Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"
save_chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one'
_Assigned_chem_shift_list.Entry_ID 1632
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_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 $sample_one . 1632 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 4.11 . . 2 . . . . . . . . 1632 1
2 . 1 1 1 1 GLY HA3 H 1 3.58 . . 2 . . . . . . . . 1632 1
3 . 1 1 2 2 ILE H H 1 8.48 . . 1 . . . . . . . . 1632 1
4 . 1 1 2 2 ILE HA H 1 3.91 . . 1 . . . . . . . . 1632 1
5 . 1 1 2 2 ILE HB H 1 1.16 . . 1 . . . . . . . . 1632 1
6 . 1 1 2 2 ILE HG12 H 1 .94 . . 2 . . . . . . . . 1632 1
7 . 1 1 2 2 ILE HG13 H 1 1.16 . . 2 . . . . . . . . 1632 1
8 . 1 1 2 2 ILE HG21 H 1 .72 . . 1 . . . . . . . . 1632 1
9 . 1 1 2 2 ILE HG22 H 1 .72 . . 1 . . . . . . . . 1632 1
10 . 1 1 2 2 ILE HG23 H 1 .72 . . 1 . . . . . . . . 1632 1
11 . 1 1 2 2 ILE HD11 H 1 .58 . . 1 . . . . . . . . 1632 1
12 . 1 1 2 2 ILE HD12 H 1 .58 . . 1 . . . . . . . . 1632 1
13 . 1 1 2 2 ILE HD13 H 1 .58 . . 1 . . . . . . . . 1632 1
14 . 1 1 3 3 VAL H H 1 8.1 . . 1 . . . . . . . . 1632 1
15 . 1 1 3 3 VAL HA H 1 3.6 . . 1 . . . . . . . . 1632 1
16 . 1 1 3 3 VAL HB H 1 1.88 . . 1 . . . . . . . . 1632 1
17 . 1 1 3 3 VAL HG11 H 1 .84 . . 2 . . . . . . . . 1632 1
18 . 1 1 3 3 VAL HG12 H 1 .84 . . 2 . . . . . . . . 1632 1
19 . 1 1 3 3 VAL HG13 H 1 .84 . . 2 . . . . . . . . 1632 1
20 . 1 1 3 3 VAL HG21 H 1 .88 . . 2 . . . . . . . . 1632 1
21 . 1 1 3 3 VAL HG22 H 1 .88 . . 2 . . . . . . . . 1632 1
22 . 1 1 3 3 VAL HG23 H 1 .88 . . 2 . . . . . . . . 1632 1
23 . 1 1 4 4 GLU H H 1 8.1 . . 1 . . . . . . . . 1632 1
24 . 1 1 4 4 GLU HA H 1 4.19 . . 1 . . . . . . . . 1632 1
25 . 1 1 4 4 GLU HB2 H 1 2.03 . . 1 . . . . . . . . 1632 1
26 . 1 1 4 4 GLU HB3 H 1 2.03 . . 1 . . . . . . . . 1632 1
27 . 1 1 4 4 GLU HG2 H 1 2.41 . . 2 . . . . . . . . 1632 1
28 . 1 1 4 4 GLU HG3 H 1 2.47 . . 2 . . . . . . . . 1632 1
29 . 1 1 5 5 GLN H H 1 8.25 . . 1 . . . . . . . . 1632 1
30 . 1 1 5 5 GLN HA H 1 4.04 . . 1 . . . . . . . . 1632 1
31 . 1 1 5 5 GLN HB2 H 1 2.08 . . 1 . . . . . . . . 1632 1
32 . 1 1 5 5 GLN HB3 H 1 2.03 . . 1 . . . . . . . . 1632 1
