Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"
save_chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Entry_ID 969
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
. . 1 $sample_one . 969 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 4 4 GLU H H 1 8.04 . . 1 . . . . . . . . 969 1
2 . 1 1 4 4 GLU N N 15 117.8 . . 1 . . . . . . . . 969 1
3 . 1 1 5 5 VAL H H 1 7.01 . . 1 . . . . . . . . 969 1
4 . 1 1 5 5 VAL N N 15 121.4 . . 1 . . . . . . . . 969 1
5 . 1 1 7 7 PHE H H 1 8.27 . . 1 . . . . . . . . 969 1
6 . 1 1 7 7 PHE N N 15 120.9 . . 1 . . . . . . . . 969 1
7 . 1 1 8 8 LYS H H 1 6.88 . . 1 . . . . . . . . 969 1
8 . 1 1 8 8 LYS N N 15 115.7 . . 1 . . . . . . . . 969 1
9 . 1 1 9 9 ASN H H 1 8.79 . . 1 . . . . . . . . 969 1
10 . 1 1 9 9 ASN N N 15 120.8 . . 1 . . . . . . . . 969 1
11 . 1 1 10 10 LYS H H 1 8.94 . . 1 . . . . . . . . 969 1
12 . 1 1 10 10 LYS N N 15 117.3 . . 1 . . . . . . . . 969 1
13 . 1 1 13 13 VAL H H 1 6.54 . . 1 . . . . . . . . 969 1
14 . 1 1 13 13 VAL N N 15 115.3 . . 1 . . . . . . . . 969 1
15 . 1 1 14 14 ALA H H 1 7.32 . . 1 . . . . . . . . 969 1
16 . 1 1 14 14 ALA N N 15 124 . . 1 . . . . . . . . 969 1
17 . 1 1 16 16 HIS H H 1 6.73 . . 1 . . . . . . . . 969 1
18 . 1 1 16 16 HIS ND1 N 15 168.2 . . 1 . . . . . . . . 969 1
19 . 1 1 16 16 HIS HD1 H 1 8.7 . . 1 . . . . . . . . 969 1
20 . 1 1 16 16 HIS N N 15 119.7 . . 1 . . . . . . . . 969 1
21 . 1 1 17 17 ALA H H 1 7.68 . . 1 . . . . . . . . 969 1
22 . 1 1 17 17 ALA N N 15 122.4 . . 1 . . . . . . . . 969 1
23 . 1 1 18 18 ILE H H 1 8.25 . . 1 . . . . . . . . 969 1
24 . 1 1 18 18 ILE N N 15 119.5 . . 1 . . . . . . . . 969 1
25 . 1 1 22 22 MET H H 1 7.28 . . 1 . . . . . . . . 969 1
26 . 1 1 22 22 MET N N 15 130.9 . . 1 . . . . . . . . 969 1
27 . 1 1 23 23 VAL H H 1 6.88 . . 1 . . . . . . . . 969 1
28 . 1 1 23 23 VAL N N 15 124.6 . . 1 . . . . . . . . 969 1
29 . 1 1 24 24 GLY H H 1 6.55 . . 1 . . . . . . . . 969 1
30 . 1 1 24 24 GLY N N 15 105.1 . . 1 . . . . . . . . 969 1
31 . 1 1 26 26 ALA H H 1 8.34 . . 1 . . . . . . . . 969 1
32 . 1 1 26 26 ALA N N 15 124.6 . . 1 . . . . . . . . 969 1
33 . 1 1 27 27 TYR H H 1 7.49 . . 1 . . . . . . . . 969 1
34 . 1 1 27 27 TYR N N 15 125.8 . . 1 . . . . . . . . 969 1
35 . 1 1 28 28 LYS H H 1 8.8 . . 1 . . . . . . . . 969 1
