Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 19580
_Assigned_chem_shift_list.ID 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 $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 .
_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 1H-1H TOCSY' 1 $sample_1 . 19580 1
2 '2D 1H-1H NOESY' 1 $sample_1 . 19580 1
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_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.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 ACE H1 H 1 2.133 0.000 . . . . . . 1 ACE HA . 19580 1
2 . 1 1 1 1 ACE H2 H 1 2.133 0.000 . . . . . . 1 ACE HA . 19580 1
3 . 1 1 1 1 ACE H3 H 1 2.133 0.000 . . . . . . 1 ACE HA . 19580 1
4 . 1 1 2 2 VAL H H 1 8.130 0.002 . . . . . A 2 VAL HN . 19580 1
5 . 1 1 2 2 VAL HA H 1 3.799 0.006 . . . . . A 2 VAL HA . 19580 1
6 . 1 1 2 2 VAL HB H 1 2.048 0.006 . . . . . A 2 VAL HB . 19580 1
7 . 1 1 2 2 VAL HG11 H 1 1.033 0.003 . . . . . A 2 VAL HG11 . 19580 1
8 . 1 1 2 2 VAL HG12 H 1 1.033 0.003 . . . . . A 2 VAL HG12 . 19580 1
9 . 1 1 2 2 VAL HG13 H 1 1.033 0.003 . . . . . A 2 VAL HG13 . 19580 1
10 . 1 1 2 2 VAL HG21 H 1 0.945 0.003 . . . . . A 2 VAL HG21 . 19580 1
11 . 1 1 2 2 VAL HG22 H 1 0.945 0.003 . . . . . A 2 VAL HG22 . 19580 1
12 . 1 1 2 2 VAL HG23 H 1 0.945 0.003 . . . . . A 2 VAL HG23 . 19580 1
13 . 1 1 3 3 LEU H H 1 8.275 0.003 . . . . . A 3 LEU H . 19580 1
14 . 1 1 3 3 LEU HA H 1 4.143 0.011 . . . . . A 3 LEU HA . 19580 1
15 . 1 1 3 3 LEU HB2 H 1 1.815 0.007 . . . . . A 3 LEU HB2 . 19580 1
16 . 1 1 3 3 LEU HB3 H 1 1.815 0.007 . . . . . A 3 LEU HB3 . 19580 1
17 . 1 1 3 3 LEU HG H 1 1.659 0.005 . . . . . A 3 LEU HG . 19580 1
18 . 1 1 3 3 LEU HD11 H 1 0.946 0.007 . . . . . A 3 LEU HD11 . 19580 1
19 . 1 1 3 3 LEU HD12 H 1 0.946 0.007 . . . . . A 3 LEU HD12 . 19580 1
20 . 1 1 3 3 LEU HD13 H 1 0.946 0.007 . . . . . A 3 LEU HD13 . 19580 1
21 . 1 1 3 3 LEU HD21 H 1 0.871 0.005 . . . . . A 3 LEU HD21 . 19580 1
22 . 1 1 3 3 LEU HD22 H 1 0.871 0.005 . . . . . A 3 LEU HD22 . 19580 1
23 . 1 1 3 3 LEU HD23 H 1 0.871 0.005 . . . . . A 3 LEU HD23 . 19580 1
24 . 1 1 4 4 VAL H H 1 7.747 0.003 . . . . . A 4 VAL H . 19580 1
25 . 1 1 4 4 VAL HA H 1 3.521 0.003 . . . . . A 4 VAL HA . 19580 1
26 . 1 1 4 4 VAL HB H 1 2.002 0.005 . . . . . A 4 VAL HB . 19580 1
27 . 1 1 4 4 VAL HG11 H 1 1.046 0.005 . . . . . A 4 VAL HG11 . 19580 1
28 . 1 1 4 4 VAL HG12 H 1 1.046 0.005 . . . . . A 4 VAL HG12 . 19580 1
29 . 1 1 4 4 VAL HG13 H 1 1.046 0.005 . . . . . A 4 VAL HG13 . 19580 1
30 . 1 1 4 4 VAL HG21 H 1 0.941 0.007 . . . . . A 4 VAL HG21 . 19580 1
31 . 1 1 4 4 VAL HG22 H 1 0.941 0.007 . . . . . A 4 VAL HG22 . 19580 1
32 . 1 1 4 4 VAL HG23 H 1 0.941 0.007 . . . . . A 4 VAL HG23 . 19580 1
33 . 1 1 5 5 ASN H H 1 7.976 0.003 . . . . . A 5 ASN H . 19580 1
34 . 1 1 5 5 ASN HA H 1 4.367 0.007 . . . . . A 5 ASN HA . 19580 1
35 . 1 1 5 5 ASN HB2 H 1 2.827 0.005 . . . . . A 5 ASN HB2 . 19580 1
36 . 1 1 5 5 ASN HB3 H 1 2.724 0.003 . . . . . A 5 ASN HB3 . 19580 1
37 . 1 1 5 5 ASN HD21 H 1 7.736 0.004 . . . . . A 5 ASN HD21 . 19580 1
