NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
647892 |
6k59   |
36258 | cing | 2-parsed | STAR | distance | NOE | simple |
data_6k59_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6k59
_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_6k59 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6k59
_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 6k59 "Master copy" parsed_6k59
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6k59
_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 6k59.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6k59 1
1 6k59.mr . . DYANA/DIANA 2 distance NOE simple 0 parsed_6k59 1
1 6k59.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6k59 1
1 6k59.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6k59 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6k59
_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 "Restraints file 1: GLARGINE_INSULIN2.upl" 1 1 1 42 parsed_6k59 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 "1 GLY A QA 19 TYR A H 2.0 4.8" 2 1 2 76 parsed_6k59 1
2 "2 ILE A H 3 VAL A H 2.0 3.0" 3 1 3 76 parsed_6k59 1
3 "2 ILE A HA 3 VAL A H 2.0 3.0" 4 1 4 76 parsed_6k59 1
4 "2 ILE A HB 2 ILE A H 2.0 3.0" 5 1 5 76 parsed_6k59 1
5 "2 ILE A HB 19 TYR A QE 2.0 4.5" 6 1 6 76 parsed_6k59 1
6 "2 ILE A MD 2 ILE A H 2.0 3.0" 7 1 7 76 parsed_6k59 1
7 "2 ILE A MD 19 TYR A QE 2.0 4.5" 8 1 8 76 parsed_6k59 1
8 "2 ILE A MD 19 TYR A QD 2.0 4.5" 9 1 9 76 parsed_6k59 1
9 "2 ILE A QG 2 ILE A H 2.0 3.5" 10 1 10 76 parsed_6k59 1
10 "2 ILE A QG 19 TYR A QE 2.0 4.5" 11 1 11 76 parsed_6k59 1
11 "2 ILE A QG 19 TYR A QD 2.0 4.5" 12 1 12 76 parsed_6k59 1
12 "2 ILE A QG 26 TYR B QE 2.0 5.0" 13 1 13 76 parsed_6k59 1
13 "2 ILE A QG 3 VAL A H 2.0 3.5" 14 1 14 76 parsed_6k59 1
14 "2 ILE A MD 5 GLN A H 2.0 4.0" 15 1 15 76 parsed_6k59 1
15 "2 ILE A HA 4 GLU A H 2.0 4.5" 16 1 16 76 parsed_6k59 1
16 "2 ILE A HA 5 GLN A H 2.0 3.5" 17 1 17 76 parsed_6k59 1
17 "3 VAL A H 4 GLU A H 2.0 4.5" 18 1 18 76 parsed_6k59 1
18 "3 VAL A HA 5 GLN A H 2.0 3.0" 19 1 19 76 parsed_6k59 1
19 "3 VAL A HA 6 CYS A H 2.0 3.5" 20 1 20 76 parsed_6k59 1
20 "3 VAL A HB 3 VAL A H 2.0 3.0" 21 1 21 76 parsed_6k59 1
21 "3 VAL A HB 4 GLU A H 2.0 4.5" 22 1 22 76 parsed_6k59 1
22 "4 GLU A HA 5 GLN A H 2.0 3.5" 23 1 23 76 parsed_6k59 1
23 "4 GLU A QB 4 GLU A H 2.0 3.5" 24 1 24 76 parsed_6k59 1
24 "4 GLU A QB 5 GLN A H 2.0 3.5" 25 1 25 76 parsed_6k59 1
25 "4 GLU A QG 4 GLU A H 2.0 3.5" 26 1 26 76 parsed_6k59 1
26 "4 GLU A QG 5 GLN A H 2.0 3.5" 27 1 27 76 parsed_6k59 1
27
;
5 GLN A H 4 GLU A H 2.0 3.0
#5 GLN A HA 5 GLN A H 2.0 3.8
;
28 1 29 76 parsed_6k59 1
28 "5 GLN A QB 5 GLN A H 2.0 3.8" 30 1 30 76 parsed_6k59 1
29
;
5 GLN A QB 6 CYS A H 2.0 3.0
#5 GLN A QG 3 ASN A H 2.0 4.5
;
31 1 32 76 parsed_6k59 1
30
;
5 GLN A QG 5 GLN A H 2.0 3.0
#6 CYS A HA 7 CYS A H 2.0 3.2
;
33 1 34 76 parsed_6k59 1
31 "6 CYS A HB2 6 CYS A H 2.0 3.0" 35 1 35 76 parsed_6k59 1
32 "6 CYS A HB2 7 CYS A H 2.0 3.5" 36 1 36 76 parsed_6k59 1
33
;
6 CYS A SG 11 CYS A SG 2.0 2.1
#6 CYS A CA 11 CYS A CA 2.0 4.8
#6 CYS A CB 11 CYS A CB 2.0 4.1
;
37 1 39 76 parsed_6k59 1
34 "7 CYS A H 4 GLU A HA 2.0 3.0" 40 1 40 76 parsed_6k59 1
