
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 144 and name HN) -0.055 0.001
;
276 1 280 43 parsed_2rse 3
57
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 145 and name HN) -0.047 0.001
;
281 1 285 43 parsed_2rse 3
58
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 146 and name HN) -0.044 0.001
;
286 1 290 43 parsed_2rse 3
59
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 147 and name HN) -0.058 0.001
;
291 1 295 43 parsed_2rse 3
60
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 148 and name HN) -0.043 0.001
;
296 1 300 43 parsed_2rse 3
61
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 149 and name HN) -0.041 0.001
;
301 1 305 43 parsed_2rse 3
62
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 156 and name HN) -0.055 0.001
;
306 1 310 43 parsed_2rse 3
63
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 157 and name HN) -0.055 0.001
;
311 1 315 43 parsed_2rse 3
64
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 159 and name HN) -0.078 0.001
;
316 1 320 43 parsed_2rse 3
65
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 160 and name HN) -0.064 0.001
;
321 1 325 43 parsed_2rse 3
66
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 161 and name HN) -0.07 0.001
;
326 1 330 42 parsed_2rse 3
67
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 162 and name HN) -0.072 0.001
;
331 1 335 43 parsed_2rse 3
68
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 163 and name HN) -0.079 0.001
;
336 1 340 43 parsed_2rse 3
69
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 164 and name HN) -0.079 0.001
;
341 1 345 43 parsed_2rse 3
70
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 166 and name HN) -0.084 0.001
;
346 1 350 43 parsed_2rse 3
71
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 167 and name HN) -0.08 0.001
;
351 1 355 42 parsed_2rse 3
72
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 168 and name HN) -0.075 0.001
;
356 1 360 43 parsed_2rse 3
73
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 173 and name HN) -0.019 0.001
;
361 1 365 43 parsed_2rse 3
74
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 175 and name HN) -0.067 0.001
;
366 1 370 43 parsed_2rse 3
75
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 176 and name HN) -0.057 0.001
;
371 1 375 43 parsed_2rse 3
76
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 177 and name HN) 0.003 0.001
;
376 1 380 42 parsed_2rse 3
77
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 178 and name HN) -0.065 0.001
;
381 1 385 43 parsed_2rse 3
78
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 179 and name HN) -0.065 0.001
;
386 1 390 43 parsed_2rse 3
79
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 180 and name HN) -0.082 0.001
;
391 1 395 43 parsed_2rse 3
80
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 183 and name HN) -0.155 0.001
;
396 1 400 43 parsed_2rse 3
81
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 185 and name HN) -0.15 0.001
;
401 1 405 42 parsed_2rse 3
82
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 186 and name HN) -0.136 0.001
;
406 1 410 43 parsed_2rse 3
83
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 187 and name HN) -0.154 0.001
;
411 1 415 43 parsed_2rse 3
84
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 189 and name HN) -0.112 0.001
;
416 1 420 43 parsed_2rse 3
85
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 190 and name HN) -0.103 0.001
;
421 1 425 43 parsed_2rse 3
86
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 192 and name HN) -0.11 0.001
;
426 1 430 42 parsed_2rse 3
87
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 193 and name HN) -0.075 0.001
;
431 1 435 43 parsed_2rse 3
88
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 194 and name HN) -0.067 0.001
;
436 1 440 43 parsed_2rse 3
89
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 195 and name HN) -0.086 0.001
;
441 1 445 43 parsed_2rse 3
90
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 196 and name HN) -0.093 0.001
;
446 1 450 43 parsed_2rse 3
91
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 197 and name HN) -0.076 0.001
;
451 1 455 43 parsed_2rse 3
92
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 198 and name HN) -0.08 0.001
;
456 1 460 42 parsed_2rse 3
93
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 199 and name HN) -0.085 0.001
;
461 1 465 43 parsed_2rse 3
94
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 200 and name HN) -0.139 0.001
;
466 1 470 43 parsed_2rse 3
95
;
assign (resid 800 and name OO)
(resid 800 and name Z)
(resid 800 and name X)
(resid 800 and name Y)
(resid 201 and name HN) -0.128 0.001
;
471 1 475 43 parsed_2rse 3
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2rse
_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_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 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 3 and name HN) -2.786 0.001
;
1 1 5 41 parsed_2rse 4
2
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 5 and name HN) -2.743 0.001
;
6 1 10 41 parsed_2rse 4
3
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 7 and name HN) -1.055 0.001
;
