NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
|
|
494542 |
2kro   |
16643 | cing | 2-parsed | STAR | dipolar coupling |
data_2kro_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kro
_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_2kro 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kro
_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 2kro "Master copy" parsed_2kro
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kro
_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 2kro.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kro 1
1 2kro.mr . . XPLOR/CNS 2 distance NOE simple 1041 parsed_2kro 1
1 2kro.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2kro 1
1 2kro.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kro 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2kro
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_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 3 and name HN ) ( resid 3 and name N ) 8.513 1.0 1.00 0" 1 1 1 77 parsed_2kro 1
2 "assign ( resid 4 and name HN ) ( resid 4 and name N ) 4.501 1.0 1.00 0" 2 1 2 77 parsed_2kro 1
3 "assign ( resid 5 and name HN ) ( resid 5 and name N ) 11.742 1.0 1.00 0" 3 1 3 77 parsed_2kro 1
4 "assign ( resid 6 and name HN ) ( resid 6 and name N ) 11.644 1.0 1.00 0" 4 1 4 77 parsed_2kro 1
5 "assign ( resid 7 and name HN ) ( resid 7 and name N ) -2.544 1.0 1.00 0" 5 1 5 77 parsed_2kro 1
6 "assign ( resid 8 and name HN ) ( resid 8 and name N ) 12.525 1.0 1.00 0" 6 1 6 77 parsed_2kro 1
7 "assign ( resid 9 and name HN ) ( resid 9 and name N ) 2.446 1.0 1.00 0" 7 1 7 77 parsed_2kro 1
8 "assign ( resid 10 and name HN ) ( resid 10 and name N ) 8.513 1.0 1.00 0" 8 1 8 77 parsed_2kro 1
9 "assign ( resid 11 and name HN ) ( resid 11 and name N ) 0.587 1.0 1.00 0" 9 1 9 77 parsed_2kro 1
10 "assign ( resid 12 and name HN ) ( resid 12 and name N ) 10.470 1.0 1.00 0" 10 1 10 77 parsed_2kro 1
11 "assign ( resid 13 and name HN ) ( resid 13 and name N ) -19.178 1.0 1.00 0" 11 1 11 77 parsed_2kro 1
12 "assign ( resid 15 and name HN ) ( resid 15 and name N ) -0.783 1.0 1.00 0" 12 1 12 77 parsed_2kro 1
13 "assign ( resid 16 and name HN ) ( resid 16 and name N ) -10.666 1.0 1.00 0" 13 1 13 77 parsed_2kro 1
14 "assign ( resid 17 and name HN ) ( resid 17 and name N ) 8.415 1.0 1.00 0" 14 1 14 77 parsed_2kro 1
15 "assign ( resid 18 and name HN ) ( resid 18 and name N ) 25.441 1.0 1.00 0" 15 1 15 77 parsed_2kro 1
16 "assign ( resid 19 and name HN ) ( resid 19 and name N ) 22.212 1.0 1.00 0" 16 1 16 77 parsed_2kro 1
17 "assign ( resid 20 and name HN ) ( resid 20 and name N ) 17.319 1.0 1.00 0" 17 1 17 77 parsed_2kro 1
18 "assign ( resid 21 and name HN ) ( resid 21 and name N ) 12.329 1.0 1.00 0" 18 1 18 77 parsed_2kro 1
19 "assign ( resid 22 and name HN ) ( resid 22 and name N ) 29.942 1.0 1.00 0" 19 1 19 77 parsed_2kro 1
20 "assign ( resid 23 and name HN ) ( resid 23 and name N ) 15.754 1.0 1.00 0" 20 1 20 77 parsed_2kro 1
21 "assign ( resid 24 and name HN ) ( resid 24 and name N ) -13.503 1.0 1.00 0" 21 1 21 77 parsed_2kro 1
22 "assign ( resid 25 and name HN ) ( resid 25 and name N ) -3.816 1.0 1.00 0" 22 1 22 77 parsed_2kro 1