35 "7 CYS A HB2 4 GLU A HA 2.0 3.0" 41 1 41 76 parsed_6k59 1
36 "7 CYS A HB2 7 CYS A H 2.0 3.4" 42 1 42 76 parsed_6k59 1
37 "7 CYS A HB3 7 CYS A H 2.0 3.0" 43 1 43 76 parsed_6k59 1
38
;
7 CYS A SG 7 CYS B SG 2.0 2.1
#7 CYS A CA 7 CYS B CA 2.0 4.6
#7 CYS A CB 7 CYS B CB 2.0 3.9
;
44 1 46 76 parsed_6k59 1
39 "8 THR A HB 8 THR A H 2.0 3.2" 47 1 47 76 parsed_6k59 1
40 "8 THR A HA 9 SER A H 2.0 3.5" 48 1 48 76 parsed_6k59 1
41 "8 THR A QG 8 THR A H 2.0 3.5" 49 1 49 76 parsed_6k59 1
42 "9 SER A HA 10 VAL A H 2.0 3.0" 50 1 50 76 parsed_6k59 1
43 "9 SER A HB2 9 SER A H 2.0 3.5" 51 1 51 76 parsed_6k59 1
44 "9 SER A HB2 10 VAL A H 2.0 3.5" 52 1 52 76 parsed_6k59 1
45 "9 SER A HB3 9 SER A H 2.0 3.5" 53 1 53 76 parsed_6k59 1
46 "9 SER A HB3 10 VAL A H 2.0 3.5" 54 1 54 76 parsed_6k59 1
47 "10 ILE A HB 10 ILE A H 2.0 3.0" 55 1 55 76 parsed_6k59 1
48 "10 ILE A MD 10 ILE A H 2.0 3.0" 56 1 56 76 parsed_6k59 1
49 "10 ILE A QG 10 ILE A H 2.0 3.5" 57 1 57 76 parsed_6k59 1
50 "10 ILE A QG 11 CYS A H 2.0 4.5" 58 1 58 76 parsed_6k59 1
51 "10 ILE A HB 11 CYS A H 2.0 4.5" 59 1 59 76 parsed_6k59 1
52 "10 ILE A HA 11 CYS A H 2.0 4.0" 60 1 60 76 parsed_6k59 1
53 "10 ILE A H 11 CYS A H 2.0 3.5" 61 1 61 76 parsed_6k59 1
54 "11 CYS A HA 12 SER A H 2.0 3.5" 62 1 62 76 parsed_6k59 1
55 "12 SER A H 13 LEU A H 2.0 3.0" 63 1 63 76 parsed_6k59 1
56 "12 SER A HA 13 LEU A H 2.0 3.4" 64 1 64 76 parsed_6k59 1
57 "12 SER A HA 15 GLN A H 2.0 3.5" 65 1 65 76 parsed_6k59 1
58 "12 SER A HB2 12 SER A H 2.0 3.0" 66 1 66 76 parsed_6k59 1
59 "12 SER A HB2 13 LEU A H 2.0 4.0" 67 1 67 76 parsed_6k59 1
60 "12 SER A HB3 12 SER A H 2.0 3.0" 68 1 68 76 parsed_6k59 1
61 "12 SER A HB3 13 LEU A H 2.0 4.0" 69 1 69 76 parsed_6k59 1
62 "12 SER A HB3 14 TYR A H 2.0 5.0" 70 1 70 76 parsed_6k59 1
63 "12 SER A HB2 14 TYR A H 2.0 5.0" 71 1 71 76 parsed_6k59 1
64 "12 SER A HA 14 TYR A H 2.0 4.5" 72 1 72 76 parsed_6k59 1
65 "12 SER A HB3 14 TYR A H 2.0 4.5" 73 1 73 76 parsed_6k59 1
66 "12 SER A HB3 15 GLN A H 2.0 3.8" 74 1 74 76 parsed_6k59 1
67 "12 SER A HB2 15 GLN A H 2.0 3.8" 75 1 75 76 parsed_6k59 1
68 "12 SER A HA 15 GLN A H 2.0 3.5" 76 1 76 76 parsed_6k59 1
69 "13 LEU A HG 22 PHE B QD 2.0 5.2" 77 1 77 76 parsed_6k59 1
70 "13 LEU A HG 13 LEU A H 2.0 4.0" 78 1 78 76 parsed_6k59 1
71 "13 LEU A QB 13 LEU A H 2.0 3.8" 79 1 79 76 parsed_6k59 1
72 "13 LEU A QB 14 TYR A H 2.0 3.8" 80 1 80 76 parsed_6k59 1
73 "13 LEU A QD1 1 PHE B QD 2.0 5.2" 81 1 81 76 parsed_6k59 1
74 "13 LEU A QD1 13 LEU A H 2.0 4.0" 82 1 82 76 parsed_6k59 1
75 "13 LEU A QD2 1 PHE B QD 2.0 5.2" 83 1 83 76 parsed_6k59 1
76 "13 LEU A QD2 13 LEU A H 2.0 4.0" 84 1 84 76 parsed_6k59 1
77 "13 LEU A HA 15 GLN A H 2.0 4.5" 85 1 85 76 parsed_6k59 1
78 "13 LEU A HA 16 LEU A H 2.0 3.5" 86 1 86 76 parsed_6k59 1
79 "14 TYR A H 13 LEU A H 2.0 3.4" 87 1 87 76 parsed_6k59 1
80 "14 TYR A H 14 TYR A QE 2.0 4.5" 88 1 88 76 parsed_6k59 1
81 "14 TYR A HA 14 TYR A QD 2.0 4.2" 89 1 89 76 parsed_6k59 1
82 "14 TYR A HA 15 GLN A H 2.0 3.7" 90 1 90 76 parsed_6k59 1
83 "14 TYR A HA 18 ASN A H 2.0 4.4" 91 1 91 76 parsed_6k59 1
84 "14 TYR A HB2 14 TYR A QD 2.0 3.2" 92 1 92 76 parsed_6k59 1
85 "14 TYR A HB2 14 TYR A QE 2.0 3.5" 93 1 93 76 parsed_6k59 1
