Content for NMR-STAR saveframe, "chemical_shift_assignment_two"
save_chemical_shift_assignment_two
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_two
_Assigned_chem_shift_list.Entry_ID 4203
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one
_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 '1H NOESY' 1 $sample_one . 4203 2
2 '1H TOCY' 1 $sample_one . 4203 2
3 '1H DQF-COSY' 1 $sample_one . 4203 2
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 . 2 2 1 1 3NF H H 1 8.360 . . 1 . . . . . . . . . 4203 2
2 . 2 2 1 1 3NF HA H 1 4.477 . . 1 . . . . . . . . . 4203 2
3 . 2 2 1 1 3NF HB2 H 1 2.928 . . 1 . . . . . . . . . 4203 2
4 . 2 2 1 1 3NF HB3 H 1 2.976 . . 1 . . . . . . . . . 4203 2
5 . 2 2 1 1 3NF HD1 H 1 7.103 . . 1 . . . . . . . . . 4203 2
6 . 2 2 1 1 3NF HD2 H 1 7.103 . . 1 . . . . . . . . . 4203 2
7 . 2 2 1 1 3NF HE1 H 1 6.813 . . 1 . . . . . . . . . 4203 2
8 . 2 2 1 1 3NF HE2 H 1 6.813 . . 1 . . . . . . . . . 4203 2
9 . 2 2 2 2 GLU H H 1 8.497 . . 1 . . . . . . . . . 4203 2
10 . 2 2 2 2 GLU HA H 1 4.191 . . 1 . . . . . . . . . 4203 2
11 . 2 2 2 2 GLU HB2 H 1 1.866 . . 1 . . . . . . . . . 4203 2
12 . 2 2 2 2 GLU HB3 H 1 1.965 . . 1 . . . . . . . . . 4203 2
13 . 2 2 2 2 GLU HG2 H 1 2.204 . . 1 . . . . . . . . . 4203 2
14 . 2 2 2 2 GLU HG3 H 1 2.204 . . 1 . . . . . . . . . 4203 2
15 . 2 2 3 3 GLN H H 1 8.387 . . 1 . . . . . . . . . 4203 2
16 . 2 2 3 3 GLN HA H 1 4.218 . . 1 . . . . . . . . . 4203 2
17 . 2 2 3 3 GLN HB2 H 1 1.965 . . 1 . . . . . . . . . 4203 2
18 . 2 2 3 3 GLN HB3 H 1 2.061 . . 1 . . . . . . . . . 4203 2
19 . 2 2 3 3 GLN HG2 H 1 2.353 . . 1 . . . . . . . . . 4203 2
20 . 2 2 3 3 GLN HG3 H 1 2.353 . . 1 . . . . . . . . . 4203 2
21 . 2 2 3 3 GLN HE21 H 1 7.000 . . 1 . . . . . . . . . 4203 2
22 . 2 2 3 3 GLN HE22 H 1 7.719 . . 1 . . . . . . . . . 4203 2
23 . 2 2 4 4 ALA H H 1 8.414 . . 1 . . . . . . . . . 4203 2
24 . 2 2 4 4 ALA HA H 1 4.258 . . 1 . . . . . . . . . 4203 2
25 . 2 2 4 4 ALA HB1 H 1 1.338 . . 1 . . . . . . . . . 4203 2
26 . 2 2 4 4 ALA HB2 H 1 1.338 . . 1 . . . . . . . . . 4203 2
27 . 2 2 4 4 ALA HB3 H 1 1.338 . . 1 . . . . . . . . . 4203 2
28 . 2 2 5 5 ILE H H 1 8.228 . . 1 . . . . . . . . . 4203 2
29 . 2 2 5 5 ILE HA H 1 3.927 . . 1 . . . . . . . . . 4203 2
30 . 2 2 5 5 ILE HB H 1 1.620 . . 1 . . . . . . . . . 4203 2
31 . 2 2 5 5 ILE HG12 H 1 1.025 . . 1 . . . . . . . . . 4203 2
32 . 2 2 5 5 ILE HG13 H 1 1.386 . . 1 . . . . . . . . . 4203 2
