Content for NMR-STAR saveframe, "assigned_chemical_shifts_two"
save_assigned_chemical_shifts_two
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_two
_Assigned_chem_shift_list.Entry_ID 4042
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_two
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_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 . 4042 2
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 3 3 GLU N N 15 124.55 . . 1 . . . . . . . . 4042 2
2 . 1 1 5 5 ARG N N 15 119.38 . . 1 . . . . . . . . 4042 2
3 . 1 1 5 5 ARG NE N 15 84.8 . . 1 . . . . . . . . 4042 2
4 . 1 1 6 6 ALA N N 15 127.14 . . 1 . . . . . . . . 4042 2
5 . 1 1 7 7 GLU N N 15 122.34 . . 1 . . . . . . . . 4042 2
6 . 1 1 8 8 ASP N N 15 122.30 . . 1 . . . . . . . . 4042 2
7 . 1 1 9 9 GLY N N 15 120.65 . . 1 . . . . . . . . 4042 2
8 . 1 1 10 10 HIS N N 15 119.61 . . 1 . . . . . . . . 4042 2
9 . 1 1 11 11 ALA N N 15 111.18 . . 1 . . . . . . . . 4042 2
10 . 1 1 12 12 HIS N N 15 118.95 . . 1 . . . . . . . . 4042 2
11 . 1 1 13 13 ASP N N 15 111.00 . . 1 . . . . . . . . 4042 2
12 . 1 1 14 14 TYR N N 15 114.72 . . 1 . . . . . . . . 4042 2
13 . 1 1 15 15 VAL N N 15 124.58 . . 1 . . . . . . . . 4042 2
14 . 1 1 16 16 ASN N N 15 117.38 . . 1 . . . . . . . . 4042 2
15 . 1 1 16 16 ASN ND2 N 15 114.24 . . 1 . . . . . . . . 4042 2
16 . 1 1 17 17 GLU N N 15 117.18 . . 1 . . . . . . . . 4042 2
17 . 1 1 18 18 ALA N N 15 128.49 . . 1 . . . . . . . . 4042 2
18 . 1 1 19 19 ALA N N 15 114.57 . . 1 . . . . . . . . 4042 2
19 . 1 1 20 20 ASP N N 15 118.16 . . 1 . . . . . . . . 4042 2
20 . 1 1 21 21 ALA N N 15 124.44 . . 1 . . . . . . . . 4042 2
21 . 1 1 22 22 SER N N 15 111.43 . . 1 . . . . . . . . 4042 2
22 . 1 1 23 23 GLY N N 15 112.31 . . 1 . . . . . . . . 4042 2
23 . 1 1 24 24 HIS N N 15 126.27 . . 1 . . . . . . . . 4042 2
24 . 1 1 26 26 ARG N N 15 118.67 . . 1 . . . . . . . . 4042 2
25 . 1 1 26 26 ARG NE N 15 84.9 . . 1 . . . . . . . . 4042 2
26 . 1 1 27 27 TYR N N 15 121.69 . . 1 . . . . . . . . 4042 2
27 . 1 1 28 28 GLN N N 15 125.11 . . 1 . . . . . . . . 4042 2
28 . 1 1 28 28 GLN NE2 N 15 112.16 . . 1 . . . . . . . . 4042 2
29 . 1 1 29 29 GLU N N 15 121.81 . . 1 . . . . . . . . 4042 2
30 . 1 1 30 30 GLY N N 15 114.94 . . 1 . . . . . . . . 4042 2
31 . 1 1 31 31 GLN N N 15 122.30 . . 1 . . . . . . . . 4042 2
32 . 1 1 31 31 GLN NE2 N 15 108.20 . . 1 . . . . . . . . 4042 2
33 . 1 1 32 32 LEU N N 15 123.55 . . 1 . . . . . . . . 4042 2
