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 52515
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Small hydrophobic protein 1-34 in DHPC'
_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-15N HSQC' . . . 52515 1
2 '2D 1H-13C HSQC' . . . 52515 1
3 '2D 1H-1H TOCSY' . . . 52515 1
4 '2D 1H-1H ROESY' . . . 52515 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
1 $software_1 . . 52515 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 PRO HA H 1 4.242 0.000 . 1 . . . . . 1 PRO HA . 52515 1
2 . 1 . 1 1 1 PRO CA C 13 61.759 0.000 . 1 . . . . . 1 PRO CA . 52515 1
3 . 1 . 1 2 2 ALA HA H 1 4.357 0.000 . 1 . . . . . 2 ALA HA . 52515 1
4 . 1 . 1 2 2 ALA CA C 13 52.556 0.000 . 1 . . . . . 2 ALA CA . 52515 1
5 . 1 . 1 3 3 ILE H H 1 8.383 0.001 . 1 . . . . . 3 ILE H . 52515 1
6 . 1 . 1 3 3 ILE HA H 1 4.122 0.000 . 1 . . . . . 3 ILE HA . 52515 1
7 . 1 . 1 3 3 ILE HB H 1 1.802 0.002 . 1 . . . . . 3 ILE HB . 52515 1
8 . 1 . 1 3 3 ILE HG21 H 1 0.876 0.002 . 1 . . . . . 3 ILE HG21 . 52515 1
9 . 1 . 1 3 3 ILE HG22 H 1 0.876 0.002 . 1 . . . . . 3 ILE HG22 . 52515 1
10 . 1 . 1 3 3 ILE HG23 H 1 0.876 0.002 . 1 . . . . . 3 ILE HG23 . 52515 1
11 . 1 . 1 3 3 ILE CB C 13 38.781 0.000 . 1 . . . . . 3 ILE CB . 52515 1
12 . 1 . 1 3 3 ILE CG2 C 13 17.380 0.000 . 1 . . . . . 3 ILE CG2 . 52515 1
13 . 1 . 1 3 3 ILE N N 15 121.447 0.000 . 1 . . . . . 3 ILE N . 52515 1
14 . 1 . 1 4 4 GLN H H 1 8.632 0.000 . 1 . . . . . 4 GLN H . 52515 1
15 . 1 . 1 4 4 GLN HA H 1 4.612 0.001 . 1 . . . . . 4 GLN HA . 52515 1
16 . 1 . 1 4 4 GLN HB2 H 1 2.059 0.002 . 2 . . . . . 4 GLN HB2 . 52515 1
17 . 1 . 1 4 4 GLN HB3 H 1 1.912 0.003 . 2 . . . . . 4 GLN HB3 . 52515 1
18 . 1 . 1 4 4 GLN HG2 H 1 2.370 0.001 . 1 . . . . . 4 GLN HG2 . 52515 1
19 . 1 . 1 4 4 GLN CA C 13 53.370 0.000 . 1 . . . . . 4 GLN CA . 52515 1
20 . 1 . 1 4 4 GLN CB C 13 28.966 0.000 . 1 . . . . . 4 GLN CB . 52515 1
21 . 1 . 1 4 4 GLN CG C 13 33.383 0.000 . 1 . . . . . 4 GLN CG . 52515 1
22 . 1 . 1 4 4 GLN N N 15 127.076 0.000 . 1 . . . . . 4 GLN N . 52515 1
23 . 1 . 1 5 5 PRO HA H 1 4.374 0.000 . 1 . . . . . 5 PRO HA . 52515 1
24 . 1 . 1 5 5 PRO CA C 13 62.215 0.000 . 1 . . . . . 5 PRO CA . 52515 1
25 . 1 . 1 6 6 PRO HA H 1 4.355 0.000 . 1 . . . . . 6 PRO HA . 52515 1
26 . 1 . 1 6 6 PRO CA C 13 62.807 0.000 . 1 . . . . . 6 PRO CA . 52515 1
27 . 1 . 1 7 7 LEU H H 1 8.313 0.001 . 1 . . . . . 7 LEU H . 52515 1
28 . 1 . 1 7 7 LEU HA H 1 4.203 0.003 . 1 . . . . . 7 LEU HA . 52515 1
29 . 1 . 1 7 7 LEU HB2 H 1 1.540 0.000 . 2 . . . . . 7 LEU HB2 . 52515 1