23 "assign ( resid 26 and name HN ) ( resid 26 and name N ) -1.468 1.0 1.00 0" 23 1 23 77 parsed_2kro 1
24 "assign ( resid 27 and name HN ) ( resid 27 and name N ) 11.742 1.0 1.00 0" 24 1 24 77 parsed_2kro 1
25 "assign ( resid 28 and name HN ) ( resid 28 and name N ) 17.319 1.0 1.00 0" 25 1 25 77 parsed_2kro 1
26 "assign ( resid 29 and name HN ) ( resid 29 and name N ) 13.112 1.0 1.00 0" 26 1 26 77 parsed_2kro 1
27 "assign ( resid 30 and name HN ) ( resid 30 and name N ) 12.329 1.0 1.00 0" 27 1 27 77 parsed_2kro 1
28 "assign ( resid 31 and name HN ) ( resid 31 and name N ) -9.100 1.0 1.00 0" 28 1 28 77 parsed_2kro 1
29 "assign ( resid 32 and name HN ) ( resid 32 and name N ) 20.059 1.0 1.00 0" 29 1 29 77 parsed_2kro 1
30 "assign ( resid 33 and name HN ) ( resid 33 and name N ) 23.092 1.0 1.00 0" 30 1 30 77 parsed_2kro 1
31 "assign ( resid 34 and name HN ) ( resid 34 and name N ) 17.319 1.0 1.00 0" 31 1 31 77 parsed_2kro 1
32 "assign ( resid 35 and name HN ) ( resid 35 and name N ) 13.503 1.0 1.00 0" 32 1 32 77 parsed_2kro 1
33 "assign ( resid 36 and name HN ) ( resid 36 and name N ) 21.037 1.0 1.00 0" 33 1 33 77 parsed_2kro 1
34 "assign ( resid 37 and name HN ) ( resid 37 and name N ) -8.121 1.0 1.00 0" 34 1 34 77 parsed_2kro 1
35 "assign ( resid 38 and name HN ) ( resid 38 and name N ) -27.202 1.0 1.00 0" 35 1 35 77 parsed_2kro 1
36 "assign ( resid 39 and name HN ) ( resid 39 and name N ) 11.742 1.0 1.00 0" 36 1 36 77 parsed_2kro 1
37 "assign ( resid 40 and name HN ) ( resid 40 and name N ) 16.341 1.0 1.00 0" 37 1 37 77 parsed_2kro 1
38 "assign ( resid 41 and name HN ) ( resid 41 and name N ) 17.906 1.0 1.00 0" 38 1 38 77 parsed_2kro 1
39 "assign ( resid 42 and name HN ) ( resid 42 and name N ) 26.028 1.0 1.00 0" 39 1 39 77 parsed_2kro 1
40 "assign ( resid 43 and name HN ) ( resid 43 and name N ) 10.568 1.0 1.00 0" 40 1 40 77 parsed_2kro 1
41 "assign ( resid 44 and name HN ) ( resid 44 and name N ) 14.677 1.0 1.00 0" 41 1 41 77 parsed_2kro 1
42 "assign ( resid 45 and name HN ) ( resid 45 and name N ) 31.605 1.0 1.00 0" 42 1 42 77 parsed_2kro 1
43 "assign ( resid 46 and name HN ) ( resid 46 and name N ) 30.040 1.0 1.00 0" 43 1 43 77 parsed_2kro 1
44 "assign ( resid 47 and name HN ) ( resid 47 and name N ) 19.863 1.0 1.00 0" 44 1 44 77 parsed_2kro 1
45 "assign ( resid 48 and name HN ) ( resid 48 and name N ) 9.198 1.0 1.00 0" 45 1 45 77 parsed_2kro 1
46 "assign ( resid 49 and name HN ) ( resid 49 and name N ) 25.441 1.0 1.00 0" 46 1 46 77 parsed_2kro 1
47 "assign ( resid 50 and name HN ) ( resid 50 and name N ) 21.625 1.0 1.00 0" 47 1 47 77 parsed_2kro 1
48 "assign ( resid 52 and name HN ) ( resid 52 and name N ) -6.849 1.0 1.00 0" 48 1 48 77 parsed_2kro 1
49 "assign ( resid 53 and name HN ) ( resid 53 and name N ) 22.407 1.0 1.00 0" 49 1 49 77 parsed_2kro 1
50 "assign ( resid 54 and name HN ) ( resid 54 and name N ) 22.897 1.0 1.00 0" 50 1 50 77 parsed_2kro 1
51 "assign ( resid 55 and name HN ) ( resid 55 and name N ) 25.832 1.0 1.00 0" 51 1 51 77 parsed_2kro 1
52 "assign ( resid 58 and name HN ) ( resid 58 and name N ) 22.407 1.0 1.00 0" 52 1 52 77 parsed_2kro 1
