Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 15050
_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 $chemical_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
4 '2D 1H-1H COSY' . . . 15050 1
5 '2D 1H-1H TOCSY' . . . 15050 1
6 '2D 1H-1H NOESY' . . . 15050 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 PHE HA H 1 4.14 0.01 . 1 . . . . 1 PHE HA . 15050 1
2 . 1 1 1 1 PHE HB2 H 1 3.22 0.01 . 2 . . . . 1 PHE HB2 . 15050 1
3 . 1 1 1 1 PHE HB3 H 1 3.06 0.01 . 2 . . . . 1 PHE HB3 . 15050 1
4 . 1 1 1 1 PHE HD1 H 1 7.30 0.01 . 1 . . . . 1 PHE HD1 . 15050 1
5 . 1 1 1 1 PHE HD2 H 1 7.30 0.01 . 1 . . . . 1 PHE HD2 . 15050 1
6 . 1 1 1 1 PHE HE1 H 1 7.10 0.01 . 3 . . . . 1 PHE HE1 . 15050 1
7 . 1 1 1 1 PHE HE2 H 1 7.30 0.01 . 3 . . . . 1 PHE HE2 . 15050 1
8 . 1 1 1 1 PHE HZ H 1 7.10 0.01 . 1 . . . . 1 PHE HZ . 15050 1
9 . 1 1 2 2 PHE HA H 1 4.31 0.01 . 1 . . . . 2 PHE HA . 15050 1
10 . 1 1 2 2 PHE HB2 H 1 3.09 0.01 . 2 . . . . 2 PHE HB2 . 15050 1
11 . 1 1 2 2 PHE HB3 H 1 2.88 0.01 . 2 . . . . 2 PHE HB3 . 15050 1
12 . 1 1 2 2 PHE HD1 H 1 7.40 0.01 . 1 . . . . 2 PHE HD1 . 15050 1
13 . 1 1 2 2 PHE HD2 H 1 7.40 0.01 . 1 . . . . 2 PHE HD2 . 15050 1
14 . 1 1 2 2 PHE HE1 H 1 7.40 0.01 . 1 . . . . 2 PHE HE1 . 15050 1
15 . 1 1 2 2 PHE HE2 H 1 7.40 0.01 . 1 . . . . 2 PHE HE2 . 15050 1
16 . 1 1 2 2 PHE HZ H 1 7.20 0.01 . 1 . . . . 2 PHE HZ . 15050 1
17 . 1 1 3 3 HIS HA H 1 4.42 0.01 . 1 . . . . 3 HIS HA . 15050 1
18 . 1 1 3 3 HIS HB2 H 1 3.13 0.01 . 1 . . . . 3 HIS HB2 . 15050 1
19 . 1 1 3 3 HIS HB3 H 1 3.13 0.01 . 1 . . . . 3 HIS HB3 . 15050 1
20 . 1 1 4 4 HIS H H 1 8.29 0.01 . 1 . . . . 4 HIS H . 15050 1
21 . 1 1 4 4 HIS HA H 1 4.56 0.01 . 1 . . . . 4 HIS HA . 15050 1
22 . 1 1 4 4 HIS HB2 H 1 3.26 0.01 . 1 . . . . 4 HIS HB2 . 15050 1
23 . 1 1 4 4 HIS HB3 H 1 3.26 0.01 . 1 . . . . 4 HIS HB3 . 15050 1
24 . 1 1 5 5 ILE H H 1 8.10 0.01 . 1 . . . . 5 ILE H . 15050 1
25 . 1 1 5 5 ILE HA H 1 3.91 0.01 . 1 . . . . 5 ILE HA . 15050 1
26 . 1 1 5 5 ILE HB H 1 1.91 0.01 . 1 . . . . 5 ILE HB . 15050 1
27 . 1 1 5 5 ILE HG12 H 1 1.42 0.01 . 2 . . . . 5 ILE HG12 . 15050 1
28 . 1 1 5 5 ILE HG13 H 1 1.10 0.01 . 2 . . . . 5 ILE HG13 . 15050 1
29 . 1 1 5 5 ILE HG21 H 1 0.80 0.01 . 1 . . . . 5 ILE HG2 . 15050 1
30 . 1 1 5 5 ILE HG22 H 1 0.80 0.01 . 1 . . . . 5 ILE HG2 . 15050 1
31 . 1 1 5 5 ILE HG23 H 1 0.80 0.01 . 1 . . . . 5 ILE HG2 . 15050 1