30 . 1 . 1 7 7 LEU HB3 H 1 1.429 0.000 . 2 . . . . . 7 LEU HB3 . 52515 1
31 . 1 . 1 7 7 LEU CA C 13 55.442 0.000 . 1 . . . . . 7 LEU CA . 52515 1
32 . 1 . 1 7 7 LEU N N 15 122.158 0.000 . 1 . . . . . 7 LEU N . 52515 1
33 . 1 . 1 8 8 TYR H H 1 8.088 0.000 . 1 . . . . . 8 TYR H . 52515 1
34 . 1 . 1 8 8 TYR HA H 1 4.548 0.002 . 1 . . . . . 8 TYR HA . 52515 1
35 . 1 . 1 8 8 TYR HB2 H 1 3.025 0.003 . 2 . . . . . 8 TYR HB2 . 52515 1
36 . 1 . 1 8 8 TYR HB3 H 1 2.949 0.002 . 2 . . . . . 8 TYR HB3 . 52515 1
37 . 1 . 1 8 8 TYR CA C 13 57.480 0.000 . 1 . . . . . 8 TYR CA . 52515 1
38 . 1 . 1 8 8 TYR CB C 13 38.471 0.001 . 1 . . . . . 8 TYR CB . 52515 1
39 . 1 . 1 8 8 TYR N N 15 120.005 0.000 . 1 . . . . . 8 TYR N . 52515 1
40 . 1 . 1 9 9 LEU H H 1 8.104 0.000 . 1 . . . . . 9 LEU H . 52515 1
41 . 1 . 1 9 9 LEU HA H 1 4.329 0.002 . 1 . . . . . 9 LEU HA . 52515 1
42 . 1 . 1 9 9 LEU HB2 H 1 1.556 0.000 . 2 . . . . . 9 LEU HB2 . 52515 1
43 . 1 . 1 9 9 LEU HB3 H 1 1.441 0.000 . 2 . . . . . 9 LEU HB3 . 52515 1
44 . 1 . 1 9 9 LEU CA C 13 55.043 0.000 . 1 . . . . . 9 LEU CA . 52515 1
45 . 1 . 1 9 9 LEU N N 15 123.705 0.000 . 1 . . . . . 9 LEU N . 52515 1
46 . 1 . 1 10 10 THR H H 1 7.997 0.002 . 1 . . . . . 10 THR H . 52515 1
47 . 1 . 1 10 10 THR HA H 1 4.120 0.002 . 1 . . . . . 10 THR HA . 52515 1
48 . 1 . 1 10 10 THR HB H 1 4.120 0.000 . 1 . . . . . 10 THR HB . 52515 1
49 . 1 . 1 10 10 THR HG21 H 1 1.112 0.002 . 1 . . . . . 10 THR HG21 . 52515 1
50 . 1 . 1 10 10 THR HG22 H 1 1.112 0.002 . 1 . . . . . 10 THR HG22 . 52515 1
51 . 1 . 1 10 10 THR HG23 H 1 1.112 0.002 . 1 . . . . . 10 THR HG23 . 52515 1
52 . 1 . 1 10 10 THR CA C 13 60.912 0.000 . 1 . . . . . 10 THR CA . 52515 1
53 . 1 . 1 10 10 THR CB C 13 69.918 0.000 . 1 . . . . . 10 THR CB . 52515 1
54 . 1 . 1 10 10 THR CG2 C 13 21.404 0.000 . 1 . . . . . 10 THR CG2 . 52515 1
55 . 1 . 1 10 10 THR N N 15 114.577 0.000 . 1 . . . . . 10 THR N . 52515 1
56 . 1 . 1 11 11 PHE H H 1 8.229 0.001 . 1 . . . . . 11 PHE H . 52515 1
57 . 1 . 1 11 11 PHE HA H 1 4.618 0.001 . 1 . . . . . 11 PHE HA . 52515 1
58 . 1 . 1 11 11 PHE HB2 H 1 3.172 0.002 . 2 . . . . . 11 PHE HB2 . 52515 1
59 . 1 . 1 11 11 PHE HB3 H 1 3.002 0.003 . 2 . . . . . 11 PHE HB3 . 52515 1
60 . 1 . 1 11 11 PHE CA C 13 57.392 0.000 . 1 . . . . . 11 PHE CA . 52515 1
61 . 1 . 1 11 11 PHE CB C 13 39.799 0.002 . 1 . . . . . 11 PHE CB . 52515 1
62 . 1 . 1 11 11 PHE N N 15 122.861 0.000 . 1 . . . . . 11 PHE N . 52515 1
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