53 "assign ( resid 59 and name HN ) ( resid 59 and name N ) -19.863 1.0 1.00 0" 53 1 53 77 parsed_2kro 1
54 "assign ( resid 60 and name HN ) ( resid 60 and name N ) 16.928 1.0 1.00 0" 54 1 54 77 parsed_2kro 1
55 "assign ( resid 61 and name HN ) ( resid 61 and name N ) 14.482 1.0 1.00 0" 55 1 55 77 parsed_2kro 1
56 "assign ( resid 62 and name HN ) ( resid 62 and name N ) 6.947 1.0 1.00 0" 56 1 56 77 parsed_2kro 1
57 "assign ( resid 63 and name HN ) ( resid 63 and name N ) -15.264 1.0 1.00 0" 57 1 57 77 parsed_2kro 1
58 "assign ( resid 64 and name HN ) ( resid 64 and name N ) -3.718 1.0 1.00 0" 58 1 58 77 parsed_2kro 1
59 "assign ( resid 3 and name HN ) ( resid 2 and name C ) -0.000 0.5 1.00 0" 59 1 59 77 parsed_2kro 1
60 "assign ( resid 4 and name HN ) ( resid 3 and name C ) -1.056 0.5 1.00 0" 60 1 60 77 parsed_2kro 1
61 "assign ( resid 5 and name HN ) ( resid 4 and name C ) 1.358 0.5 1.00 0" 61 1 61 77 parsed_2kro 1
62 "assign ( resid 6 and name HN ) ( resid 5 and name C ) 4.979 0.5 1.00 0" 62 1 62 77 parsed_2kro 1
63 "assign ( resid 7 and name HN ) ( resid 6 and name C ) -3.017 0.5 1.00 0" 63 1 63 77 parsed_2kro 1
64 "assign ( resid 8 and name HN ) ( resid 7 and name C ) 7.694 0.5 1.00 0" 64 1 64 77 parsed_2kro 1
65 "assign ( resid 9 and name HN ) ( resid 8 and name C ) -9.354 0.5 1.00 0" 65 1 65 77 parsed_2kro 1
66 "assign ( resid 10 and name HN ) ( resid 9 and name C ) 9.354 0.5 1.00 0" 66 1 66 77 parsed_2kro 1
67 "assign ( resid 11 and name HN ) ( resid 10 and name C ) -4.828 0.5 1.00 0" 67 1 67 77 parsed_2kro 1
68 "assign ( resid 12 and name HN ) ( resid 11 and name C ) -3.922 0.5 1.00 0" 68 1 68 77 parsed_2kro 1
69 "assign ( resid 13 and name HN ) ( resid 12 and name C ) 5.431 0.5 1.00 0" 69 1 69 77 parsed_2kro 1
70 "assign ( resid 15 and name HN ) ( resid 14 and name C ) 11.013 0.5 1.00 0" 70 1 70 77 parsed_2kro 1
71 "assign ( resid 16 and name HN ) ( resid 15 and name C ) -2.716 0.5 1.00 0" 71 1 71 77 parsed_2kro 1
72 "assign ( resid 17 and name HN ) ( resid 16 and name C ) 6.185 0.5 1.00 0" 72 1 72 77 parsed_2kro 1
73 "assign ( resid 18 and name HN ) ( resid 17 and name C ) -4.677 0.5 1.00 0" 73 1 73 77 parsed_2kro 1
74 "assign ( resid 19 and name HN ) ( resid 18 and name C ) -6.185 0.5 1.00 0" 74 1 74 77 parsed_2kro 1
75 "assign ( resid 20 and name HN ) ( resid 19 and name C ) 6.185 0.5 1.00 0" 75 1 75 77 parsed_2kro 1
76 "assign ( resid 21 and name HN ) ( resid 20 and name C ) -1.056 0.5 1.00 0" 76 1 76 77 parsed_2kro 1
77 "assign ( resid 22 and name HN ) ( resid 21 and name C ) -2.565 0.5 1.00 0" 77 1 77 77 parsed_2kro 1
78 "assign ( resid 23 and name HN ) ( resid 22 and name C ) -3.470 0.5 1.00 0" 78 1 78 77 parsed_2kro 1
79 "assign ( resid 24 and name HN ) ( resid 23 and name C ) -1.056 0.5 1.00 0" 79 1 79 77 parsed_2kro 1
80 "assign ( resid 25 and name HN ) ( resid 24 and name C ) 11.466 0.5 1.00 0" 80 1 80 77 parsed_2kro 1
81 "assign ( resid 26 and name HN ) ( resid 25 and name C ) -4.073 0.5 1.00 0" 81 1 81 77 parsed_2kro 1
82 "assign ( resid 27 and name HN ) ( resid 26 and name C ) 9.052 0.5 1.00 0" 82 1 82 77 parsed_2kro 1
83 "assign ( resid 28 and name HN ) ( resid 27 and name C ) -5.884 0.5 1.00 0" 83 1 83 77 parsed_2kro 1