11 1 15 41 parsed_2rse 4
4
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 8 and name HN) -0.687 0.001
;
16 1 20 41 parsed_2rse 4
5
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 21 and name HN) -0.205 0.001
;
21 1 25 42 parsed_2rse 4
6
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 22 and name HN) -0.296 0.001
;
26 1 30 42 parsed_2rse 4
7
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 23 and name HN) -0.317 0.001
;
31 1 35 42 parsed_2rse 4
8
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 24 and name HN) -0.372 0.001
;
36 1 40 42 parsed_2rse 4
9
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 25 and name HN) -0.487 0.001
;
41 1 45 42 parsed_2rse 4
10
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 26 and name HN) -0.518 0.001
;
46 1 50 42 parsed_2rse 4
11
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 27 and name HN) -0.828 0.001
;
51 1 55 42 parsed_2rse 4
12
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 28 and name HN) -0.741 0.001
;
56 1 60 42 parsed_2rse 4
13
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 29 and name HN) -1.156 0.001
;
61 1 65 42 parsed_2rse 4
14
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 46 and name HN) -0.37 0.001
;
66 1 70 41 parsed_2rse 4
15
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 47 and name HN) -0.314 0.001
;
71 1 75 42 parsed_2rse 4
16
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 48 and name HN) -0.315 0.001
;
76 1 80 42 parsed_2rse 4
17
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 49 and name HN) -0.264 0.001
;
81 1 85 42 parsed_2rse 4
18
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 56 and name HN) -0.451 0.001
;
86 1 90 42 parsed_2rse 4
19
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 57 and name HN) -0.435 0.001
;
91 1 95 42 parsed_2rse 4
20
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 58 and name HN) -0.675 0.001
;
96 1 100 42 parsed_2rse 4
21
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 59 and name HN) -0.702 0.001
;
101 1 105 42 parsed_2rse 4
22
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 60 and name HN) -0.573 0.001
;
106 1 110 42 parsed_2rse 4
23
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 61 and name HN) -0.645 0.001
;
111 1 115 42 parsed_2rse 4
24
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 62 and name HN) -0.883 0.001
;
116 1 120 42 parsed_2rse 4
25
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 63 and name HN) -0.778 0.001
;
121 1 125 42 parsed_2rse 4
26
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 64 and name HN) -0.617 0.001
;
126 1 130 42 parsed_2rse 4
27
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 65 and name HN) -0.699 0.001
;
131 1 135 42 parsed_2rse 4
28
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 71 and name HN) -0.591 0.001
;
136 1 140 42 parsed_2rse 4
29
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 72 and name HN) -0.996 0.001
;
141 1 145 42 parsed_2rse 4
30
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 76 and name HN) -2.001 0.001
;
146 1 150 42 parsed_2rse 4
31
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 79 and name HN) -0.279 0.001
;
151 1 155 42 parsed_2rse 4
32
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 80 and name HN) -0.531 0.001
;
156 1 160 42 parsed_2rse 4
33
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 81 and name HN) -0.473 0.001
;
161 1 165 42 parsed_2rse 4
34
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 97 and name HN) -1.369 0.001
;
166 1 170 42 parsed_2rse 4
35
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 99 and name HN) -1.745 0.001
;
171 1 175 42 parsed_2rse 4
36
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 100 and name HN) -1.167 0.001
;
176 1 180 43 parsed_2rse 4
37
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 101 and name HN) -1.129 0.001
;
181 1 185 43 parsed_2rse 4
38
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 102 and name HN) -0.644 0.001
;
186 1 190 43 parsed_2rse 4
39
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 103 and name HN) -0.533 0.001
;
191 1 195 43 parsed_2rse 4
40
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 104 and name HN) -0.375 0.001
;
196 1 200 43 parsed_2rse 4
41
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 105 and name HN) -0.3 0.001
;
201 1 205 41 parsed_2rse 4
42
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 106 and name HN) -0.218 0.001
;
206 1 210 43 parsed_2rse 4
43
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 107 and name HN) -0.211 0.001
;
211 1 215 43 parsed_2rse 4
44
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 112 and name HN) -0.12 0.001
;
216 1 220 42 parsed_2rse 4
45
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 113 and name HN) -0.188 0.001
;
221 1 225 43 parsed_2rse 4
46
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 130 and name HN) -0.09 0.001
;
226 1 230 42 parsed_2rse 4
47
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 133 and name HN) -0.057 0.001
;
231 1 235 43 parsed_2rse 4
48
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 135 and name HN) -0.011 0.001
;
236 1 240 43 parsed_2rse 4