34 . 1 1 33 33 CYS H H 1 9.28 . . 1 . . . . . . . . 4042 2
35 . 1 1 33 33 CYS HB2 H 1 16.93 . . 2 . . . . . . . . 4042 2
36 . 1 1 33 33 CYS HB3 H 1 7.72 . . 2 . . . . . . . . 4042 2
37 . 1 1 33 33 CYS N N 15 128.93 . . 1 . . . . . . . . 4042 2
38 . 1 1 34 34 GLU N N 15 109.28 . . 1 . . . . . . . . 4042 2
39 . 1 1 35 35 ASN N N 15 116.75 . . 1 . . . . . . . . 4042 2
40 . 1 1 35 35 ASN ND2 N 15 115.96 . . 1 . . . . . . . . 4042 2
41 . 1 1 37 37 ALA N N 15 138.97 . . 1 . . . . . . . . 4042 2
42 . 1 1 40 40 GLY N N 15 118.99 . . 1 . . . . . . . . 4042 2
43 . 1 1 41 41 GLU N N 15 114.33 . . 1 . . . . . . . . 4042 2
44 . 1 1 42 42 ALA N N 15 123.61 . . 1 . . . . . . . . 4042 2
45 . 1 1 43 43 VAL N N 15 120.70 . . 1 . . . . . . . . 4042 2
46 . 1 1 44 44 GLN N N 15 116.89 . . 1 . . . . . . . . 4042 2
47 . 1 1 44 44 GLN NE2 N 15 111.89 . . 1 . . . . . . . . 4042 2
48 . 1 1 45 45 ASP N N 15 121.47 . . 1 . . . . . . . . 4042 2
49 . 1 1 46 46 GLY N N 15 106.99 . . 1 . . . . . . . . 4042 2
50 . 1 1 47 47 TRP N N 15 121.69 . . 1 . . . . . . . . 4042 2
51 . 1 1 48 48 GLY N N 15 112.24 . . 1 . . . . . . . . 4042 2
52 . 1 1 49 49 ARG N N 15 116.71 . . 1 . . . . . . . . 4042 2
53 . 1 1 49 49 ARG NE N 15 84.2 . . 1 . . . . . . . . 4042 2
54 . 1 1 50 50 CYS HB2 H 1 14.33 . . 2 . . . . . . . . 4042 2
55 . 1 1 50 50 CYS HB3 H 1 4.70 . . 2 . . . . . . . . 4042 2
56 . 1 1 50 50 CYS N N 15 137.27 . . 1 . . . . . . . . 4042 2
57 . 1 1 51 51 THR N N 15 126.14 . . 1 . . . . . . . . 4042 2
58 . 1 1 55 55 PHE N N 15 119.03 . . 1 . . . . . . . . 4042 2
59 . 1 1 57 57 GLU N N 15 115.87 . . 1 . . . . . . . . 4042 2
60 . 1 1 58 58 VAL N N 15 109.64 . . 1 . . . . . . . . 4042 2
61 . 1 1 59 59 LEU N N 15 119.44 . . 1 . . . . . . . . 4042 2
62 . 1 1 60 60 VAL N N 15 114.26 . . 1 . . . . . . . . 4042 2
63 . 1 1 61 61 LYS N N 15 125.28 . . 1 . . . . . . . . 4042 2
64 . 1 1 62 62 ALA N N 15 126.01 . . 1 . . . . . . . . 4042 2
65 . 1 1 63 63 GLU N N 15 109.46 . . 1 . . . . . . . . 4042 2
66 . 1 1 64 64 GLY N N 15 111.10 . . 1 . . . . . . . . 4042 2
67 . 1 1 67 67 SER N N 15 113.80 . . 1 . . . . . . . . 4042 2
68 . 1 1 68 68 VAL N N 15 142.76 . . 1 . . . . . . . . 4042 2
69 . 1 1 70 70 ALA N N 15 142.69 . . 1 . . . . . . . . 4042 2
70 . 1 1 72 72 ALA N N 15 125.38 . . 1 . . . . . . . . 4042 2
71 . 1 1 73 73 SER N N 15 119.78 . . 1 . . . . . . . . 4042 2
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