84 "assign ( resid 29 and name HN ) ( resid 28 and name C ) -4.979 0.5 1.00 0" 84 1 84 77 parsed_2kro 1
85 "assign ( resid 30 and name HN ) ( resid 29 and name C ) -0.754 0.5 1.00 0" 85 1 85 77 parsed_2kro 1
86 "assign ( resid 31 and name HN ) ( resid 30 and name C ) 0.000 0.5 1.00 0" 86 1 86 77 parsed_2kro 1
87 "assign ( resid 32 and name HN ) ( resid 31 and name C ) 10.711 0.5 1.00 0" 87 1 87 77 parsed_2kro 1
88 "assign ( resid 33 and name HN ) ( resid 32 and name C ) -4.224 0.5 1.00 0" 88 1 88 77 parsed_2kro 1
89 "assign ( resid 34 and name HN ) ( resid 33 and name C ) -7.694 0.5 1.00 0" 89 1 89 77 parsed_2kro 1
90 "assign ( resid 35 and name HN ) ( resid 34 and name C ) 1.660 0.5 1.00 0" 90 1 90 77 parsed_2kro 1
91 "assign ( resid 36 and name HN ) ( resid 35 and name C ) -7.996 0.5 1.00 0" 91 1 91 77 parsed_2kro 1
92 "assign ( resid 37 and name HN ) ( resid 36 and name C ) 11.013 0.5 1.00 0" 92 1 92 77 parsed_2kro 1
93 "assign ( resid 38 and name HN ) ( resid 37 and name C ) 0.453 0.5 1.00 0" 93 1 93 77 parsed_2kro 1
94 "assign ( resid 39 and name HN ) ( resid 38 and name C ) -1.207 0.5 1.00 0" 94 1 94 77 parsed_2kro 1
95 "assign ( resid 40 and name HN ) ( resid 39 and name C ) -1.509 0.5 1.00 0" 95 1 95 77 parsed_2kro 1
96 "assign ( resid 41 and name HN ) ( resid 40 and name C ) -0.905 0.5 1.00 0" 96 1 96 77 parsed_2kro 1
97 "assign ( resid 42 and name HN ) ( resid 41 and name C ) -6.638 0.5 1.00 0" 97 1 97 77 parsed_2kro 1
98 "assign ( resid 43 and name HN ) ( resid 42 and name C ) 8.599 0.5 1.00 0" 98 1 98 77 parsed_2kro 1
99 "assign ( resid 44 and name HN ) ( resid 43 and name C ) -3.168 0.5 1.00 0" 99 1 99 77 parsed_2kro 1
100 "assign ( resid 45 and name HN ) ( resid 44 and name C ) -1.961 0.5 1.00 0" 100 1 100 77 parsed_2kro 1
101 "assign ( resid 46 and name HN ) ( resid 45 and name C ) -8.901 0.5 1.00 0" 101 1 101 77 parsed_2kro 1
102 "assign ( resid 47 and name HN ) ( resid 46 and name C ) -6.789 0.5 1.00 0" 102 1 102 77 parsed_2kro 1
103 "assign ( resid 48 and name HN ) ( resid 47 and name C ) -7.242 0.5 1.00 0" 103 1 103 77 parsed_2kro 1
104 "assign ( resid 49 and name HN ) ( resid 48 and name C ) -7.091 0.5 1.00 0" 104 1 104 77 parsed_2kro 1
105 "assign ( resid 50 and name HN ) ( resid 49 and name C ) -3.168 0.5 1.00 0" 105 1 105 77 parsed_2kro 1
106 "assign ( resid 52 and name HN ) ( resid 51 and name C ) 3.772 0.5 1.00 0" 106 1 106 77 parsed_2kro 1
107 "assign ( resid 53 and name HN ) ( resid 52 and name C ) 1.509 0.5 1.00 0" 107 1 107 77 parsed_2kro 1
108 "assign ( resid 54 and name HN ) ( resid 53 and name C ) -6.336 0.5 1.00 0" 108 1 108 77 parsed_2kro 1
109 "assign ( resid 55 and name HN ) ( resid 54 and name C ) -5.582 0.5 1.00 0" 109 1 109 77 parsed_2kro 1
110 "assign ( resid 58 and name HN ) ( resid 57 and name C ) -5.129 0.5 1.00 0" 110 1 110 77 parsed_2kro 1
111 "assign ( resid 59 and name HN ) ( resid 58 and name C ) 10.410 0.5 1.00 0" 111 1 111 77 parsed_2kro 1
112 "assign ( resid 60 and name HN ) ( resid 59 and name C ) -6.336 0.5 1.00 0" 112 1 112 77 parsed_2kro 1
113 "assign ( resid 61 and name HN ) ( resid 60 and name C ) -5.733 0.5 1.00 0" 113 1 113 77 parsed_2kro 1
