Content for NMR-STAR saveframe, "heteronucl_NOEs_1"
save_heteronucl_NOEs_1
_Heteronucl_NOE_list.Sf_category heteronucl_NOEs
_Heteronucl_NOE_list.Sf_framecode heteronucl_NOEs_1
_Heteronucl_NOE_list.Entry_ID 51065
_Heteronucl_NOE_list.ID 1
_Heteronucl_NOE_list.Name 'hetNOE in S100A9'
_Heteronucl_NOE_list.Sample_condition_list_ID 1
_Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1
_Heteronucl_NOE_list.Spectrometer_frequency_1H 900.1
_Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height'
_Heteronucl_NOE_list.NOE_ref_val 0
_Heteronucl_NOE_list.NOE_ref_description .
_Heteronucl_NOE_list.Details
;
Additional values:
108* G 0.37 0.04
109* L 0.3 0.03
112* G 0.17 0.02
113* T 0.16 0.02
;
_Heteronucl_NOE_list.Text_data_format .
_Heteronucl_NOE_list.Text_data .
loop_
_Heteronucl_NOE_experiment.Experiment_ID
_Heteronucl_NOE_experiment.Experiment_name
_Heteronucl_NOE_experiment.Sample_ID
_Heteronucl_NOE_experiment.Sample_label
_Heteronucl_NOE_experiment.Sample_state
_Heteronucl_NOE_experiment.Entry_ID
_Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID
20 '1H-15N hetNOE' . . . 51065 1
stop_
loop_
_Heteronucl_NOE_software.Software_ID
_Heteronucl_NOE_software.Software_label
_Heteronucl_NOE_software.Method_ID
_Heteronucl_NOE_software.Method_label
_Heteronucl_NOE_software.Entry_ID
_Heteronucl_NOE_software.Heteronucl_NOE_list_ID
1 $software_1 . . 51065 1
2 $software_2 . . 51065 1
stop_
loop_
_Heteronucl_NOE.ID
_Heteronucl_NOE.Assembly_atom_ID_1
_Heteronucl_NOE.Entity_assembly_ID_1
_Heteronucl_NOE.Entity_ID_1
_Heteronucl_NOE.Comp_index_ID_1
_Heteronucl_NOE.Seq_ID_1
_Heteronucl_NOE.Comp_ID_1
_Heteronucl_NOE.Atom_ID_1
_Heteronucl_NOE.Atom_type_1
_Heteronucl_NOE.Atom_isotope_number_1
_Heteronucl_NOE.Assembly_atom_ID_2
_Heteronucl_NOE.Entity_assembly_ID_2
_Heteronucl_NOE.Entity_ID_2
_Heteronucl_NOE.Comp_index_ID_2
_Heteronucl_NOE.Seq_ID_2
_Heteronucl_NOE.Comp_ID_2
_Heteronucl_NOE.Atom_ID_2
_Heteronucl_NOE.Atom_type_2
_Heteronucl_NOE.Atom_isotope_number_2
_Heteronucl_NOE.Val
_Heteronucl_NOE.Val_err
_Heteronucl_NOE.Resonance_ID_1
_Heteronucl_NOE.Resonance_ID_2
_Heteronucl_NOE.Auth_entity_assembly_ID_1
_Heteronucl_NOE.Auth_seq_ID_1
_Heteronucl_NOE.Auth_comp_ID_1
_Heteronucl_NOE.Auth_atom_ID_1
_Heteronucl_NOE.Auth_entity_assembly_ID_2
_Heteronucl_NOE.Auth_seq_ID_2
_Heteronucl_NOE.Auth_comp_ID_2
_Heteronucl_NOE.Auth_atom_ID_2
_Heteronucl_NOE.Entry_ID
_Heteronucl_NOE.Heteronucl_NOE_list_ID
1 . 2 2 7 7 GLN N N 15 . 2 2 7 7 GLN H H 1 0.71 0.07 . . . . . . . . . . 51065 1
2 . 2 2 8 8 LEU N N 15 . 2 2 8 8 LEU H H 1 0.85 0.08 . . . . . . . . . . 51065 1