86 "14 TYR A HB2 14 TYR A H 2.0 3.0" 94 1 94 76 parsed_6k59 1
87 "14 TYR A HB3 14 TYR A H 2.0 3.6" 95 1 95 76 parsed_6k59 1
88 "14 TYR A HB2 15 GLN A H 2.0 3.0" 96 1 96 76 parsed_6k59 1
89 "14 TYR A HB3 14 TYR A QE 2.0 3.5" 97 1 97 76 parsed_6k59 1
90 "14 TYR A HB3 14 TYR A QD 2.0 3.5" 98 1 98 76 parsed_6k59 1
91 "14 TYR A HB3 14 TYR A H 2.0 3.2" 99 1 99 76 parsed_6k59 1
92 "14 TYR A HB3 15 GLN A H 2.0 3.2" 100 1 100 76 parsed_6k59 1
93 "15 GLN A H 14 TYR A HA 2.0 3.4" 101 1 101 76 parsed_6k59 1
94 "15 GLN A H 16 LEU A H 2.0 3.0" 102 1 102 76 parsed_6k59 1
95 "15 GLN A HA 16 LEU A H 2.0 3.2" 103 1 103 76 parsed_6k59 1
96 "15 GLN A QB 15 GLN A H 2.0 3.5" 104 1 104 76 parsed_6k59 1
97 "15 GLN A QB 15 GLN A H 2.0 4.0" 105 1 105 76 parsed_6k59 1
98 "15 GLN A QB 15 GLN A QG 2.0 3.8" 106 1 106 76 parsed_6k59 1
99 "15 GLN A QB 15 GLN A QG 2.0 3.8" 107 1 107 76 parsed_6k59 1
100 "15 GLN A QB 16 LEU A H 2.0 4.0" 108 1 108 76 parsed_6k59 1
101 "15 GLN A QG 15 GLN A H 2.0 4.0" 109 1 109 76 parsed_6k59 1
102 "15 GLN A QG 15 GLN A QG 2.0 3.2" 110 1 110 76 parsed_6k59 1
103 "15 GLN A QG 15 GLN A QG 2.0 3.2" 111 1 111 76 parsed_6k59 1
104 "15 GLN A QG 16 LEU A H 2.0 4.2" 112 1 112 76 parsed_6k59 1
105 "16 LEU A H 14 TYR A HA 2.0 4.0" 113 1 113 76 parsed_6k59 1
106 "16 LEU A HA 17 GLU A H 2.0 4.0" 114 1 114 76 parsed_6k59 1
107 "16 LEU A HB2 16 LEU A H 2.0 3.0" 115 1 115 76 parsed_6k59 1
108 "16 LEU A HB3 13 LEU A HA 2.0 3.0" 116 1 116 76 parsed_6k59 1
109 "16 LEU A HB3 16 LEU A H 2.0 3.0" 117 1 117 76 parsed_6k59 1
110 "16 LEU A HG 16 LEU A H 2.0 4.0" 118 1 118 76 parsed_6k59 1
111 "16 LEU A QD1 16 LEU A H 2.0 4.0" 119 1 119 76 parsed_6k59 1
112 "16 LEU A QD2 16 LEU A H 2.0 3.2" 120 1 120 76 parsed_6k59 1
113 "17 GLU A H 13 LEU A HA 2.0 3.3" 121 1 121 76 parsed_6k59 1
114 "17 GLU A H 18 ASN A H 2.0 3.0" 122 1 122 76 parsed_6k59 1
115 "17 GLU A QG 17 GLU A H 2.0 3.0" 123 1 123 76 parsed_6k59 1
116 "17 GLU A QG 17 GLU A H 2.0 3.0" 124 1 124 76 parsed_6k59 1
117 "17 GLU A QG 18 ASN A H 2.0 4.0" 125 1 125 76 parsed_6k59 1
118 "17 GLU A QG 18 ASN A H 2.0 4.0" 126 1 126 76 parsed_6k59 1
119 "17 GLU A QB 14 TYR A HA 2.0 3.5" 127 1 127 76 parsed_6k59 1
120 "17 GLU A QB 17 GLU A H 2.0 3.2" 128 1 128 76 parsed_6k59 1
121 "17 GLU A QB 18 ASN A H 2.0 4.0" 129 1 129 76 parsed_6k59 1
122 "18 ASN A H 19 TYR A H 2.0 4.0" 130 1 130 76 parsed_6k59 1
123 "18 ASN A HA 18 ASN A QD2 2.0 3.0" 131 1 131 76 parsed_6k59 1
124 "18 ASN A HA 19 TYR A H 2.0 4.0" 132 1 132 76 parsed_6k59 1
125 "18 ASN A HB2 18 ASN A H 2.0 4.0" 133 1 133 76 parsed_6k59 1
126 "18 ASN A HB3 18 ASN A H 2.0 4.0" 134 1 134 76 parsed_6k59 1
127 "18 ASN A HB2 18 ASN A QD2 2.0 3.6" 135 1 135 76 parsed_6k59 1
128 "18 ASN A HB2 19 TYR A QE 2.0 5.2" 136 1 136 76 parsed_6k59 1
129 "18 ASN A HB2 19 TYR A QD 2.0 5.2" 137 1 137 76 parsed_6k59 1
130 "18 ASN A HB3 18 ASN A H 2.0 3.3" 138 1 138 76 parsed_6k59 1
131 "18 ASN A HB3 18 ASN A H 2.0 4.4" 139 1 139 76 parsed_6k59 1
132 "18 ASN A HB3 18 ASN A QD2 2.0 4.2" 140 1 140 76 parsed_6k59 1
133 "18 ASN A HB3 18 ASN A QD2 2.0 3.5" 141 1 141 76 parsed_6k59 1
134 "18 ASN A HB3 19 TYR A H 2.0 3.8" 142 1 142 76 parsed_6k59 1
135 "18 ASN A HB3 19 TYR A H 2.0 3.8" 143 1 143 76 parsed_6k59 1