38 . 1 1 5 5 ASN HD22 H 1 6.885 0.002 . . . . . A 5 ASN HD22 . 19580 1
39 . 1 1 6 6 GLU H H 1 7.987 0.003 . . . . . A 6 GLU H . 19580 1
40 . 1 1 6 6 GLU HA H 1 4.175 0.011 . . . . . A 6 GLU HA . 19580 1
41 . 1 1 6 6 GLU HB2 H 1 2.337 0.007 . . . . . A 6 GLU HB2 . 19580 1
42 . 1 1 6 6 GLU HB3 H 1 2.144 0.009 . . . . . A 6 GLU HB3 . 19580 1
43 . 1 1 6 6 GLU HG2 H 1 2.532 0.006 . . . . . A 6 GLU HG2 . 19580 1
44 . 1 1 6 6 GLU HG3 H 1 2.532 0.006 . . . . . A 6 GLU HG3 . 19580 1
45 . 1 1 7 7 ILE H H 1 8.101 0.002 . . . . . A 7 ILE H . 19580 1
46 . 1 1 7 7 ILE HA H 1 3.697 0.006 . . . . . A 7 ILE HA . 19580 1
47 . 1 1 7 7 ILE HB H 1 2.008 0.007 . . . . . A 7 ILE HB . 19580 1
48 . 1 1 7 7 ILE HG12 H 1 1.802 0.004 . . . . . A 7 ILE HG12 . 19580 1
49 . 1 1 7 7 ILE HG13 H 1 1.049 0.003 . . . . . A 7 ILE HG13 . 19580 1
50 . 1 1 7 7 ILE HG21 H 1 0.890 0.003 . . . . . A 7 ILE HG21 . 19580 1
51 . 1 1 7 7 ILE HG22 H 1 0.890 0.003 . . . . . A 7 ILE HG22 . 19580 1
52 . 1 1 7 7 ILE HG23 H 1 0.890 0.003 . . . . . A 7 ILE HG23 . 19580 1
53 . 1 1 7 7 ILE HD11 H 1 0.812 0.001 . . . . . A 7 ILE HD11 . 19580 1
54 . 1 1 7 7 ILE HD12 H 1 0.812 0.001 . . . . . A 7 ILE HD12 . 19580 1
55 . 1 1 7 7 ILE HD13 H 1 0.812 0.001 . . . . . A 7 ILE HD13 . 19580 1
56 . 1 1 8 8 LEU H H 1 8.289 0.003 . . . . . A 8 LEU H . 19580 1
57 . 1 1 8 8 LEU HA H 1 4.093 0.009 . . . . . A 8 LEU HA . 19580 1
58 . 1 1 8 8 LEU HB2 H 1 1.815 0.007 . . . . . A 8 LEU HB2 . 19580 1
59 . 1 1 8 8 LEU HB3 H 1 1.815 0.007 . . . . . A 8 LEU HB3 . 19580 1
60 . 1 1 8 8 LEU HG H 1 1.529 0.007 . . . . . A 8 LEU HG . 19580 1
61 . 1 1 8 8 LEU HD11 H 1 0.940 0.000 . . . . . A 8 LEU HD11 . 19580 1
62 . 1 1 8 8 LEU HD12 H 1 0.940 0.000 . . . . . A 8 LEU HD12 . 19580 1
63 . 1 1 8 8 LEU HD13 H 1 0.940 0.000 . . . . . A 8 LEU HD13 . 19580 1
64 . 1 1 8 8 LEU HD21 H 1 0.867 0.004 . . . . . A 8 LEU HD21 . 19580 1
65 . 1 1 8 8 LEU HD22 H 1 0.867 0.004 . . . . . A 8 LEU HD22 . 19580 1
66 . 1 1 8 8 LEU HD23 H 1 0.867 0.004 . . . . . A 8 LEU HD23 . 19580 1
67 . 1 1 9 9 ASN H H 1 7.891 0.003 . . . . . A 9 ASN H . 19580 1
68 . 1 1 9 9 ASN HA H 1 4.643 0.003 . . . . . A 9 ASN HA . 19580 1
69 . 1 1 9 9 ASN HB2 H 1 2.760 0.005 . . . . . A 9 ASN HB2 . 19580 1
70 . 1 1 9 9 ASN HB3 H 1 2.760 0.005 . . . . . A 9 ASN HB3 . 19580 1
71 . 1 1 9 9 ASN HD21 H 1 7.501 0.014 . . . . . A 9 ASN HD21 . 19580 1
72 . 1 1 9 9 ASN HD22 H 1 6.840 0.002 . . . . . A 9 ASN HD22 . 19580 1
73 . 1 1 10 10 HIS H H 1 7.885 0.002 . . . . . A 10 HIS H . 19580 1
74 . 1 1 10 10 HIS HA H 1 4.404 0.008 . . . . . A 10 HIS HA . 19580 1
75 . 1 1 10 10 HIS HB2 H 1 3.403 0.004 . . . . . A 10 HIS HB2 . 19580 1
76 . 1 1 10 10 HIS HB3 H 1 3.283 0.006 . . . . . A 10 HIS HB3 . 19580 1
77 . 1 1 10 10 HIS HD2 H 1 7.517 0.002 . . . . . A 10 HIS HD2 . 19580 1
78 . 1 1 10 10 HIS HE1 H 1 8.694 0.003 . . . . . A 10 HIS HE1 . 19580 1
79 . 1 1 11 11 NH2 HN1 H 1 7.463 0.001 . . . . . A 11 NH2 HN1 . 19580 1
80 . 1 1 11 11 NH2 HN2 H 1 7.092 0.001 . . . . . A 11 NH2 HN2 . 19580 1
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