114 "assign ( resid 62 and name HN ) ( resid 61 and name C ) -4.979 0.5 1.00 0" 114 1 114 77 parsed_2kro 1
115 "assign ( resid 63 and name HN ) ( resid 62 and name C ) 3.621 0.5 1.00 0" 115 1 115 77 parsed_2kro 1
116 "assign ( resid 64 and name HN ) ( resid 63 and name C ) 4.375 0.5 1.00 0" 116 1 116 77 parsed_2kro 1
117 "assign ( resid 2 and name CA ) ( resid 2 and name C ) -0.453 0.3 1.00 0" 117 1 117 77 parsed_2kro 1
118 "assign ( resid 3 and name CA ) ( resid 3 and name C ) 0.302 0.3 1.00 0" 118 1 118 77 parsed_2kro 1
119 "assign ( resid 4 and name CA ) ( resid 4 and name C ) 0.151 0.3 1.00 0" 119 1 119 77 parsed_2kro 1
120 "assign ( resid 5 and name CA ) ( resid 5 and name C ) -3.319 0.3 1.00 0" 120 1 120 77 parsed_2kro 1
121 "assign ( resid 6 and name CA ) ( resid 6 and name C ) 3.923 0.3 1.00 0" 121 1 121 77 parsed_2kro 1
122 "assign ( resid 7 and name CA ) ( resid 7 and name C ) -4.375 0.3 1.00 0" 122 1 122 77 parsed_2kro 1
123 "assign ( resid 8 and name CA ) ( resid 8 and name C ) 5.582 0.3 1.00 0" 123 1 123 77 parsed_2kro 1
124 "assign ( resid 9 and name CA ) ( resid 9 and name C ) -1.810 0.3 1.00 0" 124 1 124 77 parsed_2kro 1
125 "assign ( resid 10 and name CA ) ( resid 10 and name C ) -1.509 0.3 1.00 0" 125 1 125 77 parsed_2kro 1
126 "assign ( resid 11 and name CA ) ( resid 11 and name C ) 6.940 0.3 1.00 0" 126 1 126 77 parsed_2kro 1
127 "assign ( resid 12 and name CA ) ( resid 12 and name C ) -5.280 0.3 1.00 0" 127 1 127 77 parsed_2kro 1
128 "assign ( resid 14 and name CA ) ( resid 14 and name C ) -3.772 0.3 1.00 0" 128 1 128 77 parsed_2kro 1
129 "assign ( resid 15 and name CA ) ( resid 15 and name C ) 1.056 0.3 1.00 0" 129 1 129 77 parsed_2kro 1
130 "assign ( resid 16 and name CA ) ( resid 16 and name C ) 0.302 0.3 1.00 0" 130 1 130 77 parsed_2kro 1
131 "assign ( resid 17 and name CA ) ( resid 17 and name C ) -3.772 0.3 1.00 0" 131 1 131 77 parsed_2kro 1
132 "assign ( resid 18 and name CA ) ( resid 18 and name C ) 4.828 0.3 1.00 0" 132 1 132 77 parsed_2kro 1
133 "assign ( resid 19 and name CA ) ( resid 19 and name C ) 0.151 0.3 1.00 0" 133 1 133 77 parsed_2kro 1
134 "assign ( resid 20 and name CA ) ( resid 20 and name C ) -5.431 0.3 1.00 0" 134 1 134 77 parsed_2kro 1
135 "assign ( resid 22 and name CA ) ( resid 22 and name C ) -1.961 0.3 1.00 0" 135 1 135 77 parsed_2kro 1
136 "assign ( resid 21 and name CA ) ( resid 21 and name C ) 3.621 0.3 1.00 0" 136 1 136 77 parsed_2kro 1
137 "assign ( resid 23 and name CA ) ( resid 23 and name C ) 2.565 0.3 1.00 0" 137 1 137 77 parsed_2kro 1
138 "assign ( resid 24 and name CA ) ( resid 24 and name C ) -3.470 0.3 1.00 0" 138 1 138 77 parsed_2kro 1
139 "assign ( resid 25 and name CA ) ( resid 25 and name C ) 6.336 0.3 1.00 0" 139 1 139 77 parsed_2kro 1
140 "assign ( resid 26 and name CA ) ( resid 26 and name C ) -3.772 0.3 1.00 0" 140 1 140 77 parsed_2kro 1
141 "assign ( resid 27 and name CA ) ( resid 27 and name C ) -3.168 0.3 1.00 0" 141 1 141 77 parsed_2kro 1
142 "assign ( resid 28 and name CA ) ( resid 28 and name C ) 7.091 0.3 1.00 0" 142 1 142 77 parsed_2kro 1
143 "assign ( resid 29 and name CA ) ( resid 29 and name C ) -1.509 0.3 1.00 0" 143 1 143 77 parsed_2kro 1