49
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 137 and name HN) -0.06 0.001
;
241 1 245 42 parsed_2rse 4
50
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 138 and name HN) -0.066 0.001
;
246 1 250 43 parsed_2rse 4
51
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 139 and name HN) -0.027 0.001
;
251 1 255 43 parsed_2rse 4
52
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 143 and name HN) -0.077 0.001
;
256 1 260 43 parsed_2rse 4
53
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 144 and name HN) -0.089 0.001
;
261 1 265 43 parsed_2rse 4
54
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 145 and name HN) -0.067 0.001
;
266 1 270 43 parsed_2rse 4
55
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 146 and name HN) -0.064 0.001
;
271 1 275 43 parsed_2rse 4
56
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 147 and name HN) -0.081 0.001
;
276 1 280 43 parsed_2rse 4
57
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 148 and name HN) -0.066 0.001
;
281 1 285 43 parsed_2rse 4
58
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 149 and name HN) -0.056 0.001
;
286 1 290 43 parsed_2rse 4
59
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 156 and name HN) -0.072 0.001
;
291 1 295 43 parsed_2rse 4
60
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 157 and name HN) -0.078 0.001
;
296 1 300 43 parsed_2rse 4
61
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 159 and name HN) -0.11 0.001
;
301 1 305 42 parsed_2rse 4
62
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 160 and name HN) -0.098 0.001
;
306 1 310 43 parsed_2rse 4
63
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 161 and name HN) -0.095 0.001
;
311 1 315 43 parsed_2rse 4
64
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 162 and name HN) -0.106 0.001
;
316 1 320 43 parsed_2rse 4
65
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 163 and name HN) -0.116 0.001
;
321 1 325 43 parsed_2rse 4
66
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 164 and name HN) -0.114 0.001
;
326 1 330 43 parsed_2rse 4
67
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 166 and name HN) -0.121 0.001
;
331 1 335 43 parsed_2rse 4
68
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 167 and name HN) -0.112 0.001
;
336 1 340 43 parsed_2rse 4
69
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 168 and name HN) -0.111 0.001
;
341 1 345 43 parsed_2rse 4
70
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 170 and name HN) -0.103 0.001
;
346 1 350 43 parsed_2rse 4
71
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 173 and name HN) -0.015 0.001
;
351 1 355 43 parsed_2rse 4
72
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 175 and name HN) -0.072 0.001
;
356 1 360 43 parsed_2rse 4
73
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 176 and name HN) -0.065 0.001
;
361 1 365 43 parsed_2rse 4
74
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 177 and name HN) -0.008 0.001
;
366 1 370 43 parsed_2rse 4
75
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 178 and name HN) -0.072 0.001
;
371 1 375 43 parsed_2rse 4
76
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 179 and name HN) -0.066 0.001
;
376 1 380 43 parsed_2rse 4
77
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 180 and name HN) -0.071 0.001
;
381 1 385 43 parsed_2rse 4
78
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 183 and name HN) -0.135 0.001
;
386 1 390 43 parsed_2rse 4
79
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 185 and name HN) -0.151 0.001
;
391 1 395 43 parsed_2rse 4
80
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 186 and name HN) -0.16 0.001
;
396 1 400 42 parsed_2rse 4
81
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 187 and name HN) -0.192 0.001
;
401 1 405 43 parsed_2rse 4
82
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 189 and name HN) -0.15 0.001
;
406 1 410 42 parsed_2rse 4
83
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 190 and name HN) -0.159 0.001
;
411 1 415 43 parsed_2rse 4
84
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 192 and name HN) -0.161 0.001
;
416 1 420 43 parsed_2rse 4
85
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 193 and name HN) -0.151 0.001
;
421 1 425 43 parsed_2rse 4
86
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 194 and name HN) -0.163 0.001
;
426 1 430 43 parsed_2rse 4
87
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 195 and name HN) -0.174 0.001
;
431 1 435 43 parsed_2rse 4
88
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 196 and name HN) -0.153 0.001
;
436 1 440 43 parsed_2rse 4
89
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 198 and name HN) -0.15 0.001
;
441 1 445 42 parsed_2rse 4
90
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 199 and name HN) -0.161 0.001
;
446 1 450 43 parsed_2rse 4
91
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 200 and name HN) -0.19 0.001
;
451 1 455 42 parsed_2rse 4
92
;
assign (resid 700 and name OO)
(resid 700 and name Z)
(resid 700 and name X)
(resid 700 and name Y)
(resid 201 and name HN) -0.192 0.001
;
456 1 460 43 parsed_2rse 4
stop_
save_