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 51584
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chemical_shifts_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err 0.5
_Assigned_chem_shift_list.Chem_shift_15N_err 1
_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 '2D NCaCX' . . . 51584 1
2 '2D NCOCX' . . . 51584 1
3 '2D 13C-13C PDSD' . . . 51584 1
4 '2D NCa' . . . 51584 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 . . 51584 1
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loop_
_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 19 19 PHE CA C 13 56.5400 0.5 . 1 . . . . . 19 PHE CA . 51584 1
2 . 1 . 1 19 19 PHE N N 15 122.1150 1 . 1 . . . . . 19 PHE N . 51584 1
3 . 1 . 1 20 20 PHE CA C 13 56.3480 0.5 . 1 . . . . . 20 PHE CA . 51584 1
4 . 1 . 1 20 20 PHE CB C 13 43.0560 0.5 . 1 . . . . . 20 PHE CB . 51584 1
5 . 1 . 1 20 20 PHE N N 15 131.5170 1 . 1 . . . . . 20 PHE N . 51584 1
6 . 1 . 1 21 21 ALA CA C 13 49.0740 0.5 . 1 . . . . . 21 ALA CA . 51584 1
7 . 1 . 1 21 21 ALA CB C 13 22.4020 0.5 . 1 . . . . . 21 ALA CB . 51584 1
8 . 1 . 1 21 21 ALA N N 15 129.8590 1 . 1 . . . . . 21 ALA N . 51584 1
9 . 1 . 1 24 24 VAL CA C 13 58.0100 0.5 . 1 . . . . . 24 VAL CA . 51584 1
10 . 1 . 1 24 24 VAL CB C 13 36.1090 0.5 . 1 . . . . . 24 VAL CB . 51584 1
11 . 1 . 1 24 24 VAL CG1 C 13 21.1350 0.5 . 2 . . . . . 24 VAL CG1 . 51584 1
12 . 1 . 1 24 24 VAL CG2 C 13 23.0440 0.5 . 2 . . . . . 24 VAL CG2 . 51584 1
13 . 1 . 1 24 24 VAL N N 15 117.7680 1 . 1 . . . . . 24 VAL N . 51584 1
14 . 1 . 1 25 25 GLY CA C 13 48.7510 0.5 . 1 . . . . . 25 GLY CA . 51584 1
15 . 1 . 1 25 25 GLY N N 15 116.6310 1 . 1 . . . . . 25 GLY N . 51584 1
16 . 1 . 1 26 26 SER CA C 13 56.6300 0.5 . 1 . . . . . 26 SER CA . 51584 1
17 . 1 . 1 26 26 SER CB C 13 65.6390 0.5 . 1 . . . . . 26 SER CB . 51584 1
18 . 1 . 1 26 26 SER N N 15 113.1110 1 . 1 . . . . . 26 SER N . 51584 1
19 . 1 . 1 27 27 ASN CA C 13 52.3060 0.5 . 1 . . . . . 27 ASN CA . 51584 1
20 . 1 . 1 27 27 ASN CB C 13 40.9830 0.5 . 1 . . . . . 27 ASN CB . 51584 1
21 . 1 . 1 27 27 ASN N N 15 118.7430 1 . 1 . . . . . 27 ASN N . 51584 1
22 . 1 . 1 28 28 LYS CA C 13 54.9090 0.5 . 1 . . . . . 28 LYS CA . 51584 1
23 . 1 . 1 28 28 LYS CB C 13 35.3120 0.5 . 1 . . . . . 28 LYS CB . 51584 1
24 . 1 . 1 28 28 LYS CG C 13 25.4880 0.5 . 1 . . . . . 28 LYS CG . 51584 1
25 . 1 . 1 28 28 LYS CD C 13 29.9870 0.5 . 1 . . . . . 28 LYS CD . 51584 1
26 . 1 . 1 28 28 LYS CE C 13 42.7220 0.5 . 1 . . . . . 28 LYS CE . 51584 1
27 . 1 . 1 28 28 LYS N N 15 128.0600 1 . 1 . . . . . 28 LYS N . 51584 1
28 . 1 . 1 29 29 GLY CA C 13 44.6210 0.5 . 1 . . . . . 29 GLY CA . 51584 1
29 . 1 . 1 29 29 GLY N N 15 111.4570 1 . 1 . . . . . 29 GLY N . 51584 1
30 . 1 . 1 30 30 ALA CA C 13 49.0810 0.5 . 1 . . . . . 30 ALA CA . 51584 1
31 . 1 . 1 30 30 ALA CB C 13 22.1990 0.5 . 1 . . . . . 30 ALA CB . 51584 1
32 . 1 . 1 30 30 ALA N N 15 122.3310 1 . 1 . . . . . 30 ALA N . 51584 1
33 . 1 . 1 31 31 ILE CA C 13 59.9610 0.5 . 1 . . . . . 31 ILE CA . 51584 1