144 "assign ( resid 30 and name CA ) ( resid 30 and name C ) 5.733 0.3 1.00 0" 144 1 144 77 parsed_2kro 1
145 "assign ( resid 31 and name CA ) ( resid 31 and name C ) -1.509 0.3 1.00 0" 145 1 145 77 parsed_2kro 1
146 "assign ( resid 32 and name CA ) ( resid 32 and name C ) -1.660 0.3 1.00 0" 146 1 146 77 parsed_2kro 1
147 "assign ( resid 33 and name CA ) ( resid 33 and name C ) 4.073 0.3 1.00 0" 147 1 147 77 parsed_2kro 1
148 "assign ( resid 34 and name CA ) ( resid 34 and name C ) -2.716 0.3 1.00 0" 148 1 148 77 parsed_2kro 1
149 "assign ( resid 35 and name CA ) ( resid 35 and name C ) 5.129 0.3 1.00 0" 149 1 149 77 parsed_2kro 1
150 "assign ( resid 36 and name CA ) ( resid 36 and name C ) -2.112 0.3 1.00 0" 150 1 150 77 parsed_2kro 1
151 "assign ( resid 37 and name CA ) ( resid 37 and name C ) -1.056 0.3 1.00 0" 151 1 151 77 parsed_2kro 1
152 "assign ( resid 38 and name CA ) ( resid 38 and name C ) -3.017 0.3 1.00 0" 152 1 152 77 parsed_2kro 1
153 "assign ( resid 39 and name CA ) ( resid 39 and name C ) 3.319 0.3 1.00 0" 153 1 153 77 parsed_2kro 1
154 "assign ( resid 40 and name CA ) ( resid 40 and name C ) 0.754 0.3 1.00 0" 154 1 154 77 parsed_2kro 1
155 "assign ( resid 41 and name CA ) ( resid 41 and name C ) -0.151 0.3 1.00 0" 155 1 155 77 parsed_2kro 1
156 "assign ( resid 42 and name CA ) ( resid 42 and name C ) -0.151 0.3 1.00 0" 156 1 156 77 parsed_2kro 1
157 "assign ( resid 43 and name CA ) ( resid 43 and name C ) -0.453 0.3 1.00 0" 157 1 157 77 parsed_2kro 1
158 "assign ( resid 44 and name CA ) ( resid 44 and name C ) 1.509 0.3 1.00 0" 158 1 158 77 parsed_2kro 1
159 "assign ( resid 45 and name CA ) ( resid 45 and name C ) -2.716 0.3 1.00 0" 159 1 159 77 parsed_2kro 1
160 "assign ( resid 46 and name CA ) ( resid 46 and name C ) -0.302 0.3 1.00 0" 160 1 160 77 parsed_2kro 1
161 "assign ( resid 47 and name CA ) ( resid 47 and name C ) 0.905 0.3 1.00 0" 161 1 161 77 parsed_2kro 1
162 "assign ( resid 48 and name CA ) ( resid 48 and name C ) -1.358 0.3 1.00 0" 162 1 162 77 parsed_2kro 1
163 "assign ( resid 49 and name CA ) ( resid 49 and name C ) 4.979 0.3 1.00 0" 163 1 163 77 parsed_2kro 1
164 "assign ( resid 51 and name CA ) ( resid 51 and name C ) -1.961 0.3 1.00 0" 164 1 164 77 parsed_2kro 1
165 "assign ( resid 52 and name CA ) ( resid 52 and name C ) -1.056 0.3 1.00 0" 165 1 165 77 parsed_2kro 1
166 "assign ( resid 53 and name CA ) ( resid 53 and name C ) 2.866 0.3 1.00 0" 166 1 166 77 parsed_2kro 1
167 "assign ( resid 54 and name CA ) ( resid 54 and name C ) 3.319 0.3 1.00 0" 167 1 167 77 parsed_2kro 1
168 "assign ( resid 57 and name CA ) ( resid 57 and name C ) 6.638 0.3 1.00 0" 168 1 168 77 parsed_2kro 1
169 "assign ( resid 58 and name CA ) ( resid 58 and name C ) -1.810 0.3 1.00 0" 169 1 169 77 parsed_2kro 1
170 "assign ( resid 59 and name CA ) ( resid 59 and name C ) -2.112 0.3 1.00 0" 170 1 170 77 parsed_2kro 1
171 "assign ( resid 60 and name CA ) ( resid 60 and name C ) -3.470 0.3 1.00 0" 171 1 171 77 parsed_2kro 1
172 "assign ( resid 61 and name CA ) ( resid 61 and name C ) 3.470 0.3 1.00 0" 172 1 172 77 parsed_2kro 1
