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 52889
_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 '2D NCA' . . . 52889 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 . . 52889 1
stop_
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 29 29 GLY C C 13 174.162 0.000 . 1 . . . . . 28 G C . 52889 1
2 . 1 . 1 30 30 ILE C C 13 174.921 0.000 . 1 . . . . . 29 I C . 52889 1
3 . 1 . 1 30 30 ILE N N 15 122.265 0.000 . 1 . . . . . 29 I N . 52889 1
4 . 1 . 1 31 31 THR C C 13 174.219 0.000 . 1 . . . . . 30 T C . 52889 1
5 . 1 . 1 31 31 THR CA C 13 62.258 0.000 . 1 . . . . . 30 T CA . 52889 1
6 . 1 . 1 31 31 THR N N 15 115.091 0.038 . 1 . . . . . 30 T N . 52889 1
7 . 1 . 1 32 32 LYS C C 13 175.593 0.000 . 1 . . . . . 31 K C . 52889 1
8 . 1 . 1 32 32 LYS CA C 13 61.407 0.000 . 1 . . . . . 31 K CA . 52889 1
9 . 1 . 1 32 32 LYS N N 15 119.275 0.073 . 1 . . . . . 31 K N . 52889 1
10 . 1 . 1 33 33 PRO CA C 13 66.137 0.000 . 1 . . . . . 32 P CA . 52889 1
11 . 1 . 1 33 33 PRO N N 15 134.121 0.020 . 1 . . . . . 32 P N . 52889 1
12 . 1 . 1 34 34 ALA CA C 13 55.878 0.000 . 1 . . . . . 33 A CA . 52889 1
13 . 1 . 1 34 34 ALA N N 15 120.174 0.000 . 1 . . . . . 33 A N . 52889 1
14 . 1 . 1 37 37 ARG CA C 13 60.953 0.000 . 1 . . . . . 36 R CA . 52889 1
15 . 1 . 1 37 37 ARG N N 15 117.702 0.000 . 1 . . . . . 36 R N . 52889 1
16 . 1 . 1 39 39 ALA C C 13 180.501 0.000 . 1 . . . . . 38 A C . 52889 1
17 . 1 . 1 39 39 ALA CA C 13 55.415 0.000 . 1 . . . . . 38 A CA . 52889 1
18 . 1 . 1 39 39 ALA N N 15 120.450 0.000 . 1 . . . . . 38 A N . 52889 1
19 . 1 . 1 40 40 ARG N N 15 118.537 0.000 . 1 . . . . . 39 R N . 52889 1
20 . 1 . 1 41 41 ARG C C 13 177.846 0.000 . 1 . . . . . 40 R C . 52889 1
21 . 1 . 1 42 42 GLY C C 13 172.283 0.000 . 1 . . . . . 41 G C . 52889 1
22 . 1 . 1 42 42 GLY CA C 13 45.688 0.000 . 1 . . . . . 41 G CA . 52889 1
23 . 1 . 1 42 42 GLY N N 15 106.602 0.013 . 1 . . . . . 41 G N . 52889 1
24 . 1 . 1 43 43 GLY C C 13 173.831 0.000 . 1 . . . . . 42 G C . 52889 1
25 . 1 . 1 43 43 GLY CA C 13 45.144 0.000 . 1 . . . . . 42 G CA . 52889 1
26 . 1 . 1 43 43 GLY N N 15 105.389 0.015 . 1 . . . . . 42 G N . 52889 1
27 . 1 . 1 44 44 VAL C C 13 176.414 0.218 . 1 . . . . . 43 V C . 52889 1
28 . 1 . 1 44 44 VAL CA C 13 63.138 0.000 . 1 . . . . . 43 V CA . 52889 1
29 . 1 . 1 44 44 VAL N N 15 120.551 0.013 . 1 . . . . . 43 V N . 52889 1
30 . 1 . 1 45 45 LYS CA C 13 57.599 0.000 . 6 . . . . . 44 K CA . 52889 1
31 . 1 . 1 45 45 LYS N N 15 126.462 0.052 . 6 . . . . . 44 K N . 52889 1
32 . 1 . 1 46 46 ARG C C 13 174.321 0.000 . 1 . . . . . 45 R C . 52889 1
33 . 1 . 1 46 46 ARG CA C 13 55.017 0.000 . 1 . . . . . 45 R CA . 52889 1
34 . 1 . 1 46 46 ARG N N 15 122.216 0.000 . 1 . . . . . 45 R N . 52889 1
35 . 1 . 1 47 47 ILE N N 15 125.240 0.000 . 1 . . . . . 46 I N . 52889 1
36 . 1 . 1 48 48 SER C C 13 176.798 0.000 . 1 . . . . . 47 S C . 52889 1
37 . 1 . 1 49 49 GLY CA C 13 47.742 0.000 . 1 . . . . . 48 G CA . 52889 1
38 . 1 . 1 49 49 GLY N N 15 115.225 0.124 . 1 . . . . . 48 G N . 52889 1
39 . 1 . 1 52 52 TYR CA C 13 63.426 0.000 . 1 . . . . . 51 Y CA . 52889 1
40 . 1 . 1 52 52 TYR N N 15 120.893 0.000 . 1 . . . . . 51 Y N . 52889 1
41 . 1 . 1 54 54 GLU C C 13 179.375 0.000 . 1 . . . . . 53 E C . 52889 1
