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 1652
_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 . 1652 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 HIS HA H 1 4.45 . . 1 . . . . . . . . 1652 1
2 . 1 1 1 1 HIS HB2 H 1 3.48 . . 1 . . . . . . . . 1652 1
3 . 1 1 1 1 HIS HB3 H 1 3.48 . . 1 . . . . . . . . 1652 1
4 . 1 1 1 1 HIS HD2 H 1 7.48 . . 1 . . . . . . . . 1652 1
5 . 1 1 1 1 HIS HE1 H 1 8.69 . . 1 . . . . . . . . 1652 1
6 . 1 1 2 2 SER H H 1 8.83 . . 1 . . . . . . . . 1652 1
7 . 1 1 2 2 SER HA H 1 4.61 . . 1 . . . . . . . . 1652 1
8 . 1 1 2 2 SER HB2 H 1 3.92 . . 2 . . . . . . . . 1652 1
9 . 1 1 2 2 SER HB3 H 1 4.02 . . 2 . . . . . . . . 1652 1
10 . 1 1 3 3 ASP H H 1 8.78 . . 1 . . . . . . . . 1652 1
11 . 1 1 3 3 ASP HA H 1 4.93 . . 1 . . . . . . . . 1652 1
12 . 1 1 3 3 ASP HB2 H 1 3 . . 2 . . . . . . . . 1652 1
13 . 1 1 3 3 ASP HB3 H 1 3.08 . . 2 . . . . . . . . 1652 1
14 . 1 1 4 4 ALA H H 1 8.32 . . 1 . . . . . . . . 1652 1
15 . 1 1 4 4 ALA HA H 1 4.29 . . 1 . . . . . . . . 1652 1
16 . 1 1 4 4 ALA HB1 H 1 1.44 . . 1 . . . . . . . . 1652 1
17 . 1 1 4 4 ALA HB2 H 1 1.44 . . 1 . . . . . . . . 1652 1
18 . 1 1 4 4 ALA HB3 H 1 1.44 . . 1 . . . . . . . . 1652 1
19 . 1 1 5 5 VAL H H 1 7.76 . . 1 . . . . . . . . 1652 1
20 . 1 1 5 5 VAL HA H 1 3.88 . . 1 . . . . . . . . 1652 1
21 . 1 1 5 5 VAL HB H 1 2.04 . . 1 . . . . . . . . 1652 1
22 . 1 1 5 5 VAL HG11 H 1 .94 . . 2 . . . . . . . . 1652 1
23 . 1 1 5 5 VAL HG12 H 1 .94 . . 2 . . . . . . . . 1652 1
24 . 1 1 5 5 VAL HG13 H 1 .94 . . 2 . . . . . . . . 1652 1
25 . 1 1 5 5 VAL HG21 H 1 .86 . . 2 . . . . . . . . 1652 1
26 . 1 1 5 5 VAL HG22 H 1 .86 . . 2 . . . . . . . . 1652 1
27 . 1 1 5 5 VAL HG23 H 1 .86 . . 2 . . . . . . . . 1652 1
28 . 1 1 6 6 PHE H H 1 7.8 . . 1 . . . . . . . . 1652 1
29 . 1 1 6 6 PHE HA H 1 4.52 . . 1 . . . . . . . . 1652 1
30 . 1 1 6 6 PHE HB2 H 1 3.16 . . 2 . . . . . . . . 1652 1
31 . 1 1 6 6 PHE HB3 H 1 3.23 . . 2 . . . . . . . . 1652 1
32 . 1 1 7 7 THR H H 1 8.04 . . 1 . . . . . . . . 1652 1
33 . 1 1 7 7 THR HA H 1 4.11 . . 1 . . . . . . . . 1652 1
34 . 1 1 7 7 THR HB H 1 4.31 . . 1 . . . . . . . . 1652 1
