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 11004
_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 isotropic 11004 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 11004 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.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 GLY HA2 H 1 4.005 . . 2 . . . . 1 GLY HA1 . 11004 1
2 . 1 1 1 1 GLY HA3 H 1 3.936 . . 2 . . . . 1 GLY HA2 . 11004 1
3 . 1 1 2 2 ALA H H 1 8.532 . . 1 . . . . 2 ALA HN . 11004 1
4 . 1 1 2 2 ALA HA H 1 4.409 . . 1 . . . . 2 ALA HA . 11004 1
5 . 1 1 2 2 ALA HB1 H 1 1.477 . . 1 . . . . 2 ALA HB1 . 11004 1
6 . 1 1 2 2 ALA HB2 H 1 1.477 . . 1 . . . . 2 ALA HB1 . 11004 1
7 . 1 1 2 2 ALA HB3 H 1 1.477 . . 1 . . . . 2 ALA HB1 . 11004 1
8 . 1 1 3 3 ALA H H 1 8.316 . . 1 . . . . 3 ALA HN . 11004 1
9 . 1 1 3 3 ALA HA H 1 4.392 . . 1 . . . . 3 ALA HA . 11004 1
10 . 1 1 3 3 ALA HB1 H 1 1.472 . . 1 . . . . 3 ALA HB1 . 11004 1
11 . 1 1 3 3 ALA HB2 H 1 1.472 . . 1 . . . . 3 ALA HB1 . 11004 1
12 . 1 1 3 3 ALA HB3 H 1 1.472 . . 1 . . . . 3 ALA HB1 . 11004 1
13 . 1 1 4 4 ILE H H 1 7.733 . . 1 . . . . 4 ILE HN . 11004 1
14 . 1 1 4 4 ILE HA H 1 4.190 . . 1 . . . . 4 ILE HA . 11004 1
15 . 1 1 4 4 ILE HB H 1 1.982 . . 1 . . . . 4 ILE HB . 11004 1
16 . 1 1 4 4 ILE HG12 H 1 1.593 . . 1 . . . . 4 ILE HG11 . 11004 1
17 . 1 1 4 4 ILE HD11 H 1 1.011 . . 1 . . . . 4 ILE HD11 . 11004 1
18 . 1 1 4 4 ILE HD12 H 1 1.011 . . 1 . . . . 4 ILE HD11 . 11004 1
19 . 1 1 4 4 ILE HD13 H 1 1.011 . . 1 . . . . 4 ILE HD11 . 11004 1
20 . 1 1 4 4 ILE HG21 H 1 1.270 . . 1 . . . . 4 ILE HG21 . 11004 1
21 . 1 1 4 4 ILE HG22 H 1 1.270 . . 1 . . . . 4 ILE HG21 . 11004 1
22 . 1 1 4 4 ILE HG23 H 1 1.270 . . 1 . . . . 4 ILE HG21 . 11004 1
23 . 1 1 5 5 GLY H H 1 7.961 . . 1 . . . . 5 GLY HN . 11004 1
24 . 1 1 5 5 GLY HA2 H 1 4.064 . . 2 . . . . 5 GLY HA1 . 11004 1
25 . 1 1 5 5 GLY HA3 H 1 3.988 . . 2 . . . . 5 GLY HA2 . 11004 1
26 . 1 1 6 6 LEU H H 1 7.868 . . 1 . . . . 6 LEU HN . 11004 1
27 . 1 1 6 6 LEU HA H 1 4.298 . . 1 . . . . 6 LEU HA . 11004 1
28 . 1 1 6 6 LEU HB2 H 1 1.672 . . 2 . . . . 6 LEU HB1 . 11004 1
29 . 1 1 6 6 LEU HB3 H 1 1.600 . . 2 . . . . 6 LEU HB2 . 11004 1
30 . 1 1 6 6 LEU HG H 1 1.500 . . 1 . . . . 6 LEU HG . 11004 1