136 "19 TYR A H 19 TYR A QE 2.0 4.5" 144 1 144 76 parsed_6k59 1
137 "19 TYR A H 19 TYR A QD 2.0 4.2" 145 1 145 76 parsed_6k59 1
138 "19 TYR A HA 19 TYR A QE 2.0 3.5" 146 1 146 76 parsed_6k59 1
139 "19 TYR A HA 19 TYR A QD 2.0 3.5" 147 1 147 76 parsed_6k59 1
140 "19 TYR A HA 20 CYS A H 2.0 3.5" 148 1 148 76 parsed_6k59 1
141 "19 TYR A HB2 19 TYR A QE 2.0 3.0" 149 1 149 76 parsed_6k59 1
142 "19 TYR A HB2 19 TYR A QD 2.0 3.2" 150 1 150 76 parsed_6k59 1
143 "19 TYR A HB2 19 TYR A H 2.0 3.2" 151 1 151 76 parsed_6k59 1
144 "19 TYR A HB2 20 CYS A H 2.0 4.5" 152 1 152 76 parsed_6k59 1
145 "19 TYR A HB3 20 CYS A H 2.0 4.2" 153 1 153 76 parsed_6k59 1
146 "19 TYR A HB3 19 TYR A QE 2.0 3.8" 154 1 154 76 parsed_6k59 1
147 "19 TYR A HB3 19 TYR A H 2.0 4.0" 155 1 155 76 parsed_6k59 1
148 "20 CYS A H 19 TYR A H 2.0 3.8" 156 1 156 76 parsed_6k59 1
149 "20 CYS A HB2 20 CYS A H 2.0 3.6" 157 1 157 76 parsed_6k59 1
150 "20 CYS A HB3 20 CYS A H 2.0 3.6" 158 1 158 76 parsed_6k59 1
151 "20 CYS A HA 25 PHE B H 2.0 5.2" 159 1 159 76 parsed_6k59 1
152
;
20 CYS A SG 19 CYS B SG 2.0 2.1
#20 CYS A CA 19 CYS B CA 2.0 5.5
#20 CYS A CB 19 CYS B CB 2.0 3.8
;
160 1 162 76 parsed_6k59 1
153 "21 GLY A HA 21 GLY A H 2.0 3.5" 163 1 163 76 parsed_6k59 1
154 "1 PHE B HA 1 PHE B QE 2.0 3.2" 164 1 164 76 parsed_6k59 1
155 "1 PHE B HA 1 PHE B QD 2.0 3.2" 165 1 165 76 parsed_6k59 1
156 "1 PHE B QB 1 PHE B QE 2.0 3.0" 166 1 166 76 parsed_6k59 1
157 "1 PHE B QB 1 PHE B QD 2.0 4.0" 167 1 167 76 parsed_6k59 1
158 "1 PHE B QB 2 VAL B H 2.0 4.0" 168 1 168 76 parsed_6k59 1
159 "2 VAL B HA 3 ASN B H 2.0 4.0" 169 1 169 76 parsed_6k59 1
160 "2 VAL B HB 1 PHE B QD 2.0 4.5" 170 1 170 76 parsed_6k59 1
161 "2 VAL B HB 2 VAL B H 2.0 3.2" 171 1 171 76 parsed_6k59 1
162 "2 VAL B HB 3 ASN B H 2.0 3.6" 172 1 172 76 parsed_6k59 1
163 "2 VAL B QQG 2 VAL B H 2.0 4.0" 173 1 173 76 parsed_6k59 1
164 "2 VAL B QQG 3 ASN B H 2.0 3.5" 174 1 174 76 parsed_6k59 1
165 "2 VAL B QQG 4 GLN B QE2 2.0 5.2" 175 1 175 76 parsed_6k59 1
166 "3 ASN B H 2 VAL B H 2.0 4.0" 176 1 176 76 parsed_6k59 1
167 "3 ASN B H 3 ASN B HD21 2.0 3.5" 177 1 177 76 parsed_6k59 1
168 "3 ASN B H 3 ASN B HD22 2.0 3.5" 178 1 178 76 parsed_6k59 1
169 "3 ASN B HA 3 ASN B HD21 2.0 4.0" 179 1 179 76 parsed_6k59 1
170 "3 ASN B HA 4 GLN B H 2.0 4.0" 180 1 180 76 parsed_6k59 1
171 "3 ASN B QB 3 ASN B H 2.0 4.0" 181 1 181 76 parsed_6k59 1
172 "3 ASN B QB 3 ASN B HD21 2.0 3.0" 182 1 182 76 parsed_6k59 1
173 "3 ASN B QB 3 ASN B HD22 2.0 3.0" 183 1 183 76 parsed_6k59 1
174 "3 ASN B QB 4 GLN B H 2.0 3.5" 184 1 184 76 parsed_6k59 1
175 "4 GLN B H 5 HIS B H 2.0 4.0" 185 1 185 76 parsed_6k59 1
176 "4 GLN B HA 5 HIS B H 2.0 4.0" 186 1 186 76 parsed_6k59 1
177 "4 GLN B HB2 5 HIS B H 2.0 4.0" 187 1 187 76 parsed_6k59 1
178 "4 GLN B HB3 4 GLN B H 2.0 4.5" 188 1 188 76 parsed_6k59 1
179 "4 GLN B HB3 5 HIS B H 2.0 3.8" 189 1 189 76 parsed_6k59 1
180 "4 GLN B QG 5 HIS B H 2.0 4.0" 190 1 190 76 parsed_6k59 1
181 "5 HIS B H 5 HIS B HE 2.0 5.0" 191 1 191 76 parsed_6k59 1
182 "5 HIS B H 6 LEU B H 2.0 4.0" 192 1 192 76 parsed_6k59 1
183 "5 HIS B HA 5 HIS B HE 2.0 3.0" 193 1 193 76 parsed_6k59 1
184 "5 HIS B HA 6 LEU B H 2.0 3.8" 194 1 194 76 parsed_6k59 1
