Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 21069
_Assigned_chem_shift_list.ID 1
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.004
_Assigned_chem_shift_list.Chem_shift_13C_err 0.009
_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-13C HSQC' 1 $sample_1 isotropic 21069 1
2 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 21069 1
3 '2D DQF-COSY' 1 $sample_1 isotropic 21069 1
4 '2D 1H-1H NOESY' 1 $sample_1 isotropic 21069 1
6 '2D 1H-13C HMBC' 1 $sample_1 isotropic 21069 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_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 UVR CA C 13 62.825 0.009 . . . . . . . 1 Y Ca . 21069 1
2 . 1 1 1 1 UVR CB C 13 46.912 0.009 . . . . . . . 1 Y Cb . 21069 1
3 . 1 1 1 1 UVR CD C 13 58.514 0.009 . . . . . . . 1 Y Cd . 21069 1
4 . 1 1 1 1 UVR CG C 13 32.091 0.009 . . . . . . . 1 Y Cg . 21069 1
5 . 1 1 1 1 UVR H21 H 1 7.172 0.004 . 3 . . . . . 1 Y H2* . 21069 1
6 . 1 1 1 1 UVR H22 H 1 7.172 0.004 . 3 . . . . . 1 Y H2* . 21069 1
7 . 1 1 1 1 UVR H31 H 1 6.973 0.004 . 3 . . . . . 1 Y H3* . 21069 1
8 . 1 1 1 1 UVR H32 H 1 6.973 0.004 . 3 . . . . . 1 Y H3* . 21069 1
9 . 1 1 1 1 UVR HA H 1 4.493 0.004 . . . . . . . 1 Y Ha . 21069 1
10 . 1 1 1 1 UVR HB H 1 2.905 0.004 . . . . . . . 1 Y Hb . 21069 1
11 . 1 1 1 1 UVR HD H 1 3.678 0.004 . . . . . . . 1 Y Hd . 21069 1
12 . 1 1 1 1 UVR HG1 H 1 1.993 0.004 . . . . . . . 1 Y Hg1 . 21069 1
13 . 1 1 1 1 UVR HG2 H 1 1.675 0.004 . . . . . . . 1 Y Hg2 . 21069 1
14 . 1 1 2 2 UVR CA C 13 61.931 0.009 . . . . . . . 2 X Ca . 21069 1
15 . 1 1 2 2 UVR CB C 13 46.431 0.009 . . . . . . . 2 X Cb . 21069 1
16 . 1 1 2 2 UVR CD C 13 57.915 0.009 . . . . . . . 2 X Cd . 21069 1
17 . 1 1 2 2 UVR CG C 13 30.202 0.009 . . . . . . . 2 X Cg . 21069 1
18 . 1 1 2 2 UVR H21 H 1 7.702 0.004 . 3 . . . . . 2 X H2* . 21069 1
19 . 1 1 2 2 UVR H22 H 1 7.702 0.004 . 3 . . . . . 2 X H2* . 21069 1
20 . 1 1 2 2 UVR H31 H 1 7.037 0.004 . 3 . . . . . 2 X H3* . 21069 1
21 . 1 1 2 2 UVR H32 H 1 7.037 0.004 . 3 . . . . . 2 X H3* . 21069 1
22 . 1 1 2 2 UVR HA H 1 5.247 0.004 . . . . . . . 2 X Ha . 21069 1
23 . 1 1 2 2 UVR HB H 1 3.164 0.004 . . . . . . . 2 X Hb . 21069 1
24 . 1 1 2 2 UVR HD H 1 3.400 0.004 . . . . . . . 2 X Hd . 21069 1
25 . 1 1 2 2 UVR HG1 H 1 2.025 0.004 . 1 . . . . . 2 X Hg* . 21069 1
26 . 1 1 2 2 UVR HG2 H 1 2.025 0.004 . 1 . . . . . 2 X Hg* . 21069 1
27 . 1 1 3 3 UVR CA C 13 63.525 0.009 . . . . . . . 3 Y Ca . 21069 1
28 . 1 1 3 3 UVR CB C 13 44.326 0.009 . . . . . . . 3 Y Cb . 21069 1
29 . 1 1 3 3 UVR CD C 13 59.275 0.009 . . . . . . . 3 Y Cd . 21069 1
30 . 1 1 3 3 UVR CG C 13 31.950 0.009 . . . . . . . 3 Y Cg . 21069 1
31 . 1 1 3 3 UVR H21 H 1 7.270 0.004 . 3 . . . . . 3 Y H2* . 21069 1
32 . 1 1 3 3 UVR H22 H 1 7.270 0.004 . 3 . . . . . 3 Y H2* . 21069 1
33 . 1 1 3 3 UVR HA H 1 5.529 0.004 . . . . . . . 3 Y Ha . 21069 1
