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 30361
_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 $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 1H-1H TOCSY' . . . 30361 1
2 '2D 1H-1H NOESY' . . . 30361 1
3 '2D 1H-1H TOCSY' . . . 30361 1
4 '2D 1H-1H NOESY' . . . 30361 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 1 1 DAL H H 1 7.723 0.00 . . . . . . A 1 DAL H1 . 30361 1
2 . 1 1 1 1 DAL HA H 1 3.977 0.00 . . . . . . A 1 DAL HA . 30361 1
3 . 1 1 1 1 DAL HB2 H 1 1.216 0.00 . . . . . . A 1 DAL HB2 . 30361 1
4 . 1 1 2 2 GLN H H 1 6.785 0.12 . . . . . . A 2 GLN H . 30361 1
5 . 1 1 2 2 GLN HA H 1 4.292 0.01 . . . . . . A 2 GLN HA . 30361 1
6 . 1 1 2 2 GLN HB2 H 1 1.944 0.00 . . . . . . A 2 GLN HB2 . 30361 1
7 . 1 1 2 2 GLN HB3 H 1 1.749 0.00 . . . . . . A 2 GLN HB3 . 30361 1
8 . 1 1 2 2 GLN HG2 H 1 2.147 0.00 . . . . . . A 2 GLN HG2 . 30361 1
9 . 1 1 2 2 GLN HG3 H 1 2.035 0.00 . . . . . . A 2 GLN HG3 . 30361 1
10 . 1 1 2 2 GLN HE21 H 1 6.721 0.00 . . . . . . A 2 GLN HE21 . 30361 1
11 . 1 1 2 2 GLN HE22 H 1 7.050 0.01 . . . . . . A 2 GLN HE22 . 30361 1
12 . 1 1 3 3 DPR HA H 1 4.179 0.00 . . . . . . A 3 DPR HA . 30361 1
13 . 1 1 3 3 DPR HB2 H 1 1.958 0.00 . . . . . . A 3 DPR HB2 . 30361 1
14 . 1 1 3 3 DPR HB3 H 1 1.563 0.00 . . . . . . A 3 DPR HB3 . 30361 1
15 . 1 1 3 3 DPR HD3 H 1 3.570 0.01 . . . . . . A 3 DPR HD3 . 30361 1
16 . 1 1 3 3 DPR HG2 H 1 1.876 0.00 . . . . . . A 3 DPR HG2 . 30361 1
17 . 1 1 3 3 DPR HG3 H 1 1.759 0.00 . . . . . . A 3 DPR HG3 . 30361 1
18 . 1 1 4 4 DCY H H 1 8.066 0.00 . . . . . . A 4 DCY H . 30361 1
19 . 1 1 4 4 DCY HA H 1 4.515 0.00 . . . . . . A 4 DCY HA . 30361 1
20 . 1 1 4 4 DCY HB2 H 1 3.038 0.00 . . . . . . A 4 DCY HB2 . 30361 1
21 . 1 1 4 4 DCY HB3 H 1 2.885 0.00 . . . . . . A 4 DCY HB3 . 30361 1
22 . 1 1 5 5 DLY H H 1 8.489 0.00 . . . . . . A 5 DLY H . 30361 1
23 . 1 1 5 5 DLY HA H 1 3.715 0.00 . . . . . . A 5 DLY HA . 30361 1
24 . 1 1 5 5 DLY HB3 H 1 1.409 0.00 . . . . . . A 5 DLY HB3 . 30361 1
25 . 1 1 5 5 DLY HD3 H 1 1.335 0.00 . . . . . . A 5 DLY HD3 . 30361 1
26 . 1 1 5 5 DLY HE3 H 1 2.637 0.00 . . . . . . A 5 DLY HE3 . 30361 1
27 . 1 1 5 5 DLY HG3 H 1 1.014 0.00 . . . . . . A 5 DLY HG3 . 30361 1
