Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 51009
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'Flutemetamol-bound Ab40 in vitro minor conformation'
_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 13C-detected NCA' . . . 51009 2
2 '2D 13C-detected CORD' . . . 51009 2
3 '3D NCACX' . . . 51009 2
4 '3D NCOCX' . . . 51009 2
5 '3D CONCA' . . . 51009 2
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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 . . 51009 2
2 $software_2 . . 51009 2
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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 . 2 . 1 13 13 HIS C C 13 173.181 0.000 . . . . . . . 13 HIS C . 51009 2
2 . 2 . 1 21 21 ALA C C 13 175.339 0.130 . . . . . . . 21 ALA C . 51009 2
3 . 2 . 1 21 21 ALA CA C 13 50.849 0.082 . . . . . . . 21 ALA CA . 51009 2
4 . 2 . 1 21 21 ALA CB C 13 21.973 0.068 . . . . . . . 21 ALA CB . 51009 2
5 . 2 . 1 21 21 ALA N N 15 123.672 0.072 . . . . . . . 21 ALA N . 51009 2
6 . 2 . 1 22 22 GLU C C 13 174.375 0.000 . . . . . . . 22 GLU C . 51009 2
7 . 2 . 1 22 22 GLU CA C 13 53.626 0.025 . . . . . . . 22 GLU CA . 51009 2
8 . 2 . 1 22 22 GLU CB C 13 33.933 0.000 . . . . . . . 22 GLU CB . 51009 2
9 . 2 . 1 22 22 GLU CG C 13 37.027 0.000 . . . . . . . 22 GLU CG . 51009 2
10 . 2 . 1 22 22 GLU N N 15 122.212 0.101 . . . . . . . 22 GLU N . 51009 2
11 . 2 . 1 31 31 ILE CB C 13 39.845 0.000 . . . . . . . 31 ILE CB . 51009 2
12 . 2 . 1 31 31 ILE CG1 C 13 28.492 0.010 . . . . . . . 31 ILE CG1 . 51009 2
13 . 2 . 1 31 31 ILE CD1 C 13 14.593 0.000 . . . . . . . 31 ILE CD . 51009 2
14 . 2 . 1 32 32 ILE C C 13 175.783 0.134 . . . . . . . 32 ILE C . 51009 2
15 . 2 . 1 32 32 ILE CA C 13 56.159 0.037 . . . . . . . 32 ILE CA . 51009 2
16 . 2 . 1 32 32 ILE CB C 13 42.867 0.000 . . . . . . . 32 ILE CB . 51009 2
17 . 2 . 1 32 32 ILE CG1 C 13 27.148 0.000 . . . . . . . 32 ILE CG1 . 51009 2
18 . 2 . 1 32 32 ILE CG2 C 13 17.095 0.000 . . . . . . . 32 ILE CG2 . 51009 2
19 . 2 . 1 32 32 ILE CD1 C 13 14.372 0.055 . . . . . . . 32 ILE CD . 51009 2
20 . 2 . 1 33 33 GLY CA C 13 48.154 0.119 . . . . . . . 33 GLY CA . 51009 2
21 . 2 . 1 33 33 GLY N N 15 114.475 0.089 . . . . . . . 33 GLY N . 51009 2
22 . 2 . 1 35 35 MET C C 13 173.459 0.017 . . . . . . . 35 MET C . 51009 2
23 . 2 . 1 35 35 MET CA C 13 53.067 0.126 . . . . . . . 35 MET CA . 51009 2
24 . 2 . 1 35 35 MET CB C 13 35.007 0.000 . . . . . . . 35 MET CB . 51009 2
25 . 2 . 1 35 35 MET CG C 13 30.951 0.145 . . . . . . . 35 MET CG . 51009 2
26 . 2 . 1 35 35 MET N N 15 124.348 0.047 . . . . . . . 35 MET N . 51009 2
27 . 2 . 1 36 36 VAL C C 13 175.848 0.118 . . . . . . . 36 VAL C . 51009 2
28 . 2 . 1 36 36 VAL CA C 13 60.646 0.108 . . . . . . . 36 VAL CA . 51009 2
29 . 2 . 1 36 36 VAL CB C 13 33.585 0.172 . . . . . . . 36 VAL CB . 51009 2
30 . 2 . 1 36 36 VAL CG1 C 13 20.903 0.000 . . . . . . . 36 VAL CG1 . 51009 2
31 . 2 . 1 36 36 VAL N N 15 128.428 0.227 . . . . . . . 36 VAL N . 51009 2
32 . 2 . 1 37 37 GLY C C 13 174.222 0.000 . . . . . . . 37 GLY C . 51009 2
33 . 2 . 1 37 37 GLY CA C 13 48.573 0.007 . . . . . . . 37 GLY CA . 51009 2
34 . 2 . 1 37 37 GLY N N 15 117.335 0.060 . . . . . . . 37 GLY N . 51009 2
35 . 2 . 1 38 38 GLY CA C 13 44.865 0.015 . . . . . . . 38 GLY CA . 51009 2
36 . 2 . 1 38 38 GLY N N 15 109.826 0.164 . . . . . . . 38 GLY N . 51009 2
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save_