33 . 2 2 5 5 ILE HG21 H 1 0.393 . . 1 . . . . . . . . . 4203 2
34 . 2 2 5 5 ILE HG22 H 1 0.393 . . 1 . . . . . . . . . 4203 2
35 . 2 2 5 5 ILE HG23 H 1 0.393 . . 1 . . . . . . . . . 4203 2
36 . 2 2 5 5 ILE HD11 H 1 0.757 . . 1 . . . . . . . . . 4203 2
37 . 2 2 5 5 ILE HD12 H 1 0.757 . . 1 . . . . . . . . . 4203 2
38 . 2 2 5 5 ILE HD13 H 1 0.757 . . 1 . . . . . . . . . 4203 2
39 . 2 2 6 6 VAL H H 1 8.216 . . 1 . . . . . . . . . 4203 2
40 . 2 2 6 6 VAL HA H 1 4.046 . . 1 . . . . . . . . . 4203 2
41 . 2 2 6 6 VAL HB H 1 1.904 . . 1 . . . . . . . . . 4203 2
42 . 2 2 6 6 VAL HG11 H 1 0.796 . . 1 . . . . . . . . . 4203 2
43 . 2 2 6 6 VAL HG12 H 1 0.796 . . 1 . . . . . . . . . 4203 2
44 . 2 2 6 6 VAL HG13 H 1 0.796 . . 1 . . . . . . . . . 4203 2
45 . 2 2 6 6 VAL HG21 H 1 0.852 . . 1 . . . . . . . . . 4203 2
46 . 2 2 6 6 VAL HG22 H 1 0.852 . . 1 . . . . . . . . . 4203 2
47 . 2 2 6 6 VAL HG23 H 1 0.852 . . 1 . . . . . . . . . 4203 2
48 . 2 2 7 7 TRP H H 1 8.516 . . 1 . . . . . . . . . 4203 2
49 . 2 2 7 7 TRP HA H 1 4.349 . . 1 . . . . . . . . . 4203 2
50 . 2 2 7 7 TRP HB2 H 1 3.040 . . 1 . . . . . . . . . 4203 2
51 . 2 2 7 7 TRP HB3 H 1 3.338 . . 1 . . . . . . . . . 4203 2
52 . 2 2 8 8 PRO HA H 1 4.449 . . 1 . . . . . . . . . 4203 2
53 . 2 2 8 8 PRO HB2 H 1 1.890 . . 1 . . . . . . . . . 4203 2
54 . 2 2 8 8 PRO HB3 H 1 2.268 . . 1 . . . . . . . . . 4203 2
55 . 2 2 8 8 PRO HG2 H 1 2.005 . . 1 . . . . . . . . . 4203 2
56 . 2 2 8 8 PRO HG3 H 1 2.005 . . 1 . . . . . . . . . 4203 2
57 . 2 2 8 8 PRO HD2 H 1 3.603 . . 1 . . . . . . . . . 4203 2
58 . 2 2 8 8 PRO HD3 H 1 3.777 . . 1 . . . . . . . . . 4203 2
59 . 2 2 9 9 LEU H H 1 8.432 . . 1 . . . . . . . . . 4203 2
60 . 2 2 9 9 LEU HA H 1 4.613 . . 1 . . . . . . . . . 4203 2
61 . 2 2 9 9 LEU HB2 H 1 1.635 . . 1 . . . . . . . . . 4203 2
62 . 2 2 9 9 LEU HB3 H 1 1.635 . . 1 . . . . . . . . . 4203 2
63 . 2 2 9 9 LEU HG H 1 1.752 . . 1 . . . . . . . . . 4203 2
64 . 2 2 9 9 LEU HD11 H 1 0.971 . . 1 . . . . . . . . . 4203 2
65 . 2 2 9 9 LEU HD12 H 1 0.971 . . 1 . . . . . . . . . 4203 2
66 . 2 2 9 9 LEU HD13 H 1 0.971 . . 1 . . . . . . . . . 4203 2
67 . 2 2 9 9 LEU HD21 H 1 0.971 . . 1 . . . . . . . . . 4203 2
68 . 2 2 9 9 LEU HD22 H 1 0.971 . . 1 . . . . . . . . . 4203 2
69 . 2 2 9 9 LEU HD23 H 1 0.971 . . 1 . . . . . . . . . 4203 2
70 . 2 2 10 10 PRO HA H 1 4.395 . . 1 . . . . . . . . . 4203 2
71 . 2 2 10 10 PRO HB2 H 1 1.888 . . 1 . . . . . . . . . 4203 2
