NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
637217 |
6gw7   |
34292 | cing | 2-parsed | STAR | entry | full | 70 |
data_6gw7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6gw7
_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_6gw7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6gw7
_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 6gw7 "Master copy" parsed_6gw7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6gw7
_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 6gw7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6gw7 1
1 6gw7.mr . . XPLOR/CNS 2 distance NOE simple 0 parsed_6gw7 1
1 6gw7.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 18 parsed_6gw7 1
1 6gw7.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 52 parsed_6gw7 1
1 6gw7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6gw7 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_6gw7
_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 DNA BINDING PROTEIN 22-JUN-18 6GW7
*TITLE THE CTD OF HPDPRA, A DNA BINDING WINGED HELIX DOMAIN WHICH DO NOT BIND
*TITLE 2 DSDNA
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: DNA PROTECTING PROTEIN DPRA;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI;
*SOURCE 3 ORGANISM_COMMON: CAMPYLOBACTER PYLORI;
*SOURCE 4 ORGANISM_TAXID: 210;
*SOURCE 5 GENE: BB415_01075;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI 'BL21-GOLD(DE3)PLYSS AG';
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 866768
*KEYWDS WINGED HELIX, DNA BINDING PROTEIN, DPRA, HELICOBACTER PYLORI
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR J.LISBOA,L.CELMA,D.SANCHEZ,M.MARQUIS,J.ANDREANI,R.GUEROIS,
*AUTHOR 2 F.OCHSENBEIN,D.DURAND,S.MARSIN,P.CUNIASSE,J.P.RADICELLA,S.QUEVILLON-
*AUTHOR 3 CHERUEL
*REVDAT 1 24-APR-19 6GW7 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6gw7
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "#SUP 0.75" 707 88 707 100 parsed_6gw7 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 1: dpra_noe_restraints.tbl" 1 1 1 44 parsed_6gw7 1
2 "assign resid 26 and name HB2 resid 28 and name HG1 4.63 2.83 0.00" 7 1 7 86 parsed_6gw7 1
3 "assign resid 25 and name HB2 resid 26 and name HB2 3.58 1.78 0.00" 8 1 8 86 parsed_6gw7 1
4 "assign resid 21 and name HA resid 24 and name HA 4.77 2.97 0.00" 9 1 9 86 parsed_6gw7 1
5 "assign resid 20 and name HB2 resid 21 and name HA 3.86 2.06 0.00" 10 1 10 86 parsed_6gw7 1
6 "assign resid 21 and name HA resid 56 and name HD2* 4.27 2.47 0.00" 11 1 11 86 parsed_6gw7 1
7 "assign resid 25 and name HA resid 54 and name HG* 5.50 3.70 0.00" 12 1 12 86 parsed_6gw7 1
8 "assign resid 25 and name HA resid 53 and name HD1* 5.50 3.70 0.00" 13 1 13 86 parsed_6gw7 1
9 "assign resid 27 and name HA resid 27 and name HD* 3.73 1.93 0.00" 14 1 14 86 parsed_6gw7 1
10 "assign resid 27 and name HA resid 30 and name HB* 3.69 1.89 0.00" 15 1 15 86 parsed_6gw7 1
11 "assign resid 27 and name HA resid 54 and name HG* 3.38 1.58 0.00" 16 1 16 86 parsed_6gw7 1
12 "assign resid 26 and name HA resid 27 and name HA 5.21 3.41 0.00" 17 1 17 86 parsed_6gw7 1
13 "assign resid 41 and name HA resid 41 and name HD* 3.73 1.93 0.00" 18 1 18 86 parsed_6gw7 1
14 "assign resid 41 and name HA resid 44 and name HD2* 3.82 2.02 0.00" 19 1 19 86 parsed_6gw7 1
15 "assign resid 41 and name HA resid 44 and name HB2 4.29 2.49 0.00" 20 1 20 86 parsed_6gw7 1
16 "assign resid 27 and name HE* resid 54 and name HA 5.20 3.40 0.00" 21 1 21 86 parsed_6gw7 1
17 "assign resid 54 and name HA resid 54 and name HG* 3.44 1.64 0.00" 22 1 22 86 parsed_6gw7 1
18 "assign resid 41 and name HA resid 44 and name HB1 3.28 1.48 0.00" 23 1 23 86 parsed_6gw7 1
19 "assign resid 31 and name HA resid 38 and name HB1 3.84 2.04 0.00" 24 1 24 86 parsed_6gw7 1
20 "assign resid 31 and name HA resid 38 and name HD2* 3.65 1.85 0.00" 25 1 25 86 parsed_6gw7 1
21 "assign resid 27 and name HD* resid 28 and name HA 4.05 2.25 0.00" 26 1 26 86 parsed_6gw7 1
22 "assign resid 31 and name HA resid 35 and name HA2 5.28 3.48 0.00" 27 1 27 86 parsed_6gw7 1
23 "assign resid 27 and name HB1 resid 53 and name HA 5.12 3.32 0.00" 28 1 28 86 parsed_6gw7 1
24 "assign resid 28 and name HA resid 28 and name HB1 3.04 1.24 0.00" 29 1 29 86 parsed_6gw7 1
25 "assign resid 17 and name HA resid 20 and name HD* 4.89 3.09 0.00" 30 1 30 86 parsed_6gw7 1
26 "assign resid 17 and name HA resid 34 and name HE* 4.75 2.95 0.00" 31 1 31 86 parsed_6gw7 1
27 "assign resid 53 and name HA resid 54 and name HA 4.53 2.73 0.00" 32 1 32 86 parsed_6gw7 1
28 "assign resid 53 and name HA resid 54 and name HG* 5.27 3.47 0.00" 33 1 33 86 parsed_6gw7 1
29 "assign resid 53 and name HA resid 53 and name HG2* 3.49 1.69 0.00" 34 1 34 86 parsed_6gw7 1
30 "assign resid 42 and name HA resid 42 and name HB2 2.99 1.19 0.00" 35 1 35 86 parsed_6gw7 1
31 "assign resid 42 and name HA resid 47 and name HG12 3.57 1.77 0.00" 36 1 36 86 parsed_6gw7 1
32 "assign resid 42 and name HA resid 47 and name HD1* 4.25 2.45 0.00" 37 1 37 86 parsed_6gw7 1
33 "assign resid 42 and name HA resid 47 and name HG11 3.56 1.76 0.00" 38 1 38 86 parsed_6gw7 1
34 "assign resid 50 and name HA resid 50 and name HG12 3.80 2.00 0.00" 39 1 39 86 parsed_6gw7 1
35 "assign resid 50 and name HA resid 50 and name HG11 3.49 1.69 0.00" 40 1 40 86 parsed_6gw7 1
36 "assign resid 50 and name HA resid 50 and name HG2* 3.23 1.43 0.00" 41 1 41 86 parsed_6gw7 1
37 "assign resid 41 and name HB2 resid 42 and name HA 5.00 3.20 0.00" 42 1 42 86 parsed_6gw7 1
38 "assign resid 16 and name HA resid 16 and name HG1 3.44 1.64 0.00" 43 1 43 86 parsed_6gw7 1
39 "assign resid 16 and name HA resid 16 and name HB2 2.64 0.84 0.00" 44 1 44 86 parsed_6gw7 1
40 "assign resid 40 and name HA resid 41 and name HD* 4.96 3.16 0.00" 45 1 45 86 parsed_6gw7 1
41 "assign resid 40 and name HA resid 40 and name HB2 2.65 0.85 0.00" 46 1 46 86 parsed_6gw7 1
42 "assign resid 29 and name HA resid 32 and name HB2 3.41 1.61 0.00" 47 1 47 86 parsed_6gw7 1
43 "assign resid 29 and name HA resid 33 and name HB2 5.00 3.20 0.00" 48 1 48 86 parsed_6gw7 1
44 "assign resid 37 and name HA resid 37 and name HG1 3.13 1.33 0.00" 49 1 49 86 parsed_6gw7 1
45 "assign resid 19 and name HA resid 19 and name HG1 3.60 1.80 0.00" 50 1 50 86 parsed_6gw7 1
46 "assign resid 19 and name HA resid 19 and name HB* 2.88 1.08 0.00" 51 1 51 86 parsed_6gw7 1
47 "assign resid 47 and name HA resid 57 and name HA 5.09 3.29 0.00" 52 1 52 86 parsed_6gw7 1
48 "assign resid 55 and name HA resid 55 and name HG1* 3.41 1.61 0.00" 53 1 53 86 parsed_6gw7 1
49 "assign resid 34 and name HA resid 34 and name HD* 3.22 1.42 0.00" 54 1 54 86 parsed_6gw7 1
50 "assign resid 37 and name HA resid 37 and name HB1 2.95 1.15 0.00" 55 1 55 86 parsed_6gw7 1
51 "assign resid 38 and name HA resid 41 and name HB1 3.94 2.14 0.00" 56 1 56 86 parsed_6gw7 1
52 "assign resid 38 and name HA resid 47 and name HD1* 4.00 2.20 0.00" 57 1 57 86 parsed_6gw7 1
53 "assign resid 38 and name HA resid 38 and name HD1* 3.52 1.72 0.00" 58 1 58 86 parsed_6gw7 1
54 "assign resid 33 and name HA resid 33 and name HB2 3.01 1.21 0.00" 59 1 59 86 parsed_6gw7 1
55 "assign resid 33 and name HA resid 33 and name HG2 3.38 1.58 0.00" 60 1 60 86 parsed_6gw7 1
56 "assign resid 33 and name HA resid 33 and name HG1 3.74 1.94 0.00" 61 1 61 86 parsed_6gw7 1
57 "assign resid 47 and name HA resid 56 and name HA 3.24 1.44 0.00" 62 1 62 86 parsed_6gw7 1
58 "assign resid 47 and name HA resid 47 and name HG2* 3.21 1.41 0.00" 63 1 63 86 parsed_6gw7 1
59 "assign resid 47 and name HA resid 57 and name HB* 4.03 2.23 0.00" 64 1 64 86 parsed_6gw7 1
60 "assign resid 26 and name HA resid 53 and name HG2* 3.57 1.77 0.00" 65 1 65 86 parsed_6gw7 1
61 "assign resid 33 and name HD1 resid 34 and name HA 4.60 2.80 0.00" 66 1 66 86 parsed_6gw7 1
62 "assign resid 34 and name HA resid 34 and name HE* 5.18 3.38 0.00" 67 1 67 86 parsed_6gw7 1
63 "assign resid 34 and name HA resid 37 and name HB1 4.98 3.18 0.00" 68 1 68 86 parsed_6gw7 1
64 "assign resid 5 and name HA resid 5 and name HB2 2.93 1.13 0.00" 69 1 69 86 parsed_6gw7 1
65 "assign resid 3 and name HD* resid 5 and name HA 5.36 3.56 0.00" 70 1 70 86 parsed_6gw7 1
66 "assign resid 43 and name HA resid 43 and name HD* 3.00 1.20 0.00" 71 1 71 86 parsed_6gw7 1
67 "assign resid 17 and name HD* resid 18 and name HA 4.78 2.98 0.00" 72 1 72 86 parsed_6gw7 1
68 "assign resid 18 and name HA resid 21 and name HB2 3.56 1.76 0.00" 73 1 73 86 parsed_6gw7 1
69 "assign resid 46 and name HA resid 46 and name HE* 4.30 2.50 0.00" 74 1 74 86 parsed_6gw7 1
70 "assign resid 46 and name HA resid 46 and name HG2 3.20 1.40 0.00" 75 1 75 86 parsed_6gw7 1
71 "assign resid 46 and name HA resid 46 and name HB2 2.95 1.15 0.00" 76 1 76 86 parsed_6gw7 1
72 "assign resid 39 and name HA resid 42 and name HB1 3.33 1.53 0.00" 77 1 77 86 parsed_6gw7 1
73 "assign resid 39 and name HA resid 39 and name HB1 2.96 1.16 0.00" 78 1 78 86 parsed_6gw7 1
74 "assign resid 39 and name HA resid 39 and name HD1* 3.81 2.01 0.00" 79 1 79 86 parsed_6gw7 1
75 "assign resid 39 and name HA resid 39 and name HD2* 3.32 1.52 0.00" 80 1 80 86 parsed_6gw7 1
76 "assign resid 14 and name HA resid 15 and name HA 4.81 3.01 0.00" 81 1 81 86 parsed_6gw7 1
77 "assign resid 14 and name HA resid 17 and name HA 5.16 3.36 0.00" 82 1 82 86 parsed_6gw7 1
78 "assign resid 14 and name HA resid 17 and name HB2 4.25 2.45 0.00" 83 1 83 86 parsed_6gw7 1
79 "assign resid 14 and name HA resid 14 and name HB1 2.89 1.09 0.00" 84 1 84 86 parsed_6gw7 1
80 "assign resid 32 and name HA resid 32 and name HD* 2.96 1.16 0.00" 85 1 85 86 parsed_6gw7 1
81 "assign resid 31 and name HD* resid 32 and name HA 4.94 3.14 0.00" 86 1 86 86 parsed_6gw7 1
82 "assign resid 36 and name HA resid 39 and name HB2 3.60 1.80 0.00" 87 1 87 86 parsed_6gw7 1
