Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34414
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_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 .
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_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 '2D 1H-1H NOESY' . . . 34414 1
2 '2D 1H-1H TOCSY' . . . 34414 1
3 '2D 1H-1H COSY' . . . 34414 1
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_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $software_2 . . 34414 1
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_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 1 1 GLN H H 1 8.443 0.06 . 1 . . . . A 27 GLN H1 . 34414 1
2 . 1 . 1 1 1 GLN HA H 1 4.372 0.08 . 1 . . . . A 27 GLN HA . 34414 1
3 . 1 . 1 1 1 GLN HB2 H 1 1.957 0.08 . . . . . . A 27 GLN HB2 . 34414 1
4 . 1 . 1 1 1 GLN HB3 H 1 1.854 0.08 . . . . . . A 27 GLN HB3 . 34414 1
5 . 1 . 1 1 1 GLN HG2 H 1 2.230 0.09 . . . . . . A 27 GLN HG2 . 34414 1
6 . 1 . 1 1 1 GLN HG3 H 1 2.230 0.09 . . . . . . A 27 GLN HG3 . 34414 1
7 . 1 . 1 1 1 GLN HE21 H 1 7.340 0.07 . . . . . . A 27 GLN HE21 . 34414 1
8 . 1 . 1 1 1 GLN HE22 H 1 7.020 0.07 . . . . . . A 27 GLN HE22 . 34414 1
9 . 1 . 1 2 2 ASP H H 1 8.283 0.08 . 1 . . . . A 28 ASP H . 34414 1
10 . 1 . 1 2 2 ASP HB2 H 1 2.852 0.09 . . . . . . A 28 ASP HB2 . 34414 1
11 . 1 . 1 2 2 ASP HB3 H 1 2.767 0.07 . . . . . . A 28 ASP HB3 . 34414 1
12 . 1 . 1 3 3 VAL H H 1 7.828 0.06 . 1 . . . . A 29 VAL H . 34414 1
13 . 1 . 1 3 3 VAL HA H 1 3.880 0.07 . 1 . . . . A 29 VAL HA . 34414 1
14 . 1 . 1 3 3 VAL HB H 1 1.874 0.08 . 1 . . . . A 29 VAL HB . 34414 1
15 . 1 . 1 3 3 VAL HG11 H 1 0.907 0.08 . . . . . . A 29 VAL HG11 . 34414 1
16 . 1 . 1 3 3 VAL HG12 H 1 0.907 0.08 . . . . . . A 29 VAL HG12 . 34414 1
17 . 1 . 1 3 3 VAL HG13 H 1 0.907 0.08 . . . . . . A 29 VAL HG13 . 34414 1
18 . 1 . 1 3 3 VAL HG21 H 1 0.907 0.08 . . . . . . A 29 VAL HG21 . 34414 1
19 . 1 . 1 3 3 VAL HG22 H 1 0.907 0.08 . . . . . . A 29 VAL HG22 . 34414 1
20 . 1 . 1 3 3 VAL HG23 H 1 0.907 0.08 . . . . . . A 29 VAL HG23 . 34414 1
21 . 1 . 1 4 4 ASN H H 1 8.524 0.08 . 1 . . . . A 30 ASN H . 34414 1
22 . 1 . 1 4 4 ASN HA H 1 4.581 0.01 . 1 . . . . A 30 ASN HA . 34414 1
23 . 1 . 1 4 4 ASN HB2 H 1 2.920 0.07 . . . . . . A 30 ASN HB2 . 34414 1
24 . 1 . 1 4 4 ASN HB3 H 1 2.852 0.06 . . . . . . A 30 ASN HB3 . 34414 1
25 . 1 . 1 5 5 THR H H 1 7.640 0.07 . 1 . . . . A 31 THR H . 34414 1
