Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 27861
_Assigned_chem_shift_list.ID 2
_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 $chemical_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 'Peak splitting'
_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 (H)NH' . . . 27861 2
2 '3D (H)CANH' . . . 27861 2
3 '3D (H)CONH' . . . 27861 2
4 '3D (H)COCA(N)H' . . . 27861 2
5 '3D (H)CA(CO)NH' . . . 27861 2
6 '3D (H)CO(CA)NH' . . . 27861 2
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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 $CcpNmr_Analysis . . 27861 2
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_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 7 7 ASN C C 13 177.047 0.000 . 1 . . . . . 6 ASN C . 27861 2
2 . 1 . 1 8 8 GLY H H 1 6.717 0.008 . 1 . . . . . 7 GLY H . 27861 2
3 . 1 . 1 8 8 GLY C C 13 170.758 0.062 . 1 . . . . . 7 GLY C . 27861 2
4 . 1 . 1 8 8 GLY CA C 13 46.811 0.037 . 1 . . . . . 7 GLY CA . 27861 2
5 . 1 . 1 8 8 GLY N N 15 114.468 0.044 . 1 . . . . . 7 GLY N . 27861 2
6 . 1 . 1 9 9 GLY H H 1 6.440 0.005 . 1 . . . . . 8 GLY H . 27861 2
7 . 1 . 1 9 9 GLY C C 13 171.472 0.010 . 1 . . . . . 8 GLY C . 27861 2
8 . 1 . 1 9 9 GLY CA C 13 46.332 0.045 . 1 . . . . . 8 GLY CA . 27861 2
9 . 1 . 1 9 9 GLY N N 15 104.031 0.065 . 1 . . . . . 8 GLY N . 27861 2
10 . 1 . 1 10 10 THR H H 1 8.421 0.006 . 1 . . . . . 9 THR H . 27861 2
11 . 1 . 1 10 10 THR C C 13 172.490 0.000 . 1 . . . . . 9 THR C . 27861 2
12 . 1 . 1 10 10 THR CA C 13 61.999 0.056 . 1 . . . . . 9 THR CA . 27861 2
13 . 1 . 1 10 10 THR N N 15 117.670 0.120 . 1 . . . . . 9 THR N . 27861 2
14 . 1 . 1 16 16 GLU H H 1 7.771 0.009 . 1 . . . . . 15 GLU H . 27861 2
15 . 1 . 1 16 16 GLU C C 13 173.828 0.034 . 1 . . . . . 15 GLU C . 27861 2
16 . 1 . 1 16 16 GLU CA C 13 55.868 0.023 . 1 . . . . . 15 GLU CA . 27861 2
17 . 1 . 1 16 16 GLU N N 15 115.092 0.063 . 1 . . . . . 15 GLU N . 27861 2
18 . 1 . 1 17 17 VAL H H 1 8.790 0.011 . 1 . . . . . 16 VAL H . 27861 2
19 . 1 . 1 17 17 VAL C C 13 176.849 0.000 . 1 . . . . . 16 VAL C . 27861 2
20 . 1 . 1 17 17 VAL CA C 13 59.968 0.000 . 1 . . . . . 16 VAL CA . 27861 2
21 . 1 . 1 17 17 VAL N N 15 122.880 0.070 . 1 . . . . . 16 VAL N . 27861 2
22 . 1 . 1 18 18 VAL C C 13 174.427 0.000 . 1 . . . . . 17 VAL C . 27861 2
23 . 1 . 1 18 18 VAL CA C 13 58.715 0.000 . 1 . . . . . 17 VAL CA . 27861 2
24 . 1 . 1 19 19 ASN H H 1 9.370 0.006 . 1 . . . . . 18 ASN H . 27861 2
25 . 1 . 1 19 19 ASN C C 13 173.052 0.052 . 1 . . . . . 18 ASN C . 27861 2
26 . 1 . 1 19 19 ASN CA C 13 51.198 0.027 . 1 . . . . . 18 ASN CA . 27861 2
27 . 1 . 1 19 19 ASN N N 15 123.823 0.117 . 1 . . . . . 18 ASN N . 27861 2
28 . 1 . 1 20 20 ALA H H 1 7.500 0.005 . 1 . . . . . 19 ALA H . 27861 2
29 . 1 . 1 20 20 ALA C C 13 176.723 0.000 . 1 . . . . . 19 ALA C . 27861 2
30 . 1 . 1 20 20 ALA CA C 13 50.902 0.000 . 1 . . . . . 19 ALA CA . 27861 2
31 . 1 . 1 20 20 ALA N N 15 120.276 0.068 . 1 . . . . . 19 ALA N . 27861 2
32 . 1 . 1 37 37 GLN C C 13 175.205 0.071 . 1 . . . . . 36 GLN C . 27861 2
33 . 1 . 1 37 37 GLN CA C 13 53.762 0.036 . 1 . . . . . 36 GLN CA . 27861 2