72 . 2 2 10 10 PRO HB3 H 1 2.289 . . 1 . . . . . . . . . 4203 2
73 . 2 2 10 10 PRO HG2 H 1 2.032 . . 1 . . . . . . . . . 4203 2
74 . 2 2 10 10 PRO HG3 H 1 2.032 . . 1 . . . . . . . . . 4203 2
75 . 2 2 10 10 PRO HD2 H 1 3.676 . . 1 . . . . . . . . . 4203 2
76 . 2 2 10 10 PRO HD3 H 1 3.863 . . 1 . . . . . . . . . 4203 2
77 . 2 2 11 11 ASN H H 1 8.598 . . 1 . . . . . . . . . 4203 2
78 . 2 2 11 11 ASN HA H 1 4.638 . . 1 . . . . . . . . . 4203 2
79 . 2 2 11 11 ASN HB2 H 1 2.781 . . 1 . . . . . . . . . 4203 2
80 . 2 2 11 11 ASN HB3 H 1 2.814 . . 1 . . . . . . . . . 4203 2
81 . 2 2 11 11 ASN HD21 H 1 7.019 . . 1 . . . . . . . . . 4203 2
82 . 2 2 11 11 ASN HD22 H 1 7.739 . . 1 . . . . . . . . . 4203 2
83 . 2 2 12 12 LYS H H 1 8.457 . . 1 . . . . . . . . . 4203 2
84 . 2 2 12 12 LYS HA H 1 4.288 . . 1 . . . . . . . . . 4203 2
85 . 2 2 12 12 LYS HB2 H 1 1.735 . . 1 . . . . . . . . . 4203 2
86 . 2 2 12 12 LYS HB3 H 1 1.826 . . 1 . . . . . . . . . 4203 2
87 . 2 2 12 12 LYS HG2 H 1 1.423 . . 1 . . . . . . . . . 4203 2
88 . 2 2 12 12 LYS HG3 H 1 1.423 . . 1 . . . . . . . . . 4203 2
89 . 2 2 12 12 LYS HD2 H 1 1.657 . . 1 . . . . . . . . . 4203 2
90 . 2 2 12 12 LYS HD3 H 1 1.657 . . 1 . . . . . . . . . 4203 2
91 . 2 2 12 12 LYS HE2 H 1 2.962 . . 1 . . . . . . . . . 4203 2
92 . 2 2 12 12 LYS HE3 H 1 2.962 . . 1 . . . . . . . . . 4203 2
93 . 2 2 13 13 ARG H H 1 8.485 . . 1 . . . . . . . . . 4203 2
94 . 2 2 13 13 ARG HA H 1 4.340 . . 1 . . . . . . . . . 4203 2
95 . 2 2 13 13 ARG HB2 H 1 1.766 . . 1 . . . . . . . . . 4203 2
96 . 2 2 13 13 ARG HB3 H 1 1.844 . . 1 . . . . . . . . . 4203 2
97 . 2 2 13 13 ARG HG2 H 1 1.585 . . 1 . . . . . . . . . 4203 2
98 . 2 2 13 13 ARG HG3 H 1 1.638 . . 1 . . . . . . . . . 4203 2
99 . 2 2 13 13 ARG HD2 H 1 3.160 . . 1 . . . . . . . . . 4203 2
100 . 2 2 13 13 ARG HD3 H 1 3.160 . . 1 . . . . . . . . . 4203 2
101 . 2 2 13 13 ARG HE H 1 7.272 . . 1 . . . . . . . . . 4203 2
102 . 2 2 14 14 CYS H H 1 8.570 . . 1 . . . . . . . . . 4203 2
103 . 2 2 14 14 CYS HA H 1 4.730 . . 1 . . . . . . . . . 4203 2
104 . 2 2 14 14 CYS HB2 H 1 2.910 . . 1 . . . . . . . . . 4203 2
105 . 2 2 14 14 CYS HB3 H 1 3.281 . . 1 . . . . . . . . . 4203 2
106 . 2 2 15 15 SET H H 1 8.502 . . 1 . . . . . . . . . 4203 2
107 . 2 2 15 15 SET HA H 1 4.415 . . 1 . . . . . . . . . 4203 2
108 . 2 2 15 15 SET HB2 H 1 3.857 . . 1 . . . . . . . . . 4203 2
109 . 2 2 15 15 SET HB3 H 1 3.901 . . 1 . . . . . . . . . 4203 2
stop_
save_