83 "assign resid 36 and name HA resid 39 and name HG 3.73 1.93 0.00" 88 1 88 86 parsed_6gw7 1
84 "assign resid 36 and name HA resid 39 and name HD1* 3.68 1.88 0.00" 89 1 89 86 parsed_6gw7 1
85 "assign resid 36 and name HA resid 39 and name HD2* 4.56 2.76 0.00" 90 1 90 86 parsed_6gw7 1
86 "assign resid 3 and name HA resid 3 and name HE* 4.58 2.78 0.00" 91 1 91 86 parsed_6gw7 1
87 "assign resid 9 and name HA resid 9 and name HB2 2.77 0.97 0.00" 92 1 92 86 parsed_6gw7 1
88 "assign resid 9 and name HA resid 9 and name HG* 3.34 1.54 0.00" 93 1 93 86 parsed_6gw7 1
89 "assign resid 3 and name HA resid 3 and name HG* 3.54 1.74 0.00" 94 1 94 86 parsed_6gw7 1
90 "assign resid 6 and name HA resid 6 and name HB2 2.93 1.13 0.00" 95 1 95 86 parsed_6gw7 1
91 "assign resid 13 and name HA resid 13 and name HG1 3.48 1.68 0.00" 96 1 96 86 parsed_6gw7 1
92 "assign resid 13 and name HA resid 13 and name HB* 2.69 0.89 0.00" 97 1 97 86 parsed_6gw7 1
93 "assign resid 13 and name HA resid 14 and name HG* 4.13 2.33 0.00" 98 1 98 86 parsed_6gw7 1
94 "assign resid 23 and name HA resid 23 and name HG1 3.26 1.46 0.00" 99 1 99 86 parsed_6gw7 1
95 "assign resid 49 and name HA resid 54 and name HA 3.38 1.58 0.00" 100 1 100 86 parsed_6gw7 1
96 "assign resid 15 and name HA resid 18 and name HD1* 4.07 2.27 0.00" 101 1 101 86 parsed_6gw7 1
97 "assign resid 15 and name HA resid 18 and name HB2 4.06 2.26 0.00" 102 1 102 86 parsed_6gw7 1
98 "assign resid 30 and name HA resid 33 and name HB1 3.98 2.18 0.00" 103 1 103 86 parsed_6gw7 1
99 "assign resid 2 and name HA resid 2 and name HG 2.99 1.19 0.00" 104 1 104 86 parsed_6gw7 1
100 "assign resid 56 and name HA resid 56 and name HB* 2.99 1.19 0.00" 105 1 105 86 parsed_6gw7 1
101 "assign resid 44 and name HA resid 44 and name HB1 2.91 1.11 0.00" 106 1 106 86 parsed_6gw7 1
102 "assign resid 7 and name HA resid 7 and name HB* 2.91 1.11 0.00" 107 1 107 86 parsed_6gw7 1
103 "assign resid 6 and name HB1 resid 7 and name HA 4.51 2.71 0.00" 108 1 108 86 parsed_6gw7 1
104 "assign resid 27 and name HD* resid 49 and name HA 5.34 3.54 0.00" 109 1 109 86 parsed_6gw7 1
105 "assign resid 49 and name HA resid 54 and name HG* 4.33 2.53 0.00" 110 1 110 86 parsed_6gw7 1
106 "assign resid 49 and name HA resid 49 and name HG* 3.45 1.65 0.00" 111 1 111 86 parsed_6gw7 1
107 "assign resid 42 and name HG1 resid 48 and name HA 4.97 3.17 0.00" 112 1 112 86 parsed_6gw7 1
108 "assign resid 30 and name HA resid 34 and name HE* 3.32 1.52 0.00" 113 1 113 86 parsed_6gw7 1
109 "assign resid 30 and name HA resid 33 and name HB2 4.03 2.23 0.00" 114 1 114 86 parsed_6gw7 1
110 "assign resid 44 and name HA resid 44 and name HD2* 3.95 2.15 0.00" 115 1 115 86 parsed_6gw7 1
111 "assign resid 1 and name HA resid 1 and name HG* 4.28 2.48 0.00" 116 1 116 86 parsed_6gw7 1
112 "assign resid 48 and name HA resid 48 and name HG2 4.24 2.44 0.00" 117 1 117 86 parsed_6gw7 1
113 "assign resid 23 and name HB1 resid 24 and name HA 5.12 3.32 0.00" 118 1 118 86 parsed_6gw7 1
114 "assign resid 9 and name HA resid 10 and name HA 4.72 2.92 0.00" 119 1 119 86 parsed_6gw7 1
115 "assign resid 4 and name HA resid 7 and name HD1* 5.50 3.70 0.00" 120 1 120 86 parsed_6gw7 1
116 "assign resid 4 and name HA resid 4 and name HB* 3.01 1.21 0.00" 121 1 121 86 parsed_6gw7 1
117 "assign resid 4 and name HA resid 5 and name HD* 4.80 3.00 0.00" 122 1 122 86 parsed_6gw7 1
118 "assign resid 22 and name HA resid 56 and name HD2* 3.40 1.60 0.00" 123 1 123 86 parsed_6gw7 1
119 "assign resid 24 and name HA resid 53 and name HD1* 4.49 2.69 0.00" 124 1 124 86 parsed_6gw7 1
120 "assign resid 9 and name HG* resid 10 and name HA 4.98 3.18 0.00" 125 1 125 86 parsed_6gw7 1
121 "assign resid 10 and name HA resid 11 and name HD2 2.80 1.00 0.00" 126 1 126 86 parsed_6gw7 1
122 "assign resid 10 and name HA resid 10 and name HB2 3.02 1.22 0.00" 127 1 127 86 parsed_6gw7 1
123 "assign resid 10 and name HA resid 10 and name HG1 3.58 1.78 0.00" 128 1 128 86 parsed_6gw7 1
124 "assign resid 24 and name HA resid 25 and name HD1 3.75 1.95 0.00" 129 1 129 86 parsed_6gw7 1
125 "assign resid 25 and name HD1 resid 53 and name HD1* 5.50 3.70 0.00" 130 1 130 86 parsed_6gw7 1
126 "assign resid 10 and name HG1 resid 11 and name HD2 5.17 3.37 0.00" 131 1 131 86 parsed_6gw7 1
127 "assign resid 10 and name HA resid 11 and name HD1 3.00 1.20 0.00" 132 1 132 86 parsed_6gw7 1
128 "assign resid 10 and name HG1 resid 11 and name HD1 5.50 3.70 0.00" 133 1 133 86 parsed_6gw7 1
129 "assign resid 24 and name HB1 resid 25 and name HD1 5.42 3.62 0.00" 134 1 134 86 parsed_6gw7 1
130 "assign resid 32 and name HD* resid 35 and name HA2 5.50 3.70 0.00" 135 1 135 86 parsed_6gw7 1
131 "assign resid 31 and name HD* resid 35 and name HA2 5.19 3.39 0.00" 136 1 136 86 parsed_6gw7 1
132 "assign resid 31 and name HE* resid 35 and name HA2 5.27 3.47 0.00" 137 1 137 86 parsed_6gw7 1
133 "assign resid 35 and name HA2 resid 36 and name HA 5.24 3.44 0.00" 138 1 138 86 parsed_6gw7 1
134 "assign resid 35 and name HA1 resid 36 and name HA 5.39 3.59 0.00" 139 1 139 86 parsed_6gw7 1
135 "assign resid 31 and name HD* resid 35 and name HA1 5.02 3.22 0.00" 140 1 140 86 parsed_6gw7 1
136 "assign resid 31 and name HE* resid 35 and name HA1 4.75 2.95 0.00" 141 1 141 86 parsed_6gw7 1
137 "assign resid 45 and name HA2 resid 57 and name HB* 5.50 3.70 0.00" 142 1 142 86 parsed_6gw7 1
138 "assign resid 45 and name HA1 resid 57 and name HB* 5.50 3.70 0.00" 143 1 143 86 parsed_6gw7 1
139 "assign resid 27 and name HE* resid 49 and name HD* 4.83 3.03 0.00" 144 1 144 86 parsed_6gw7 1
140 "assign resid 49 and name HA resid 49 and name HD* 4.86 3.06 0.00" 145 1 145 86 parsed_6gw7 1
141 "assign resid 49 and name HD* resid 54 and name HA 5.50 3.70 0.00" 146 1 146 86 parsed_6gw7 1
142 "assign resid 31 and name HA resid 38 and name HB2 3.49 1.69 0.00" 147 1 147 86 parsed_6gw7 1
143 "assign resid 31 and name HB1 resid 38 and name HB2 4.42 2.62 0.00" 148 1 148 86 parsed_6gw7 1
144 "assign resid 48 and name HE* resid 57 and name HA 4.23 2.43 0.00" 149 1 149 86 parsed_6gw7 1
145 "assign resid 48 and name HE* resid 55 and name HG2* 3.78 1.98 0.00" 150 1 150 86 parsed_6gw7 1
146 "assign resid 38 and name HB2 resid 38 and name HD1* 4.06 2.26 0.00" 151 1 151 86 parsed_6gw7 1
147 "assign resid 47 and name HB resid 56 and name HA 4.25 2.45 0.00" 152 1 152 86 parsed_6gw7 1
148 "assign resid 5 and name HB2 resid 7 and name HB* 4.03 2.23 0.00" 153 1 153 86 parsed_6gw7 1
149 "assign resid 31 and name HB1 resid 38 and name HB1 4.16 2.36 0.00" 154 1 154 86 parsed_6gw7 1
150 "assign resid 38 and name HB1 resid 38 and name HD2* 3.79 1.99 0.00" 155 1 155 86 parsed_6gw7 1
151 "assign resid 3 and name HG* resid 3 and name HE* 3.85 2.05 0.00" 156 1 156 86 parsed_6gw7 1
152 "assign resid 23 and name HB1 resid 23 and name HE* 2.80 1.00 0.00" 157 1 157 86 parsed_6gw7 1
153 "assign resid 8 and name HG2 resid 8 and name HE* 3.57 1.77 0.00" 158 1 158 86 parsed_6gw7 1
154 "assign resid 48 and name HB1 resid 48 and name HE* 3.00 1.20 0.00" 159 1 159 86 parsed_6gw7 1
155 "assign resid 48 and name HG2 resid 48 and name HE* 3.71 1.91 0.00" 160 1 160 86 parsed_6gw7 1
156 "assign resid 46 and name HD* resid 46 and name HE* 3.04 1.24 0.00" 161 1 161 86 parsed_6gw7 1
157 "assign resid 41 and name HE* resid 46 and name HE* 4.39 2.59 0.00" 162 1 162 86 parsed_6gw7 1
158 "assign resid 37 and name HA resid 37 and name HE1 5.48 3.68 0.00" 163 1 163 86 parsed_6gw7 1
159 "assign resid 33 and name HG1 resid 33 and name HE2 4.21 2.41 0.00" 164 1 164 86 parsed_6gw7 1
160 "assign resid 33 and name HD1 resid 34 and name HB1 4.84 3.04 0.00" 165 1 165 86 parsed_6gw7 1
161 "assign resid 40 and name HA resid 43 and name HB2 3.76 1.96 0.00" 166 1 166 86 parsed_6gw7 1
162 "assign resid 43 and name HB2 resid 43 and name HD* 3.18 1.38 0.00" 167 1 167 86 parsed_6gw7 1
163 "assign resid 32 and name HB2 resid 32 and name HD* 3.23 1.43 0.00" 168 1 168 86 parsed_6gw7 1
164 "assign resid 40 and name HA resid 43 and name HB1 4.21 2.41 0.00" 169 1 169 86 parsed_6gw7 1
165 "assign resid 43 and name HB1 resid 43 and name HD* 3.18 1.38 0.00" 170 1 170 86 parsed_6gw7 1
166 "assign resid 15 and name HB2 resid 18 and name HD1* 4.39 2.59 0.00" 171 1 171 86 parsed_6gw7 1
167 "assign resid 37 and name HG1 resid 37 and name HE2 4.09 2.29 0.00" 172 1 172 86 parsed_6gw7 1
168 "assign resid 33 and name HE2 resid 34 and name HE* 4.42 2.62 0.00" 173 1 173 86 parsed_6gw7 1
169 "assign resid 15 and name HA resid 15 and name HB1 3.01 1.21 0.00" 174 1 174 86 parsed_6gw7 1
170 "assign resid 31 and name HA resid 34 and name HB1 5.09 3.29 0.00" 175 1 175 86 parsed_6gw7 1
171 "assign resid 17 and name HE* resid 34 and name HB1 4.49 2.69 0.00" 176 1 176 86 parsed_6gw7 1
172 "assign resid 33 and name HG1 resid 33 and name HE1 3.98 2.18 0.00" 177 1 177 86 parsed_6gw7 1
173 "assign resid 27 and name HB1 resid 53 and name HB 4.87 3.07 0.00" 178 1 178 86 parsed_6gw7 1
174 "assign resid 36 and name HA resid 39 and name HB1 4.54 2.74 0.00" 179 1 179 86 parsed_6gw7 1
175 "assign resid 39 and name HB1 resid 40 and name HA 4.84 3.04 0.00" 180 1 180 86 parsed_6gw7 1
176 "assign resid 39 and name HB1 resid 39 and name HD1* 3.84 2.04 0.00" 181 1 181 86 parsed_6gw7 1
177 "assign resid 39 and name HB1 resid 39 and name HD2* 3.69 1.89 0.00" 182 1 182 86 parsed_6gw7 1
178 "assign resid 15 and name HA resid 18 and name HB1 4.92 3.12 0.00" 183 1 183 86 parsed_6gw7 1
179 "assign resid 36 and name HB2 resid 37 and name HN 4.39 2.59 0.00" 184 1 184 86 parsed_6gw7 1
180 "assign resid 15 and name HB2 resid 18 and name HB2 4.62 2.82 0.00" 185 1 185 86 parsed_6gw7 1
181 "assign resid 18 and name HB2 resid 18 and name HD1* 4.02 2.22 0.00" 186 1 186 86 parsed_6gw7 1
182 "assign resid 15 and name HB2 resid 18 and name HB1 4.54 2.74 0.00" 187 1 187 86 parsed_6gw7 1