185 "5 HIS B HB2 5 HIS B HE 2.0 3.8" 195 1 195 76 parsed_6k59 1
186 "5 HIS B HB2 5 HIS B H 2.0 3.4" 196 1 196 76 parsed_6k59 1
187 "5 HIS B HB2 6 LEU B H 2.0 3.4" 197 1 197 76 parsed_6k59 1
188 "5 HIS B HB3 5 HIS B HE 2.0 3.4" 198 1 198 76 parsed_6k59 1
189 "5 HIS B HB3 5 HIS B H 2.0 4.7" 199 1 199 76 parsed_6k59 1
190 "6 LEU B HA 6 LEU B H 2.0 3.6" 200 1 200 76 parsed_6k59 1
191 "6 LEU B HA 7 CYS B H 2.0 4.0" 201 1 201 76 parsed_6k59 1
192 "6 LEU B QD2 7 CYS B H 2.0 5.2" 202 1 202 76 parsed_6k59 1
193 "6 LEU B QB 6 LEU B H 2.0 3.0" 203 1 203 76 parsed_6k59 1
194 "6 LEU B QB 7 CYS B H 2.0 4.5" 204 1 204 76 parsed_6k59 1
195 "6 LEU B QD1 7 CYS B H 2.0 5.0" 205 1 205 76 parsed_6k59 1
196 "7 CYS B HB2 7 CYS B H 2.0 3.5" 206 1 206 76 parsed_6k59 1
197 "7 CYS B HB3 7 CYS B H 2.0 3.5" 207 1 207 76 parsed_6k59 1
198 "8 GLY B HA2 9 SER B H 2.0 4.0" 208 1 208 76 parsed_6k59 1
199 "8 GLY B HA3 9 SER B H 2.0 4.0" 209 1 209 76 parsed_6k59 1
200 "9 SER B H 10 HIS B H 2.0 4.0" 210 1 210 76 parsed_6k59 1
201 "9 SER B HA 10 HIS B H 2.0 4.0" 211 1 211 76 parsed_6k59 1
202 "9 SER B HA 12 VAL B H 2.0 4.5" 212 1 212 76 parsed_6k59 1
203 "9 SER B QB 9 SER B H 2.0 3.5" 213 1 213 76 parsed_6k59 1
204 "9 SER B QB 10 HIS B H 2.0 4.2" 214 1 214 76 parsed_6k59 1
205 "9 SER B QB 12 VAL B H 2.0 3.0" 215 1 215 76 parsed_6k59 1
206 "10 HIS B H 10 HIS B HD 2.0 3.5" 216 1 216 76 parsed_6k59 1
207 "10 HIS B HA 10 HIS B HD 2.0 3.2" 217 1 217 76 parsed_6k59 1
208 "10 HIS B HA 11 LEU B H 2.0 3.5" 218 1 218 76 parsed_6k59 1
209 "10 HIS B HA 12 VAL B H 2.0 4.5" 219 1 219 76 parsed_6k59 1
210 "10 HIS B HA 13 GLU B HB 2.0 4.5" 220 1 220 76 parsed_6k59 1
211 "10 HIS B HA 13 GLU B H 2.0 3.5" 221 1 221 76 parsed_6k59 1
212 "10 HIS B HB2 10 HIS B H 2.0 3.5" 222 1 222 76 parsed_6k59 1
213 "10 HIS B HB3 10 HIS B H 2.0 3.5" 223 1 223 76 parsed_6k59 1
214 "10 HIS B HB2 10 HIS B H 2.0 3.5" 224 1 224 76 parsed_6k59 1
215 "10 HIS B HB3 10 HIS B H 2.0 3.5" 225 1 225 76 parsed_6k59 1
216 "10 HIS B HB2 11 LEU B H 2.0 4.0" 226 1 226 76 parsed_6k59 1
217 "10 HIS B H 10 HIS B HD 2.0 3.5" 227 1 227 76 parsed_6k59 1
218 "10 HIS B HD 11 LEU B H 2.0 4.8" 228 1 228 76 parsed_6k59 1
219 "11 LEU B H 10 HIS B H 2.0 3.8" 229 1 229 76 parsed_6k59 1
220 "11 LEU B HA 12 VAL B H 2.0 4.0" 230 1 230 76 parsed_6k59 1
221 "11 LEU B HA 14 ALA B H 2.0 3.5" 231 1 231 76 parsed_6k59 1
222 "11 LEU B HA 15 LEU B H 2.0 4.4" 232 1 232 76 parsed_6k59 1
223 "11 LEU B QB 11 LEU B H 2.0 4.0" 233 1 233 76 parsed_6k59 1
224 "11 LEU B QD1 11 LEU B H 2.0 3.5" 234 1 234 76 parsed_6k59 1
225 "11 LEU B QD2 11 LEU B H 2.0 3.5" 235 1 235 76 parsed_6k59 1
226 "12 VAL B H 10 HIS B HA 2.0 3.8" 236 1 236 76 parsed_6k59 1
227 "12 VAL B H 11 LEU B HA 2.0 4.2" 237 1 237 76 parsed_6k59 1
228 "12 VAL B HA 13 GLU B H 2.0 4.0" 238 1 238 76 parsed_6k59 1
229 "12 VAL B HA 15 LEU B HB 2.0 4.5" 239 1 239 76 parsed_6k59 1
230 "12 VAL B HB 9 SER B HA 2.0 5.0" 240 1 240 76 parsed_6k59 1
231 "12 VAL B HB 12 VAL B H 2.0 3.0" 241 1 241 76 parsed_6k59 1
232 "12 VAL B HB 12 VAL B H 2.0 3.0" 242 1 242 76 parsed_6k59 1
233 "12 VAL B HB 13 GLU B H 2.0 4.0" 243 1 243 76 parsed_6k59 1
234 "12 VAL B HB 16 TYR B H 2.0 4.0" 244 1 244 76 parsed_6k59 1