34 . 1 1 3 3 UVR HB H 1 3.095 0.004 . . . . . . . 3 Y Hb . 21069 1
35 . 1 1 3 3 UVR HD H 1 5.107 0.004 . . . . . . . 3 Y Hd . 21069 1
36 . 1 1 3 3 UVR HG1 H 1 2.135 0.004 . . . . . . . 3 Y Hg1 . 21069 1
37 . 1 1 3 3 UVR HG2 H 1 2.415 0.004 . . . . . . . 3 Y Hg2 . 21069 1
38 . 1 1 4 4 UVR CA C 13 60.097 0.009 . . . . . . . 4 X Ca . 21069 1
39 . 1 1 4 4 UVR CB C 13 46.762 0.009 . . . . . . . 4 X Cb . 21069 1
40 . 1 1 4 4 UVR CD C 13 58.278 0.009 . . . . . . . 4 X Cd . 21069 1
41 . 1 1 4 4 UVR CG C 13 28.897 0.009 . . . . . . . 4 X Cg . 21069 1
42 . 1 1 4 4 UVR H21 H 1 7.589 0.004 . 3 . . . . . 4 X H2* . 21069 1
43 . 1 1 4 4 UVR H22 H 1 7.589 0.004 . 3 . . . . . 4 X H2* . 21069 1
44 . 1 1 4 4 UVR HA H 1 5.616 0.004 . . . . . . . 4 X Ha . 21069 1
45 . 1 1 4 4 UVR HB H 1 2.834 0.004 . . . . . . . 4 X Hb . 21069 1
46 . 1 1 4 4 UVR HD H 1 3.096 0.004 . . . . . . . 4 X Hd . 21069 1
47 . 1 1 4 4 UVR HG1 H 1 1.975 0.004 . . . . . . . 4 X Hg1 . 21069 1
48 . 1 1 4 4 UVR HG2 H 1 1.508 0.004 . . . . . . . 4 X Hg2 . 21069 1
49 . 1 1 5 5 UVR CA C 13 61.163 0.009 . . . . . . . 5 Z Ca . 21069 1
50 . 1 1 5 5 UVR CB C 13 49.576 0.009 . . . . . . . 5 Z Cb . 21069 1
51 . 1 1 5 5 UVR CD C 13 58.753 0.009 . . . . . . . 5 Z Cd . 21069 1
52 . 1 1 5 5 UVR CG C 13 28.413 0.009 . . . . . . . 5 Z Cg . 21069 1
53 . 1 1 5 5 UVR H21 H 1 7.711 0.004 . 3 . . . . . 5 Z H2* . 21069 1
54 . 1 1 5 5 UVR H22 H 1 7.711 0.004 . 3 . . . . . 5 Z H2* . 21069 1
55 . 1 1 5 5 UVR H31 H 1 7.440 0.004 . 3 . . . . . 5 Z H3* . 21069 1
56 . 1 1 5 5 UVR H32 H 1 7.440 0.004 . 3 . . . . . 5 Z H3* . 21069 1
57 . 1 1 5 5 UVR HA H 1 5.827 0.004 . . . . . . . 5 Z Ha . 21069 1
58 . 1 1 5 5 UVR HB H 1 3.567 0.004 . . . . . . . 5 Z Hb . 21069 1
59 . 1 1 5 5 UVR HD H 1 3.777 0.004 . . . . . . . 5 Z Hd . 21069 1
60 . 1 1 5 5 UVR HG1 H 1 2.145 0.004 . . . . . . . 5 Z Hg1 . 21069 1
61 . 1 1 5 5 UVR HG2 H 1 2.303 0.004 . . . . . . . 5 Z Hg2 . 21069 1
62 . 1 1 5 5 UVR CT1 C 13 27.067 0.009 . 1 . . . . . 5 Z CT* . 21069 1
63 . 1 1 5 5 UVR CT2 C 13 27.067 0.009 . 1 . . . . . 5 Z CT* . 21069 1
64 . 1 1 5 5 UVR CT3 C 13 27.067 0.009 . 1 . . . . . 5 Z CT* . 21069 1
65 . 1 1 5 5 UVR HT11 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
66 . 1 1 5 5 UVR HT12 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
67 . 1 1 5 5 UVR HT13 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
68 . 1 1 5 5 UVR HT21 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
69 . 1 1 5 5 UVR HT22 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
70 . 1 1 5 5 UVR HT23 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
71 . 1 1 5 5 UVR HT31 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
72 . 1 1 5 5 UVR HT32 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
73 . 1 1 5 5 UVR HT33 H 1 1.109 0.004 . 1 . . . . . 5 Z HT* . 21069 1
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