31 . 1 1 6 6 LEU HD11 H 1 0.899 . . 2 . . . . 6 LEU HD11 . 11004 1
32 . 1 1 6 6 LEU HD12 H 1 0.899 . . 2 . . . . 6 LEU HD11 . 11004 1
33 . 1 1 6 6 LEU HD13 H 1 0.899 . . 2 . . . . 6 LEU HD11 . 11004 1
34 . 1 1 7 7 ALA H H 1 8.153 . . 1 . . . . 7 ALA HN . 11004 1
35 . 1 1 7 7 ALA HA H 1 4.184 . . 1 . . . . 7 ALA HA . 11004 1
36 . 1 1 7 7 ALA HB1 H 1 1.437 . . 1 . . . . 7 ALA HB1 . 11004 1
37 . 1 1 7 7 ALA HB2 H 1 1.437 . . 1 . . . . 7 ALA HB1 . 11004 1
38 . 1 1 7 7 ALA HB3 H 1 1.437 . . 1 . . . . 7 ALA HB1 . 11004 1
39 . 1 1 8 8 TRP H H 1 7.415 . . 1 . . . . 8 TRP HN . 11004 1
40 . 1 1 8 8 TRP HA H 1 4.551 . . 1 . . . . 8 TRP HA . 11004 1
41 . 1 1 8 8 TRP HB2 H 1 3.512 . . 2 . . . . 8 TRP HB1 . 11004 1
42 . 1 1 8 8 TRP HB3 H 1 3.299 . . 2 . . . . 8 TRP HB2 . 11004 1
43 . 1 1 8 8 TRP HD1 H 1 7.394 . . 1 . . . . 8 TRP HD1 . 11004 1
44 . 1 1 8 8 TRP HE1 H 1 9.970 . . 1 . . . . 8 TRP HE1 . 11004 1
45 . 1 1 8 8 TRP HZ2 H 1 7.422 . . 1 . . . . 8 TRP HZ2 . 11004 1
46 . 1 1 8 8 TRP HH2 H 1 7.137 . . 1 . . . . 8 TRP HH2 . 11004 1
47 . 1 1 8 8 TRP HZ3 H 1 7.039 . . 1 . . . . 8 TRP HZ3 . 11004 1
48 . 1 1 8 8 TRP HE3 H 1 7.549 . . 1 . . . . 8 TRP HE3 . 11004 1
49 . 1 1 9 9 ILE H H 1 7.179 . . 1 . . . . 9 ILE HN . 11004 1
50 . 1 1 9 9 ILE HA H 1 4.068 . . 1 . . . . 9 ILE HA . 11004 1
51 . 1 1 9 9 ILE HB H 1 1.833 . . 1 . . . . 9 ILE HB . 11004 1
52 . 1 1 9 9 ILE HG12 H 1 0.956 . . 1 . . . . 9 ILE HG11 . 11004 1
53 . 1 1 9 9 ILE HG13 H 1 0.887 . . 1 . . . . 9 ILE HG12 . 11004 1
54 . 1 1 9 9 ILE HD11 H 1 0.622 . . 1 . . . . 9 ILE HD11 . 11004 1
55 . 1 1 9 9 ILE HD12 H 1 0.622 . . 1 . . . . 9 ILE HD11 . 11004 1
56 . 1 1 9 9 ILE HD13 H 1 0.622 . . 1 . . . . 9 ILE HD11 . 11004 1
57 . 1 1 9 9 ILE HG21 H 1 0.773 . . 1 . . . . 9 ILE HG21 . 11004 1
58 . 1 1 9 9 ILE HG22 H 1 0.773 . . 1 . . . . 9 ILE HG21 . 11004 1
59 . 1 1 9 9 ILE HG23 H 1 0.773 . . 1 . . . . 9 ILE HG21 . 11004 1
60 . 1 1 10 10 PRO HA H 1 4.372 . . 1 . . . . 10 PRO HA . 11004 1
61 . 1 1 10 10 PRO HB2 H 1 2.464 . . 2 . . . . 10 PRO HB1 . 11004 1
62 . 1 1 10 10 PRO HB3 H 1 2.267 . . 2 . . . . 10 PRO HB2 . 11004 1
63 . 1 1 10 10 PRO HG2 H 1 1.997 . . 2 . . . . 10 PRO HG1 . 11004 1