183 "assign resid 18 and name HB1 resid 18 and name HD1* 4.25 2.45 0.00" 188 1 188 86 parsed_6gw7 1
184 "assign resid 36 and name HA resid 36 and name HB2 3.03 1.23 0.00" 189 1 189 86 parsed_6gw7 1
185 "assign resid 17 and name HD* resid 20 and name HB2 5.19 3.39 0.00" 190 1 190 86 parsed_6gw7 1
186 "assign resid 17 and name HA resid 20 and name HB2 4.02 2.22 0.00" 191 1 191 86 parsed_6gw7 1
187 "assign resid 20 and name HB1 resid 30 and name HB* 5.50 3.70 0.00" 192 1 192 86 parsed_6gw7 1
188 "assign resid 27 and name HB2 resid 54 and name HG* 4.33 2.53 0.00" 193 1 193 86 parsed_6gw7 1
189 "assign resid 27 and name HB1 resid 54 and name HA 5.30 3.50 0.00" 194 1 194 86 parsed_6gw7 1
190 "assign resid 31 and name HB1 resid 38 and name HD1* 4.02 2.22 0.00" 195 1 195 86 parsed_6gw7 1
191 "assign resid 20 and name HB2 resid 34 and name HE* 4.27 2.47 0.00" 196 1 196 86 parsed_6gw7 1
192 "assign resid 20 and name HB2 resid 34 and name HZ 4.73 2.93 0.00" 197 1 197 86 parsed_6gw7 1
193 "assign resid 17 and name HE* resid 41 and name HB1 4.47 2.67 0.00" 198 1 198 86 parsed_6gw7 1
194 "assign resid 41 and name HB1 resid 46 and name HB2 5.10 3.30 0.00" 199 1 199 86 parsed_6gw7 1
195 "assign resid 41 and name HB1 resid 46 and name HB1 4.41 2.61 0.00" 200 1 200 86 parsed_6gw7 1
196 "assign resid 41 and name HB1 resid 47 and name HG12 5.10 3.30 0.00" 201 1 201 86 parsed_6gw7 1
197 "assign resid 41 and name HB1 resid 47 and name HG2* 4.00 2.20 0.00" 202 1 202 86 parsed_6gw7 1
198 "assign resid 20 and name HB1 resid 34 and name HE* 4.74 2.94 0.00" 203 1 203 86 parsed_6gw7 1
199 "assign resid 17 and name HD* resid 20 and name HB1 5.30 3.50 0.00" 204 1 204 86 parsed_6gw7 1
200 "assign resid 17 and name HA resid 20 and name HB1 3.88 2.08 0.00" 205 1 205 86 parsed_6gw7 1
201 "assign resid 31 and name HB2 resid 38 and name HB2 4.79 2.99 0.00" 206 1 206 86 parsed_6gw7 1
202 "assign resid 31 and name HB2 resid 32 and name HG 4.30 2.50 0.00" 207 1 207 86 parsed_6gw7 1
203 "assign resid 50 and name HG2* resid 51 and name HB2 4.29 2.49 0.00" 208 1 208 86 parsed_6gw7 1
204 "assign resid 24 and name HB2 resid 53 and name HG1* 4.78 2.98 0.00" 209 1 209 86 parsed_6gw7 1
205 "assign resid 28 and name HA resid 28 and name HG2 3.70 1.90 0.00" 210 1 210 86 parsed_6gw7 1
206 "assign resid 27 and name HD* resid 28 and name HG2 4.76 2.96 0.00" 211 1 211 86 parsed_6gw7 1
207 "assign resid 26 and name HB1 resid 28 and name HG1 3.77 1.97 0.00" 212 1 212 86 parsed_6gw7 1
208 "assign resid 27 and name HD* resid 28 and name HG1 4.51 2.71 0.00" 213 1 213 86 parsed_6gw7 1
209 "assign resid 37 and name HA resid 40 and name HG* 3.19 1.39 0.00" 214 1 214 86 parsed_6gw7 1
210 "assign resid 42 and name HG1 resid 47 and name HD1* 5.50 3.70 0.00" 215 1 215 86 parsed_6gw7 1
211 "assign resid 42 and name HA resid 42 and name HG1 3.89 2.09 0.00" 216 1 216 86 parsed_6gw7 1
212 "assign resid 14 and name HG* resid 18 and name HD1* 4.22 2.42 0.00" 217 1 217 86 parsed_6gw7 1
213 "assign resid 12 and name HA resid 12 and name HG* 3.14 1.34 0.00" 218 1 218 86 parsed_6gw7 1
214 "assign resid 48 and name HB2 resid 48 and name HE* 5.03 3.23 0.00" 219 1 219 86 parsed_6gw7 1
215 "assign resid 19 and name HA resid 19 and name HG2 3.80 2.00 0.00" 220 1 220 86 parsed_6gw7 1
216 "assign resid 29 and name HA resid 29 and name HG1 3.37 1.57 0.00" 221 1 221 86 parsed_6gw7 1
217 "assign resid 29 and name HG1 resid 32 and name HD* 4.57 2.77 0.00" 222 1 222 86 parsed_6gw7 1
218 "assign resid 14 and name HG* resid 15 and name HB2 4.40 2.60 0.00" 223 1 223 86 parsed_6gw7 1
219 "assign resid 29 and name HA resid 29 and name HG2 3.62 1.82 0.00" 224 1 224 86 parsed_6gw7 1
220 "assign resid 46 and name HB2 resid 46 and name HE* 4.19 2.39 0.00" 225 1 225 86 parsed_6gw7 1
221 "assign resid 41 and name HD* resid 46 and name HB2 4.18 2.38 0.00" 226 1 226 86 parsed_6gw7 1
222 "assign resid 41 and name HD* resid 46 and name HB1 4.21 2.41 0.00" 227 1 227 86 parsed_6gw7 1
223 "assign resid 46 and name HB1 resid 46 and name HE* 3.99 2.19 0.00" 228 1 228 86 parsed_6gw7 1
224 "assign resid 18 and name HD2* resid 46 and name HB1 5.18 3.38 0.00" 229 1 229 86 parsed_6gw7 1
225 "assign resid 46 and name HB1 resid 47 and name HG2* 4.72 2.92 0.00" 230 1 230 86 parsed_6gw7 1
226 "assign resid 33 and name HB2 resid 34 and name HD* 4.34 2.54 0.00" 231 1 231 86 parsed_6gw7 1
227 "assign resid 33 and name HB1 resid 34 and name HD* 4.14 2.34 0.00" 232 1 232 86 parsed_6gw7 1
228 "assign resid 33 and name HB1 resid 33 and name HE1 5.50 3.70 0.00" 233 1 233 86 parsed_6gw7 1
229 "assign resid 24 and name HA resid 54 and name HB 4.93 3.13 0.00" 234 1 234 86 parsed_6gw7 1
230 "assign resid 27 and name HD* resid 54 and name HB 4.72 2.92 0.00" 235 1 235 86 parsed_6gw7 1
231 "assign resid 33 and name HB2 resid 34 and name HE* 4.67 2.87 0.00" 236 1 236 86 parsed_6gw7 1
232 "assign resid 33 and name HB2 resid 33 and name HE2 5.08 3.28 0.00" 237 1 237 86 parsed_6gw7 1
233 "assign resid 33 and name HB1 resid 33 and name HD1 3.93 2.13 0.00" 238 1 238 86 parsed_6gw7 1
234 "assign resid 33 and name HB1 resid 34 and name HE* 4.69 2.89 0.00" 239 1 239 86 parsed_6gw7 1
235 "assign resid 12 and name HN resid 13 and name HB* 5.04 3.24 0.00" 240 1 240 86 parsed_6gw7 1
236 "assign resid 3 and name HB2 resid 3 and name HE* 4.60 2.80 0.00" 241 1 241 86 parsed_6gw7 1
237 "assign resid 3 and name HB1 resid 3 and name HE* 4.48 2.68 0.00" 242 1 242 86 parsed_6gw7 1
238 "assign resid 13 and name HA resid 13 and name HG2 3.88 2.08 0.00" 243 1 243 86 parsed_6gw7 1
239 "assign resid 1 and name HB* resid 2 and name HD1* 5.31 3.51 0.00" 244 1 244 86 parsed_6gw7 1
240 "assign resid 9 and name HA resid 10 and name HB2 5.03 3.23 0.00" 245 1 245 86 parsed_6gw7 1
241 "assign resid 34 and name HD* resid 37 and name HB2 5.11 3.31 0.00" 246 1 246 86 parsed_6gw7 1
242 "assign resid 34 and name HB2 resid 37 and name HB1 4.20 2.40 0.00" 247 1 247 86 parsed_6gw7 1
243 "assign resid 34 and name HD* resid 37 and name HB1 5.29 3.49 0.00" 248 1 248 86 parsed_6gw7 1
244 "assign resid 37 and name HB1 resid 37 and name HE2 4.64 2.84 0.00" 249 1 249 86 parsed_6gw7 1
245 "assign resid 34 and name HB2 resid 37 and name HB2 3.91 2.11 0.00" 250 1 250 86 parsed_6gw7 1
246 "assign resid 27 and name HD* resid 49 and name HB2 4.73 2.93 0.00" 251 1 251 86 parsed_6gw7 1
247 "assign resid 49 and name HB2 resid 54 and name HG* 5.49 3.69 0.00" 252 1 252 86 parsed_6gw7 1
248 "assign resid 49 and name HB1 resid 49 and name HD* 4.13 2.33 0.00" 253 1 253 86 parsed_6gw7 1
249 "assign resid 27 and name HE* resid 49 and name HB2 4.60 2.80 0.00" 254 1 254 86 parsed_6gw7 1
250 "assign resid 49 and name HB2 resid 49 and name HD* 3.83 2.03 0.00" 255 1 255 86 parsed_6gw7 1
251 "assign resid 1 and name HG* resid 2 and name HD1* 5.50 3.70 0.00" 256 1 256 86 parsed_6gw7 1
252 "assign resid 42 and name HB2 resid 47 and name HG12 4.47 2.67 0.00" 257 1 257 86 parsed_6gw7 1
253 "assign resid 39 and name HA resid 42 and name HB2 3.93 2.13 0.00" 258 1 258 86 parsed_6gw7 1
254 "assign resid 9 and name HB2 resid 10 and name HA 5.01 3.21 0.00" 259 1 259 86 parsed_6gw7 1
255 "assign resid 42 and name HB1 resid 43 and name HD* 4.65 2.85 0.00" 260 1 260 86 parsed_6gw7 1
256 "assign resid 28 and name HB2 resid 32 and name HD* 3.63 1.83 0.00" 261 1 261 86 parsed_6gw7 1
257 "assign resid 19 and name HB* resid 19 and name HG1 2.59 0.79 0.00" 262 1 262 86 parsed_6gw7 1
258 "assign resid 28 and name HB1 resid 32 and name HD* 4.62 2.82 0.00" 263 1 263 86 parsed_6gw7 1
259 "assign resid 40 and name HB1 resid 41 and name HN 5.18 3.38 0.00" 264 1 264 86 parsed_6gw7 1
260 "assign resid 28 and name HB1 resid 29 and name HN 4.93 3.13 0.00" 265 1 265 86 parsed_6gw7 1
261 "assign resid 3 and name HA resid 3 and name HD* 3.79 1.99 0.00" 266 1 266 86 parsed_6gw7 1
262 "assign resid 41 and name HA resid 44 and name HG 4.07 2.27 0.00" 267 1 267 86 parsed_6gw7 1
263 "assign resid 48 and name HB1 resid 48 and name HD* 3.37 1.57 0.00" 268 1 268 86 parsed_6gw7 1
264 "assign resid 17 and name HD* resid 37 and name HD* 5.47 3.67 0.00" 269 1 269 86 parsed_6gw7 1
265 "assign resid 33 and name HA resid 33 and name HD2 4.91 3.11 0.00" 270 1 270 86 parsed_6gw7 1
266 "assign resid 34 and name HD* resid 37 and name HD* 4.83 3.03 0.00" 271 1 271 86 parsed_6gw7 1
267 "assign resid 37 and name HA resid 37 and name HD* 4.69 2.89 0.00" 272 1 272 86 parsed_6gw7 1
268 "assign resid 33 and name HD2 resid 34 and name HE* 4.90 3.10 0.00" 273 1 273 86 parsed_6gw7 1
269 "assign resid 33 and name HB2 resid 33 and name HD2 3.31 1.51 0.00" 274 1 274 86 parsed_6gw7 1
270 "assign resid 33 and name HA resid 33 and name HD1 4.40 2.60 0.00" 275 1 275 86 parsed_6gw7 1
271 "assign resid 33 and name HD1 resid 34 and name HN 4.13 2.33 0.00" 276 1 276 86 parsed_6gw7 1
272 "assign resid 33 and name HB2 resid 33 and name HD1 3.58 1.78 0.00" 277 1 277 86 parsed_6gw7 1
273 "assign resid 22 and name HA resid 56 and name HG 4.35 2.55 0.00" 278 1 278 86 parsed_6gw7 1
274 "assign resid 47 and name HA resid 56 and name HG 5.50 3.70 0.00" 279 1 279 86 parsed_6gw7 1
275 "assign resid 10 and name HA resid 11 and name HG1 4.46 2.66 0.00" 280 1 280 86 parsed_6gw7 1
276 "assign resid 36 and name HB1 resid 39 and name HG 5.34 3.54 0.00" 281 1 281 86 parsed_6gw7 1
277 "assign resid 38 and name HA resid 38 and name HG 3.83 2.03 0.00" 282 1 282 86 parsed_6gw7 1
278 "assign resid 21 and name HB1 resid 56 and name HG 4.44 2.64 0.00" 283 1 283 86 parsed_6gw7 1
279 "assign resid 43 and name HA resid 43 and name HG 4.11 2.31 0.00" 284 1 284 86 parsed_6gw7 1
280 "assign resid 31 and name HB1 resid 32 and name HG 5.49 3.69 0.00" 285 1 285 86 parsed_6gw7 1
281 "assign resid 31 and name HD* resid 32 and name HG 5.38 3.58 0.00" 286 1 286 86 parsed_6gw7 1