36 . 1 1 28 28 LYS N N 15 119 . . 1 . . . . . . . . 969 1
37 . 1 1 29 29 ASP H H 1 6.75 . . 1 . . . . . . . . 969 1
38 . 1 1 29 29 ASP N N 15 121.3 . . 1 . . . . . . . . 969 1
39 . 1 1 30 30 VAL H H 1 7.51 . . 1 . . . . . . . . 969 1
40 . 1 1 30 30 VAL N N 15 124.5 . . 1 . . . . . . . . 969 1
41 . 1 1 31 31 ALA H H 1 8.55 . . 1 . . . . . . . . 969 1
42 . 1 1 31 31 ALA N N 15 123.5 . . 1 . . . . . . . . 969 1
43 . 1 1 32 32 ALA H H 1 7.53 . . 1 . . . . . . . . 969 1
44 . 1 1 32 32 ALA N N 15 119.5 . . 1 . . . . . . . . 969 1
45 . 1 1 33 33 LYS H H 1 7.71 . . 1 . . . . . . . . 969 1
46 . 1 1 33 33 LYS N N 15 120.9 . . 1 . . . . . . . . 969 1
47 . 1 1 34 34 PHE H H 1 7.55 . . 1 . . . . . . . . 969 1
48 . 1 1 34 34 PHE N N 15 115.5 . . 1 . . . . . . . . 969 1
49 . 1 1 40 40 ALA H H 1 7.57 . . 1 . . . . . . . . 969 1
50 . 1 1 40 40 ALA N N 15 124 . . 1 . . . . . . . . 969 1
51 . 1 1 42 42 ALA H H 1 7.55 . . 1 . . . . . . . . 969 1
52 . 1 1 42 42 ALA N N 15 122.3 . . 1 . . . . . . . . 969 1
53 . 1 1 43 43 GLU H H 1 7.61 . . 1 . . . . . . . . 969 1
54 . 1 1 43 43 GLU N N 15 120.6 . . 1 . . . . . . . . 969 1
55 . 1 1 44 44 LEU H H 1 8.45 . . 1 . . . . . . . . 969 1
56 . 1 1 44 44 LEU N N 15 120.2 . . 1 . . . . . . . . 969 1
57 . 1 1 46 46 GLN H H 1 7.18 . . 1 . . . . . . . . 969 1
58 . 1 1 46 46 GLN N N 15 116.4 . . 1 . . . . . . . . 969 1
59 . 1 1 48 48 ILE H H 1 7.98 . . 1 . . . . . . . . 969 1
60 . 1 1 48 48 ILE N N 15 119.5 . . 1 . . . . . . . . 969 1
61 . 1 1 49 49 LYS H H 1 7.11 . . 1 . . . . . . . . 969 1
62 . 1 1 49 49 LYS N N 15 117.7 . . 1 . . . . . . . . 969 1
63 . 1 1 50 50 ASN H H 1 7.96 . . 1 . . . . . . . . 969 1
64 . 1 1 50 50 ASN N N 15 113.5 . . 1 . . . . . . . . 969 1
65 . 1 1 51 51 GLY H H 1 7.32 . . 1 . . . . . . . . 969 1
66 . 1 1 51 51 GLY N N 15 112 . . 1 . . . . . . . . 969 1
67 . 1 1 52 52 SER H H 1 7.16 . . 1 . . . . . . . . 969 1
68 . 1 1 52 52 SER N N 15 110.4 . . 1 . . . . . . . . 969 1
69 . 1 1 54 54 GLY H H 1 8.38 . . 1 . . . . . . . . 969 1
70 . 1 1 54 54 GLY N N 15 112.6 . . 1 . . . . . . . . 969 1
71 . 1 1 55 55 VAL H H 1 10.43 . . 1 . . . . . . . . 969 1
72 . 1 1 55 55 VAL N N 15 129.2 . . 1 . . . . . . . . 969 1
73 . 1 1 57 57 GLY H H 1 8.03 . . 1 . . . . . . . . 969 1
74 . 1 1 57 57 GLY N N 15 111.3 . . 1 . . . . . . . . 969 1