235 "12 VAL B QG2 12 VAL B H 2.0 3.5" 245 1 245 76 parsed_6k59 1
236 "12 VAL B QG1 12 VAL B H 2.0 3.2" 246 1 246 76 parsed_6k59 1
237 "12 VAL B QG1 13 GLU B H 2.0 3.0" 247 1 247 76 parsed_6k59 1
238 "12 VAL B QG1 16 TYR B QE 2.0 3.2" 248 1 248 76 parsed_6k59 1
239 "12 VAL B QG2 12 VAL B H 2.0 3.4" 249 1 249 76 parsed_6k59 1
240 "12 VAL B QG2 26 TYR B QE 2.0 3.4" 250 1 250 76 parsed_6k59 1
241 "13 GLU B H 10 HIS B HA 2.0 5.0" 251 1 251 76 parsed_6k59 1
242 "13 GLU B H 11 LEU B HA 2.0 4.5" 252 1 252 76 parsed_6k59 1
243 "13 GLU B HA 14 ALA B H 2.0 4.0" 253 1 253 76 parsed_6k59 1
244 "13 GLU B QB 10 HIS B HA 2.0 4.0" 254 1 254 76 parsed_6k59 1
245 "13 GLU B QB 13 GLU B H 2.0 3.0" 255 1 255 76 parsed_6k59 1
246 "13 GLU B QB 14 ALA B H 2.0 3.5" 256 1 256 76 parsed_6k59 1
247 "13 GLU B QG 13 GLU B H 2.0 3.5" 257 1 257 76 parsed_6k59 1
248 "14 ALA B H 10 HIS B HA 2.0 3.6" 258 1 258 76 parsed_6k59 1
249 "14 ALA B H 11 LEU B HA 2.0 4.0" 259 1 259 76 parsed_6k59 1
250 "14 ALA B H 12 VAL B H 2.0 5.0" 260 1 260 76 parsed_6k59 1
251 "14 ALA B H 13 GLU B H 2.0 4.0" 261 1 261 76 parsed_6k59 1
252 "14 ALA B H 13 GLU B HA 2.0 4.0" 262 1 262 76 parsed_6k59 1
253 "14 ALA B QB 11 LEU B HA 2.0 4.0" 263 1 263 76 parsed_6k59 1
254 "14 ALA B QB 14 ALA B H 2.0 3.0" 264 1 264 76 parsed_6k59 1
255 "14 ALA B QB 15 LEU B H 2.0 3.0" 265 1 265 76 parsed_6k59 1
256 "14 ALA B HA 15 LEU B H 2.0 4.0" 266 1 266 76 parsed_6k59 1
257 "15 LEU B H 11 LEU B HA 2.0 4.2" 267 1 267 76 parsed_6k59 1
258 "15 LEU B H 12 VAL B HA 2.0 4.5" 268 1 268 76 parsed_6k59 1
259 "15 LEU B H 13 GLU B HA 2.0 4.5" 269 1 269 76 parsed_6k59 1
260 "15 LEU B H 14 ALA B H 2.0 3.5" 270 1 270 76 parsed_6k59 1
261 "15 LEU B HA 16 TYR B H 2.0 3.5" 271 1 271 76 parsed_6k59 1
262 "15 LEU B QB 12 VAL B HA 2.0 3.5" 272 1 272 76 parsed_6k59 1
263 "15 LEU B QB 15 LEU B H 2.0 4.0" 273 1 273 76 parsed_6k59 1
264 "15 LEU B QD1 15 LEU B H 2.0 4.0" 274 1 274 76 parsed_6k59 1
265 "15 LEU B QD1 16 TYR B H 2.0 4.5" 275 1 275 76 parsed_6k59 1
266 "15 LEU B QD1 24 PHE B QE 2.0 5.0" 276 1 276 76 parsed_6k59 1
267 "15 LEU B QD1 24 PHE B QD 2.0 5.0" 277 1 277 76 parsed_6k59 1
268 "15 LEU B QD2 15 LEU B H 2.0 4.0" 278 1 278 76 parsed_6k59 1
269
;
15 LEU B QD2 16 TYR B H 2.0 4.0
#15 LEU B QD2 19 TYR B QD 2.0 3.8
;
279 1 280 76 parsed_6k59 1
270 "15 LEU B QD2 24 PHE B QD 2.0 5.0" 281 1 281 76 parsed_6k59 1
271 "15 LEU B QD2 24 PHE B QD 2.0 5.0" 282 1 282 76 parsed_6k59 1
272 "15 LEU B QD2 24 PHE B QD 2.0 5.0" 283 1 283 76 parsed_6k59 1
273 "16 TYR B H 12 VAL B HA 2.0 4.4" 284 1 284 76 parsed_6k59 1
274 "16 TYR B H 13 GLU B HA 2.0 3.5" 285 1 285 76 parsed_6k59 1
275 "16 TYR B H 16 TYR B QE 2.0 3.0" 286 1 286 76 parsed_6k59 1
276 "16 TYR B HA 16 TYR B QE 2.0 3.0" 287 1 287 76 parsed_6k59 1
277 "16 TYR B HA 16 TYR B QD 2.0 3.0" 288 1 288 76 parsed_6k59 1
278 "16 TYR B HA 17 LEU B H 2.0 3.0" 289 1 289 76 parsed_6k59 1
279 "16 TYR B HB3 16 TYR B QD 2.0 3.0" 290 1 290 76 parsed_6k59 1
280 "16 TYR B HB2 16 TYR B QD 2.0 3.5" 291 1 291 76 parsed_6k59 1
281 "16 TYR B HB3 16 TYR B QE 2.0 3.5" 292 1 292 76 parsed_6k59 1
282 "16 TYR B HB2 16 TYR B QE 2.0 3.5" 293 1 293 76 parsed_6k59 1
