Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 50637
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'assigned chem shift list 1 2'
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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
3 '2D 1H-15N HSQC/HMQC' . . . 50637 2
4 '2D 1H-1H NOESY' . . . 50637 2
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 . . 50637 2
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 1 1 G H1 H 1 12.975 0.0 . 1 . . 41 . . 1 G H1 . 50637 2
2 . 1 . 1 1 1 G N1 N 15 148.276 . . 1 . . 42 . . 1 G N1 . 50637 2
3 . 1 . 1 4 4 G H1 H 1 12.089 0.0 . 1 . . 65 . . 4 G H1 . 50637 2
4 . 1 . 1 4 4 G N1 N 15 146.423 . . 1 . . 66 . . 4 G N1 . 50637 2
5 . 1 . 1 5 5 G H1 H 1 12.548 0.0 . 1 . . 57 . . 5 G H1 . 50637 2
6 . 1 . 1 5 5 G N1 N 15 147.213 . . 1 . . 58 . . 5 G N1 . 50637 2
7 . 1 . 1 6 6 G H1 H 1 12.554 0.0 . 1 . . 55 . . 6 G H1 . 50637 2
8 . 1 . 1 6 6 G N1 N 15 147.157 . . 1 . . 56 . . 6 G N1 . 50637 2
9 . 1 . 1 10 10 U H3 H 1 15.119 0.001 . 1 . . 3 . . 10 U H3 . 50637 2
10 . 1 . 1 10 10 U N3 N 15 164.102 . . 1 . . 4 . . 10 U N3 . 50637 2
11 . 1 . 1 15 15 U H3 H 1 11.126 0.0 . 1 . . 21 . . 15 U H3 . 50637 2
12 . 1 . 1 15 15 U N3 N 15 157.587 . . 1 . . 22 . . 15 U N3 . 50637 2
13 . 1 . 1 23 23 G H1 H 1 13.470 0.001 . 1 . . 33 . . 23 G H1 . 50637 2
14 . 1 . 1 23 23 G N1 N 15 148.374 . . 1 . . 34 . . 23 G N1 . 50637 2
15 . 1 . 1 24 24 G H1 H 1 13.939 0.0 . 1 . . 29 . . 24 G H1 . 50637 2
16 . 1 . 1 24 24 G N1 N 15 149.465 . . 1 . . 30 . . 24 G N1 . 50637 2
17 . 1 . 1 25 25 U H3 H 1 10.802 0.0 . 1 . . 23 . . 25 U H3 . 50637 2
18 . 1 . 1 25 25 U N3 N 15 159.361 . . 1 . . 24 . . 25 U N3 . 50637 2
19 . 1 . 1 27 27 G H1 H 1 11.303 0.0 . 1 . . 71 . . 27 G H1 . 50637 2
20 . 1 . 1 27 27 G N1 N 15 143.186 . . 1 . . 72 . . 27 G N1 . 50637 2
21 . 1 . 1 28 28 U H3 H 1 13.271 0.0 . 1 . . 11 . . 28 U H3 . 50637 2
22 . 1 . 1 28 28 U N3 N 15 161.941 . . 1 . . 12 . . 28 U N3 . 50637 2
23 . 1 . 1 30 30 G H1 H 1 11.383 0.0 . 1 . . 73 . . 30 G H1 . 50637 2
24 . 1 . 1 30 30 G N1 N 15 144.745 . . 1 . . 74 . . 30 G N1 . 50637 2
25 . 1 . 1 33 33 G H1 H 1 13.649 0.0 . 1 . . 31 . . 33 G H1 . 50637 2
26 . 1 . 1 33 33 G N1 N 15 148.177 . . 1 . . 32 . . 33 G N1 . 50637 2
27 . 1 . 1 42 42 U H3 H 1 13.443 0.0 . 1 . . 7 . . 42 U H3 . 50637 2
28 . 1 . 1 42 42 U N3 N 15 161.529 . . 1 . . 8 . . 42 U N3 . 50637 2
29 . 1 . 1 43 43 G H1 H 1 12.665 0.0 . 1 . . 49 . . 43 G H1 . 50637 2
30 . 1 . 1 43 43 G N1 N 15 147.546 . . 1 . . 50 . . 43 G N1 . 50637 2
31 . 1 . 1 44 44 U H3 H 1 11.955 0.0 . 1 . . 13 . . 44 U H3 . 50637 2
32 . 1 . 1 44 44 U N3 N 15 158.559 . . 1 . . 14 . . 44 U N3 . 50637 2
33 . 1 . 1 45 45 U H3 H 1 13.347 0.0 . 1 . . 9 . . 45 U H3 . 50637 2
34 . 1 . 1 45 45 U N3 N 15 161.511 . . 1 . . 10 . . 45 U N3 . 50637 2
35 . 1 . 1 47 47 U H3 H 1 11.481 0.0 . 1 . . 15 . . 47 U H3 . 50637 2
36 . 1 . 1 47 47 U N3 N 15 159.046 . . 1 . . 16 . . 47 U N3 . 50637 2