75 . 1 1 59 59 ILE H H 1 7.42 . . 1 . . . . . . . . 969 1
76 . 1 1 59 59 ILE N N 15 124.1 . . 1 . . . . . . . . 969 1
77 . 1 1 61 61 MET H H 1 8.58 . . 1 . . . . . . . . 969 1
78 . 1 1 61 61 MET N N 15 122.3 . . 1 . . . . . . . . 969 1
79 . 1 1 64 64 ASN H H 1 6.88 . . 1 . . . . . . . . 969 1
80 . 1 1 64 64 ASN N N 15 119.5 . . 1 . . . . . . . . 969 1
81 . 1 1 66 66 VAL H H 1 7.62 . . 1 . . . . . . . . 969 1
82 . 1 1 66 66 VAL N N 15 115.4 . . 1 . . . . . . . . 969 1
83 . 1 1 67 67 SER H H 1 9.21 . . 1 . . . . . . . . 969 1
84 . 1 1 67 67 SER N N 15 120 . . 1 . . . . . . . . 969 1
85 . 1 1 70 70 GLU H H 1 7.8 . . 1 . . . . . . . . 969 1
86 . 1 1 70 70 GLU N N 15 122.8 . . 1 . . . . . . . . 969 1
87 . 1 1 71 71 ALA H H 1 8.77 . . 1 . . . . . . . . 969 1
88 . 1 1 71 71 ALA N N 15 122.9 . . 1 . . . . . . . . 969 1
89 . 1 1 72 72 GLN H H 1 8.06 . . 1 . . . . . . . . 969 1
90 . 1 1 72 72 GLN N N 15 119.1 . . 1 . . . . . . . . 969 1
91 . 1 1 73 73 THR H H 1 8.16 . . 1 . . . . . . . . 969 1
92 . 1 1 73 73 THR N N 15 119.6 . . 1 . . . . . . . . 969 1
93 . 1 1 74 74 LEU H H 1 8.53 . . 1 . . . . . . . . 969 1
94 . 1 1 74 74 LEU N N 15 123.6 . . 1 . . . . . . . . 969 1
95 . 1 1 75 75 ALA H H 1 8.76 . . 1 . . . . . . . . 969 1
96 . 1 1 75 75 ALA N N 15 124.2 . . 1 . . . . . . . . 969 1
97 . 1 1 76 76 LYS H H 1 8.13 . . 1 . . . . . . . . 969 1
98 . 1 1 76 76 LYS N N 15 117.6 . . 1 . . . . . . . . 969 1
99 . 1 1 77 77 TRP H H 1 7.78 . . 1 . . . . . . . . 969 1
100 . 1 1 77 77 TRP NE1 N 15 132.2 . . 1 . . . . . . . . 969 1
101 . 1 1 77 77 TRP HE1 H 1 10.08 . . 1 . . . . . . . . 969 1
102 . 1 1 77 77 TRP N N 15 122.8 . . 1 . . . . . . . . 969 1
103 . 1 1 78 78 VAL H H 1 9.11 . . 1 . . . . . . . . 969 1
104 . 1 1 78 78 VAL N N 15 125.6 . . 1 . . . . . . . . 969 1
105 . 1 1 79 79 LEU H H 1 7.72 . . 1 . . . . . . . . 969 1
106 . 1 1 79 79 LEU N N 15 115.9 . . 1 . . . . . . . . 969 1
107 . 1 1 80 80 SER H H 1 7.41 . . 1 . . . . . . . . 969 1
108 . 1 1 80 80 SER N N 15 115 . . 1 . . . . . . . . 969 1
109 . 1 1 81 81 GLN H H 1 7.12 . . 1 . . . . . . . . 969 1
110 . 1 1 81 81 GLN N N 15 122.8 . . 1 . . . . . . . . 969 1
111 . 1 1 82 82 LYS H H 1 7.38 . . 1 . . . . . . . . 969 1
112 . 1 1 82 82 LYS N N 15 126.9 . . 1 . . . . . . . . 969 1
stop_
save_