64 . 1 1 10 10 PRO HG3 H 1 1.789 . . 2 . . . . 10 PRO HG2 . 11004 1
65 . 1 1 10 10 PRO HD2 H 1 3.986 . . 2 . . . . 10 PRO HD1 . 11004 1
66 . 1 1 10 10 PRO HD3 H 1 3.583 . . 2 . . . . 10 PRO HD2 . 11004 1
67 . 1 1 11 11 TYR H H 1 7.562 . . 1 . . . . 11 TYR HN . 11004 1
68 . 1 1 11 11 TYR HA H 1 4.208 . . 1 . . . . 11 TYR HA . 11004 1
69 . 1 1 11 11 TYR HB2 H 1 2.801 . . 2 . . . . 11 TYR HB1 . 11004 1
70 . 1 1 11 11 TYR HB3 H 1 2.826 . . 2 . . . . 11 TYR HB2 . 11004 1
71 . 1 1 11 11 TYR HD1 H 1 6.776 . . 3 . . . . 11 TYR HD1 . 11004 1
72 . 1 1 12 12 PHE H H 1 7.992 . . 1 . . . . 12 PHE HN . 11004 1
73 . 1 1 12 12 PHE HA H 1 4.647 . . 1 . . . . 12 PHE HA . 11004 1
74 . 1 1 12 12 PHE HB2 H 1 2.924 . . 2 . . . . 12 PHE HB1 . 11004 1
75 . 1 1 12 12 PHE HB3 H 1 3.309 . . 2 . . . . 12 PHE HB2 . 11004 1
76 . 1 1 12 12 PHE HD1 H 1 7.373 . . 3 . . . . 12 PHE HD1 . 11004 1
77 . 1 1 12 12 PHE HE1 H 1 7.245 . . 3 . . . . 12 PHE HE1 . 11004 1
78 . 1 1 13 13 GLY H H 1 7.735 . . 1 . . . . 13 GLY HN . 11004 1
79 . 1 1 13 13 GLY HA2 H 1 4.079 . . 2 . . . . 13 GLY HA2 . 11004 1
80 . 1 1 14 14 PRO HA H 1 4.490 . . 1 . . . . 14 PRO HA . 11004 1
81 . 1 1 14 14 PRO HB2 H 1 2.349 . . 2 . . . . 14 PRO HB1 . 11004 1
82 . 1 1 14 14 PRO HB3 H 1 2.061 . . 2 . . . . 14 PRO HB2 . 11004 1
83 . 1 1 14 14 PRO HG2 H 1 1.999 . . 2 . . . . 14 PRO HG2 . 11004 1
84 . 1 1 14 14 PRO HD2 H 1 4.082 . . 2 . . . . 14 PRO HD1 . 11004 1
85 . 1 1 14 14 PRO HD3 H 1 3.647 . . 2 . . . . 14 PRO HD2 . 11004 1
86 . 1 1 15 15 ALA H H 1 8.386 . . 1 . . . . 15 ALA HN . 11004 1
87 . 1 1 15 15 ALA HA H 1 4.362 . . 1 . . . . 15 ALA HA . 11004 1
88 . 1 1 15 15 ALA HB1 H 1 1.437 . . 1 . . . . 15 ALA HB1 . 11004 1
89 . 1 1 15 15 ALA HB2 H 1 1.437 . . 1 . . . . 15 ALA HB1 . 11004 1
90 . 1 1 15 15 ALA HB3 H 1 1.437 . . 1 . . . . 15 ALA HB1 . 11004 1
91 . 1 1 16 16 ALA H H 1 7.901 . . 1 . . . . 16 ALA HN . 11004 1
92 . 1 1 16 16 ALA HA H 1 4.132 . . 1 . . . . 16 ALA HA . 11004 1
93 . 1 1 16 16 ALA HB1 H 1 1.360 . . 1 . . . . 16 ALA HB1 . 11004 1
94 . 1 1 16 16 ALA HB2 H 1 1.360 . . 1 . . . . 16 ALA HB1 . 11004 1
95 . 1 1 16 16 ALA HB3 H 1 1.360 . . 1 . . . . 16 ALA HB1 . 11004 1
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save_