3 . 2 2 9 9 GLU N N 15 . 2 2 9 9 GLU H H 1 0.85 0.09 . . . . . . . . . . 51065 1
4 . 2 2 10 10 ARG N N 15 . 2 2 10 10 ARG H H 1 0.93 0.09 . . . . . . . . . . 51065 1
5 . 2 2 11 11 ASN N N 15 . 2 2 11 11 ASN H H 1 0.78 0.08 . . . . . . . . . . 51065 1
6 . 2 2 13 13 GLU N N 15 . 2 2 13 13 GLU H H 1 0.77 0.08 . . . . . . . . . . 51065 1
7 . 2 2 14 14 THR N N 15 . 2 2 14 14 THR H H 1 0.79 0.08 . . . . . . . . . . 51065 1
8 . 2 2 15 15 ILE N N 15 . 2 2 15 15 ILE H H 1 0.83 0.08 . . . . . . . . . . 51065 1
9 . 2 2 16 16 ILE N N 15 . 2 2 16 16 ILE H H 1 1.03 0.1 . . . . . . . . . . 51065 1
10 . 2 2 17 17 ASN N N 15 . 2 2 17 17 ASN H H 1 0.84 0.08 . . . . . . . . . . 51065 1
11 . 2 2 18 18 THR N N 15 . 2 2 18 18 THR H H 1 0.7 0.07 . . . . . . . . . . 51065 1
12 . 2 2 19 19 PHE N N 15 . 2 2 19 19 PHE H H 1 0.98 0.1 . . . . . . . . . . 51065 1
13 . 2 2 20 20 HIS N N 15 . 2 2 20 20 HIS H H 1 0.86 0.09 . . . . . . . . . . 51065 1
14 . 2 2 21 21 GLN N N 15 . 2 2 21 21 GLN H H 1 0.83 0.08 . . . . . . . . . . 51065 1
15 . 2 2 22 22 TYR N N 15 . 2 2 22 22 TYR H H 1 0.88 0.09 . . . . . . . . . . 51065 1
16 . 2 2 23 23 SER N N 15 . 2 2 23 23 SER H H 1 0.78 0.08 . . . . . . . . . . 51065 1
17 . 2 2 24 24 VAL N N 15 . 2 2 24 24 VAL H H 1 0.83 0.08 . . . . . . . . . . 51065 1
18 . 2 2 25 25 LYS N N 15 . 2 2 25 25 LYS H H 1 0.78 0.08 . . . . . . . . . . 51065 1
19 . 2 2 26 26 LEU N N 15 . 2 2 26 26 LEU H H 1 0.91 0.09 . . . . . . . . . . 51065 1
20 . 2 2 27 27 GLY N N 15 . 2 2 27 27 GLY H H 1 0.89 0.09 . . . . . . . . . . 51065 1
21 . 2 2 28 28 HIS N N 15 . 2 2 28 28 HIS H H 1 0.9 0.09 . . . . . . . . . . 51065 1
22 . 2 2 30 30 ASP N N 15 . 2 2 30 30 ASP H H 1 1 0.1 . . . . . . . . . . 51065 1
23 . 2 2 31 31 THR N N 15 . 2 2 31 31 THR H H 1 0.73 0.07 . . . . . . . . . . 51065 1
24 . 2 2 32 32 LEU N N 15 . 2 2 32 32 LEU H H 1 0.82 0.08 . . . . . . . . . . 51065 1
25 . 2 2 33 33 ASN N N 15 . 2 2 33 33 ASN H H 1 0.82 0.08 . . . . . . . . . . 51065 1
26 . 2 2 34 34 GLN N N 15 . 2 2 34 34 GLN H H 1 0.93 0.09 . . . . . . . . . . 51065 1
27 . 2 2 35 35 GLY N N 15 . 2 2 35 35 GLY H H 1 0.73 0.07 . . . . . . . . . . 51065 1
28 . 2 2 36 36 GLU N N 15 . 2 2 36 36 GLU H H 1 0.78 0.08 . . . . . . . . . . 51065 1
29 . 2 2 37 37 PHE N N 15 . 2 2 37 37 PHE H H 1 0.82 0.08 . . . . . . . . . . 51065 1
30 . 2 2 38 38 LYS N N 15 . 2 2 38 38 LYS H H 1 0.81 0.08 . . . . . . . . . . 51065 1
31 . 2 2 39 39 GLU N N 15 . 2 2 39 39 GLU H H 1 0.92 0.09 . . . . . . . . . . 51065 1
32 . 2 2 40 40 LEU N N 15 . 2 2 40 40 LEU H H 1 0.85 0.08 . . . . . . . . . . 51065 1