35 . 1 1 7 7 THR HG21 H 1 1.3 . . 1 . . . . . . . . 1652 1
36 . 1 1 7 7 THR HG22 H 1 1.3 . . 1 . . . . . . . . 1652 1
37 . 1 1 7 7 THR HG23 H 1 1.3 . . 1 . . . . . . . . 1652 1
38 . 1 1 8 8 ASP H H 1 8.55 . . 1 . . . . . . . . 1652 1
39 . 1 1 8 8 ASP HA H 1 4.58 . . 1 . . . . . . . . 1652 1
40 . 1 1 8 8 ASP HB2 H 1 2.95 . . 2 . . . . . . . . 1652 1
41 . 1 1 8 8 ASP HB3 H 1 3.06 . . 2 . . . . . . . . 1652 1
42 . 1 1 9 9 ASN H H 1 8.16 . . 1 . . . . . . . . 1652 1
43 . 1 1 9 9 ASN HA H 1 4.57 . . 1 . . . . . . . . 1652 1
44 . 1 1 9 9 ASN HB2 H 1 2.77 . . 2 . . . . . . . . 1652 1
45 . 1 1 9 9 ASN HB3 H 1 2.86 . . 2 . . . . . . . . 1652 1
46 . 1 1 10 10 TYR H H 1 8.4 . . 1 . . . . . . . . 1652 1
47 . 1 1 10 10 TYR HA H 1 4.25 . . 1 . . . . . . . . 1652 1
48 . 1 1 10 10 TYR HB2 H 1 3 . . 1 . . . . . . . . 1652 1
49 . 1 1 10 10 TYR HB3 H 1 3 . . 1 . . . . . . . . 1652 1
50 . 1 1 11 11 THR H H 1 8.12 . . 1 . . . . . . . . 1652 1
51 . 1 1 11 11 THR HA H 1 3.81 . . 1 . . . . . . . . 1652 1
52 . 1 1 11 11 THR HB H 1 4.32 . . 1 . . . . . . . . 1652 1
53 . 1 1 11 11 THR HG21 H 1 1.33 . . 1 . . . . . . . . 1652 1
54 . 1 1 11 11 THR HG22 H 1 1.33 . . 1 . . . . . . . . 1652 1
55 . 1 1 11 11 THR HG23 H 1 1.33 . . 1 . . . . . . . . 1652 1
56 . 1 1 12 12 ARG H H 1 7.79 . . 1 . . . . . . . . 1652 1
57 . 1 1 12 12 ARG HA H 1 4.02 . . 1 . . . . . . . . 1652 1
58 . 1 1 12 12 ARG HB2 H 1 1.96 . . 1 . . . . . . . . 1652 1
59 . 1 1 12 12 ARG HB3 H 1 1.96 . . 1 . . . . . . . . 1652 1
60 . 1 1 12 12 ARG HG2 H 1 1.62 . . 2 . . . . . . . . 1652 1
61 . 1 1 12 12 ARG HG3 H 1 1.82 . . 2 . . . . . . . . 1652 1
62 . 1 1 12 12 ARG HD2 H 1 3.25 . . 1 . . . . . . . . 1652 1
63 . 1 1 12 12 ARG HD3 H 1 3.25 . . 1 . . . . . . . . 1652 1
64 . 1 1 12 12 ARG HE H 1 7.13 . . 1 . . . . . . . . 1652 1
65 . 1 1 13 13 LEU H H 1 7.99 . . 1 . . . . . . . . 1652 1
66 . 1 1 13 13 LEU HA H 1 4.14 . . 1 . . . . . . . . 1652 1
67 . 1 1 13 13 LEU HB2 H 1 1.76 . . 1 . . . . . . . . 1652 1
68 . 1 1 13 13 LEU HB3 H 1 1.76 . . 1 . . . . . . . . 1652 1
69 . 1 1 13 13 LEU HG H 1 1.74 . . 1 . . . . . . . . 1652 1
70 . 1 1 13 13 LEU HD11 H 1 .96 . . 1 . . . . . . . . 1652 1