283 "16 TYR B HB3 16 TYR B H 2.0 3.5" 294 1 294 76 parsed_6k59 1
284 "16 TYR B HB2 16 TYR B H 2.0 3.5" 295 1 295 76 parsed_6k59 1
285 "16 TYR B HB3 17 LEU B H 2.0 3.5" 296 1 296 76 parsed_6k59 1
286 "17 LEU B H 16 TYR B H 2.0 3.2" 297 1 297 76 parsed_6k59 1
287 "17 LEU B H 18 VAL B H 2.0 3.5" 298 1 298 76 parsed_6k59 1
288 "17 LEU B HA 18 VAL B H 2.0 3.6" 299 1 299 76 parsed_6k59 1
289 "17 LEU B HB2 14 ALA B HA 2.0 3.5" 300 1 300 76 parsed_6k59 1
290 "17 LEU B HB2 17 LEU B H 2.0 3.5" 301 1 301 76 parsed_6k59 1
291 "17 LEU B HB3 17 LEU B H 2.0 3.8" 302 1 302 76 parsed_6k59 1
292 "17 LEU B HG 17 LEU B H 2.0 4.0" 303 1 303 76 parsed_6k59 1
293 "17 LEU B QQD 17 LEU B H 2.0 3.8" 304 1 304 76 parsed_6k59 1
294 "18 VAL B H 17 LEU B H 2.0 3.5" 305 1 305 76 parsed_6k59 1
295 "18 VAL B H 19 CYS B H 2.0 4.0" 306 1 306 76 parsed_6k59 1
296 "18 VAL B HA 19 CYS B H 2.0 3.6" 307 1 307 76 parsed_6k59 1
297 "18 VAL B HB 18 VAL B H 2.0 3.0" 308 1 308 76 parsed_6k59 1
298 "18 VAL B HB 19 CYS B H 2.0 4.0" 309 1 309 76 parsed_6k59 1
299 "18 VAL B QG1 18 VAL B H 2.0 4.0" 310 1 310 76 parsed_6k59 1
300 "18 VAL B QG1 19 CYS B H 2.0 4.0" 311 1 311 76 parsed_6k59 1
301 "18 VAL B QG2 18 VAL B H 2.0 4.0" 312 1 312 76 parsed_6k59 1
302 "18 VAL B QG2 19 CYS B H 2.0 4.0" 313 1 313 76 parsed_6k59 1
303 "19 CYS B H 20 GLY B H 2.0 4.5" 314 1 314 76 parsed_6k59 1
304 "19 CYS B HB3 19 CYS B H 2.0 3.0" 315 1 315 76 parsed_6k59 1
305 "19 CYS B HB3 20 GLY B H 2.0 3.5" 316 1 316 76 parsed_6k59 1
306 "19 CYS B HB3 24 PHE B QD 2.0 4.0" 317 1 317 76 parsed_6k59 1
307 "19 CYS B HB2 19 CYS B H 2.0 3.5" 318 1 318 76 parsed_6k59 1
308 "20 GLY B QA 21 GLU B H 2.0 3.0" 319 1 319 76 parsed_6k59 1
309 "21 GLU B HA 22 ARG B H 2.0 3.5" 320 1 320 76 parsed_6k59 1
310 "21 GLU B HB2 21 GLU B H 2.0 3.5" 321 1 321 76 parsed_6k59 1
311 "21 GLU B HB2 22 ARG B H 2.0 3.5" 322 1 322 76 parsed_6k59 1
312 "21 GLU B HB3 21 GLU B H 2.0 4.0" 323 1 323 76 parsed_6k59 1
313 "21 GLU B HB3 22 ARG B H 2.0 4.0" 324 1 324 76 parsed_6k59 1
314 "21 GLU B QG 21 GLU B H 2.0 3.5" 325 1 325 76 parsed_6k59 1
315 "21 GLU B QG 22 ARG B H 2.0 3.5" 326 1 326 76 parsed_6k59 1
316 "22 ARG B HA 23 GLY B H 2.0 3.5" 327 1 327 76 parsed_6k59 1
317 "22 ARG B QB 22 ARG B H 2.0 3.0" 328 1 328 76 parsed_6k59 1
318 "22 ARG B QB 24 PHE B QE 2.0 3.8" 329 1 329 76 parsed_6k59 1
319 "22 ARG B QD 22 ARG B H 2.0 4.0" 330 1 330 76 parsed_6k59 1
320 "22 ARG B QG 22 ARG B H 2.0 4.0" 331 1 331 76 parsed_6k59 1
321 "23 GLY B H 24 PHE B H 2.0 4.0" 332 1 332 76 parsed_6k59 1
322 "23 GLY B HA2 24 PHE B QD 2.0 4.2" 333 1 333 76 parsed_6k59 1
323 "23 GLY B HA3 24 PHE B QD 2.0 4.2" 334 1 334 76 parsed_6k59 1
324 "23 GLY B HA2 24 PHE B H 2.0 3.0" 335 1 335 76 parsed_6k59 1
325 "24 PHE B H 24 PHE B QE 2.0 4.0" 336 1 336 76 parsed_6k59 1
326 "24 PHE B H 24 PHE B QD 2.0 4.0" 337 1 337 76 parsed_6k59 1
327 "24 PHE B HA 24 PHE B QE 2.0 4.0" 338 1 338 76 parsed_6k59 1
328 "24 PHE B HA 24 PHE B QD 2.0 4.0" 339 1 339 76 parsed_6k59 1
329 "24 PHE B HA 24 PHE B QD 2.0 4.0" 340 1 340 76 parsed_6k59 1
330 "24 PHE B HA 25 PHE B H 2.0 3.0" 341 1 341 76 parsed_6k59 1
331 "24 PHE B HB3 24 PHE B QE 2.0 4.0" 342 1 342 76 parsed_6k59 1
332 "24 PHE B HB3 24 PHE B QD 2.0 4.0" 343 1 343 76 parsed_6k59 1