37 . 1 . 1 48 48 G H1 H 1 11.216 0.0 . 1 . . 75 . . 48 G H1 . 50637 2
38 . 1 . 1 48 48 G N1 N 15 146.285 . . 1 . . 76 . . 48 G N1 . 50637 2
39 . 1 . 1 49 49 U H3 H 1 11.480 0.0 . 1 . . 17 . . 49 U H3 . 50637 2
40 . 1 . 1 49 49 U N3 N 15 159.389 . . 1 . . 18 . . 49 U N3 . 50637 2
41 . 1 . 1 52 52 U H3 H 1 11.341 0.0 . 1 . . 20 . . 52 U H3 . 50637 2
42 . 1 . 1 52 52 U N3 N 15 159.655 . . 1 . . 19 . . 52 U N3 . 50637 2
43 . 1 . 1 53 53 U H3 H 1 10.266 0.0 . 1 . . 25 . . 53 U H3 . 50637 2
44 . 1 . 1 53 53 U N3 N 15 156.437 . . 1 . . 26 . . 53 U N3 . 50637 2
45 . 1 . 1 54 54 G H1 H 1 12.543 0.0 . 1 . . 51 . . 54 G H1 . 50637 2
46 . 1 . 1 54 54 G N1 N 15 147.697 . . 1 . . 52 . . 54 G N1 . 50637 2
47 . 1 . 1 55 55 G H1 H 1 12.958 0.0 . 1 . . 43 . . 55 G H1 . 50637 2
48 . 1 . 1 55 55 G N1 N 15 147.871 . . 1 . . 44 . . 55 G N1 . 50637 2
49 . 1 . 1 58 58 G H1 H 1 11.763 0.0 . 1 . . 69 . . 58 G H1 . 50637 2
50 . 1 . 1 58 58 G N1 N 15 146.253 . . 1 . . 70 . . 58 G N1 . 50637 2
51 . 1 . 1 60 60 G H1 H 1 12.775 0.0 . 1 . . 47 . . 60 G H1 . 50637 2
52 . 1 . 1 60 60 G N1 N 15 148.023 . . 1 . . 48 . . 60 G N1 . 50637 2
53 . 1 . 1 61 61 G H1 H 1 12.246 0.0 . 1 . . 63 . . 61 G H1 . 50637 2
54 . 1 . 1 61 61 G N1 N 15 147.555 . . 1 . . 64 . . 61 G N1 . 50637 2
55 . 1 . 1 63 63 U H3 H 1 13.796 0.0 . 1 . . 5 . . 63 U H3 . 50637 2
56 . 1 . 1 63 63 U N3 N 15 160.022 . . 1 . . 6 . . 63 U N3 . 50637 2
57 . 1 . 1 66 66 G H1 H 1 12.417 0.0 . 1 . . 61 . . 66 G H1 . 50637 2
58 . 1 . 1 66 66 G N1 N 15 148.119 . . 1 . . 62 . . 66 G N1 . 50637 2
59 . 1 . 1 67 67 U H3 H 1 13.837 0.0 . 1 . . 2 . . 67 U H3 . 50637 2
60 . 1 . 1 67 67 U N3 N 15 162.435 . . 1 . . 1 . . 67 U N3 . 50637 2
61 . 1 . 1 68 68 G H1 H 1 11.956 0.0 . 1 . . 67 . . 68 G H1 . 50637 2
62 . 1 . 1 68 68 G N1 N 15 146.769 . . 1 . . 68 . . 68 G N1 . 50637 2
63 . 1 . 1 71 71 G H1 H 1 13.024 0.0 . 1 . . 39 . . 71 G H1 . 50637 2
64 . 1 . 1 71 71 G N1 N 15 148.006 . . 1 . . 40 . . 71 G N1 . 50637 2
65 . 1 . 1 74 74 G H1 H 1 10.581 0.0 . 1 . . 77 . . 74 G H1 . 50637 2
66 . 1 . 1 74 74 G N1 N 15 146.090 . . 1 . . 78 . . 74 G N1 . 50637 2
67 . 1 . 1 78 78 G H1 H 1 12.563 0.0 . 1 . . 53 . . 78 G H1 . 50637 2
68 . 1 . 1 78 78 G N1 N 15 147.157 . . 1 . . 54 . . 78 G N1 . 50637 2
69 . 1 . 1 79 79 G H1 H 1 13.120 0.0 . 1 . . 37 . . 79 G H1 . 50637 2
70 . 1 . 1 79 79 G N1 N 15 148.312 . . 1 . . 38 . . 79 G N1 . 50637 2
71 . 1 . 1 81 81 G H1 H 1 12.559 0.0 . 1 . . 59 . . 81 G H1 . 50637 2
72 . 1 . 1 81 81 G N1 N 15 147.257 . . 1 . . 60 . . 81 G N1 . 50637 2
73 . 1 . 1 89 89 G H1 H 1 13.165 0.0 . 1 . . 35 . . 89 G H1 . 50637 2
74 . 1 . 1 89 89 G N1 N 15 147.761 . . 1 . . 36 . . 89 G N1 . 50637 2
75 . 1 . 1 95 95 G H1 H 1 14.275 0.0 . 1 . . 27 . . 95 G H1 . 50637 2
76 . 1 . 1 95 95 G N1 N 15 153.119 . . 1 . . 28 . . 95 G N1 . 50637 2
77 . 1 . 1 99 99 G H1 H 1 12.926 0.0 . 1 . . 45 . . 99 G H1 . 50637 2
78 . 1 . 1 99 99 G N1 N 15 147.822 . . 1 . . 46 . . 99 G N1 . 50637 2
stop_
save_