71 . 1 1 13 13 LEU HD12 H 1 .96 . . 1 . . . . . . . . 1652 1
72 . 1 1 13 13 LEU HD13 H 1 .96 . . 1 . . . . . . . . 1652 1
73 . 1 1 13 13 LEU HD21 H 1 .96 . . 1 . . . . . . . . 1652 1
74 . 1 1 13 13 LEU HD22 H 1 .96 . . 1 . . . . . . . . 1652 1
75 . 1 1 13 13 LEU HD23 H 1 .96 . . 1 . . . . . . . . 1652 1
76 . 1 1 14 14 ARG H H 1 8.18 . . 1 . . . . . . . . 1652 1
77 . 1 1 14 14 ARG HA H 1 4.2 . . 1 . . . . . . . . 1652 1
78 . 1 1 14 14 ARG HB2 H 1 1.78 . . 1 . . . . . . . . 1652 1
79 . 1 1 14 14 ARG HB3 H 1 1.78 . . 1 . . . . . . . . 1652 1
80 . 1 1 14 14 ARG HG2 H 1 1.44 . . 2 . . . . . . . . 1652 1
81 . 1 1 14 14 ARG HG3 H 1 1.58 . . 2 . . . . . . . . 1652 1
82 . 1 1 14 14 ARG HD2 H 1 3.08 . . 1 . . . . . . . . 1652 1
83 . 1 1 14 14 ARG HD3 H 1 3.08 . . 1 . . . . . . . . 1652 1
84 . 1 1 14 14 ARG HE H 1 7.05 . . 1 . . . . . . . . 1652 1
85 . 1 1 15 15 LYS H H 1 8.23 . . 1 . . . . . . . . 1652 1
86 . 1 1 15 15 LYS HA H 1 3.97 . . 1 . . . . . . . . 1652 1
87 . 1 1 15 15 LYS HB2 H 1 2.01 . . 1 . . . . . . . . 1652 1
88 . 1 1 15 15 LYS HB3 H 1 2.01 . . 1 . . . . . . . . 1652 1
89 . 1 1 16 16 GLN H H 1 8.21 . . 1 . . . . . . . . 1652 1
90 . 1 1 16 16 GLN HA H 1 4 . . 1 . . . . . . . . 1652 1
91 . 1 1 16 16 GLN HB2 H 1 2.18 . . 2 . . . . . . . . 1652 1
92 . 1 1 16 16 GLN HB3 H 1 2.33 . . 2 . . . . . . . . 1652 1
93 . 1 1 16 16 GLN HG2 H 1 2.64 . . 1 . . . . . . . . 1652 1
94 . 1 1 16 16 GLN HG3 H 1 2.64 . . 1 . . . . . . . . 1652 1
95 . 1 1 17 17 MET H H 1 8.43 . . 1 . . . . . . . . 1652 1
96 . 1 1 17 17 MET HA H 1 4.19 . . 1 . . . . . . . . 1652 1
97 . 1 1 17 17 MET HB2 H 1 2.14 . . 2 . . . . . . . . 1652 1
98 . 1 1 17 17 MET HB3 H 1 2.26 . . 2 . . . . . . . . 1652 1
99 . 1 1 17 17 MET HG2 H 1 2.79 . . 1 . . . . . . . . 1652 1
100 . 1 1 17 17 MET HG3 H 1 2.79 . . 1 . . . . . . . . 1652 1
101 . 1 1 17 17 MET HE1 H 1 2.16 . . 1 . . . . . . . . 1652 1
102 . 1 1 17 17 MET HE2 H 1 2.16 . . 1 . . . . . . . . 1652 1
103 . 1 1 17 17 MET HE3 H 1 2.16 . . 1 . . . . . . . . 1652 1
104 . 1 1 18 18 ALA H H 1 7.99 . . 1 . . . . . . . . 1652 1
105 . 1 1 18 18 ALA HA H 1 4.15 . . 1 . . . . . . . . 1652 1
