Content for NMR-STAR saveframe, "shift_set_1"
save_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_1
_Assigned_chem_shift_list.Entry_ID 6214
_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 $EX-cod_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 .
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 '13C-13C RFDR' 1 $sample_1 . 6214 1
2 '15N-13C ramp-CP' 1 $sample_1 . 6214 1
3 CA-CBCG 1 $sample_1 . 6214 1
4 CA(NHCO)CA 1 $sample_1 . 6214 1
5 NH(CO)CACB 1 $sample_1 . 6214 1
6 COCACB 1 $sample_1 . 6214 1
7 NHCACB 1 $sample_1 . 6214 1
stop_
loop_
_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 ILE C C 13 174.1 2.0 . 1 . . . . . . . . . 6214 1
2 . 1 1 1 1 ILE CA C 13 59.9 1.4 . 1 . . . . . . . . . 6214 1
3 . 1 1 1 1 ILE CB C 13 39.3 0.9 . 1 . . . . . . . . . 6214 1
4 . 1 1 1 1 ILE CG1 C 13 27.3 2.0 . 1 . . . . . . . . . 6214 1
5 . 1 1 1 1 ILE CG2 C 13 17.3 2.0 . 1 . . . . . . . . . 6214 1
6 . 1 1 1 1 ILE CD1 C 13 13.3 2.0 . 1 . . . . . . . . . 6214 1
7 . 1 1 1 1 ILE N N 15 37.3 2.3 . 1 . . . . . . . . . 6214 1
8 . 1 1 2 2 ASN C C 13 174.9 1.9 . 1 . . . . . . . . . 6214 1
9 . 1 1 2 2 ASN CA C 13 51.0 1.0 . 1 . . . . . . . . . 6214 1
10 . 1 1 2 2 ASN CB C 13 36.6 1.5 . 1 . . . . . . . . . 6214 1
11 . 1 1 2 2 ASN CG C 13 177.0 1.8 . 1 . . . . . . . . . 6214 1
12 . 1 1 2 2 ASN N N 15 127.3 4.0 . 1 . . . . . . . . . 6214 1
13 . 1 1 2 2 ASN ND2 N 15 112.8 3.5 . 1 . . . . . . . . . 6214 1
14 . 1 1 3 3 TRP C C 13 175.8 1.1 . 1 . . . . . . . . . 6214 1
15 . 1 1 3 3 TRP CA C 13 60.1 1.0 . 1 . . . . . . . . . 6214 1
16 . 1 1 3 3 TRP CB C 13 30.8 1.5 . 1 . . . . . . . . . 6214 1
17 . 1 1 3 3 TRP CG C 13 111.5 1.3 . 1 . . . . . . . . . 6214 1
18 . 1 1 3 3 TRP CD1 C 13 128.1 1.0 . 1 . . . . . . . . . 6214 1
19 . 1 1 3 3 TRP CD2 C 13 128.8 0.8 . 1 . . . . . . . . . 6214 1
20 . 1 1 3 3 TRP CE2 C 13 139.8 0.8 . 1 . . . . . . . . . 6214 1
21 . 1 1 3 3 TRP CE3 C 13 119.8 1.0 . 1 . . . . . . . . . 6214 1
22 . 1 1 3 3 TRP CZ2 C 13 113.8 1.6 . 1 . . . . . . . . . 6214 1
23 . 1 1 3 3 TRP CZ3 C 13 120.8 1.4 . 1 . . . . . . . . . 6214 1
24 . 1 1 3 3 TRP CH2 C 13 124.8 1.2 . 1 . . . . . . . . . 6214 1
25 . 1 1 3 3 TRP N N 15 126.3 2.3 . 1 . . . . . . . . . 6214 1
26 . 1 1 3 3 TRP NE1 N 15 129.8 3.2 . 1 . . . . . . . . . 6214 1
27 . 1 1 4 4 LYS C C 13 177.8 1.3 . 1 . . . . . . . . . 6214 1
28 . 1 1 4 4 LYS CA C 13 59.5 1.3 . 1 . . . . . . . . . 6214 1