33 . 1 1 5 5 GLN HG2 H 1 2.36 . . 2 . . . . . . . . 1632 1
34 . 1 1 5 5 GLN HG3 H 1 2.44 . . 2 . . . . . . . . 1632 1
35 . 1 1 5 5 GLN HE21 H 1 6.84 . . 2 . . . . . . . . 1632 1
36 . 1 1 5 5 GLN HE22 H 1 7.46 . . 2 . . . . . . . . 1632 1
37 . 1 1 6 6 CYS H H 1 8.26 . . 1 . . . . . . . . 1632 1
38 . 1 1 6 6 CYS HA H 1 4.86 . . 1 . . . . . . . . 1632 1
39 . 1 1 6 6 CYS HB2 H 1 2.85 . . 1 . . . . . . . . 1632 1
40 . 1 1 6 6 CYS HB3 H 1 3.32 . . 1 . . . . . . . . 1632 1
41 . 1 1 7 7 CYS H H 1 8.22 . . 1 . . . . . . . . 1632 1
42 . 1 1 7 7 CYS HA H 1 4.8 . . 1 . . . . . . . . 1632 1
43 . 1 1 7 7 CYS HB2 H 1 3.73 . . 1 . . . . . . . . 1632 1
44 . 1 1 7 7 CYS HB3 H 1 3.27 . . 1 . . . . . . . . 1632 1
45 . 1 1 8 8 THR H H 1 8.17 . . 1 . . . . . . . . 1632 1
46 . 1 1 8 8 THR HA H 1 4.03 . . 1 . . . . . . . . 1632 1
47 . 1 1 8 8 THR HB H 1 4.35 . . 1 . . . . . . . . 1632 1
48 . 1 1 8 8 THR HG21 H 1 1.2 . . 1 . . . . . . . . 1632 1
49 . 1 1 8 8 THR HG22 H 1 1.2 . . 1 . . . . . . . . 1632 1
50 . 1 1 8 8 THR HG23 H 1 1.2 . . 1 . . . . . . . . 1632 1
51 . 1 1 9 9 SER H H 1 7.39 . . 1 . . . . . . . . 1632 1
52 . 1 1 9 9 SER HA H 1 4.73 . . 1 . . . . . . . . 1632 1
53 . 1 1 9 9 SER HB2 H 1 4.02 . . 2 . . . . . . . . 1632 1
54 . 1 1 9 9 SER HB3 H 1 3.85 . . 2 . . . . . . . . 1632 1
55 . 1 1 10 10 ILE H H 1 7.78 . . 1 . . . . . . . . 1632 1
56 . 1 1 10 10 ILE HA H 1 4.32 . . 1 . . . . . . . . 1632 1
57 . 1 1 10 10 ILE HB H 1 1.53 . . 1 . . . . . . . . 1632 1
58 . 1 1 10 10 ILE HG12 H 1 .39 . . 2 . . . . . . . . 1632 1
59 . 1 1 10 10 ILE HG13 H 1 1.05 . . 2 . . . . . . . . 1632 1
60 . 1 1 10 10 ILE HG21 H 1 .6 . . 1 . . . . . . . . 1632 1
61 . 1 1 10 10 ILE HG22 H 1 .6 . . 1 . . . . . . . . 1632 1
62 . 1 1 10 10 ILE HG23 H 1 .6 . . 1 . . . . . . . . 1632 1
63 . 1 1 10 10 ILE HD11 H 1 .45 . . 1 . . . . . . . . 1632 1
64 . 1 1 10 10 ILE HD12 H 1 .45 . . 1 . . . . . . . . 1632 1
65 . 1 1 10 10 ILE HD13 H 1 .45 . . 1 . . . . . . . . 1632 1
66 . 1 1 11 11 CYS H H 1 9.62 . . 1 . . . . . . . . 1632 1
67 . 1 1 11 11 CYS HA H 1 4.86 . . 1 . . . . . . . . 1632 1
68 . 1 1 11 11 CYS HB2 H 1 2.84 . . 2 . . . . . . . . 1632 1
69 . 1 1 11 11 CYS HB3 H 1 3.13 . . 2 . . . . . . . . 1632 1