282 "assign resid 7 and name HA resid 7 and name HG 3.91 2.11 0.00" 287 1 287 86 parsed_6gw7 1
283 "assign resid 49 and name HG* resid 54 and name HA 4.51 2.71 0.00" 288 1 288 86 parsed_6gw7 1
284 "assign resid 21 and name HB2 resid 56 and name HG 4.55 2.75 0.00" 289 1 289 86 parsed_6gw7 1
285 "assign resid 21 and name HB2 resid 56 and name HD2* 3.55 1.75 0.00" 290 1 290 86 parsed_6gw7 1
286 "assign resid 21 and name HB1 resid 56 and name HA 4.77 2.97 0.00" 291 1 291 86 parsed_6gw7 1
287 "assign resid 21 and name HB1 resid 56 and name HD2* 3.57 1.77 0.00" 292 1 292 86 parsed_6gw7 1
288 "assign resid 41 and name HD* resid 46 and name HG2 5.44 3.64 0.00" 293 1 293 86 parsed_6gw7 1
289 "assign resid 46 and name HG2 resid 46 and name HE* 3.83 2.03 0.00" 294 1 294 86 parsed_6gw7 1
290 "assign resid 46 and name HA resid 46 and name HG1 3.84 2.04 0.00" 295 1 295 86 parsed_6gw7 1
291 "assign resid 41 and name HD* resid 46 and name HG1 5.50 3.70 0.00" 296 1 296 86 parsed_6gw7 1
292 "assign resid 46 and name HG1 resid 46 and name HE* 3.70 1.90 0.00" 297 1 297 86 parsed_6gw7 1
293 "assign resid 18 and name HA resid 18 and name HD1* 4.19 2.39 0.00" 298 1 298 86 parsed_6gw7 1
294 "assign resid 18 and name HD1* resid 41 and name HE* 4.58 2.78 0.00" 299 1 299 86 parsed_6gw7 1
295 "assign resid 31 and name HD* resid 38 and name HD2* 4.42 2.62 0.00" 300 1 300 86 parsed_6gw7 1
296 "assign resid 38 and name HA resid 38 and name HD2* 3.41 1.61 0.00" 301 1 301 86 parsed_6gw7 1
297 "assign resid 31 and name HB1 resid 38 and name HD2* 3.60 1.80 0.00" 302 1 302 86 parsed_6gw7 1
298 "assign resid 31 and name HB2 resid 38 and name HD2* 3.49 1.69 0.00" 303 1 303 86 parsed_6gw7 1
299 "assign resid 38 and name HB2 resid 38 and name HD2* 3.38 1.58 0.00" 304 1 304 86 parsed_6gw7 1
300 "assign resid 31 and name HA resid 38 and name HD1* 3.10 1.30 0.00" 305 1 305 86 parsed_6gw7 1
301 "assign resid 56 and name HB* resid 56 and name HD2* 2.93 1.13 0.00" 306 1 306 86 parsed_6gw7 1
302 "assign resid 44 and name HB2 resid 44 and name HD2* 3.25 1.45 0.00" 307 1 307 86 parsed_6gw7 1
303 "assign resid 23 and name HG2 resid 23 and name HE* 3.99 2.19 0.00" 308 1 308 86 parsed_6gw7 1
304 "assign resid 23 and name HA resid 23 and name HG2 3.58 1.78 0.00" 309 1 309 86 parsed_6gw7 1
305 "assign resid 37 and name HA resid 37 and name HG2 3.77 1.97 0.00" 310 1 310 86 parsed_6gw7 1
306 "assign resid 37 and name HG2 resid 37 and name HE2 4.16 2.36 0.00" 311 1 311 86 parsed_6gw7 1
307 "assign resid 31 and name HD* resid 39 and name HD1* 4.98 3.18 0.00" 312 1 312 86 parsed_6gw7 1
308 "assign resid 39 and name HB2 resid 39 and name HD1* 3.40 1.60 0.00" 313 1 313 86 parsed_6gw7 1
309 "assign resid 38 and name HB1 resid 38 and name HD1* 2.92 1.12 0.00" 314 1 314 86 parsed_6gw7 1
310 "assign resid 2 and name HA resid 2 and name HD1* 4.18 2.38 0.00" 315 1 315 86 parsed_6gw7 1
311 "assign resid 33 and name HG2 resid 33 and name HE2 4.05 2.25 0.00" 316 1 316 86 parsed_6gw7 1
312 "assign resid 33 and name HG1 resid 34 and name HE* 5.19 3.39 0.00" 317 1 317 86 parsed_6gw7 1
313 "assign resid 33 and name HG1 resid 34 and name HD* 5.23 3.43 0.00" 318 1 318 86 parsed_6gw7 1
314 "assign resid 33 and name HG2 resid 33 and name HE1 3.59 1.79 0.00" 319 1 319 86 parsed_6gw7 1
315 "assign resid 18 and name HD2* resid 41 and name HE* 4.48 2.68 0.00" 320 1 320 86 parsed_6gw7 1
316 "assign resid 17 and name HD* resid 18 and name HD2* 4.31 2.51 0.00" 321 1 321 86 parsed_6gw7 1
317 "assign resid 18 and name HA resid 18 and name HD2* 3.20 1.40 0.00" 322 1 322 86 parsed_6gw7 1
318 "assign resid 18 and name HB1 resid 18 and name HD2* 3.72 1.92 0.00" 323 1 323 86 parsed_6gw7 1
319 "assign resid 44 and name HA resid 44 and name HD1* 2.84 1.04 0.00" 324 1 324 86 parsed_6gw7 1
320 "assign resid 18 and name HD2* resid 21 and name HB2 5.05 3.25 0.00" 325 1 325 86 parsed_6gw7 1
321 "assign resid 18 and name HD2* resid 46 and name HB2 4.29 2.49 0.00" 326 1 326 86 parsed_6gw7 1
322 "assign resid 27 and name HD* resid 54 and name HG* 3.78 1.98 0.00" 327 1 327 86 parsed_6gw7 1
323 "assign resid 49 and name HG* resid 54 and name HG* 3.70 1.90 0.00" 328 1 328 86 parsed_6gw7 1
324 "assign resid 44 and name HB2 resid 44 and name HD1* 2.92 1.12 0.00" 329 1 329 86 parsed_6gw7 1
325 "assign resid 48 and name HB2 resid 55 and name HG2* 3.65 1.85 0.00" 330 1 330 86 parsed_6gw7 1
326 "assign resid 48 and name HB1 resid 55 and name HG2* 3.72 1.92 0.00" 331 1 331 86 parsed_6gw7 1
327 "assign resid 48 and name HD* resid 55 and name HG2* 3.98 2.18 0.00" 332 1 332 86 parsed_6gw7 1
328 "assign resid 48 and name HG2 resid 55 and name HG2* 5.50 3.70 0.00" 333 1 333 86 parsed_6gw7 1
329 "assign resid 55 and name HA resid 55 and name HG2* 3.85 2.05 0.00" 334 1 334 86 parsed_6gw7 1
330 "assign resid 27 and name HB2 resid 30 and name HB* 5.35 3.55 0.00" 335 1 335 86 parsed_6gw7 1
331 "assign resid 30 and name HB* resid 33 and name HB1 4.96 3.16 0.00" 336 1 336 86 parsed_6gw7 1
332 "assign resid 48 and name HE* resid 57 and name HB* 4.67 2.87 0.00" 337 1 337 86 parsed_6gw7 1
333 "assign resid 47 and name HG2* resid 56 and name HA 3.64 1.84 0.00" 338 1 338 86 parsed_6gw7 1
334 "assign resid 47 and name HG2* resid 47 and name HG12 4.08 2.28 0.00" 339 1 339 86 parsed_6gw7 1
335 "assign resid 20 and name HD* resid 30 and name HB* 4.26 2.46 0.00" 340 1 340 86 parsed_6gw7 1
336 "assign resid 30 and name HB* resid 31 and name HA 5.15 3.35 0.00" 341 1 341 86 parsed_6gw7 1
337 "assign resid 17 and name HE* resid 30 and name HB* 4.97 3.17 0.00" 342 1 342 86 parsed_6gw7 1
338 "assign resid 30 and name HB* resid 31 and name HB1 5.27 3.47 0.00" 343 1 343 86 parsed_6gw7 1
339 "assign resid 29 and name HB2 resid 30 and name HB* 4.21 2.41 0.00" 344 1 344 86 parsed_6gw7 1
340 "assign resid 30 and name HB* resid 38 and name HD1* 3.43 1.63 0.00" 345 1 345 86 parsed_6gw7 1
341 "assign resid 21 and name HB1 resid 22 and name HB* 5.25 3.45 0.00" 346 1 346 86 parsed_6gw7 1
342 "assign resid 19 and name HA resid 22 and name HB* 3.50 1.70 0.00" 347 1 347 86 parsed_6gw7 1
343 "assign resid 22 and name HB* resid 56 and name HD2* 3.51 1.71 0.00" 348 1 348 86 parsed_6gw7 1
344 "assign resid 27 and name HB1 resid 53 and name HG2* 3.96 2.16 0.00" 349 1 349 86 parsed_6gw7 1
345 "assign resid 26 and name HB2 resid 53 and name HG2* 5.50 3.70 0.00" 350 1 350 86 parsed_6gw7 1
346 "assign resid 52 and name HB1 resid 53 and name HG2* 4.64 2.84 0.00" 351 1 351 86 parsed_6gw7 1
347 "assign resid 53 and name HG2* resid 53 and name HG1* 3.77 1.97 0.00" 352 1 352 86 parsed_6gw7 1
348 "assign resid 50 and name HG2* resid 51 and name HB1 4.18 2.38 0.00" 353 1 353 86 parsed_6gw7 1
349 "assign resid 50 and name HG2* resid 54 and name HA 5.50 3.70 0.00" 354 1 354 86 parsed_6gw7 1
350 "assign resid 41 and name HB1 resid 47 and name HD1* 4.07 2.27 0.00" 355 1 355 86 parsed_6gw7 1
351 "assign resid 41 and name HB2 resid 47 and name HD1* 4.14 2.34 0.00" 356 1 356 86 parsed_6gw7 1
352 "assign resid 42 and name HB2 resid 47 and name HD1* 4.08 2.28 0.00" 357 1 357 86 parsed_6gw7 1
353 "assign resid 38 and name HG resid 47 and name HD1* 4.69 2.89 0.00" 358 1 358 86 parsed_6gw7 1
354 "assign resid 47 and name HA resid 47 and name HD1* 4.60 2.80 0.00" 359 1 359 86 parsed_6gw7 1
355 "assign resid 47 and name HD1* resid 48 and name HA 4.96 3.16 0.00" 360 1 360 86 parsed_6gw7 1
356 "assign resid 47 and name HB resid 47 and name HD1* 3.49 1.69 0.00" 361 1 361 86 parsed_6gw7 1
357 "assign resid 47 and name HG2* resid 47 and name HD1* 2.76 0.96 0.00" 362 1 362 86 parsed_6gw7 1
358 "assign resid 50 and name HA resid 50 and name HD1* 4.02 2.22 0.00" 363 1 363 86 parsed_6gw7 1
359 "assign resid 24 and name HB1 resid 53 and name HD1* 4.35 2.55 0.00" 364 1 364 86 parsed_6gw7 1
360 "assign resid 53 and name HA resid 53 and name HD1* 4.52 2.72 0.00" 365 1 365 86 parsed_6gw7 1
361 "assign resid 53 and name HB resid 53 and name HD1* 3.85 2.05 0.00" 366 1 366 86 parsed_6gw7 1
362 "assign resid 50 and name HB resid 50 and name HD1* 3.81 2.01 0.00" 367 1 367 86 parsed_6gw7 1
363 "assign resid 24 and name HB2 resid 53 and name HD1* 4.37 2.57 0.00" 368 1 368 86 parsed_6gw7 1
364 "assign resid 49 and name HG* resid 50 and name HN 4.75 2.95 0.00" 369 1 369 86 parsed_6gw7 1
365 "assign resid 50 and name HN resid 50 and name HG2* 5.19 3.39 0.00" 370 1 370 86 parsed_6gw7 1
366 "assign resid 27 and name HN resid 53 and name HA 4.62 2.82 0.00" 371 1 371 86 parsed_6gw7 1
367 "assign resid 26 and name HB1 resid 27 and name HN 5.17 3.37 0.00" 372 1 372 86 parsed_6gw7 1
368 "assign resid 27 and name HN resid 53 and name HG2* 5.41 3.61 0.00" 373 1 373 86 parsed_6gw7 1
369 "assign resid 2 and name HN resid 2 and name HG 4.86 3.06 0.00" 374 1 374 86 parsed_6gw7 1
370 "assign resid 50 and name HG2* resid 51 and name HN 4.86 3.06 0.00" 375 1 375 86 parsed_6gw7 1
371 "assign resid 35 and name HN resid 36 and name HN 4.72 2.92 0.00" 376 1 376 86 parsed_6gw7 1
372 "assign resid 35 and name HA2 resid 36 and name HN 3.30 1.50 0.00" 377 1 377 86 parsed_6gw7 1
373 "assign resid 36 and name HN resid 36 and name HB2 3.94 2.14 0.00" 378 1 378 86 parsed_6gw7 1
374 "assign resid 36 and name HN resid 36 and name HB1 3.61 1.81 0.00" 379 1 379 86 parsed_6gw7 1
375 "assign resid 48 and name HN resid 57 and name HN 4.69 2.89 0.00" 380 1 380 86 parsed_6gw7 1
376 "assign resid 56 and name HN resid 57 and name HN 4.97 3.17 0.00" 381 1 381 86 parsed_6gw7 1
377 "assign resid 47 and name HA resid 57 and name HN 3.86 2.06 0.00" 382 1 382 86 parsed_6gw7 1
378 "assign resid 56 and name HA resid 57 and name HN 3.32 1.52 0.00" 383 1 383 86 parsed_6gw7 1
379 "assign resid 56 and name HB2 resid 57 and name HN 3.92 2.12 0.00" 384 1 384 86 parsed_6gw7 1
380 "assign resid 57 and name HN resid 57 and name HB* 3.72 1.92 0.00" 385 1 385 86 parsed_6gw7 1