28 . 1 1 5 5 DLY HZ1 H 1 7.258 0.00 . . . . . . A 5 DLY HZ1 . 30361 1
29 . 1 1 6 6 ASP H H 1 8.752 0.01 . . . . . . A 6 ASP H . 30361 1
30 . 1 1 6 6 ASP HA H 1 4.494 0.00 . . . . . . A 6 ASP HA . 30361 1
31 . 1 1 6 6 ASP HB2 H 1 2.715 0.00 . . . . . . A 6 ASP HB2 . 30361 1
32 . 1 1 6 6 ASP HB3 H 1 2.442 0.00 . . . . . . A 6 ASP HB3 . 30361 1
33 . 1 1 7 7 SER H H 1 7.751 0.01 . . . . . . A 7 SER H . 30361 1
34 . 1 1 7 7 SER HA H 1 4.407 0.00 . . . . . . A 7 SER HA . 30361 1
35 . 1 1 7 7 SER HB2 H 1 3.166 0.00 . . . . . . A 7 SER HB2 . 30361 1
36 . 1 1 7 7 SER HB3 H 1 3.166 0.00 . . . . . . A 7 SER HB3 . 30361 1
37 . 1 1 8 8 DTY H H 1 8.496 0.01 . . . . . . A 8 DTY H . 30361 1
38 . 1 1 8 8 DTY HA H 1 4.656 0.00 . . . . . . A 8 DTY HA . 30361 1
39 . 1 1 8 8 DTY HB2 H 1 2.708 0.00 . . . . . . A 8 DTY HB2 . 30361 1
40 . 1 1 8 8 DTY HB3 H 1 2.376 0.00 . . . . . . A 8 DTY HB3 . 30361 1
41 . 1 1 8 8 DTY HD1 H 1 6.616 0.01 . . . . . . A 8 DTY HD1 . 30361 1
42 . 1 1 8 8 DTY HE1 H 1 6.481 0.01 . . . . . . A 8 DTY HE1 . 30361 1
43 . 1 1 9 9 DCY H H 1 8.563 0.01 . . . . . . A 9 DCY H . 30361 1
44 . 1 1 9 9 DCY HA H 1 5.075 0.00 . . . . . . A 9 DCY HA . 30361 1
45 . 1 1 9 9 DCY HB2 H 1 2.541 0.00 . . . . . . A 9 DCY HB2 . 30361 1
46 . 1 1 9 9 DCY HB3 H 1 2.449 0.00 . . . . . . A 9 DCY HB3 . 30361 1
47 . 1 1 10 10 PRO HA H 1 4.098 0.00 . . . . . . A 10 PRO HA . 30361 1
48 . 1 1 10 10 PRO HB2 H 1 2.022 0.00 . . . . . . A 10 PRO HB2 . 30361 1
49 . 1 1 10 10 PRO HB3 H 1 1.506 0.00 . . . . . . A 10 PRO HB3 . 30361 1
50 . 1 1 10 10 PRO HG2 H 1 1.760 0.00 . . . . . . A 10 PRO HG2 . 30361 1
51 . 1 1 10 10 PRO HG3 H 1 1.633 0.00 . . . . . . A 10 PRO HG3 . 30361 1
52 . 1 1 10 10 PRO HD2 H 1 3.481 0.01 . . . . . . A 10 PRO HD2 . 30361 1
53 . 1 1 10 10 PRO HD3 H 1 2.975 0.00 . . . . . . A 10 PRO HD3 . 30361 1
54 . 1 1 11 11 DSN H H 1 8.988 0.01 . . . . . . A 11 DSN H . 30361 1
55 . 1 1 11 11 DSN HA H 1 3.956 0.01 . . . . . . A 11 DSN HA . 30361 1
56 . 1 1 11 11 DSN HB2 H 1 3.740 0.00 . . . . . . A 11 DSN HB2 . 30361 1
57 . 1 1 11 11 DSN HB3 H 1 3.612 0.00 . . . . . . A 11 DSN HB3 . 30361 1
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save_