42 . 1 . 1 55 55 THR CA C 13 68.045 0.000 . 1 . . . . . 54 T CA . 52889 1
43 . 1 . 1 55 55 THR N N 15 115.143 0.083 . 1 . . . . . 54 T N . 52889 1
44 . 1 . 1 56 56 ARG C C 13 177.776 0.000 . 1 . . . . . 55 R C . 52889 1
45 . 1 . 1 56 56 ARG CA C 13 61.902 0.000 . 1 . . . . . 55 R CA . 52889 1
46 . 1 . 1 56 56 ARG N N 15 120.994 0.000 . 1 . . . . . 55 R N . 52889 1
47 . 1 . 1 57 57 GLY CA C 13 47.711 0.000 . 1 . . . . . 56 G CA . 52889 1
48 . 1 . 1 57 57 GLY N N 15 104.644 0.067 . 1 . . . . . 56 G N . 52889 1
49 . 1 . 1 58 58 VAL C C 13 178.761 0.000 . 1 . . . . . 57 V C . 52889 1
50 . 1 . 1 58 58 VAL CA C 13 66.105 0.000 . 1 . . . . . 57 V CA . 52889 1
51 . 1 . 1 58 58 VAL N N 15 121.207 0.000 . 1 . . . . . 57 V N . 52889 1
52 . 1 . 1 59 59 LEU N N 15 121.838 0.000 . 1 . . . . . 58 L N . 52889 1
53 . 1 . 1 62 62 PHE CA C 13 61.893 0.000 . 1 . . . . . 61 F CA . 52889 1
54 . 1 . 1 62 62 PHE N N 15 120.526 0.000 . 1 . . . . . 61 F N . 52889 1
55 . 1 . 1 66 66 VAL CA C 13 66.354 0.000 . 1 . . . . . 65 V CA . 52889 1
56 . 1 . 1 66 66 VAL N N 15 118.701 0.000 . 1 . . . . . 65 V N . 52889 1
57 . 1 . 1 67 67 ILE CA C 13 66.712 0.000 . 1 . . . . . 66 I CA . 52889 1
58 . 1 . 1 67 67 ILE N N 15 119.592 0.000 . 1 . . . . . 66 I N . 52889 1
59 . 1 . 1 70 70 ALA C C 13 178.971 0.000 . 1 . . . . . 69 A C . 52889 1
60 . 1 . 1 70 70 ALA CA C 13 55.552 0.000 . 1 . . . . . 69 A CA . 52889 1
61 . 1 . 1 70 70 ALA N N 15 122.988 0.000 . 1 . . . . . 69 A N . 52889 1
62 . 1 . 1 71 71 VAL N N 15 113.747 0.000 . 1 . . . . . 70 V N . 52889 1
63 . 1 . 1 72 72 THR CA C 13 67.553 0.000 . 1 . . . . . 71 T CA . 52889 1
64 . 1 . 1 72 72 THR N N 15 120.746 0.000 . 1 . . . . . 71 T N . 52889 1
65 . 1 . 1 74 74 THR CA C 13 67.780 0.000 . 1 . . . . . 73 T CA . 52889 1
66 . 1 . 1 74 74 THR N N 15 121.240 0.000 . 1 . . . . . 73 T N . 52889 1
67 . 1 . 1 77 77 ALA C C 13 175.634 0.000 . 1 . . . . . 76 A C . 52889 1
68 . 1 . 1 77 77 ALA CA C 13 52.228 0.000 . 6 . . . . . 76 A CA . 52889 1
69 . 1 . 1 77 77 ALA N N 15 118.896 0.000 . 6 . . . . . 76 A N . 52889 1
70 . 1 . 1 78 78 LYS N N 15 113.883 0.000 . 1 . . . . . 77 K N . 52889 1
71 . 1 . 1 79 79 ARG C C 13 175.807 0.000 . 1 . . . . . 78 R C . 52889 1
72 . 1 . 1 80 80 LYS N N 15 117.030 0.000 . 1 . . . . . 79 K N . 52889 1
73 . 1 . 1 81 81 THR C C 13 172.511 0.000 . 1 . . . . . 80 T C . 52889 1
74 . 1 . 1 81 81 THR CA C 13 60.612 0.000 . 1 . . . . . 80 T CA . 52889 1
75 . 1 . 1 81 81 THR N N 15 117.072 0.000 . 1 . . . . . 80 T N . 52889 1
76 . 1 . 1 82 82 VAL CA C 13 62.126 0.000 . 1 . . . . . 81 V CA . 52889 1
77 . 1 . 1 82 82 VAL N N 15 127.272 0.045 . 1 . . . . . 81 V N . 52889 1
78 . 1 . 1 84 84 ALA CA C 13 56.141 0.000 . 1 . . . . . 83 A CA . 52889 1
79 . 1 . 1 84 84 ALA N N 15 122.256 0.000 . 1 . . . . . 83 A N . 52889 1
80 . 1 . 1 87 87 VAL CA C 13 67.177 0.000 . 1 . . . . . 86 V CA . 52889 1
81 . 1 . 1 87 87 VAL N N 15 117.615 0.000 . 1 . . . . . 86 V N . 52889 1
82 . 1 . 1 90 90 ALA CA C 13 55.871 0.000 . 1 . . . . . 89 A CA . 52889 1
83 . 1 . 1 90 90 ALA N N 15 124.603 0.000 . 1 . . . . . 89 A N . 52889 1
84 . 1 . 1 102 102 GLY CA C 13 47.073 0.000 . 1 . . . . . 101 G CA . 52889 1
85 . 1 . 1 102 102 GLY N N 15 115.053 0.000 . 1 . . . . . 101 G N . 52889 1
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save_