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 30076
_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 $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 .
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 dipolar-assisted rotational resonance' . . . 30076 1
2 '13C-13C dipolar-assisted rotational resonance' . . . 30076 1
stop_
loop_
_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 . . 30076 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 4 4 GLY C C 13 173.8 0.3 . 1 . . . . A 4 GLY C . 30076 1
2 . 1 1 4 4 GLY CA C 13 43.4 0.3 . 1 . . . . A 4 GLY CA . 30076 1
3 . 1 1 5 5 ILE C C 13 177.2 0.3 . 5 . . . . A 5 ILE C . 30076 1
4 . 1 1 5 5 ILE CA C 13 59.9 0.3 . 1 . . . . A 5 ILE CA . 30076 1
5 . 1 1 5 5 ILE CB C 13 39.0 0.3 . 1 . . . . A 5 ILE CB . 30076 1
6 . 1 1 5 5 ILE CG1 C 13 28.1 0.3 . 1 . . . . A 5 ILE CG1 . 30076 1
7 . 1 1 5 5 ILE CG2 C 13 20.7 0.3 . 1 . . . . A 5 ILE CG2 . 30076 1
8 . 1 1 5 5 ILE CD1 C 13 16.4 0.3 . 1 . . . . A 5 ILE CD1 . 30076 1
9 . 1 1 7 7 PHE C C 13 175.8 0.3 . 5 . . . . A 7 PHE C . 30076 1
10 . 1 1 7 7 PHE CA C 13 61.0 0.3 . 5 . . . . A 7 PHE CA . 30076 1
11 . 1 1 7 7 PHE CB C 13 39.4 0.3 . 5 . . . . A 7 PHE CB . 30076 1
12 . 1 1 7 7 PHE CG C 13 139.3 0.3 . 5 . . . . A 7 PHE CG . 30076 1
13 . 1 1 7 7 PHE CD1 C 13 131.1 0.3 . . . . . . A 7 PHE CD1 . 30076 1
14 . 1 1 7 7 PHE CD2 C 13 131.1 0.3 . . . . . . A 7 PHE CD2 . 30076 1
15 . 1 1 7 7 PHE CE1 C 13 131.1 0.3 . . . . . . A 7 PHE CE1 . 30076 1
16 . 1 1 7 7 PHE CE2 C 13 131.1 0.3 . . . . . . A 7 PHE CE2 . 30076 1
17 . 1 1 7 7 PHE CZ C 13 131.1 0.3 . 5 . . . . A 7 PHE CZ . 30076 1
18 . 1 1 8 8 PHE C C 13 175.8 0.3 . 5 . . . . A 8 PHE C . 30076 1
19 . 1 1 8 8 PHE CA C 13 61.0 0.3 . 5 . . . . A 8 PHE CA . 30076 1
20 . 1 1 8 8 PHE CB C 13 39.4 0.3 . 5 . . . . A 8 PHE CB . 30076 1
21 . 1 1 8 8 PHE CG C 13 139.3 0.3 . 5 . . . . A 8 PHE CG . 30076 1
22 . 1 1 8 8 PHE CD1 C 13 131.1 0.3 . . . . . . A 8 PHE CD1 . 30076 1
23 . 1 1 8 8 PHE CD2 C 13 131.1 0.3 . . . . . . A 8 PHE CD2 . 30076 1
24 . 1 1 8 8 PHE CE1 C 13 131.1 0.3 . . . . . . A 8 PHE CE1 . 30076 1
25 . 1 1 8 8 PHE CE2 C 13 131.1 0.3 . . . . . . A 8 PHE CE2 . 30076 1
26 . 1 1 8 8 PHE CZ C 13 131.1 0.3 . 5 . . . . A 8 PHE CZ . 30076 1
27 . 1 1 12 12 ILE C C 13 177.7 0.3 . 1 . . . . A 12 ILE C . 30076 1
28 . 1 1 12 12 ILE CA C 13 66.2 0.3 . 1 . . . . A 12 ILE CA . 30076 1
29 . 1 1 12 12 ILE CB C 13 36.1 0.3 . 1 . . . . A 12 ILE CB . 30076 1
30 . 1 1 12 12 ILE CG1 C 13 30.2 0.3 . 1 . . . . A 12 ILE CG1 . 30076 1
31 . 1 1 12 12 ILE CG2 C 13 18.7 0.3 . 1 . . . . A 12 ILE CG2 . 30076 1
32 . 1 1 12 12 ILE CD1 C 13 15.2 0.3 . 1 . . . . A 12 ILE CD1 . 30076 1
33 . 1 1 13 13 ILE C C 13 177.2 0.3 . 5 . . . . A 13 ILE C . 30076 1
34 . 1 1 13 13 ILE CA C 13 65.9 0.3 . 5 . . . . A 13 ILE CA . 30076 1