173 "assign ( resid 62 and name CA ) ( resid 62 and name C ) -2.565 0.3 1.00 0" 173 1 173 77 parsed_2kro 1
174 "assign ( resid 63 and name CA ) ( resid 63 and name C ) -1.056 0.3 1.00 0" 174 1 174 77 parsed_2kro 1
175 "assign ( resid 2 and name CA ) ( resid 2 and name HA ) -2.716 2.0 1.00 0" 175 1 175 77 parsed_2kro 1
176 "assign ( resid 3 and name CA ) ( resid 3 and name HA ) 0.905 2.0 1.00 0" 176 1 176 77 parsed_2kro 1
177 "assign ( resid 4 and name CA ) ( resid 4 and name HA ) 2996.197 2.0 1.00 0" 177 1 177 78 parsed_2kro 1
178 "assign ( resid 5 and name CA ) ( resid 5 and name HA ) -1.961 2.0 1.00 0" 178 1 178 77 parsed_2kro 1
179 "assign ( resid 6 and name CA ) ( resid 6 and name HA ) -6.487 2.0 1.00 0" 179 1 179 77 parsed_2kro 1
180 "assign ( resid 7 and name CA ) ( resid 7 and name HA ) -2.716 2.0 1.00 0" 180 1 180 77 parsed_2kro 1
181 "assign ( resid 8 and name CA ) ( resid 8 and name HA ) -1.358 2.0 1.00 0" 181 1 181 77 parsed_2kro 1
182 "assign ( resid 9 and name CA ) ( resid 9 and name HA ) -9.806 2.0 1.00 0" 182 1 182 77 parsed_2kro 1
183 "assign ( resid 10 and name CA ) ( resid 10 and name HA ) 24.289 2.0 1.00 0" 183 1 183 77 parsed_2kro 1
184 "assign ( resid 11 and name CA ) ( resid 11 and name HA ) -21.121 2.0 1.00 0" 184 1 184 77 parsed_2kro 1
185 "assign ( resid 12 and name CA ) ( resid 12 and name HA ) -26.854 2.0 1.00 0" 185 1 185 77 parsed_2kro 1
186 "assign ( resid 14 and name CA ) ( resid 14 and name HA ) 30.928 2.0 1.00 0" 186 1 186 77 parsed_2kro 1
187 "assign ( resid 15 and name CA ) ( resid 15 and name HA ) 25.044 2.0 1.00 0" 187 1 187 77 parsed_2kro 1
188 "assign ( resid 16 and name CA ) ( resid 16 and name HA ) 11.617 2.0 1.00 0" 188 1 188 77 parsed_2kro 1
189 "assign ( resid 18 and name CA ) ( resid 18 and name HA ) -28.514 2.0 1.00 0" 189 1 189 77 parsed_2kro 1
190 "assign ( resid 19 and name CA ) ( resid 19 and name HA ) -44.958 2.0 1.00 0" 190 1 190 77 parsed_2kro 1
191 "assign ( resid 20 and name CA ) ( resid 20 and name HA ) -6.638 2.0 1.00 0" 191 1 191 77 parsed_2kro 1
192 "assign ( resid 21 and name CA ) ( resid 21 and name HA ) 33.794 2.0 1.00 0" 192 1 192 77 parsed_2kro 1
193 "assign ( resid 22 and name CA ) ( resid 22 and name HA ) -52.652 2.0 1.00 0" 193 1 193 77 parsed_2kro 1
194 "assign ( resid 23 and name CA ) ( resid 23 and name HA ) 36.811 2.0 1.00 0" 194 1 194 77 parsed_2kro 1
195 "assign ( resid 24 and name CA ) ( resid 24 and name HA ) 37.264 2.0 1.00 0" 195 1 195 77 parsed_2kro 1
196 "assign ( resid 25 and name CA ) ( resid 25 and name HA ) 4.828 2.0 1.00 0" 196 1 196 77 parsed_2kro 1
197 "assign ( resid 26 and name CA ) ( resid 26 and name HA ) -11.466 2.0 1.00 0" 197 1 197 77 parsed_2kro 1
198 "assign ( resid 27 and name CA ) ( resid 27 and name HA ) -21.876 2.0 1.00 0" 198 1 198 77 parsed_2kro 1
199 "assign ( resid 29 and name CA ) ( resid 29 and name HA ) -17.651 2.0 1.00 0" 199 1 199 77 parsed_2kro 1
200 "assign ( resid 30 and name CA ) ( resid 30 and name HA ) 22.932 2.0 1.00 0" 200 1 200 77 parsed_2kro 1
201 "assign ( resid 31 and name CA ) ( resid 31 and name HA ) 7.694 2.0 1.00 0" 201 1 201 77 parsed_2kro 1