381 "assign resid 47 and name HG2* resid 57 and name HN 4.07 2.27 0.00" 386 1 386 86 parsed_6gw7 1
382 "assign resid 47 and name HB resid 57 and name HN 5.34 3.54 0.00" 387 1 387 86 parsed_6gw7 1
383 "assign resid 40 and name HA resid 43 and name HN 4.88 3.08 0.00" 388 1 388 86 parsed_6gw7 1
384 "assign resid 42 and name HB1 resid 43 and name HN 4.25 2.45 0.00" 389 1 389 86 parsed_6gw7 1
385 "assign resid 42 and name HB2 resid 43 and name HN 4.11 2.31 0.00" 390 1 390 86 parsed_6gw7 1
386 "assign resid 43 and name HN resid 43 and name HB2 3.53 1.73 0.00" 391 1 391 86 parsed_6gw7 1
387 "assign resid 43 and name HN resid 43 and name HG 3.76 1.96 0.00" 392 1 392 86 parsed_6gw7 1
388 "assign resid 43 and name HN resid 43 and name HB1 3.68 1.88 0.00" 393 1 393 86 parsed_6gw7 1
389 "assign resid 43 and name HN resid 43 and name HD* 4.20 2.40 0.00" 394 1 394 86 parsed_6gw7 1
390 "assign resid 15 and name HB2 resid 16 and name HN 4.65 2.85 0.00" 395 1 395 86 parsed_6gw7 1
391 "assign resid 15 and name HB1 resid 16 and name HN 4.22 2.42 0.00" 396 1 396 86 parsed_6gw7 1
392 "assign resid 16 and name HN resid 16 and name HG2 4.73 2.93 0.00" 397 1 397 86 parsed_6gw7 1
393 "assign resid 15 and name HA resid 16 and name HN 3.51 1.71 0.00" 398 1 398 86 parsed_6gw7 1
394 "assign resid 16 and name HN resid 16 and name HB2 3.41 1.61 0.00" 399 1 399 86 parsed_6gw7 1
395 "assign resid 42 and name HN resid 43 and name HN 4.10 2.30 0.00" 400 1 400 86 parsed_6gw7 1
396 "assign resid 41 and name HB1 resid 42 and name HN 4.18 2.38 0.00" 401 1 401 86 parsed_6gw7 1
397 "assign resid 40 and name HG* resid 42 and name HN 4.16 2.36 0.00" 402 1 402 86 parsed_6gw7 1
398 "assign resid 42 and name HN resid 42 and name HB1 3.57 1.77 0.00" 403 1 403 86 parsed_6gw7 1
399 "assign resid 42 and name HN resid 42 and name HB2 3.28 1.48 0.00" 404 1 404 86 parsed_6gw7 1
400 "assign resid 42 and name HN resid 47 and name HG12 5.12 3.32 0.00" 405 1 405 86 parsed_6gw7 1
401 "assign resid 42 and name HN resid 47 and name HD1* 4.53 2.73 0.00" 406 1 406 86 parsed_6gw7 1
402 "assign resid 41 and name HD* resid 42 and name HN 5.10 3.30 0.00" 407 1 407 86 parsed_6gw7 1
403 "assign resid 28 and name HG1 resid 30 and name HN 5.10 3.30 0.00" 408 1 408 86 parsed_6gw7 1
404 "assign resid 30 and name HN resid 38 and name HD1* 5.40 3.60 0.00" 409 1 409 86 parsed_6gw7 1
405 "assign resid 42 and name HN resid 44 and name HN 5.17 3.37 0.00" 410 1 410 86 parsed_6gw7 1
406 "assign resid 40 and name HA resid 42 and name HN 5.48 3.68 0.00" 411 1 411 86 parsed_6gw7 1
407 "assign resid 29 and name HB2 resid 30 and name HN 3.97 2.17 0.00" 412 1 412 86 parsed_6gw7 1
408 "assign resid 30 and name HN resid 30 and name HB* 3.78 1.98 0.00" 413 1 413 86 parsed_6gw7 1
409 "assign resid 10 and name HN resid 10 and name HG1 4.04 2.24 0.00" 414 1 414 86 parsed_6gw7 1
410 "assign resid 8 and name HN resid 8 and name HB1 2.84 1.04 0.00" 415 1 415 86 parsed_6gw7 1
411 "assign resid 7 and name HD2* resid 8 and name HN 4.62 2.82 0.00" 416 1 416 86 parsed_6gw7 1
412 "assign resid 48 and name HN resid 49 and name HN 5.27 3.47 0.00" 417 1 417 86 parsed_6gw7 1
413 "assign resid 48 and name HA resid 49 and name HN 3.42 1.62 0.00" 418 1 418 86 parsed_6gw7 1
414 "assign resid 49 and name HN resid 49 and name HD2 5.50 3.70 0.00" 419 1 419 86 parsed_6gw7 1
415 "assign resid 48 and name HB2 resid 49 and name HN 3.49 1.69 0.00" 420 1 420 86 parsed_6gw7 1
416 "assign resid 49 and name HN resid 49 and name HB2 3.66 1.86 0.00" 421 1 421 86 parsed_6gw7 1
417 "assign resid 48 and name HG2 resid 49 and name HN 5.23 3.43 0.00" 422 1 422 86 parsed_6gw7 1
418 "assign resid 55 and name HB resid 56 and name HN 3.93 2.13 0.00" 423 1 423 86 parsed_6gw7 1
419 "assign resid 56 and name HN resid 56 and name HG 3.50 1.70 0.00" 424 1 424 86 parsed_6gw7 1
420 "assign resid 56 and name HN resid 56 and name HD2* 4.03 2.23 0.00" 425 1 425 86 parsed_6gw7 1
421 "assign resid 6 and name HB2 resid 7 and name HN 3.72 1.92 0.00" 426 1 426 86 parsed_6gw7 1
422 "assign resid 7 and name HN resid 7 and name HB* 2.77 0.97 0.00" 427 1 427 86 parsed_6gw7 1
423 "assign resid 7 and name HN resid 7 and name HD2* 4.01 2.21 0.00" 428 1 428 86 parsed_6gw7 1
424 "assign resid 2 and name HD2* resid 3 and name HN 4.26 2.46 0.00" 429 1 429 86 parsed_6gw7 1
425 "assign resid 54 and name HN resid 54 and name HG2* 4.29 2.49 0.00" 430 1 430 86 parsed_6gw7 1
426 "assign resid 53 and name HB resid 54 and name HN 3.57 1.77 0.00" 431 1 431 86 parsed_6gw7 1
427 "assign resid 53 and name HD1* resid 54 and name HN 4.38 2.58 0.00" 432 1 432 86 parsed_6gw7 1
428 "assign resid 13 and name HA resid 14 and name HN 3.00 1.20 0.00" 433 1 433 86 parsed_6gw7 1
429 "assign resid 14 and name HN resid 14 and name HG* 3.66 1.86 0.00" 434 1 434 86 parsed_6gw7 1
430 "assign resid 13 and name HB* resid 14 and name HN 2.91 1.11 0.00" 435 1 435 86 parsed_6gw7 1
431 "assign resid 27 and name HB2 resid 54 and name HN 5.03 3.23 0.00" 436 1 436 86 parsed_6gw7 1
432 "assign resid 14 and name HN resid 16 and name HN 4.67 2.87 0.00" 437 1 437 86 parsed_6gw7 1
433 "assign resid 3 and name HN resid 3 and name HB1 3.01 1.21 0.00" 438 1 438 86 parsed_6gw7 1
434 "assign resid 2 and name HG resid 3 and name HN 3.58 1.78 0.00" 439 1 439 86 parsed_6gw7 1
435 "assign resid 27 and name HB1 resid 54 and name HN 5.16 3.36 0.00" 440 1 440 86 parsed_6gw7 1
436 "assign resid 9 and name HN resid 11 and name HD1 5.24 3.44 0.00" 441 1 441 86 parsed_6gw7 1
437 "assign resid 9 and name HN resid 9 and name HG* 3.43 1.63 0.00" 442 1 442 86 parsed_6gw7 1
438 "assign resid 9 and name HN resid 9 and name HA 2.88 1.08 0.00" 443 1 443 86 parsed_6gw7 1
439 "assign resid 9 and name HN resid 9 and name HB1 2.98 1.18 0.00" 444 1 444 86 parsed_6gw7 1
440 "assign resid 5 and name HN resid 6 and name HN 4.57 2.77 0.00" 445 1 445 86 parsed_6gw7 1
441 "assign resid 13 and name HA resid 15 and name HN 4.96 3.16 0.00" 446 1 446 86 parsed_6gw7 1
442 "assign resid 15 and name HN resid 18 and name HD1* 5.50 3.70 0.00" 447 1 447 86 parsed_6gw7 1
443 "assign resid 5 and name HN resid 5 and name HD* 3.69 1.89 0.00" 448 1 448 86 parsed_6gw7 1
444 "assign resid 4 and name HA resid 5 and name HN 2.81 1.01 0.00" 449 1 449 86 parsed_6gw7 1
445 "assign resid 5 and name HN resid 5 and name HB2 3.10 1.30 0.00" 450 1 450 86 parsed_6gw7 1
446 "assign resid 4 and name HB* resid 5 and name HN 3.81 2.01 0.00" 451 1 451 86 parsed_6gw7 1
447 "assign resid 5 and name HN resid 7 and name HD2* 5.12 3.32 0.00" 452 1 452 86 parsed_6gw7 1
448 "assign resid 5 and name HN resid 7 and name HB* 4.27 2.47 0.00" 453 1 453 86 parsed_6gw7 1
449 "assign resid 35 and name HN resid 37 and name HN 4.43 2.63 0.00" 454 1 454 86 parsed_6gw7 1
450 "assign resid 36 and name HN resid 37 and name HN 3.69 1.89 0.00" 455 1 455 86 parsed_6gw7 1
451 "assign resid 37 and name HN resid 38 and name HN 3.82 2.02 0.00" 456 1 456 86 parsed_6gw7 1
452 "assign resid 37 and name HN resid 37 and name HB2 3.19 1.39 0.00" 457 1 457 86 parsed_6gw7 1
453 "assign resid 37 and name HN resid 37 and name HB1 3.21 1.41 0.00" 458 1 458 86 parsed_6gw7 1
454 "assign resid 21 and name HB1 resid 22 and name HN 4.49 2.69 0.00" 459 1 459 86 parsed_6gw7 1
455 "assign resid 14 and name HA resid 15 and name HN 3.49 1.69 0.00" 460 1 460 86 parsed_6gw7 1
456 "assign resid 15 and name HN resid 15 and name HB2 3.87 2.07 0.00" 461 1 461 86 parsed_6gw7 1
457 "assign resid 15 and name HN resid 15 and name HB1 3.34 1.54 0.00" 462 1 462 86 parsed_6gw7 1
458 "assign resid 14 and name HG* resid 15 and name HN 4.64 2.84 0.00" 463 1 463 86 parsed_6gw7 1
459 "assign resid 14 and name HB1 resid 15 and name HN 4.00 2.20 0.00" 464 1 464 86 parsed_6gw7 1
460 "assign resid 16 and name HN resid 17 and name HN 3.68 1.88 0.00" 465 1 465 86 parsed_6gw7 1
461 "assign resid 16 and name HB2 resid 17 and name HN 3.98 2.18 0.00" 466 1 466 86 parsed_6gw7 1
462 "assign resid 14 and name HN resid 17 and name HN 4.48 2.68 0.00" 467 1 467 86 parsed_6gw7 1
463 "assign resid 17 and name HN resid 17 and name HB1 2.95 1.15 0.00" 468 1 468 86 parsed_6gw7 1
464 "assign resid 30 and name HA resid 32 and name HN 5.50 3.70 0.00" 469 1 469 86 parsed_6gw7 1
465 "assign resid 32 and name HN resid 32 and name HG 3.08 1.28 0.00" 470 1 470 86 parsed_6gw7 1
466 "assign resid 31 and name HN resid 32 and name HN 3.56 1.76 0.00" 471 1 471 86 parsed_6gw7 1
467 "assign resid 32 and name HN resid 34 and name HN 4.67 2.87 0.00" 472 1 472 86 parsed_6gw7 1
468 "assign resid 31 and name HB2 resid 32 and name HN 3.80 2.00 0.00" 473 1 473 86 parsed_6gw7 1
469 "assign resid 31 and name HB1 resid 32 and name HN 4.09 2.29 0.00" 474 1 474 86 parsed_6gw7 1
470 "assign resid 32 and name HN resid 32 and name HB1 3.70 1.90 0.00" 475 1 475 86 parsed_6gw7 1
471 "assign resid 32 and name HN resid 38 and name HD2* 5.50 3.70 0.00" 476 1 476 86 parsed_6gw7 1
472 "assign resid 22 and name HN resid 23 and name HN 3.52 1.72 0.00" 477 1 477 86 parsed_6gw7 1
473 "assign resid 22 and name HN resid 22 and name HB* 3.05 1.25 0.00" 478 1 478 86 parsed_6gw7 1
474 "assign resid 22 and name HN resid 56 and name HD2* 3.88 2.08 0.00" 479 1 479 86 parsed_6gw7 1
475 "assign resid 21 and name HB2 resid 22 and name HN 4.53 2.73 0.00" 480 1 480 86 parsed_6gw7 1
476 "assign resid 14 and name HA resid 17 and name HN 3.13 1.33 0.00" 481 1 481 86 parsed_6gw7 1
477 "assign resid 3 and name HD* resid 4 and name HN 3.46 1.66 0.00" 482 1 482 86 parsed_6gw7 1
478 "assign resid 17 and name HN resid 34 and name HD* 4.92 3.12 0.00" 483 1 483 86 parsed_6gw7 1
479 "assign resid 16 and name HN resid 18 and name HN 5.38 3.58 0.00" 484 1 484 86 parsed_6gw7 1
480 "assign resid 14 and name HA resid 18 and name HN 5.01 3.21 0.00" 485 1 485 86 parsed_6gw7 1