32 . 1 1 5 5 ILE HD11 H 1 0.80 0.01 . 1 . . . . 5 ILE HD1 . 15050 1
33 . 1 1 5 5 ILE HD12 H 1 0.80 0.01 . 1 . . . . 5 ILE HD1 . 15050 1
34 . 1 1 5 5 ILE HD13 H 1 0.80 0.01 . 1 . . . . 5 ILE HD1 . 15050 1
35 . 1 1 6 6 PHE H H 1 8.47 0.01 . 1 . . . . 6 PHE H . 15050 1
36 . 1 1 6 6 PHE HA H 1 4.33 0.01 . 1 . . . . 6 PHE HA . 15050 1
37 . 1 1 6 6 PHE HB2 H 1 3.18 0.01 . 1 . . . . 6 PHE HB2 . 15050 1
38 . 1 1 6 6 PHE HB3 H 1 3.18 0.01 . 1 . . . . 6 PHE HB3 . 15050 1
39 . 1 1 6 6 PHE HD1 H 1 7.40 0.01 . 1 . . . . 6 PHE HD1 . 15050 1
40 . 1 1 6 6 PHE HD2 H 1 7.40 0.01 . 1 . . . . 6 PHE HD2 . 15050 1
41 . 1 1 6 6 PHE HE1 H 1 7.40 0.01 . 1 . . . . 6 PHE HE1 . 15050 1
42 . 1 1 6 6 PHE HE2 H 1 7.40 0.01 . 1 . . . . 6 PHE HE2 . 15050 1
43 . 1 1 6 6 PHE HZ H 1 7.10 0.01 . 1 . . . . 6 PHE HZ . 15050 1
44 . 1 1 7 7 ARG H H 1 8.29 0.01 . 1 . . . . 7 ARG H . 15050 1
45 . 1 1 7 7 ARG HA H 1 3.93 0.01 . 1 . . . . 7 ARG HA . 15050 1
46 . 1 1 7 7 ARG HB2 H 1 1.91 0.01 . 1 . . . . 7 ARG HB2 . 15050 1
47 . 1 1 7 7 ARG HB3 H 1 1.91 0.01 . 1 . . . . 7 ARG HB3 . 15050 1
48 . 1 1 7 7 ARG HG2 H 1 1.77 0.01 . 2 . . . . 7 ARG HG2 . 15050 1
49 . 1 1 7 7 ARG HG3 H 1 1.63 0.01 . 2 . . . . 7 ARG HG3 . 15050 1
50 . 1 1 7 7 ARG HD2 H 1 3.17 0.01 . 1 . . . . 7 ARG HD2 . 15050 1
51 . 1 1 7 7 ARG HD3 H 1 3.17 0.01 . 1 . . . . 7 ARG HD3 . 15050 1
52 . 1 1 8 8 GLY H H 1 8.17 0.01 . 1 . . . . 8 GLY H . 15050 1
53 . 1 1 8 8 GLY HA2 H 1 3.98 0.01 . 2 . . . . 8 GLY HA2 . 15050 1
54 . 1 1 8 8 GLY HA3 H 1 3.80 0.01 . 2 . . . . 8 GLY HA3 . 15050 1
55 . 1 1 9 9 ILE H H 1 8.27 0.01 . 1 . . . . 9 ILE H . 15050 1
56 . 1 1 9 9 ILE HA H 1 3.74 0.01 . 1 . . . . 9 ILE HA . 15050 1
57 . 1 1 9 9 ILE HB H 1 2.03 0.01 . 1 . . . . 9 ILE HB . 15050 1
58 . 1 1 9 9 ILE HG12 H 1 1.82 0.01 . 2 . . . . 9 ILE HG12 . 15050 1
59 . 1 1 9 9 ILE HG13 H 1 1.10 0.01 . 2 . . . . 9 ILE HG13 . 15050 1
60 . 1 1 9 9 ILE HG21 H 1 0.79 0.01 . 1 . . . . 9 ILE HG2 . 15050 1
61 . 1 1 9 9 ILE HG22 H 1 0.79 0.01 . 1 . . . . 9 ILE HG2 . 15050 1
62 . 1 1 9 9 ILE HG23 H 1 0.79 0.01 . 1 . . . . 9 ILE HG2 . 15050 1
63 . 1 1 9 9 ILE HD11 H 1 0.86 0.01 . 1 . . . . 9 ILE HD1 . 15050 1
64 . 1 1 9 9 ILE HD12 H 1 0.86 0.01 . 1 . . . . 9 ILE HD1 . 15050 1
65 . 1 1 9 9 ILE HD13 H 1 0.86 0.01 . 1 . . . . 9 ILE HD1 . 15050 1
66 . 1 1 10 10 VAL H H 1 8.06 0.01 . 1 . . . . 10 VAL H . 15050 1