26 . 1 . 1 5 5 THR HA H 1 4.346 0.08 . 1 . . . . A 31 THR HA . 34414 1
27 . 1 . 1 5 5 THR HB H 1 4.170 0.11 . 1 . . . . A 31 THR HB . 34414 1
28 . 1 . 1 5 5 THR HG21 H 1 1.13 0.06 . 1 . . . . A 31 THR HG1 . 34414 1
29 . 1 . 1 5 5 THR HG22 H 1 1.13 0.06 . 1 . . . . A 31 THR HG1 . 34414 1
30 . 1 . 1 5 5 THR HG23 H 1 1.13 0.06 . 1 . . . . A 31 THR HG1 . 34414 1
31 . 1 . 1 6 6 ALA H H 1 8.170 0.08 . 1 . . . . A 32 ALA H . 34414 1
32 . 1 . 1 6 6 ALA HA H 1 4.208 0.07 . 1 . . . . A 32 ALA HA . 34414 1
33 . 1 . 1 6 6 ALA HB1 H 1 1.275 0.07 . 1 . . . . A 32 ALA HB1 . 34414 1
34 . 1 . 1 6 6 ALA HB2 H 1 1.275 0.07 . 1 . . . . A 32 ALA HB2 . 34414 1
35 . 1 . 1 6 6 ALA HB3 H 1 1.275 0.07 . 1 . . . . A 32 ALA HB3 . 34414 1
36 . 1 . 1 7 7 VAL H H 1 8.044 0.07 . 1 . . . . A 33 VAL H . 34414 1
37 . 1 . 1 7 7 VAL HA H 1 3.999 0.07 . 1 . . . . A 33 VAL HA . 34414 1
38 . 1 . 1 7 7 VAL HB H 1 2.111 0.09 . 1 . . . . A 33 VAL HB . 34414 1
39 . 1 . 1 7 7 VAL HG11 H 1 0.854 0.06 . . . . . . A 33 VAL HG11 . 34414 1
40 . 1 . 1 7 7 VAL HG12 H 1 0.854 0.06 . . . . . . A 33 VAL HG12 . 34414 1
41 . 1 . 1 7 7 VAL HG13 H 1 0.854 0.06 . . . . . . A 33 VAL HG13 . 34414 1
42 . 1 . 1 7 7 VAL HG21 H 1 0.854 0.06 . . . . . . A 33 VAL HG21 . 34414 1
43 . 1 . 1 7 7 VAL HG22 H 1 0.854 0.06 . . . . . . A 33 VAL HG22 . 34414 1
44 . 1 . 1 7 7 VAL HG23 H 1 0.854 0.06 . . . . . . A 33 VAL HG23 . 34414 1
45 . 1 . 1 8 8 ALA H H 1 8.160 0.08 . 1 . . . . A 34 ALA H . 34414 1
46 . 1 . 1 8 8 ALA HA H 1 4.401 0.05 . 1 . . . . A 34 ALA HA . 34414 1
47 . 1 . 1 8 8 ALA HB1 H 1 1.05 0.07 . 1 . . . . A 34 ALA HB1 . 34414 1
48 . 1 . 1 8 8 ALA HB2 H 1 1.05 0.07 . 1 . . . . A 34 ALA HB2 . 34414 1
49 . 1 . 1 8 8 ALA HB3 H 1 1.05 0.07 . 1 . . . . A 34 ALA HB3 . 34414 1
50 . 1 . 1 9 9 TRP H H 1 7.821 0.07 . 1 . . . . A 35 TRP H . 34414 1
51 . 1 . 1 9 9 TRP HA H 1 4.604 0.00 . 1 . . . . A 35 TRP HA . 34414 1
52 . 1 . 1 9 9 TRP HB2 H 1 3.221 0.06 . . . . . . A 35 TRP HB2 . 34414 1
53 . 1 . 1 9 9 TRP HB3 H 1 3.221 0.06 . . . . . . A 35 TRP HB3 . 34414 1
54 . 1 . 1 9 9 TRP HD1 H 1 7.244 0.08 . 1 . . . . A 35 TRP HD1 . 34414 1
55 . 1 . 1 9 9 TRP HE1 H 1 10.120 0.09 . 1 . . . . A 35 TRP HE1 . 34414 1
56 . 1 . 1 9 9 TRP HE3 H 1 6.852 0.07 . 1 . . . . A 35 TRP HE3 . 34414 1
57 . 1 . 1 9 9 TRP HZ2 H 1 7.501 0.06 . 1 . . . . A 35 TRP HZ2 . 34414 1
58 . 1 . 1 9 9 TRP HH2 H 1 7.159 0.07 . 1 . . . . A 35 TRP HH2 . 34414 1
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