481 "assign resid 18 and name HN resid 19 and name HB* 5.01 3.21 0.00" 486 1 486 86 parsed_6gw7 1
482 "assign resid 18 and name HN resid 18 and name HB2 3.65 1.85 0.00" 487 1 487 86 parsed_6gw7 1
483 "assign resid 18 and name HN resid 18 and name HB1 3.88 2.08 0.00" 488 1 488 86 parsed_6gw7 1
484 "assign resid 18 and name HN resid 18 and name HD1* 4.53 2.73 0.00" 489 1 489 86 parsed_6gw7 1
485 "assign resid 18 and name HN resid 18 and name HD2* 4.53 2.73 0.00" 490 1 490 86 parsed_6gw7 1
486 "assign resid 15 and name HA resid 18 and name HN 4.82 3.02 0.00" 491 1 491 86 parsed_6gw7 1
487 "assign resid 20 and name HN resid 22 and name HB* 5.50 3.70 0.00" 492 1 492 86 parsed_6gw7 1
488 "assign resid 19 and name HN resid 20 and name HN 3.85 2.05 0.00" 493 1 493 86 parsed_6gw7 1
489 "assign resid 20 and name HN resid 20 and name HD* 4.40 2.60 0.00" 494 1 494 86 parsed_6gw7 1
490 "assign resid 20 and name HN resid 20 and name HB2 3.49 1.69 0.00" 495 1 495 86 parsed_6gw7 1
491 "assign resid 19 and name HB* resid 20 and name HN 3.68 1.88 0.00" 496 1 496 86 parsed_6gw7 1
492 "assign resid 30 and name HN resid 31 and name HN 4.09 2.29 0.00" 497 1 497 86 parsed_6gw7 1
493 "assign resid 31 and name HN resid 31 and name HB2 3.83 2.03 0.00" 498 1 498 86 parsed_6gw7 1
494 "assign resid 31 and name HN resid 31 and name HB1 3.78 1.98 0.00" 499 1 499 86 parsed_6gw7 1
495 "assign resid 30 and name HB* resid 31 and name HN 4.19 2.39 0.00" 500 1 500 86 parsed_6gw7 1
496 "assign resid 31 and name HN resid 38 and name HD1* 5.02 3.22 0.00" 501 1 501 86 parsed_6gw7 1
497 "assign resid 31 and name HN resid 38 and name HD2* 4.84 3.04 0.00" 502 1 502 86 parsed_6gw7 1
498 "assign resid 12 and name HN resid 13 and name HN 3.69 1.89 0.00" 503 1 503 86 parsed_6gw7 1
499 "assign resid 11 and name HD1 resid 12 and name HN 4.42 2.62 0.00" 504 1 504 86 parsed_6gw7 1
500 "assign resid 31 and name HN resid 32 and name HG 5.50 3.70 0.00" 505 1 505 86 parsed_6gw7 1
501 "assign resid 12 and name HA resid 13 and name HN 2.97 1.17 0.00" 506 1 506 86 parsed_6gw7 1
502 "assign resid 13 and name HN resid 13 and name HB* 2.89 1.09 0.00" 507 1 507 86 parsed_6gw7 1
503 "assign resid 13 and name HN resid 13 and name HG2 3.84 2.04 0.00" 508 1 508 86 parsed_6gw7 1
504 "assign resid 48 and name HN resid 55 and name HN 4.42 2.62 0.00" 509 1 509 86 parsed_6gw7 1
505 "assign resid 48 and name HN resid 56 and name HA 5.34 3.54 0.00" 510 1 510 86 parsed_6gw7 1
506 "assign resid 47 and name HB resid 48 and name HN 3.84 2.04 0.00" 511 1 511 86 parsed_6gw7 1
507 "assign resid 48 and name HN resid 48 and name HG2 4.63 2.83 0.00" 512 1 512 86 parsed_6gw7 1
508 "assign resid 47 and name HD1* resid 48 and name HN 5.04 3.24 0.00" 513 1 513 86 parsed_6gw7 1
509 "assign resid 47 and name HG11 resid 48 and name HN 4.08 2.28 0.00" 514 1 514 86 parsed_6gw7 1
510 "assign resid 48 and name HN resid 55 and name HG2* 5.20 3.40 0.00" 515 1 515 86 parsed_6gw7 1
511 "assign resid 6 and name HN resid 7 and name HB* 4.85 3.05 0.00" 516 1 516 86 parsed_6gw7 1
512 "assign resid 6 and name HN resid 7 and name HN 3.46 1.66 0.00" 517 1 517 86 parsed_6gw7 1
513 "assign resid 5 and name HD* resid 6 and name HN 4.64 2.84 0.00" 518 1 518 86 parsed_6gw7 1
514 "assign resid 5 and name HA resid 6 and name HN 3.06 1.26 0.00" 519 1 519 86 parsed_6gw7 1
515 "assign resid 6 and name HN resid 6 and name HB1 3.53 1.73 0.00" 520 1 520 86 parsed_6gw7 1
516 "assign resid 6 and name HN resid 7 and name HD2* 5.50 3.70 0.00" 521 1 521 86 parsed_6gw7 1
517 "assign resid 50 and name HN resid 53 and name HN 4.52 2.72 0.00" 522 1 522 86 parsed_6gw7 1
518 "assign resid 53 and name HN resid 54 and name HA 4.98 3.18 0.00" 523 1 523 86 parsed_6gw7 1
519 "assign resid 51 and name HB2 resid 53 and name HN 4.98 3.18 0.00" 524 1 524 86 parsed_6gw7 1
520 "assign resid 51 and name HB1 resid 53 and name HN 4.80 3.00 0.00" 525 1 525 86 parsed_6gw7 1
521 "assign resid 53 and name HN resid 53 and name HB 3.89 2.09 0.00" 526 1 526 86 parsed_6gw7 1
522 "assign resid 49 and name HG* resid 53 and name HN 3.75 1.95 0.00" 527 1 527 86 parsed_6gw7 1
523 "assign resid 53 and name HN resid 53 and name HG2* 4.12 2.32 0.00" 528 1 528 86 parsed_6gw7 1
524 "assign resid 40 and name HN resid 41 and name HN 3.68 1.88 0.00" 529 1 529 86 parsed_6gw7 1
525 "assign resid 39 and name HN resid 40 and name HN 3.60 1.80 0.00" 530 1 530 86 parsed_6gw7 1
526 "assign resid 36 and name HA resid 40 and name HN 4.76 2.96 0.00" 531 1 531 86 parsed_6gw7 1
527 "assign resid 40 and name HN resid 40 and name HB1 3.24 1.44 0.00" 532 1 532 86 parsed_6gw7 1
528 "assign resid 39 and name HB2 resid 40 and name HN 3.54 1.74 0.00" 533 1 533 86 parsed_6gw7 1
529 "assign resid 39 and name HB1 resid 40 and name HN 3.60 1.80 0.00" 534 1 534 86 parsed_6gw7 1
530 "assign resid 28 and name HN resid 29 and name HN 3.83 2.03 0.00" 535 1 535 86 parsed_6gw7 1
531 "assign resid 29 and name HN resid 30 and name HN 3.49 1.69 0.00" 536 1 536 86 parsed_6gw7 1
532 "assign resid 26 and name HB1 resid 29 and name HN 4.74 2.94 0.00" 537 1 537 86 parsed_6gw7 1
533 "assign resid 28 and name HG1 resid 29 and name HN 3.87 2.07 0.00" 538 1 538 86 parsed_6gw7 1
534 "assign resid 29 and name HN resid 29 and name HB2 3.09 1.29 0.00" 539 1 539 86 parsed_6gw7 1
535 "assign resid 29 and name HN resid 30 and name HB* 4.92 3.12 0.00" 540 1 540 86 parsed_6gw7 1
536 "assign resid 29 and name HN resid 32 and name HD* 5.22 3.42 0.00" 541 1 541 86 parsed_6gw7 1
537 "assign resid 15 and name HA resid 19 and name HN 5.12 3.32 0.00" 542 1 542 86 parsed_6gw7 1
538 "assign resid 16 and name HA resid 19 and name HN 3.91 2.11 0.00" 543 1 543 86 parsed_6gw7 1
539 "assign resid 19 and name HN resid 20 and name HB1 5.20 3.40 0.00" 544 1 544 86 parsed_6gw7 1
540 "assign resid 19 and name HN resid 19 and name HG2 3.66 1.86 0.00" 545 1 545 86 parsed_6gw7 1
541 "assign resid 19 and name HN resid 19 and name HB* 2.98 1.18 0.00" 546 1 546 86 parsed_6gw7 1
542 "assign resid 18 and name HB2 resid 19 and name HN 3.72 1.92 0.00" 547 1 547 86 parsed_6gw7 1
543 "assign resid 18 and name HB1 resid 19 and name HN 3.91 2.11 0.00" 548 1 548 86 parsed_6gw7 1
544 "assign resid 18 and name HD1* resid 19 and name HN 5.50 3.70 0.00" 549 1 549 86 parsed_6gw7 1
545 "assign resid 36 and name HA resid 38 and name HN 5.02 3.22 0.00" 550 1 550 86 parsed_6gw7 1
546 "assign resid 36 and name HN resid 38 and name HN 4.88 3.08 0.00" 551 1 551 86 parsed_6gw7 1
547 "assign resid 41 and name HN resid 41 and name HD* 4.16 2.36 0.00" 552 1 552 86 parsed_6gw7 1
548 "assign resid 41 and name HN resid 41 and name HB1 3.76 1.96 0.00" 553 1 553 86 parsed_6gw7 1
549 "assign resid 41 and name HN resid 41 and name HB2 3.99 2.19 0.00" 554 1 554 86 parsed_6gw7 1
550 "assign resid 41 and name HN resid 42 and name HB1 5.12 3.32 0.00" 555 1 555 86 parsed_6gw7 1
551 "assign resid 40 and name HB2 resid 41 and name HN 3.70 1.90 0.00" 556 1 556 86 parsed_6gw7 1
552 "assign resid 41 and name HN resid 47 and name HD1* 5.41 3.61 0.00" 557 1 557 86 parsed_6gw7 1
553 "assign resid 37 and name HG1 resid 38 and name HN 4.56 2.76 0.00" 558 1 558 86 parsed_6gw7 1
554 "assign resid 38 and name HN resid 39 and name HN 4.03 2.23 0.00" 559 1 559 86 parsed_6gw7 1
555 "assign resid 38 and name HN resid 38 and name HB2 3.66 1.86 0.00" 560 1 560 86 parsed_6gw7 1
556 "assign resid 38 and name HN resid 38 and name HB1 3.50 1.70 0.00" 561 1 561 86 parsed_6gw7 1
557 "assign resid 37 and name HB1 resid 38 and name HN 4.20 2.40 0.00" 562 1 562 86 parsed_6gw7 1
558 "assign resid 38 and name HN resid 38 and name HD2* 5.33 3.53 0.00" 563 1 563 86 parsed_6gw7 1
559 "assign resid 36 and name HA resid 39 and name HN 4.42 2.62 0.00" 564 1 564 86 parsed_6gw7 1
560 "assign resid 39 and name HN resid 39 and name HB2 4.14 2.34 0.00" 565 1 565 86 parsed_6gw7 1
561 "assign resid 39 and name HN resid 39 and name HG 3.90 2.10 0.00" 566 1 566 86 parsed_6gw7 1
562 "assign resid 38 and name HB1 resid 39 and name HN 4.67 2.87 0.00" 567 1 567 86 parsed_6gw7 1
563 "assign resid 39 and name HN resid 39 and name HD2* 4.62 2.82 0.00" 568 1 568 86 parsed_6gw7 1
564 "assign resid 54 and name HA resid 55 and name HN 3.55 1.75 0.00" 569 1 569 86 parsed_6gw7 1
565 "assign resid 54 and name HB resid 55 and name HN 4.80 3.00 0.00" 570 1 570 86 parsed_6gw7 1
566 "assign resid 55 and name HN resid 55 and name HG2* 4.42 2.62 0.00" 571 1 571 86 parsed_6gw7 1
567 "assign resid 27 and name HN resid 28 and name HN 4.21 2.41 0.00" 572 1 572 86 parsed_6gw7 1
568 "assign resid 28 and name HN resid 30 and name HN 5.31 3.51 0.00" 573 1 573 86 parsed_6gw7 1
569 "assign resid 27 and name HD* resid 28 and name HN 4.70 2.90 0.00" 574 1 574 86 parsed_6gw7 1
570 "assign resid 26 and name HB1 resid 28 and name HN 4.90 3.10 0.00" 575 1 575 86 parsed_6gw7 1
571 "assign resid 27 and name HB2 resid 28 and name HN 4.04 2.24 0.00" 576 1 576 86 parsed_6gw7 1
572 "assign resid 27 and name HB1 resid 28 and name HN 4.24 2.44 0.00" 577 1 577 86 parsed_6gw7 1
573 "assign resid 28 and name HN resid 28 and name HG1 4.54 2.74 0.00" 578 1 578 86 parsed_6gw7 1
574 "assign resid 28 and name HN resid 28 and name HB2 3.57 1.77 0.00" 579 1 579 86 parsed_6gw7 1
575 "assign resid 28 and name HN resid 30 and name HB* 5.50 3.70 0.00" 580 1 580 86 parsed_6gw7 1
576 "assign resid 28 and name HN resid 32 and name HD* 5.50 3.70 0.00" 581 1 581 86 parsed_6gw7 1
577 "assign resid 30 and name HA resid 33 and name HN 4.82 3.02 0.00" 582 1 582 86 parsed_6gw7 1
578 "assign resid 32 and name HB1 resid 33 and name HN 3.77 1.97 0.00" 583 1 583 86 parsed_6gw7 1
579 "assign resid 33 and name HN resid 34 and name HN 3.58 1.78 0.00" 584 1 584 86 parsed_6gw7 1
580 "assign resid 32 and name HN resid 33 and name HN 3.72 1.92 0.00" 585 1 585 86 parsed_6gw7 1
581 "assign resid 33 and name HN resid 34 and name HD* 5.41 3.61 0.00" 586 1 586 86 parsed_6gw7 1