33 . 2 2 42 42 ARG N N 15 . 2 2 42 42 ARG H H 1 0.74 0.07 . . . . . . . . . . 51065 1
34 . 2 2 43 43 LYS N N 15 . 2 2 43 43 LYS H H 1 0.79 0.08 . . . . . . . . . . 51065 1
35 . 2 2 44 44 ASP N N 15 . 2 2 44 44 ASP H H 1 1.04 0.1 . . . . . . . . . . 51065 1
36 . 2 2 45 45 LEU N N 15 . 2 2 45 45 LEU H H 1 0.81 0.08 . . . . . . . . . . 51065 1
37 . 2 2 46 46 GLN N N 15 . 2 2 46 46 GLN H H 1 0.81 0.08 . . . . . . . . . . 51065 1
38 . 2 2 47 47 ASN N N 15 . 2 2 47 47 ASN H H 1 0.87 0.09 . . . . . . . . . . 51065 1
39 . 2 2 48 48 PHE N N 15 . 2 2 48 48 PHE H H 1 0.85 0.09 . . . . . . . . . . 51065 1
40 . 2 2 49 49 LEU N N 15 . 2 2 49 49 LEU H H 1 0.87 0.09 . . . . . . . . . . 51065 1
41 . 2 2 50 50 LYS N N 15 . 2 2 50 50 LYS H H 1 0.79 0.08 . . . . . . . . . . 51065 1
42 . 2 2 52 52 GLU N N 15 . 2 2 52 52 GLU H H 1 0.7 0.07 . . . . . . . . . . 51065 1
43 . 2 2 53 53 ASN N N 15 . 2 2 53 53 ASN H H 1 0.79 0.08 . . . . . . . . . . 51065 1
44 . 2 2 56 56 GLU N N 15 . 2 2 56 56 GLU H H 1 0.79 0.08 . . . . . . . . . . 51065 1
45 . 2 2 57 57 LYS N N 15 . 2 2 57 57 LYS H H 1 0.74 0.07 . . . . . . . . . . 51065 1
46 . 2 2 58 58 VAL N N 15 . 2 2 58 58 VAL H H 1 0.85 0.09 . . . . . . . . . . 51065 1
47 . 2 2 60 60 GLU N N 15 . 2 2 60 60 GLU H H 1 0.68 0.07 . . . . . . . . . . 51065 1
48 . 2 2 61 61 HIS N N 15 . 2 2 61 61 HIS H H 1 1.03 0.1 . . . . . . . . . . 51065 1
49 . 2 2 62 62 ILE N N 15 . 2 2 62 62 ILE H H 1 0.85 0.09 . . . . . . . . . . 51065 1
50 . 2 2 63 63 MET N N 15 . 2 2 63 63 MET H H 1 0.98 0.1 . . . . . . . . . . 51065 1
51 . 2 2 64 64 GLU N N 15 . 2 2 64 64 GLU H H 1 0.76 0.08 . . . . . . . . . . 51065 1
52 . 2 2 65 65 ASP N N 15 . 2 2 65 65 ASP H H 1 0.76 0.08 . . . . . . . . . . 51065 1
53 . 2 2 66 66 LEU N N 15 . 2 2 66 66 LEU H H 1 0.83 0.08 . . . . . . . . . . 51065 1
54 . 2 2 67 67 ASP N N 15 . 2 2 67 67 ASP H H 1 0.81 0.08 . . . . . . . . . . 51065 1
55 . 2 2 68 68 THR N N 15 . 2 2 68 68 THR H H 1 0.66 0.07 . . . . . . . . . . 51065 1
56 . 2 2 69 69 ASN N N 15 . 2 2 69 69 ASN H H 1 0.71 0.07 . . . . . . . . . . 51065 1
57 . 2 2 70 70 ALA N N 15 . 2 2 70 70 ALA H H 1 0.68 0.07 . . . . . . . . . . 51065 1
58 . 2 2 71 71 ASP N N 15 . 2 2 71 71 ASP H H 1 0.7 0.07 . . . . . . . . . . 51065 1
59 . 2 2 72 72 LYS N N 15 . 2 2 72 72 LYS H H 1 0.78 0.08 . . . . . . . . . . 51065 1
60 . 2 2 73 73 GLN N N 15 . 2 2 73 73 GLN H H 1 0.73 0.07 . . . . . . . . . . 51065 1
61 . 2 2 74 74 LEU N N 15 . 2 2 74 74 LEU H H 1 0.71 0.07 . . . . . . . . . . 51065 1
62 . 2 2 75 75 SER N N 15 . 2 2 75 75 SER H H 1 0.77 0.08 . . . . . . . . . . 51065 1