202 "assign ( resid 32 and name CA ) ( resid 32 and name HA ) -29.871 2.0 1.00 0" 202 1 202 77 parsed_2kro 1
203 "assign ( resid 33 and name CA ) ( resid 33 and name HA ) -35.303 2.0 1.00 0" 203 1 203 77 parsed_2kro 1
204 "assign ( resid 34 and name CA ) ( resid 34 and name HA ) -14.483 2.0 1.00 0" 204 1 204 77 parsed_2kro 1
205 "assign ( resid 35 and name CA ) ( resid 35 and name HA ) -51.596 2.0 1.00 0" 205 1 205 77 parsed_2kro 1
206 "assign ( resid 36 and name CA ) ( resid 36 and name HA ) -20.367 2.0 1.00 0" 206 1 206 77 parsed_2kro 1
207 "assign ( resid 37 and name CA ) ( resid 37 and name HA ) 42.997 2.0 1.00 0" 207 1 207 77 parsed_2kro 1
208 "assign ( resid 38 and name CA ) ( resid 38 and name HA ) 52.954 2.0 1.00 0" 208 1 208 77 parsed_2kro 1
209 "assign ( resid 39 and name CA ) ( resid 39 and name HA ) 2992.274 2.0 1.00 0" 209 1 209 78 parsed_2kro 1
210 "assign ( resid 40 and name CA ) ( resid 40 and name HA ) -20.367 2.0 1.00 0" 210 1 210 77 parsed_2kro 1
211 "assign ( resid 41 and name CA ) ( resid 41 and name HA ) -27.608 2.0 1.00 0" 211 1 211 77 parsed_2kro 1
212 "assign ( resid 42 and name CA ) ( resid 42 and name HA ) -3.319 2.0 1.00 0" 212 1 212 77 parsed_2kro 1
213 "assign ( resid 43 and name CA ) ( resid 43 and name HA ) 6.336 2.0 1.00 0" 213 1 213 77 parsed_2kro 1
214 "assign ( resid 44 and name CA ) ( resid 44 and name HA ) -16.444 2.0 1.00 0" 214 1 214 77 parsed_2kro 1
215 "assign ( resid 45 and name CA ) ( resid 45 and name HA ) -48.428 2.0 1.00 0" 215 1 215 77 parsed_2kro 1
216 "assign ( resid 46 and name CA ) ( resid 46 and name HA ) 12.371 2.0 1.00 0" 216 1 216 77 parsed_2kro 1
217 "assign ( resid 47 and name CA ) ( resid 47 and name HA ) -42.092 2.0 1.00 0" 217 1 217 77 parsed_2kro 1
218 "assign ( resid 48 and name CA ) ( resid 48 and name HA ) -34.096 2.0 1.00 0" 218 1 218 77 parsed_2kro 1
219 "assign ( resid 49 and name CA ) ( resid 49 and name HA ) -17.048 2.0 1.00 0" 219 1 219 77 parsed_2kro 1
220 "assign ( resid 56 and name CA ) ( resid 56 and name HA ) -23.988 2.0 1.00 0" 220 1 220 77 parsed_2kro 1
221 "assign ( resid 51 and name CA ) ( resid 51 and name HA ) 58.536 2.0 1.00 0" 221 1 221 77 parsed_2kro 1
222 "assign ( resid 52 and name CA ) ( resid 52 and name HA ) 4.677 2.0 1.00 0" 222 1 222 77 parsed_2kro 1
223 "assign ( resid 54 and name CA ) ( resid 54 and name HA ) -50.842 2.0 1.00 0" 223 1 223 77 parsed_2kro 1
224 "assign ( resid 57 and name CA ) ( resid 57 and name HA ) 12.522 2.0 1.00 0" 224 1 224 77 parsed_2kro 1
225 "assign ( resid 58 and name CA ) ( resid 58 and name HA ) -48.881 2.0 1.00 0" 225 1 225 77 parsed_2kro 1
226 "assign ( resid 59 and name CA ) ( resid 59 and name HA ) 74.226 2.0 1.00 0" 226 1 226 77 parsed_2kro 1
227 "assign ( resid 60 and name CA ) ( resid 60 and name HA ) -6.789 2.0 1.00 0" 227 1 227 77 parsed_2kro 1
228 "assign ( resid 61 and name CA ) ( resid 61 and name HA ) -20.216 2.0 1.00 0" 228 1 228 77 parsed_2kro 1
229 "assign ( resid 62 and name CA ) ( resid 62 and name HA ) 25.345 2.0 1.00 0" 229 1 229 77 parsed_2kro 1
230 "assign ( resid 63 and name CA ) ( resid 63 and name HA ) 59.441 2.0 1.00 0" 230 1 230 77 parsed_2kro 1
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