582 "assign resid 32 and name HB2 resid 33 and name HN 3.85 2.05 0.00" 587 1 587 86 parsed_6gw7 1
583 "assign resid 33 and name HN resid 33 and name HB2 3.35 1.55 0.00" 588 1 588 86 parsed_6gw7 1
584 "assign resid 33 and name HN resid 33 and name HB1 3.53 1.73 0.00" 589 1 589 86 parsed_6gw7 1
585 "assign resid 33 and name HN resid 33 and name HG1 5.01 3.21 0.00" 590 1 590 86 parsed_6gw7 1
586 "assign resid 19 and name HN resid 21 and name HN 4.73 2.93 0.00" 591 1 591 86 parsed_6gw7 1
587 "assign resid 21 and name HN resid 22 and name HN 4.07 2.27 0.00" 592 1 592 86 parsed_6gw7 1
588 "assign resid 20 and name HD* resid 21 and name HN 4.16 2.36 0.00" 593 1 593 86 parsed_6gw7 1
589 "assign resid 17 and name HA resid 21 and name HN 4.56 2.76 0.00" 594 1 594 86 parsed_6gw7 1
590 "assign resid 20 and name HB1 resid 21 and name HN 3.71 1.91 0.00" 595 1 595 86 parsed_6gw7 1
591 "assign resid 21 and name HN resid 21 and name HB2 3.69 1.89 0.00" 596 1 596 86 parsed_6gw7 1
592 "assign resid 20 and name HN resid 21 and name HN 3.94 2.14 0.00" 597 1 597 86 parsed_6gw7 1
593 "assign resid 21 and name HN resid 21 and name HB1 3.86 2.06 0.00" 598 1 598 86 parsed_6gw7 1
594 "assign resid 21 and name HN resid 56 and name HD2* 4.98 3.18 0.00" 599 1 599 86 parsed_6gw7 1
595 "assign resid 57 and name HN resid 58 and name HN 4.99 3.19 0.00" 600 1 600 86 parsed_6gw7 1
596 "assign resid 56 and name HB2 resid 58 and name HN 5.34 3.54 0.00" 601 1 601 86 parsed_6gw7 1
597 "assign resid 57 and name HB* resid 58 and name HN 4.75 2.95 0.00" 602 1 602 86 parsed_6gw7 1
598 "assign resid 43 and name HN resid 44 and name HN 3.92 2.12 0.00" 603 1 603 86 parsed_6gw7 1
599 "assign resid 41 and name HA resid 44 and name HN 3.81 2.01 0.00" 604 1 604 86 parsed_6gw7 1
600 "assign resid 40 and name HA resid 44 and name HN 4.75 2.95 0.00" 605 1 605 86 parsed_6gw7 1
601 "assign resid 44 and name HN resid 44 and name HB2 3.45 1.65 0.00" 606 1 606 86 parsed_6gw7 1
602 "assign resid 44 and name HN resid 44 and name HB1 3.24 1.44 0.00" 607 1 607 86 parsed_6gw7 1
603 "assign resid 44 and name HN resid 44 and name HD1* 4.24 2.44 0.00" 608 1 608 86 parsed_6gw7 1
604 "assign resid 44 and name HN resid 44 and name HD2* 4.45 2.65 0.00" 609 1 609 86 parsed_6gw7 1
605 "assign resid 46 and name HN resid 47 and name HN 3.43 1.63 0.00" 610 1 610 86 parsed_6gw7 1
606 "assign resid 46 and name HN resid 46 and name HB2 4.02 2.22 0.00" 611 1 611 86 parsed_6gw7 1
607 "assign resid 46 and name HN resid 46 and name HB1 3.79 1.99 0.00" 612 1 612 86 parsed_6gw7 1
608 "assign resid 44 and name HB1 resid 46 and name HN 4.60 2.80 0.00" 613 1 613 86 parsed_6gw7 1
609 "assign resid 46 and name HN resid 46 and name HG1 3.81 2.01 0.00" 614 1 614 86 parsed_6gw7 1
610 "assign resid 46 and name HN resid 46 and name HE* 5.22 3.42 0.00" 615 1 615 86 parsed_6gw7 1
611 "assign resid 46 and name HN resid 47 and name HG2* 4.91 3.11 0.00" 616 1 616 86 parsed_6gw7 1
612 "assign resid 23 and name HN resid 24 and name HN 3.56 1.76 0.00" 617 1 617 86 parsed_6gw7 1
613 "assign resid 24 and name HN resid 25 and name HD2 3.95 2.15 0.00" 618 1 618 86 parsed_6gw7 1
614 "assign resid 24 and name HN resid 25 and name HD1 4.02 2.22 0.00" 619 1 619 86 parsed_6gw7 1
615 "assign resid 23 and name HB2 resid 24 and name HN 4.59 2.79 0.00" 620 1 620 86 parsed_6gw7 1
616 "assign resid 23 and name HG2 resid 24 and name HN 4.35 2.55 0.00" 621 1 621 86 parsed_6gw7 1
617 "assign resid 22 and name HA resid 24 and name HN 5.05 3.25 0.00" 622 1 622 86 parsed_6gw7 1
618 "assign resid 23 and name HB1 resid 24 and name HN 4.68 2.88 0.00" 623 1 623 86 parsed_6gw7 1
619 "assign resid 24 and name HN resid 53 and name HD1* 5.00 3.20 0.00" 624 1 624 86 parsed_6gw7 1
620 "assign resid 23 and name HN resid 23 and name HB2 3.90 2.10 0.00" 625 1 625 86 parsed_6gw7 1
621 "assign resid 23 and name HN resid 23 and name HB1 3.41 1.61 0.00" 626 1 626 86 parsed_6gw7 1
622 "assign resid 22 and name HB* resid 23 and name HN 3.61 1.81 0.00" 627 1 627 86 parsed_6gw7 1
623 "assign resid 23 and name HN resid 24 and name HA 4.76 2.96 0.00" 628 1 628 86 parsed_6gw7 1
624 "assign resid 34 and name HN resid 34 and name HD* 4.05 2.25 0.00" 629 1 629 86 parsed_6gw7 1
625 "assign resid 30 and name HA resid 34 and name HN 5.24 3.44 0.00" 630 1 630 86 parsed_6gw7 1
626 "assign resid 31 and name HA resid 34 and name HN 4.52 2.72 0.00" 631 1 631 86 parsed_6gw7 1
627 "assign resid 34 and name HN resid 34 and name HB1 3.87 2.07 0.00" 632 1 632 86 parsed_6gw7 1
628 "assign resid 33 and name HB2 resid 34 and name HN 4.23 2.43 0.00" 633 1 633 86 parsed_6gw7 1
629 "assign resid 33 and name HB1 resid 34 and name HN 4.06 2.26 0.00" 634 1 634 86 parsed_6gw7 1
630 "assign resid 33 and name HG2 resid 34 and name HN 5.01 3.21 0.00" 635 1 635 86 parsed_6gw7 1
631 "assign resid 34 and name HN resid 34 and name HE* 5.38 3.58 0.00" 636 1 636 86 parsed_6gw7 1
632 "assign resid 30 and name HB* resid 34 and name HN 5.24 3.44 0.00" 637 1 637 86 parsed_6gw7 1
633 "assign resid 25 and name HA resid 26 and name HN 3.34 1.54 0.00" 638 1 638 86 parsed_6gw7 1
634 "assign resid 26 and name HN resid 26 and name HB2 3.80 2.00 0.00" 639 1 639 86 parsed_6gw7 1
635 "assign resid 26 and name HN resid 28 and name HG1 5.07 3.27 0.00" 640 1 640 86 parsed_6gw7 1
636 "assign resid 25 and name HB2 resid 26 and name HN 3.79 1.99 0.00" 641 1 641 86 parsed_6gw7 1
637 "assign resid 25 and name HB1 resid 26 and name HN 4.68 2.88 0.00" 642 1 642 86 parsed_6gw7 1
638 "assign resid 26 and name HN resid 53 and name HG2* 5.50 3.70 0.00" 643 1 643 86 parsed_6gw7 1
639 "assign resid 33 and name HN resid 35 and name HN 4.98 3.18 0.00" 644 1 644 86 parsed_6gw7 1
640 "assign resid 31 and name HA resid 35 and name HN 3.72 1.92 0.00" 645 1 645 86 parsed_6gw7 1
641 "assign resid 34 and name HB1 resid 35 and name HN 4.58 2.78 0.00" 646 1 646 86 parsed_6gw7 1
642 "assign resid 35 and name HN resid 38 and name HB1 4.96 3.16 0.00" 647 1 647 86 parsed_6gw7 1
643 "assign resid 42 and name HA resid 47 and name HN 4.33 2.53 0.00" 648 1 648 86 parsed_6gw7 1
644 "assign resid 46 and name HB2 resid 47 and name HN 5.07 3.27 0.00" 649 1 649 86 parsed_6gw7 1
645 "assign resid 46 and name HB1 resid 47 and name HN 4.59 2.79 0.00" 650 1 650 86 parsed_6gw7 1
646 "assign resid 47 and name HN resid 47 and name HG12 4.55 2.75 0.00" 651 1 651 86 parsed_6gw7 1
647 "assign resid 47 and name HN resid 47 and name HD1* 5.25 3.45 0.00" 652 1 652 86 parsed_6gw7 1
648 "assign resid 47 and name HN resid 47 and name HG2* 4.21 2.41 0.00" 653 1 653 86 parsed_6gw7 1
649 "assign resid 47 and name HN resid 48 and name HN 5.25 3.45 0.00" 654 1 654 86 parsed_6gw7 1
650 "assign resid 43 and name HN resid 45 and name HN 5.14 3.34 0.00" 655 1 655 86 parsed_6gw7 1
651 "assign resid 44 and name HN resid 45 and name HN 3.91 2.11 0.00" 656 1 656 86 parsed_6gw7 1
652 "assign resid 45 and name HN resid 47 and name HN 4.52 2.72 0.00" 657 1 657 86 parsed_6gw7 1
653 "assign resid 44 and name HB2 resid 45 and name HN 4.97 3.17 0.00" 658 1 658 86 parsed_6gw7 1
654 "assign resid 44 and name HB1 resid 45 and name HN 4.11 2.31 0.00" 659 1 659 86 parsed_6gw7 1
655 "assign resid 44 and name HD1* resid 45 and name HN 4.65 2.85 0.00" 660 1 660 86 parsed_6gw7 1
656 "assign resid 44 and name HD2* resid 45 and name HN 5.50 3.70 0.00" 661 1 661 86 parsed_6gw7 1
657 "assign resid 20 and name HA resid 20 and name HD* 3.16 1.36 0.00" 662 1 662 86 parsed_6gw7 1
658 "assign resid 5 and name HA resid 5 and name HD* 2.89 1.09 0.00" 663 1 663 86 parsed_6gw7 1
659 "assign resid 3 and name HD* resid 5 and name HD* 3.80 2.00 0.00" 664 1 664 86 parsed_6gw7 1
660 "assign resid 5 and name HD* resid 7 and name HD1* 3.50 1.70 0.00" 665 1 665 86 parsed_6gw7 1
661 "assign resid 31 and name HA resid 31 and name HD* 2.78 0.98 0.00" 666 1 666 86 parsed_6gw7 1
662 "assign resid 31 and name HD* resid 38 and name HB2 3.57 1.77 0.00" 667 1 667 86 parsed_6gw7 1
663 "assign resid 31 and name HD* resid 39 and name HG 3.66 1.86 0.00" 668 1 668 86 parsed_6gw7 1
664 "assign resid 31 and name HD* resid 38 and name HB1 3.54 1.74 0.00" 669 1 669 86 parsed_6gw7 1
665 "assign resid 31 and name HD* resid 32 and name HD* 3.08 1.28 0.00" 670 1 670 86 parsed_6gw7 1
666 "assign resid 31 and name HD* resid 36 and name HA 4.22 2.42 0.00" 671 1 671 86 parsed_6gw7 1
667 "assign resid 27 and name HD* resid 49 and name HG* 3.38 1.58 0.00" 672 1 672 86 parsed_6gw7 1
668 "assign resid 27 and name HD* resid 38 and name HD2* 3.50 1.70 0.00" 673 1 673 86 parsed_6gw7 1
669 "assign resid 40 and name HB2 resid 41 and name HD* 3.69 1.89 0.00" 674 1 674 86 parsed_6gw7 1
670 "assign resid 18 and name HG resid 41 and name HD* 3.60 1.80 0.00" 675 1 675 86 parsed_6gw7 1
671 "assign resid 41 and name HD* resid 46 and name HD* 3.94 2.14 0.00" 676 1 676 86 parsed_6gw7 1
672 "assign resid 41 and name HD* resid 47 and name HG2* 3.47 1.67 0.00" 677 1 677 86 parsed_6gw7 1
673 "assign resid 18 and name HD2* resid 41 and name HD* 3.40 1.60 0.00" 678 1 678 86 parsed_6gw7 1
674 "assign resid 30 and name HA resid 34 and name HD* 3.81 2.01 0.00" 679 1 679 86 parsed_6gw7 1
675 "assign resid 33 and name HD1 resid 34 and name HE* 3.98 2.18 0.00" 680 1 680 86 parsed_6gw7 1
676 "assign resid 17 and name HB1 resid 34 and name HE* 4.13 2.33 0.00" 681 1 681 86 parsed_6gw7 1
677 "assign resid 17 and name HD* resid 18 and name HG 3.80 2.00 0.00" 682 1 682 86 parsed_6gw7 1
678 "assign resid 17 and name HA resid 17 and name HD* 3.29 1.49 0.00" 683 1 683 86 parsed_6gw7 1
679 "assign resid 17 and name HD* resid 37 and name HG2 3.91 2.11 0.00" 684 1 684 86 parsed_6gw7 1
680 "assign resid 17 and name HD* resid 34 and name HD* 3.89 2.09 0.00" 685 1 685 86 parsed_6gw7 1