35 . 1 1 13 13 ILE CB C 13 37.9 0.3 . 5 . . . . A 13 ILE CB . 30076 1
36 . 1 1 13 13 ILE CG1 C 13 29.8 0.3 . 5 . . . . A 13 ILE CG1 . 30076 1
37 . 1 1 13 13 ILE CG2 C 13 17.4 0.3 . 5 . . . . A 13 ILE CG2 . 30076 1
38 . 1 1 13 13 ILE CD1 C 13 14.5 0.3 . 5 . . . . A 13 ILE CD1 . 30076 1
39 . 1 1 14 14 ILE C C 13 177.2 0.3 . 5 . . . . A 14 ILE C . 30076 1
40 . 1 1 14 14 ILE CA C 13 65.9 0.3 . 5 . . . . A 14 ILE CA . 30076 1
41 . 1 1 14 14 ILE CB C 13 37.9 0.3 . 5 . . . . A 14 ILE CB . 30076 1
42 . 1 1 14 14 ILE CG1 C 13 29.8 0.3 . 5 . . . . A 14 ILE CG1 . 30076 1
43 . 1 1 14 14 ILE CG2 C 13 17.4 0.3 . 5 . . . . A 14 ILE CG2 . 30076 1
44 . 1 1 14 14 ILE CD1 C 13 14.5 0.3 . 5 . . . . A 14 ILE CD1 . 30076 1
45 . 1 1 16 16 PHE C C 13 173.4 0.3 . 1 . . . . A 16 PHE C . 30076 1
46 . 1 1 16 16 PHE CA C 13 61.0 0.3 . 1 . . . . A 16 PHE CA . 30076 1
47 . 1 1 16 16 PHE CB C 13 39.4 0.3 . 5 . . . . A 16 PHE CB . 30076 1
48 . 1 1 16 16 PHE CG C 13 139.3 0.3 . 5 . . . . A 16 PHE CG . 30076 1
49 . 1 1 16 16 PHE CD1 C 13 131.1 0.3 . . . . . . A 16 PHE CD1 . 30076 1
50 . 1 1 16 16 PHE CD2 C 13 131.1 0.3 . . . . . . A 16 PHE CD2 . 30076 1
51 . 1 1 16 16 PHE CE1 C 13 131.1 0.3 . . . . . . A 16 PHE CE1 . 30076 1
52 . 1 1 16 16 PHE CE2 C 13 131.1 0.3 . . . . . . A 16 PHE CE2 . 30076 1
53 . 1 1 16 16 PHE CZ C 13 131.1 0.3 . 5 . . . . A 16 PHE CZ . 30076 1
54 . 1 1 17 17 LEU C C 13 178.9 0.3 . 1 . . . . A 17 LEU C . 30076 1
55 . 1 1 17 17 LEU CA C 13 58.1 0.3 . 1 . . . . A 17 LEU CA . 30076 1
56 . 1 1 17 17 LEU CB C 13 42.2 0.3 . 1 . . . . A 17 LEU CB . 30076 1
57 . 1 1 17 17 LEU CG C 13 26.8 0.3 . 1 . . . . A 17 LEU CG . 30076 1
58 . 1 1 17 17 LEU CD1 C 13 22.1 0.3 . . . . . . A 17 LEU CD1 . 30076 1
59 . 1 1 17 17 LEU CD2 C 13 22.1 0.3 . . . . . . A 17 LEU CD2 . 30076 1
60 . 1 1 18 18 ILE C C 13 177.2 0.3 . 5 . . . . A 18 ILE C . 30076 1
61 . 1 1 18 18 ILE CA C 13 66.1 0.3 . 1 . . . . A 18 ILE CA . 30076 1
62 . 1 1 18 18 ILE CB C 13 38.0 0.3 . 1 . . . . A 18 ILE CB . 30076 1
63 . 1 1 18 18 ILE CG1 C 13 29.9 0.3 . 5 . . . . A 18 ILE CG1 . 30076 1
64 . 1 1 18 18 ILE CG2 C 13 17.4 0.3 . 5 . . . . A 18 ILE CG2 . 30076 1
65 . 1 1 18 18 ILE CD1 C 13 14.6 0.3 . 5 . . . . A 18 ILE CD1 . 30076 1
66 . 1 1 19 19 VAL C C 13 176.9 0.3 . 1 . . . . A 19 VAL C . 30076 1
67 . 1 1 19 19 VAL CA C 13 66.9 0.3 . 1 . . . . A 19 VAL CA . 30076 1
68 . 1 1 19 19 VAL CB C 13 31.7 0.3 . 1 . . . . A 19 VAL CB . 30076 1
69 . 1 1 19 19 VAL CG1 C 13 22.8 0.3 . . . . . . A 19 VAL CG1 . 30076 1
70 . 1 1 19 19 VAL CG2 C 13 22.8 0.3 . . . . . . A 19 VAL CG2 . 30076 1
71 . 1 1 20 20 VAL C C 13 178.5 0.3 . 1 . . . . A 20 VAL C . 30076 1
72 . 1 1 20 20 VAL CA C 13 67.7 0.3 . 1 . . . . A 20 VAL CA . 30076 1
73 . 1 1 20 20 VAL CB C 13 31.3 0.3 . 1 . . . . A 20 VAL CB . 30076 1