70 . 1 1 12 12 SER H H 1 8.7 . . 1 . . . . . . . . 1632 1
71 . 1 1 12 12 SER HA H 1 4.55 . . 1 . . . . . . . . 1632 1
72 . 1 1 12 12 SER HB2 H 1 3.95 . . 1 . . . . . . . . 1632 1
73 . 1 1 12 12 SER HB3 H 1 4.25 . . 1 . . . . . . . . 1632 1
74 . 1 1 13 13 LEU H H 1 8.57 . . 1 . . . . . . . . 1632 1
75 . 1 1 13 13 LEU HA H 1 3.8 . . 1 . . . . . . . . 1632 1
76 . 1 1 13 13 LEU HB2 H 1 1.3 . . 2 . . . . . . . . 1632 1
77 . 1 1 13 13 LEU HB3 H 1 1.37 . . 2 . . . . . . . . 1632 1
78 . 1 1 13 13 LEU HG H 1 1.37 . . 1 . . . . . . . . 1632 1
79 . 1 1 13 13 LEU HD11 H 1 .69 . . 2 . . . . . . . . 1632 1
80 . 1 1 13 13 LEU HD12 H 1 .69 . . 2 . . . . . . . . 1632 1
81 . 1 1 13 13 LEU HD13 H 1 .69 . . 2 . . . . . . . . 1632 1
82 . 1 1 13 13 LEU HD21 H 1 .74 . . 2 . . . . . . . . 1632 1
83 . 1 1 13 13 LEU HD22 H 1 .74 . . 2 . . . . . . . . 1632 1
84 . 1 1 13 13 LEU HD23 H 1 .74 . . 2 . . . . . . . . 1632 1
85 . 1 1 14 14 TYR H H 1 7.43 . . 1 . . . . . . . . 1632 1
86 . 1 1 14 14 TYR HA H 1 4.12 . . 1 . . . . . . . . 1632 1
87 . 1 1 14 14 TYR HB2 H 1 2.95 . . 1 . . . . . . . . 1632 1
88 . 1 1 14 14 TYR HB3 H 1 2.85 . . 1 . . . . . . . . 1632 1
89 . 1 1 14 14 TYR HD1 H 1 7 . . 1 . . . . . . . . 1632 1
90 . 1 1 14 14 TYR HD2 H 1 7 . . 1 . . . . . . . . 1632 1
91 . 1 1 14 14 TYR HE1 H 1 6.78 . . 1 . . . . . . . . 1632 1
92 . 1 1 14 14 TYR HE2 H 1 6.78 . . 1 . . . . . . . . 1632 1
93 . 1 1 15 15 GLN H H 1 7.5 . . 1 . . . . . . . . 1632 1
94 . 1 1 15 15 GLN HA H 1 3.95 . . 1 . . . . . . . . 1632 1
95 . 1 1 15 15 GLN HB2 H 1 1.99 . . 2 . . . . . . . . 1632 1
96 . 1 1 15 15 GLN HB3 H 1 2.34 . . 2 . . . . . . . . 1632 1
97 . 1 1 15 15 GLN HG2 H 1 2.4 . . 1 . . . . . . . . 1632 1
98 . 1 1 15 15 GLN HG3 H 1 2.4 . . 1 . . . . . . . . 1632 1
99 . 1 1 15 15 GLN HE21 H 1 7.01 . . 2 . . . . . . . . 1632 1
100 . 1 1 15 15 GLN HE22 H 1 7.44 . . 2 . . . . . . . . 1632 1
101 . 1 1 16 16 LEU H H 1 8.02 . . 1 . . . . . . . . 1632 1
102 . 1 1 16 16 LEU HA H 1 4.12 . . 1 . . . . . . . . 1632 1
103 . 1 1 16 16 LEU HB2 H 1 1.52 . . 2 . . . . . . . . 1632 1
104 . 1 1 16 16 LEU HB3 H 1 1.88 . . 2 . . . . . . . . 1632 1
105 . 1 1 16 16 LEU HG H 1 1.7 . . 1 . . . . . . . . 1632 1
106 . 1 1 16 16 LEU HD11 H 1 .74 . . 2 . . . . . . . . 1632 1