34 . 1 . 1 31 31 ILE CB C 13 40.4400 0.5 . 1 . . . . . 31 ILE CB . 51584 1
35 . 1 . 1 31 31 ILE CG1 C 13 27.2010 0.5 . 1 . . . . . 31 ILE CG1 . 51584 1
36 . 1 . 1 31 31 ILE CG2 C 13 17.6860 0.5 . 1 . . . . . 31 ILE CG2 . 51584 1
37 . 1 . 1 31 31 ILE CD1 C 13 14.3600 0.5 . 1 . . . . . 31 ILE CD1 . 51584 1
38 . 1 . 1 31 31 ILE N N 15 122.0730 1 . 1 . . . . . 31 ILE N . 51584 1
39 . 1 . 1 32 32 ILE CA C 13 57.5750 0.5 . 1 . . . . . 32 ILE CA . 51584 1
40 . 1 . 1 32 32 ILE CB C 13 42.8210 0.5 . 1 . . . . . 32 ILE CB . 51584 1
41 . 1 . 1 32 32 ILE CG1 C 13 26.7760 0.5 . 1 . . . . . 32 ILE CG1 . 51584 1
42 . 1 . 1 32 32 ILE CG2 C 13 18.2890 0.5 . 1 . . . . . 32 ILE CG2 . 51584 1
43 . 1 . 1 32 32 ILE CD1 C 13 16.1450 0.5 . 1 . . . . . 32 ILE CD1 . 51584 1
44 . 1 . 1 32 32 ILE N N 15 124.2170 1 . 1 . . . . . 32 ILE N . 51584 1
45 . 1 . 1 33 33 GLY N N 15 113.4480 1 . 1 . . . . . 33 GLY N . 51584 1
46 . 1 . 1 34 34 LEU CA C 13 54.3820 0.5 . 1 . . . . . 34 LEU CA . 51584 1
47 . 1 . 1 34 34 LEU CG C 13 27.9110 0.5 . 1 . . . . . 34 LEU CG . 51584 1
48 . 1 . 1 35 35 MET CA C 13 54.4150 0.5 . 1 . . . . . 35 MET CA . 51584 1
49 . 1 . 1 35 35 MET CG C 13 31.6620 0.5 . 1 . . . . . 35 MET CG . 51584 1
50 . 1 . 1 35 35 MET N N 15 126.9160 1 . 1 . . . . . 35 MET N . 51584 1
51 . 1 . 1 36 36 VAL CA C 13 61.4540 0.5 . 1 . . . . . 36 VAL CA . 51584 1
52 . 1 . 1 36 36 VAL CB C 13 33.7350 0.5 . 1 . . . . . 36 VAL CB . 51584 1
53 . 1 . 1 36 36 VAL N N 15 124.6450 1 . 1 . . . . . 36 VAL N . 51584 1
54 . 1 . 1 37 37 GLY C C 13 169.7440 0.5 . 1 . . . . . 37 GLY C . 51584 1
55 . 1 . 1 37 37 GLY CA C 13 45.0590 0.5 . 1 . . . . . 37 GLY CA . 51584 1
56 . 1 . 1 37 37 GLY N N 15 106.2250 1 . 1 . . . . . 37 GLY N . 51584 1
57 . 1 . 1 38 38 GLY C C 13 172.8760 0.5 . 1 . . . . . 38 GLY C . 51584 1
58 . 1 . 1 38 38 GLY CA C 13 43.7280 0.5 . 1 . . . . . 38 GLY CA . 51584 1
59 . 1 . 1 38 38 GLY N N 15 101.1830 1 . 1 . . . . . 38 GLY N . 51584 1
60 . 1 . 1 39 39 VAL CA C 13 60.5680 0.5 . 1 . . . . . 39 VAL CA . 51584 1
61 . 1 . 1 39 39 VAL CB C 13 36.5440 0.5 . 1 . . . . . 39 VAL CB . 51584 1
62 . 1 . 1 39 39 VAL CG1 C 13 21.0370 0.5 . 2 . . . . . 39 VAL CG1 . 51584 1
63 . 1 . 1 39 39 VAL N N 15 118.9130 1 . 1 . . . . . 39 VAL N . 51584 1
64 . 1 . 1 40 40 VAL CA C 13 60.2120 0.5 . 1 . . . . . 40 VAL CA . 51584 1
65 . 1 . 1 40 40 VAL CB C 13 34.8560 0.5 . 1 . . . . . 40 VAL CB . 51584 1
66 . 1 . 1 40 40 VAL N N 15 126.8530 1 . 1 . . . . . 40 VAL N . 51584 1
67 . 1 . 1 41 41 ILE CA C 13 59.6780 0.5 . 1 . . . . . 41 ILE CA . 51584 1
68 . 1 . 1 41 41 ILE CG1 C 13 26.9740 0.5 . 1 . . . . . 41 ILE CG1 . 51584 1
69 . 1 . 1 41 41 ILE N N 15 127.2530 1 . 1 . . . . . 41 ILE N . 51584 1
70 . 1 . 1 42 42 ALA C C 13 182.0560 0.5 . 1 . . . . . 42 ALA C . 51584 1
71 . 1 . 1 42 42 ALA CA C 13 53.4970 0.5 . 1 . . . . . 42 ALA CA . 51584 1
72 . 1 . 1 42 42 ALA CB C 13 19.6650 0.5 . 1 . . . . . 42 ALA CB . 51584 1
73 . 1 . 1 42 42 ALA N N 15 133.9860 1 . 1 . . . . . 42 ALA N . 51584 1
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