63 . 2 2 76 76 PHE N N 15 . 2 2 76 76 PHE H H 1 0.72 0.07 . . . . . . . . . . 51065 1
64 . 2 2 77 77 GLU N N 15 . 2 2 77 77 GLU H H 1 0.7 0.07 . . . . . . . . . . 51065 1
65 . 2 2 78 78 GLU N N 15 . 2 2 78 78 GLU H H 1 0.77 0.08 . . . . . . . . . . 51065 1
66 . 2 2 79 79 PHE N N 15 . 2 2 79 79 PHE H H 1 0.88 0.09 . . . . . . . . . . 51065 1
67 . 2 2 80 80 ILE N N 15 . 2 2 80 80 ILE H H 1 0.84 0.08 . . . . . . . . . . 51065 1
68 . 2 2 81 81 MET N N 15 . 2 2 81 81 MET H H 1 0.76 0.08 . . . . . . . . . . 51065 1
69 . 2 2 82 82 LEU N N 15 . 2 2 82 82 LEU H H 1 0.84 0.08 . . . . . . . . . . 51065 1
70 . 2 2 83 83 MET N N 15 . 2 2 83 83 MET H H 1 0.86 0.09 . . . . . . . . . . 51065 1
71 . 2 2 84 84 ALA N N 15 . 2 2 84 84 ALA H H 1 0.83 0.08 . . . . . . . . . . 51065 1
72 . 2 2 85 85 ARG N N 15 . 2 2 85 85 ARG H H 1 0.85 0.09 . . . . . . . . . . 51065 1
73 . 2 2 86 86 LEU N N 15 . 2 2 86 86 LEU H H 1 0.81 0.08 . . . . . . . . . . 51065 1
74 . 2 2 88 88 TRP N N 15 . 2 2 88 88 TRP H H 1 0.91 0.09 . . . . . . . . . . 51065 1
75 . 2 2 89 89 ALA N N 15 . 2 2 89 89 ALA H H 1 0.77 0.08 . . . . . . . . . . 51065 1
76 . 2 2 90 90 SER N N 15 . 2 2 90 90 SER H H 1 0.85 0.09 . . . . . . . . . . 51065 1
77 . 2 2 91 91 HIS N N 15 . 2 2 91 91 HIS H H 1 0.76 0.08 . . . . . . . . . . 51065 1
78 . 2 2 93 93 LYS N N 15 . 2 2 93 93 LYS H H 1 0.5 0.05 . . . . . . . . . . 51065 1
79 . 2 2 94 94 MET N N 15 . 2 2 94 94 MET H H 1 0.5 0.05 . . . . . . . . . . 51065 1
80 . 2 2 99 99 GLU N N 15 . 2 2 99 99 GLU H H 1 0.33 0.03 . . . . . . . . . . 51065 1
81 . 2 2 100 100 GLY N N 15 . 2 2 100 100 GLY H H 1 0.32 0.03 . . . . . . . . . . 51065 1
82 . 2 2 102 102 GLY N N 15 . 2 2 102 102 GLY H H 1 0.38 0.04 . . . . . . . . . . 51065 1
83 . 2 2 103 103 HIS N N 15 . 2 2 103 103 HIS H H 1 0.52 0.05 . . . . . . . . . . 51065 1
84 . 2 2 104 104 HIS N N 15 . 2 2 104 104 HIS H H 1 0.31 0.03 . . . . . . . . . . 51065 1
85 . 2 2 105 105 HIS N N 15 . 2 2 105 105 HIS H H 1 0.37 0.04 . . . . . . . . . . 51065 1
86 . 2 2 108 108 GLY N N 15 . 2 2 108 108 GLY H H 1 0.27 0.03 . . . . . . . . . . 51065 1
87 . 2 2 109 109 LEU N N 15 . 2 2 109 109 LEU H H 1 0.26 0.03 . . . . . . . . . . 51065 1
88 . 2 2 110 110 GLY N N 15 . 2 2 110 110 GLY H H 1 0.13 0.01 . . . . . . . . . . 51065 1
89 . 2 2 111 111 GLU N N 15 . 2 2 111 111 GLU H H 1 0.14 0.01 . . . . . . . . . . 51065 1
90 . 2 2 112 112 GLY N N 15 . 2 2 112 112 GLY H H 1 0.19 0.02 . . . . . . . . . . 51065 1
91 . 2 2 113 113 THR N N 15 . 2 2 113 113 THR H H 1 0.29 0.03 . . . . . . . . . . 51065 1
stop_
save_