106 . 1 1 18 18 ALA HB1 H 1 1.61 . . 1 . . . . . . . . 1652 1
107 . 1 1 18 18 ALA HB2 H 1 1.61 . . 1 . . . . . . . . 1652 1
108 . 1 1 18 18 ALA HB3 H 1 1.61 . . 1 . . . . . . . . 1652 1
109 . 1 1 19 19 VAL H H 1 8.23 . . 1 . . . . . . . . 1652 1
110 . 1 1 19 19 VAL HA H 1 3.74 . . 1 . . . . . . . . 1652 1
111 . 1 1 19 19 VAL HB H 1 2.26 . . 1 . . . . . . . . 1652 1
112 . 1 1 19 19 VAL HG11 H 1 1.03 . . 2 . . . . . . . . 1652 1
113 . 1 1 19 19 VAL HG12 H 1 1.03 . . 2 . . . . . . . . 1652 1
114 . 1 1 19 19 VAL HG13 H 1 1.03 . . 2 . . . . . . . . 1652 1
115 . 1 1 19 19 VAL HG21 H 1 1.12 . . 2 . . . . . . . . 1652 1
116 . 1 1 19 19 VAL HG22 H 1 1.12 . . 2 . . . . . . . . 1652 1
117 . 1 1 19 19 VAL HG23 H 1 1.12 . . 2 . . . . . . . . 1652 1
118 . 1 1 20 20 LYS H H 1 8.09 . . 1 . . . . . . . . 1652 1
119 . 1 1 20 20 LYS HA H 1 4.09 . . 1 . . . . . . . . 1652 1
120 . 1 1 20 20 LYS HB2 H 1 1.98 . . 1 . . . . . . . . 1652 1
121 . 1 1 20 20 LYS HB3 H 1 1.98 . . 1 . . . . . . . . 1652 1
122 . 1 1 21 21 LYS H H 1 8.27 . . 1 . . . . . . . . 1652 1
123 . 1 1 21 21 LYS HA H 1 4.06 . . 1 . . . . . . . . 1652 1
124 . 1 1 21 21 LYS HB2 H 1 2.03 . . 1 . . . . . . . . 1652 1
125 . 1 1 21 21 LYS HB3 H 1 2.03 . . 1 . . . . . . . . 1652 1
126 . 1 1 22 22 TYR H H 1 8.29 . . 1 . . . . . . . . 1652 1
127 . 1 1 22 22 TYR HA H 1 4.31 . . 1 . . . . . . . . 1652 1
128 . 1 1 22 22 TYR HB2 H 1 3.26 . . 2 . . . . . . . . 1652 1
129 . 1 1 22 22 TYR HB3 H 1 3.3 . . 2 . . . . . . . . 1652 1
130 . 1 1 23 23 LEU H H 1 9.06 . . 1 . . . . . . . . 1652 1
131 . 1 1 23 23 LEU HA H 1 3.95 . . 1 . . . . . . . . 1652 1
132 . 1 1 23 23 LEU HB2 H 1 1.5 . . 1 . . . . . . . . 1652 1
133 . 1 1 23 23 LEU HB3 H 1 1.5 . . 1 . . . . . . . . 1652 1
134 . 1 1 23 23 LEU HG H 1 1.98 . . 1 . . . . . . . . 1652 1
135 . 1 1 23 23 LEU HD11 H 1 .92 . . 1 . . . . . . . . 1652 1
136 . 1 1 23 23 LEU HD12 H 1 .92 . . 1 . . . . . . . . 1652 1
137 . 1 1 23 23 LEU HD13 H 1 .92 . . 1 . . . . . . . . 1652 1
138 . 1 1 23 23 LEU HD21 H 1 .92 . . 1 . . . . . . . . 1652 1
139 . 1 1 23 23 LEU HD22 H 1 .92 . . 1 . . . . . . . . 1652 1