333 "24 PHE B QB 16 TYR B QE 2.0 4.0" 344 1 344 76 parsed_6k59 1
334 "24 PHE B QB 24 PHE B QD 2.0 4.0" 345 1 345 76 parsed_6k59 1
335 "24 PHE B QB 24 PHE B H 2.0 3.5" 346 1 346 76 parsed_6k59 1
336 "25 PHE B H 25 PHE B H 2.0 4.5" 347 1 347 76 parsed_6k59 1
337 "25 PHE B H 25 PHE B QD 2.0 4.0" 348 1 348 76 parsed_6k59 1
338 "25 PHE B HA 25 PHE B H 2.0 4.5" 349 1 349 76 parsed_6k59 1
339 "25 PHE B HA 25 PHE B QE 2.0 4.0" 350 1 350 76 parsed_6k59 1
340 "25 PHE B HA 25 PHE B QD 2.0 4.0" 351 1 351 76 parsed_6k59 1
341 "25 PHE B HA 26 TYR B H 2.0 3.5" 352 1 352 76 parsed_6k59 1
342 "25 PHE B HB2 25 PHE B H 2.0 3.0" 353 1 353 76 parsed_6k59 1
343 "25 PHE B HB2 26 TYR B H 2.0 4.0" 354 1 354 76 parsed_6k59 1
344 "25 PHE B HB3 25 PHE B H 2.0 4.5" 355 1 355 76 parsed_6k59 1
345 "25 PHE B HB3 25 PHE B QE 2.0 4.0" 356 1 356 76 parsed_6k59 1
346 "25 PHE B HB3 25 PHE B QD 2.0 4.0" 357 1 357 76 parsed_6k59 1
347 "25 PHE B HB3 25 PHE B H 2.0 3.5" 358 1 358 76 parsed_6k59 1
348 "25 PHE B HB3 26 TYR B H 2.0 4.0" 359 1 359 76 parsed_6k59 1
349 "26 TYR B QE 26 TYR B QD 2.0 4.0" 360 1 360 76 parsed_6k59 1
350 "26 TYR B H 25 PHE B H 2.0 3.5" 361 1 361 76 parsed_6k59 1
351 "26 TYR B H 26 TYR B QE 2.0 4.0" 362 1 362 76 parsed_6k59 1
352 "26 TYR B HA 26 TYR B QE 2.0 4.0" 363 1 363 76 parsed_6k59 1
353 "26 TYR B HA 26 TYR B QD 2.0 4.0" 364 1 364 76 parsed_6k59 1
354 "26 TYR B HA 27 THR B H 2.0 3.5" 365 1 365 76 parsed_6k59 1
355 "26 TYR B QB 25 PHE B QD 2.0 3.5" 366 1 366 76 parsed_6k59 1
356 "26 TYR B QB 26 TYR B QE 2.0 4.0" 367 1 367 76 parsed_6k59 1
357 "26 TYR B QB 26 TYR B QD 2.0 4.0" 368 1 368 76 parsed_6k59 1
358 "26 TYR B QB 26 TYR B H 2.0 4.0" 369 1 369 76 parsed_6k59 1
359 "26 TYR B QB 27 THR B H 2.0 4.0" 370 1 370 76 parsed_6k59 1
360 "27 THR B H 26 TYR B QD 2.0 4.0" 371 1 371 76 parsed_6k59 1
361
;
27 THR B HB 27 THR B H 2.0 3.2
#27 THR B QG 19 TYR B QE 2.0 4.0
#27 THR B QG 19 TYR B QD 2.0 4.0
;
372 1 374 76 parsed_6k59 1
362 "27 THR B QG 25 PHE B QE 2.0 4.0" 375 1 375 76 parsed_6k59 1
363 "27 THR B QG 25 PHE B QD 2.0 4.0" 376 1 376 76 parsed_6k59 1
364 "27 THR B QG 27 THR B H 2.0 3.5" 377 1 377 76 parsed_6k59 1
365 "28 PRO B HA 29 LYS B H 2.0 4.5" 378 1 378 76 parsed_6k59 1
366 "29 LYS B QG 29 LYS B H 2.0 3.5" 379 1 379 76 parsed_6k59 1
367 "29 LYS B QD 29 LYS B H 2.0 4.0" 380 1 380 76 parsed_6k59 1
368 "29 LYS B QB 29 LYS B H 2.0 4.0" 381 1 381 76 parsed_6k59 1
369 "30 THR B HA 30 THR B H 2.0 3.0" 382 1 382 76 parsed_6k59 1
370 "30 THR B HB 30 THR B H 2.0 3.5" 383 1 383 76 parsed_6k59 1
371 "30 THR B QG 30 THR B H 2.0 3.8" 384 1 384 76 parsed_6k59 1
372 "30 THR B QG 31 ARG B H 2.0 5.0" 385 1 385 76 parsed_6k59 1
373 "30 THR B QG 2 ILE A H 2.0 5.0" 386 1 386 76 parsed_6k59 1
374 "31 ARG B HA 31 ARG B H 2.0 3.6" 387 1 387 76 parsed_6k59 1
375 "31 ARG B QB 31 ARG B H 2.0 3.2" 388 1 388 76 parsed_6k59 1
376 "31 ARG B QD 31 ARG B H 2.0 3.2" 389 1 389 76 parsed_6k59 1
377 "31 ARG B QG 31 ARG B H 2.0 3.2" 390 1 390 76 parsed_6k59 1
378 "31 ARG B QD 4 GLU A H 2.0 4.0" 391 1 391 76 parsed_6k59 1
379 "31 ARG B QG 2 ILE A H 2.0 4.2" 392 1 392 76 parsed_6k59 1
stop_
save_
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