74 . 1 1 20 20 VAL CG1 C 13 23.2 0.3 . . . . . . A 20 VAL CG1 . 30076 1
75 . 1 1 20 20 VAL CG2 C 13 23.2 0.3 . . . . . . A 20 VAL CG2 . 30076 1
76 . 1 1 24 24 ILE C C 13 177.2 0.3 . 5 . . . . A 24 ILE C . 30076 1
77 . 1 1 24 24 ILE CA C 13 62.1 0.3 . 5 . . . . A 24 ILE CA . 30076 1
78 . 1 1 24 24 ILE CB C 13 39.0 0.3 . 5 . . . . A 24 ILE CB . 30076 1
79 . 1 1 24 24 ILE CG1 C 13 29.3 0.3 . 5 . . . . A 24 ILE CG1 . 30076 1
80 . 1 1 24 24 ILE CG2 C 13 17.4 0.3 . 5 . . . . A 24 ILE CG2 . 30076 1
81 . 1 1 24 24 ILE CD1 C 13 14.5 0.3 . 5 . . . . A 24 ILE CD1 . 30076 1
82 . 1 1 25 25 ALA C C 13 180.1 0.3 . 1 . . . . A 25 ALA C . 30076 1
83 . 1 1 25 25 ALA CA C 13 55.7 0.3 . 1 . . . . A 25 ALA CA . 30076 1
84 . 1 1 25 25 ALA CB C 13 18.1 0.3 . 1 . . . . A 25 ALA CB . 30076 1
85 . 1 1 26 26 ILE C C 13 177.2 0.3 . 5 . . . . A 26 ILE C . 30076 1
86 . 1 1 26 26 ILE CA C 13 65.6 0.3 . 1 . . . . A 26 ILE CA . 30076 1
87 . 1 1 26 26 ILE CB C 13 37.9 0.3 . 5 . . . . A 26 ILE CB . 30076 1
88 . 1 1 26 26 ILE CG1 C 13 29.9 0.3 . 5 . . . . A 26 ILE CG1 . 30076 1
89 . 1 1 26 26 ILE CG2 C 13 17.4 0.3 . 5 . . . . A 26 ILE CG2 . 30076 1
90 . 1 1 26 26 ILE CD1 C 13 14.6 0.3 . 1 . . . . A 26 ILE CD1 . 30076 1
91 . 1 1 27 27 ILE C C 13 177.2 0.3 . 5 . . . . A 27 ILE C . 30076 1
92 . 1 1 27 27 ILE CA C 13 60.8 0.3 . 1 . . . . A 27 ILE CA . 30076 1
93 . 1 1 27 27 ILE CB C 13 35.0 0.3 . 1 . . . . A 27 ILE CB . 30076 1
94 . 1 1 27 27 ILE CG1 C 13 30.4 0.3 . 5 . . . . A 27 ILE CG1 . 30076 1
95 . 1 1 27 27 ILE CG2 C 13 18.7 0.3 . 1 . . . . A 27 ILE CG2 . 30076 1
96 . 1 1 27 27 ILE CD1 C 13 14.6 0.3 . 5 . . . . A 27 ILE CD1 . 30076 1
97 . 1 1 28 28 LEU C C 13 177.9 0.3 . 1 . . . . A 28 LEU C . 30076 1
98 . 1 1 28 28 LEU CA C 13 58.3 0.3 . 1 . . . . A 28 LEU CA . 30076 1
99 . 1 1 28 28 LEU CB C 13 40.9 0.3 . 1 . . . . A 28 LEU CB . 30076 1
100 . 1 1 28 28 LEU CG C 13 27.0 0.3 . 1 . . . . A 28 LEU CG . 30076 1
101 . 1 1 28 28 LEU CD1 C 13 23.4 0.3 . . . . . . A 28 LEU CD1 . 30076 1
102 . 1 1 28 28 LEU CD2 C 13 23.4 0.3 . . . . . . A 28 LEU CD2 . 30076 1
103 . 1 1 31 31 PHE C C 13 175.8 0.3 . 5 . . . . A 31 PHE C . 30076 1
104 . 1 1 31 31 PHE CA C 13 61.0 0.3 . 5 . . . . A 31 PHE CA . 30076 1
105 . 1 1 31 31 PHE CB C 13 39.4 0.3 . 5 . . . . A 31 PHE CB . 30076 1
106 . 1 1 31 31 PHE CG C 13 139.3 0.3 . 5 . . . . A 31 PHE CG . 30076 1
107 . 1 1 31 31 PHE CD1 C 13 131.1 0.3 . . . . . . A 31 PHE CD1 . 30076 1
108 . 1 1 31 31 PHE CD2 C 13 131.1 0.3 . . . . . . A 31 PHE CD2 . 30076 1
109 . 1 1 31 31 PHE CE1 C 13 131.1 0.3 . . . . . . A 31 PHE CE1 . 30076 1
110 . 1 1 31 31 PHE CE2 C 13 131.1 0.3 . . . . . . A 31 PHE CE2 . 30076 1
111 . 1 1 31 31 PHE CZ C 13 131.1 0.3 . 5 . . . . A 31 PHE CZ . 30076 1
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save_