107 . 1 1 16 16 LEU HD12 H 1 .74 . . 2 . . . . . . . . 1632 1
108 . 1 1 16 16 LEU HD13 H 1 .74 . . 2 . . . . . . . . 1632 1
109 . 1 1 16 16 LEU HD21 H 1 .78 . . 2 . . . . . . . . 1632 1
110 . 1 1 16 16 LEU HD22 H 1 .78 . . 2 . . . . . . . . 1632 1
111 . 1 1 16 16 LEU HD23 H 1 .78 . . 2 . . . . . . . . 1632 1
112 . 1 1 17 17 GLU H H 1 8 . . 1 . . . . . . . . 1632 1
113 . 1 1 17 17 GLU HA H 1 4.16 . . 1 . . . . . . . . 1632 1
114 . 1 1 17 17 GLU HB2 H 1 2.03 . . 2 . . . . . . . . 1632 1
115 . 1 1 17 17 GLU HB3 H 1 2.08 . . 2 . . . . . . . . 1632 1
116 . 1 1 17 17 GLU HG2 H 1 2.28 . . 2 . . . . . . . . 1632 1
117 . 1 1 17 17 GLU HG3 H 1 2.53 . . 2 . . . . . . . . 1632 1
118 . 1 1 18 18 ASN H H 1 7.38 . . 1 . . . . . . . . 1632 1
119 . 1 1 18 18 ASN HA H 1 4.44 . . 1 . . . . . . . . 1632 1
120 . 1 1 18 18 ASN HB2 H 1 2.5 . . 2 . . . . . . . . 1632 1
121 . 1 1 18 18 ASN HB3 H 1 2.57 . . 2 . . . . . . . . 1632 1
122 . 1 1 18 18 ASN HD21 H 1 6.5 . . 2 . . . . . . . . 1632 1
123 . 1 1 18 18 ASN HD22 H 1 7.12 . . 2 . . . . . . . . 1632 1
124 . 1 1 19 19 TYR H H 1 7.86 . . 1 . . . . . . . . 1632 1
125 . 1 1 19 19 TYR HA H 1 4.44 . . 1 . . . . . . . . 1632 1
126 . 1 1 19 19 TYR HB2 H 1 2.93 . . 1 . . . . . . . . 1632 1
127 . 1 1 19 19 TYR HB3 H 1 3.3 . . 1 . . . . . . . . 1632 1
128 . 1 1 19 19 TYR HD1 H 1 7.28 . . 1 . . . . . . . . 1632 1
129 . 1 1 19 19 TYR HD2 H 1 7.28 . . 1 . . . . . . . . 1632 1
130 . 1 1 19 19 TYR HE1 H 1 6.72 . . 1 . . . . . . . . 1632 1
131 . 1 1 19 19 TYR HE2 H 1 6.72 . . 1 . . . . . . . . 1632 1
132 . 1 1 20 20 CYS H H 1 7.38 . . 1 . . . . . . . . 1632 1
133 . 1 1 20 20 CYS HA H 1 4.73 . . 1 . . . . . . . . 1632 1
134 . 1 1 20 20 CYS HB2 H 1 2.8 . . 2 . . . . . . . . 1632 1
135 . 1 1 20 20 CYS HB3 H 1 3.22 . . 2 . . . . . . . . 1632 1
136 . 1 1 21 21 ASN H H 1 8.16 . . 1 . . . . . . . . 1632 1
137 . 1 1 21 21 ASN HA H 1 4.68 . . 1 . . . . . . . . 1632 1
138 . 1 1 21 21 ASN HB2 H 1 2.7 . . 2 . . . . . . . . 1632 1
139 . 1 1 21 21 ASN HB3 H 1 2.82 . . 2 . . . . . . . . 1632 1
140 . 1 1 21 21 ASN HD21 H 1 6.61 . . 2 . . . . . . . . 1632 1
141 . 1 1 21 21 ASN HD22 H 1 7.45 . . 2 . . . . . . . . 1632 1
stop_
save_