140 . 1 1 23 23 LEU HD23 H 1 .92 . . 1 . . . . . . . . 1652 1
141 . 1 1 24 24 ASN H H 1 8.49 . . 1 . . . . . . . . 1652 1
142 . 1 1 24 24 ASN HA H 1 4.36 . . 1 . . . . . . . . 1652 1
143 . 1 1 24 24 ASN HB2 H 1 2.82 . . 2 . . . . . . . . 1652 1
144 . 1 1 24 24 ASN HB3 H 1 2.93 . . 2 . . . . . . . . 1652 1
145 . 1 1 25 25 SER H H 1 7.93 . . 1 . . . . . . . . 1652 1
146 . 1 1 25 25 SER HA H 1 4.3 . . 1 . . . . . . . . 1652 1
147 . 1 1 25 25 SER HB2 H 1 4.09 . . 1 . . . . . . . . 1652 1
148 . 1 1 25 25 SER HB3 H 1 4.09 . . 1 . . . . . . . . 1652 1
149 . 1 1 26 26 ILE H H 1 7.62 . . 1 . . . . . . . . 1652 1
150 . 1 1 26 26 ILE HA H 1 3.98 . . 1 . . . . . . . . 1652 1
151 . 1 1 26 26 ILE HB H 1 1.87 . . 1 . . . . . . . . 1652 1
152 . 1 1 26 26 ILE HG12 H 1 1.05 . . 2 . . . . . . . . 1652 1
153 . 1 1 26 26 ILE HG13 H 1 1.36 . . 2 . . . . . . . . 1652 1
154 . 1 1 26 26 ILE HG21 H 1 .8 . . 1 . . . . . . . . 1652 1
155 . 1 1 26 26 ILE HG22 H 1 .8 . . 1 . . . . . . . . 1652 1
156 . 1 1 26 26 ILE HG23 H 1 .8 . . 1 . . . . . . . . 1652 1
157 . 1 1 26 26 ILE HD11 H 1 .65 . . 1 . . . . . . . . 1652 1
158 . 1 1 26 26 ILE HD12 H 1 .65 . . 1 . . . . . . . . 1652 1
159 . 1 1 26 26 ILE HD13 H 1 .65 . . 1 . . . . . . . . 1652 1
160 . 1 1 27 27 LEU H H 1 8.18 . . 1 . . . . . . . . 1652 1
161 . 1 1 27 27 LEU HA H 1 3.95 . . 1 . . . . . . . . 1652 1
162 . 1 1 27 27 LEU HB2 H 1 1.83 . . 1 . . . . . . . . 1652 1
163 . 1 1 27 27 LEU HB3 H 1 1.83 . . 1 . . . . . . . . 1652 1
164 . 1 1 27 27 LEU HG H 1 1.75 . . 1 . . . . . . . . 1652 1
165 . 1 1 27 27 LEU HD11 H 1 .8 . . 2 . . . . . . . . 1652 1
166 . 1 1 27 27 LEU HD12 H 1 .8 . . 2 . . . . . . . . 1652 1
167 . 1 1 27 27 LEU HD13 H 1 .8 . . 2 . . . . . . . . 1652 1
168 . 1 1 27 27 LEU HD21 H 1 .86 . . 2 . . . . . . . . 1652 1
169 . 1 1 27 27 LEU HD22 H 1 .86 . . 2 . . . . . . . . 1652 1
170 . 1 1 27 27 LEU HD23 H 1 .86 . . 2 . . . . . . . . 1652 1
171 . 1 1 28 28 ASN H H 1 7.77 . . 1 . . . . . . . . 1652 1
172 . 1 1 28 28 ASN HA H 1 4.79 . . 1 . . . . . . . . 1652 1
173 . 1 1 28 28 ASN HB2 H 1 2.9 . . 1 . . . . . . . . 1652 1
174 . 1 1 28 28 ASN HB3 H 1 2.9 . . 1 . . . . . . . . 1652 1
stop_
save_