34 . 1 . 1 38 38 VAL H H 1 8.521 0.010 . 1 . . . . . 37 VAL H . 27861 2
35 . 1 . 1 38 38 VAL C C 13 172.411 0.020 . 1 . . . . . 37 VAL C . 27861 2
36 . 1 . 1 38 38 VAL CA C 13 59.844 0.002 . 1 . . . . . 37 VAL CA . 27861 2
37 . 1 . 1 38 38 VAL N N 15 118.540 0.012 . 1 . . . . . 37 VAL N . 27861 2
38 . 1 . 1 39 39 ARG H H 1 8.692 0.005 . 1 . . . . . 38 ARG H . 27861 2
39 . 1 . 1 39 39 ARG C C 13 179.462 0.000 . 1 . . . . . 38 ARG C . 27861 2
40 . 1 . 1 39 39 ARG CA C 13 55.672 0.000 . 1 . . . . . 38 ARG CA . 27861 2
41 . 1 . 1 39 39 ARG N N 15 126.857 0.082 . 1 . . . . . 38 ARG N . 27861 2
42 . 1 . 1 72 72 VAL C C 13 174.015 0.000 . 1 . . . . . 71 VAL C . 27861 2
43 . 1 . 1 72 72 VAL CA C 13 61.140 0.000 . 1 . . . . . 71 VAL CA . 27861 2
44 . 1 . 1 73 73 ALA H H 1 8.882 0.008 . 1 . . . . . 72 ALA H . 27861 2
45 . 1 . 1 73 73 ALA C C 13 176.981 0.072 . 1 . . . . . 72 ALA C . 27861 2
46 . 1 . 1 73 73 ALA CA C 13 49.817 0.013 . 1 . . . . . 72 ALA CA . 27861 2
47 . 1 . 1 73 73 ALA N N 15 129.503 0.088 . 1 . . . . . 72 ALA N . 27861 2
48 . 1 . 1 74 74 PHE H H 1 10.019 0.017 . 1 . . . . . 73 PHE H . 27861 2
49 . 1 . 1 74 74 PHE C C 13 174.442 0.002 . 1 . . . . . 73 PHE C . 27861 2
50 . 1 . 1 74 74 PHE CA C 13 57.110 0.000 . 1 . . . . . 73 PHE CA . 27861 2
51 . 1 . 1 74 74 PHE N N 15 123.151 0.160 . 1 . . . . . 73 PHE N . 27861 2
52 . 1 . 1 75 75 LEU H H 1 9.295 0.002 . 1 . . . . . 74 LEU H . 27861 2
53 . 1 . 1 75 75 LEU CA C 13 53.091 0.000 . 1 . . . . . 74 LEU CA . 27861 2
54 . 1 . 1 75 75 LEU N N 15 124.032 0.045 . 1 . . . . . 74 LEU N . 27861 2
55 . 1 . 1 128 128 GLY H H 1 9.295 0.016 . 1 . . . . . 127 GLY H . 27861 2
56 . 1 . 1 128 128 GLY C C 13 174.750 0.036 . 1 . . . . . 127 GLY C . 27861 2
57 . 1 . 1 128 128 GLY CA C 13 45.769 0.018 . 1 . . . . . 127 GLY CA . 27861 2
58 . 1 . 1 128 128 GLY N N 15 113.282 0.017 . 1 . . . . . 127 GLY N . 27861 2
59 . 1 . 1 129 129 THR H H 1 9.212 0.013 . 1 . . . . . 128 THR H . 27861 2
60 . 1 . 1 129 129 THR C C 13 175.621 0.061 . 1 . . . . . 128 THR C . 27861 2
61 . 1 . 1 129 129 THR CA C 13 62.963 0.004 . 1 . . . . . 128 THR CA . 27861 2
62 . 1 . 1 129 129 THR N N 15 125.167 0.098 . 1 . . . . . 128 THR N . 27861 2
63 . 1 . 1 130 130 ASN H H 1 10.213 0.023 . 1 . . . . . 129 ASN H . 27861 2
64 . 1 . 1 130 130 ASN C C 13 172.315 0.015 . 1 . . . . . 129 ASN C . 27861 2
65 . 1 . 1 130 130 ASN CA C 13 52.822 0.042 . 1 . . . . . 129 ASN CA . 27861 2
66 . 1 . 1 130 130 ASN N N 15 126.575 0.026 . 1 . . . . . 129 ASN N . 27861 2
67 . 1 . 1 154 154 THR H H 1 8.824 0.004 . 1 . . . . . 153 THR H . 27861 2
68 . 1 . 1 154 154 THR C C 13 173.345 0.027 . 1 . . . . . 153 THR C . 27861 2
69 . 1 . 1 154 154 THR CA C 13 60.300 0.089 . 1 . . . . . 153 THR CA . 27861 2
70 . 1 . 1 154 154 THR N N 15 110.767 0.028 . 1 . . . . . 153 THR N . 27861 2
71 . 1 . 1 155 155 PHE H H 1 8.457 0.011 . 1 . . . . . 154 PHE H . 27861 2
72 . 1 . 1 155 155 PHE C C 13 174.367 0.025 . 1 . . . . . 154 PHE C . 27861 2
73 . 1 . 1 155 155 PHE CA C 13 54.956 0.006 . 1 . . . . . 154 PHE CA . 27861 2
74 . 1 . 1 155 155 PHE N N 15 114.938 0.013 . 1 . . . . . 154 PHE N . 27861 2
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