29 . 1 1 4 4 LYS CB C 13 31.8 1.5 . 1 . . . . . . . . . 6214 1
30 . 1 1 4 4 LYS CG C 13 25.8 2.0 . 5 . . . . . . . . . 6214 1
31 . 1 1 4 4 LYS CD C 13 29.8 2.0 . 5 . . . . . . . . . 6214 1
32 . 1 1 4 4 LYS CE C 13 42.3 1.8 . 5 . . . . . . . . . 6214 1
33 . 1 1 4 4 LYS N N 15 116.6 2.3 . 1 . . . . . . . . . 6214 1
34 . 1 1 4 4 LYS NZ N 15 32.3 2.8 . 5 . . . . . . . . . 6214 1
35 . 1 1 5 5 GLY C C 13 175.1 2.2 . 1 . . . . . . . . . 6214 1
36 . 1 1 5 5 GLY CA C 13 45.3 2.1 . 1 . . . . . . . . . 6214 1
37 . 1 1 5 5 GLY N N 15 107.7 3.3 . 1 . . . . . . . . . 6214 1
38 . 1 1 6 6 ILE C C 13 178.2 0.8 . 1 . . . . . . . . . 6214 1
39 . 1 1 6 6 ILE CA C 13 64.6 0.8 . 1 . . . . . . . . . 6214 1
40 . 1 1 6 6 ILE CB C 13 37.8 0.8 . 1 . . . . . . . . . 6214 1
41 . 1 1 6 6 ILE CG1 C 13 27.8 1.0 . 1 . . . . . . . . . 6214 1
42 . 1 1 6 6 ILE CG2 C 13 18.0 1.0 . 1 . . . . . . . . . 6214 1
43 . 1 1 6 6 ILE CD1 C 13 14.3 1.0 . 1 . . . . . . . . . 6214 1
44 . 1 1 6 6 ILE N N 15 121.3 2.0 . 1 . . . . . . . . . 6214 1
45 . 1 1 7 7 ALA C C 13 178.7 1.0 . 1 . . . . . . . . . 6214 1
46 . 1 1 7 7 ALA CA C 13 55.3 0.5 . 1 . . . . . . . . . 6214 1
47 . 1 1 7 7 ALA CB C 13 18.6 1.1 . 1 . . . . . . . . . 6214 1
48 . 1 1 7 7 ALA N N 15 120.8 1.8 . 1 . . . . . . . . . 6214 1
49 . 1 1 8 8 ALA C C 13 179.0 1.0 . 1 . . . . . . . . . 6214 1
50 . 1 1 8 8 ALA CA C 13 55.1 0.5 . 1 . . . . . . . . . 6214 1
51 . 1 1 8 8 ALA CB C 13 17.5 1.1 . 1 . . . . . . . . . 6214 1
52 . 1 1 8 8 ALA N N 15 120.8 1.8 . 1 . . . . . . . . . 6214 1
53 . 1 1 9 9 MET C C 13 178.3 1.1 . 1 . . . . . . . . . 6214 1
54 . 1 1 9 9 MET CA C 13 59.7 1.0 . 1 . . . . . . . . . 6214 1
55 . 1 1 9 9 MET CB C 13 31.7 1.1 . 4 . . . . . . . . . 6214 1
56 . 1 1 9 9 MET CG C 13 34.3 1.1 . 4 . . . . . . . . . 6214 1
57 . 1 1 9 9 MET CE C 13 17.3 2.0 . 5 . . . . . . . . . 6214 1
58 . 1 1 9 9 MET N N 15 116.5 2.3 . 1 . . . . . . . . . 6214 1
59 . 1 1 10 10 ALA C C 13 179.0 1.0 . 1 . . . . . . . . . 6214 1
60 . 1 1 10 10 ALA CA C 13 55.3 0.5 . 1 . . . . . . . . . 6214 1
61 . 1 1 10 10 ALA CB C 13 17.5 1.1 . 1 . . . . . . . . . 6214 1
62 . 1 1 10 10 ALA N N 15 120.8 1.8 . 1 . . . . . . . . . 6214 1
63 . 1 1 11 11 LYS C C 13 178.3 2.3 . 1 . . . . . . . . . 6214 1
64 . 1 1 11 11 LYS CA C 13 58.9 1.3 . 1 . . . . . . . . . 6214 1
65 . 1 1 11 11 LYS CB C 13 32.3 1.5 . 1 . . . . . . . . . 6214 1
66 . 1 1 11 11 LYS CG C 13 24.9 2.0 . 5 . . . . . . . . . 6214 1