681 "assign resid 17 and name HE* resid 38 and name HB1 3.73 1.93 0.00" 686 1 686 86 parsed_6gw7 1
682 "assign resid 17 and name HE* resid 47 and name HD1* 3.81 2.01 0.00" 687 1 687 86 parsed_6gw7 1
683 "assign resid 17 and name HE* resid 38 and name HA 3.59 1.79 0.00" 688 1 688 86 parsed_6gw7 1
684 "assign resid 17 and name HE* resid 41 and name HB2 4.06 2.26 0.00" 689 1 689 86 parsed_6gw7 1
685 "assign resid 17 and name HE* resid 38 and name HD1* 3.12 1.32 0.00" 690 1 690 86 parsed_6gw7 1
686 "assign resid 17 and name HE* resid 34 and name HD* 3.65 1.85 0.00" 691 1 691 86 parsed_6gw7 1
687 "assign resid 17 and name HA resid 34 and name HZ 3.61 1.81 0.00" 692 1 692 86 parsed_6gw7 1
688 "assign resid 20 and name HB1 resid 34 and name HZ 4.01 2.21 0.00" 693 1 693 86 parsed_6gw7 1
689 "assign resid 17 and name HZ resid 38 and name HA 3.01 1.21 0.00" 694 1 694 86 parsed_6gw7 1
690 "assign resid 17 and name HZ resid 38 and name HB1 3.71 1.91 0.00" 695 1 695 86 parsed_6gw7 1
691 "assign resid 17 and name HZ resid 38 and name HG 3.67 1.87 0.00" 696 1 696 86 parsed_6gw7 1
692 "assign resid 17 and name HZ resid 38 and name HD1* 2.81 1.01 0.00" 697 1 697 86 parsed_6gw7 1
693 "assign resid 17 and name HZ resid 47 and name HD1* 3.34 1.54 0.00" 698 1 698 86 parsed_6gw7 1
694 "assign resid 17 and name HZ resid 38 and name HD2* 3.96 2.16 0.00" 699 1 699 86 parsed_6gw7 1
695 "assign resid 31 and name HE* resid 36 and name HA 3.08 1.28 0.00" 700 1 700 86 parsed_6gw7 1
696 "assign resid 31 and name HE* resid 39 and name HG 3.50 1.70 0.00" 701 1 701 86 parsed_6gw7 1
697 "assign resid 31 and name HE* resid 39 and name HD1* 3.01 1.21 0.00" 702 1 702 86 parsed_6gw7 1
698 "assign resid 3 and name HD* resid 5 and name HE* 3.45 1.65 0.00" 703 1 703 86 parsed_6gw7 1
699 "assign resid 31 and name HE* resid 32 and name HD* 3.14 1.34 0.00" 704 1 704 86 parsed_6gw7 1
700 "assign resid 17 and name HD* resid 41 and name HE* 3.70 1.90 0.00" 705 1 705 86 parsed_6gw7 1
701 "assign resid 18 and name HG resid 41 and name HE* 3.35 1.55 0.00" 706 1 706 86 parsed_6gw7 1
702 "assign resid 27 and name HE* resid 38 and name HD2* 2.99 1.19 0.00" 707 1 707 86 parsed_6gw7 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6gw7
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_6gw7 2
2 1 . . . parsed_6gw7 2
3 1 . . . parsed_6gw7 2
4 1 . . . parsed_6gw7 2
5 1 . . . parsed_6gw7 2
6 1 . . . parsed_6gw7 2
7 1 . . . parsed_6gw7 2
8 1 . . . parsed_6gw7 2
9 1 . . . parsed_6gw7 2
10 1 . . . parsed_6gw7 2
11 1 . . . parsed_6gw7 2
12 1 . . . parsed_6gw7 2
13 1 . . . parsed_6gw7 2
14 1 . . . parsed_6gw7 2
15 1 . . . parsed_6gw7 2
16 1 . . . parsed_6gw7 2
17 1 . . . parsed_6gw7 2
18 1 . . . parsed_6gw7 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 48 . N parsed_6gw7 2
1 1 2 . . . . . . . . . 55 . O parsed_6gw7 2
2 1 1 . . . . . . . . . 48 . HN parsed_6gw7 2
2 1 2 . . . . . . . . . 55 . O parsed_6gw7 2
3 1 1 . . . . . . . . . 55 . N parsed_6gw7 2
3 1 2 . . . . . . . . . 48 . O parsed_6gw7 2
4 1 1 . . . . . . . . . 55 . HN parsed_6gw7 2
4 1 2 . . . . . . . . . 48 . O parsed_6gw7 2
5 1 1 . . . . . . . . . 19 . N parsed_6gw7 2
5 1 2 . . . . . . . . . 15 . O parsed_6gw7 2
6 1 1 . . . . . . . . . 19 . HN parsed_6gw7 2
6 1 2 . . . . . . . . . 15 . O parsed_6gw7 2
7 1 1 . . . . . . . . . 31 . N parsed_6gw7 2
7 1 2 . . . . . . . . . 27 . O parsed_6gw7 2
8 1 1 . . . . . . . . . 31 . HN parsed_6gw7 2
8 1 2 . . . . . . . . . 27 . O parsed_6gw7 2
9 1 1 . . . . . . . . . 32 . N parsed_6gw7 2
9 1 2 . . . . . . . . . 28 . O parsed_6gw7 2
10 1 1 . . . . . . . . . 32 . HN parsed_6gw7 2
10 1 2 . . . . . . . . . 28 . O parsed_6gw7 2
11 1 1 . . . . . . . . . 41 . N parsed_6gw7 2
11 1 2 . . . . . . . . . 37 . O parsed_6gw7 2
12 1 1 . . . . . . . . . 41 . HN parsed_6gw7 2
12 1 2 . . . . . . . . . 37 . O parsed_6gw7 2
13 1 1 . . . . . . . . . 43 . N parsed_6gw7 2
13 1 2 . . . . . . . . . 39 . O parsed_6gw7 2
14 1 1 . . . . . . . . . 43 . HN parsed_6gw7 2
14 1 2 . . . . . . . . . 39 . O parsed_6gw7 2
15 1 1 . . . . . . . . . 44 . N parsed_6gw7 2
15 1 2 . . . . . . . . . 40 . O parsed_6gw7 2
16 1 1 . . . . . . . . . 44 . HN parsed_6gw7 2
16 1 2 . . . . . . . . . 40 . O parsed_6gw7 2
17 1 1 . . . . . . . . . 45 . N parsed_6gw7 2
17 1 2 . . . . . . . . . 41 . O parsed_6gw7 2
18 1 1 . . . . . . . . . 45 . HN parsed_6gw7 2
18 1 2 . . . . . . . . . 41 . O parsed_6gw7 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
2 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
3 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
4 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
5 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
6 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
7 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
8 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
9 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
10 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
11 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
12 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
13 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
14 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
15 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
16 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
17 1 . . . . . 3.2 2.9 3.3 parsed_6gw7 2
18 1 . . . . . 2.2 1.9 2.3 parsed_6gw7 2
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "liaison 48 N <--> 55 O" 2 1 2 27 parsed_6gw7 2
2 "liaison 55 N <--> 48 O" 5 1 6 27 parsed_6gw7 2
3 "liaison 19 N <--> 15 O" 9 1 10 27 parsed_6gw7 2
4 "liaison 31 N <--> 27 O" 13 1 14 27 parsed_6gw7 2
5 "liaison 32 N <--> 28 O" 17 1 18 27 parsed_6gw7 2
6 "liaison 41 N <--> 37 O" 21 1 22 27 parsed_6gw7 2
7 "liaison 43 N <--> 39 O" 25 1 26 27 parsed_6gw7 2
8 "liaison 44 N <--> 40 O" 29 1 30 27 parsed_6gw7 2
9 "liaison 45 N <--> 41 O" 33 1 34 27 parsed_6gw7 2
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 2: dpra_hbond_restraints.tbl" 1 1 1 46 parsed_6gw7 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6gw7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_6gw7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_6gw7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_6gw7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_6gw7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_6gw7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_6gw7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_6gw7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_6gw7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_6gw7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_6gw7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_6gw7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 60.0 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_6gw7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_6gw7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_6gw7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_6gw7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_6gw7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_6gw7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_6gw7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_6gw7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_6gw7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_6gw7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_6gw7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_6gw7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_6gw7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_6gw7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_6gw7 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_6gw7 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_6gw7 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_6gw7 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_6gw7 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_6gw7 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_6gw7 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_6gw7 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_6gw7 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_6gw7 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_6gw7 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_6gw7 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_6gw7 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_6gw7 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_6gw7 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_6gw7 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_6gw7 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_6gw7 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_6gw7 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_6gw7 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 220.0 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_6gw7 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_6gw7 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 220.0 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_6gw7 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -20.0 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_6gw7 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 0.0 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_6gw7 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_6gw7 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 220.0 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_6gw7 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1
;
Angle constraint file from UNIO
UNIO version 2.0.3
File format : cns
File generated: 2015 April 6th, 16:50:40
;
2 1 5 44 parsed_6gw7 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 3: dpra_dihe_restraints.tbl" 1 1 1 45 parsed_6gw7 1
stop_
save_
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