67 . 1 1 11 11 LYS CD C 13 28.9 2.0 . 5 . . . . . . . . . 6214 1
68 . 1 1 11 11 LYS CE C 13 41.8 1.8 . 5 . . . . . . . . . 6214 1
69 . 1 1 11 11 LYS N N 15 118.2 2.3 . 1 . . . . . . . . . 6214 1
70 . 1 1 11 11 LYS NZ N 15 32.3 2.8 . 5 . . . . . . . . . 6214 1
71 . 1 1 12 12 LYS C C 13 178.3 1.3 . 1 . . . . . . . . . 6214 1
72 . 1 1 12 12 LYS CA C 13 60.0 1.1 . 1 . . . . . . . . . 6214 1
73 . 1 1 12 12 LYS CB C 13 31.3 1.5 . 1 . . . . . . . . . 6214 1
74 . 1 1 12 12 LYS CG C 13 24.9 2.0 . 5 . . . . . . . . . 6214 1
75 . 1 1 12 12 LYS CD C 13 28.9 2.0 . 5 . . . . . . . . . 6214 1
76 . 1 1 12 12 LYS CE C 13 41.8 1.8 . 5 . . . . . . . . . 6214 1
77 . 1 1 12 12 LYS N N 15 117.8 2.3 . 1 . . . . . . . . . 6214 1
78 . 1 1 12 12 LYS NZ N 15 32.3 2.8 . 5 . . . . . . . . . 6214 1
79 . 1 1 13 13 LEU C C 13 177.8 1.1 . 1 . . . . . . . . . 6214 1
80 . 1 1 13 13 LEU CA C 13 56.8 1.5 . 1 . . . . . . . . . 6214 1
81 . 1 1 13 13 LEU CB C 13 42.8 1.3 . 5 . . . . . . . . . 6214 1
82 . 1 1 13 13 LEU CG C 13 29.5 2.0 . 5 . . . . . . . . . 6214 1
83 . 1 1 13 13 LEU CD1 C 13 24.3 2.0 . 5 . . . . . . . . . 6214 1
84 . 1 1 13 13 LEU CD2 C 13 24.1 2.0 . 5 . . . . . . . . . 6214 1
85 . 1 1 13 13 LEU N N 15 117.8 2.5 . 1 . . . . . . . . . 6214 1
86 . 1 1 14 14 LEU C C 13 177.8 1.1 . 1 . . . . . . . . . 6214 1
87 . 1 1 14 14 LEU CA C 13 57.3 1.5 . 1 . . . . . . . . . 6214 1
88 . 1 1 14 14 LEU CB C 13 42.8 1.3 . 5 . . . . . . . . . 6214 1
89 . 1 1 14 14 LEU CG C 13 29.5 2.0 . 5 . . . . . . . . . 6214 1
90 . 1 1 14 14 LEU CD1 C 13 24.7 2.0 . 5 . . . . . . . . . 6214 1
91 . 1 1 14 14 LEU CD2 C 13 24.1 2.0 . 5 . . . . . . . . . 6214 1
92 . 1 1 14 14 LEU N N 15 117.8 2.5 . 1 . . . . . . . . . 6214 1
93 . 1 1 15 15 GLY C C 13 175.1 2.0 . 1 . . . . . . . . . 6214 1
94 . 1 1 15 15 GLY CA C 13 43.8 1.1 . 1 . . . . . . . . . 6214 1
95 . 1 1 15 15 GLY N N 15 108.8 3.3 . 1 . . . . . . . . . 6214 1
stop_
loop_
_Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
_Ambiguous_atom_chem_shift.Atom_chem_shift_ID
_Ambiguous_atom_chem_shift.Entry_ID
_Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID
1 55 6214 1
1 56 6214 1
2 30 6214 1
2 66 6214 1
2 74 6214 1
3 31 6214 1
3 67 6214 1
3 75 6214 1
4 32 6214 1
4 68 6214 1
4 76 6214 1
5 34 6214 1
5 70 6214 1
5 78 6214 1
6 81 6214 1
6 88 6214 1
7 82 6214 1
7 89 6214 1
8 83 6214 1
8 84 6214 1
8 90 6214 1
8 91 6214 1
9 57 6214 1
stop_
save_