67 . 1 1 10 10 VAL HA H 1 3.57 0.01 . 1 . . . . 10 VAL HA . 15050 1
68 . 1 1 10 10 VAL HB H 1 2.04 0.01 . 1 . . . . 10 VAL HB . 15050 1
69 . 1 1 10 10 VAL HG11 H 1 0.91 0.01 . 2 . . . . 10 VAL HG1 . 15050 1
70 . 1 1 10 10 VAL HG12 H 1 0.91 0.01 . 2 . . . . 10 VAL HG1 . 15050 1
71 . 1 1 10 10 VAL HG13 H 1 0.91 0.01 . 2 . . . . 10 VAL HG1 . 15050 1
72 . 1 1 10 10 VAL HG21 H 1 0.80 0.01 . 2 . . . . 10 VAL HG2 . 15050 1
73 . 1 1 10 10 VAL HG22 H 1 0.80 0.01 . 2 . . . . 10 VAL HG2 . 15050 1
74 . 1 1 10 10 VAL HG23 H 1 0.80 0.01 . 2 . . . . 10 VAL HG2 . 15050 1
75 . 1 1 11 11 HIS H H 1 8.14 0.01 . 1 . . . . 11 HIS H . 15050 1
76 . 1 1 11 11 HIS HA H 1 4.42 0.01 . 1 . . . . 11 HIS HA . 15050 1
77 . 1 1 11 11 HIS HB2 H 1 3.45 0.01 . 2 . . . . 11 HIS HB2 . 15050 1
78 . 1 1 11 11 HIS HB3 H 1 3.37 0.01 . 2 . . . . 11 HIS HB3 . 15050 1
79 . 1 1 12 12 VAL H H 1 8.45 0.01 . 1 . . . . 12 VAL H . 15050 1
80 . 1 1 12 12 VAL HA H 1 3.68 0.01 . 1 . . . . 12 VAL HA . 15050 1
81 . 1 1 12 12 VAL HB H 1 2.29 0.01 . 1 . . . . 12 VAL HB . 15050 1
82 . 1 1 12 12 VAL HG11 H 1 1.13 0.01 . 2 . . . . 12 VAL HG1 . 15050 1
83 . 1 1 12 12 VAL HG12 H 1 1.13 0.01 . 2 . . . . 12 VAL HG1 . 15050 1
84 . 1 1 12 12 VAL HG13 H 1 1.13 0.01 . 2 . . . . 12 VAL HG1 . 15050 1
85 . 1 1 12 12 VAL HG21 H 1 0.95 0.01 . 2 . . . . 12 VAL HG2 . 15050 1
86 . 1 1 12 12 VAL HG22 H 1 0.95 0.01 . 2 . . . . 12 VAL HG2 . 15050 1
87 . 1 1 12 12 VAL HG23 H 1 0.95 0.01 . 2 . . . . 12 VAL HG2 . 15050 1
88 . 1 1 13 13 GLY H H 1 8.85 0.01 . 1 . . . . 13 GLY H . 15050 1
89 . 1 1 13 13 GLY HA2 H 1 3.75 0.01 . 2 . . . . 13 GLY HA2 . 15050 1
90 . 1 1 13 13 GLY HA3 H 1 3.69 0.01 . 2 . . . . 13 GLY HA3 . 15050 1
91 . 1 1 14 14 LYS H H 1 8.59 0.01 . 1 . . . . 14 LYS H . 15050 1
92 . 1 1 14 14 LYS HA H 1 4.07 0.01 . 1 . . . . 14 LYS HA . 15050 1
93 . 1 1 14 14 LYS HB2 H 1 1.92 0.01 . 1 . . . . 14 LYS HB2 . 15050 1
94 . 1 1 14 14 LYS HB3 H 1 1.92 0.01 . 1 . . . . 14 LYS HB3 . 15050 1
95 . 1 1 14 14 LYS HG2 H 1 1.45 0.01 . 1 . . . . 14 LYS HG2 . 15050 1
96 . 1 1 14 14 LYS HG3 H 1 1.45 0.01 . 1 . . . . 14 LYS HG3 . 15050 1
97 . 1 1 14 14 LYS HD2 H 1 1.69 0.01 . 1 . . . . 14 LYS HD2 . 15050 1
98 . 1 1 14 14 LYS HD3 H 1 1.69 0.01 . 1 . . . . 14 LYS HD3 . 15050 1
99 . 1 1 14 14 LYS HE2 H 1 3.00 0.01 . 1 . . . . 14 LYS HE2 . 15050 1
100 . 1 1 14 14 LYS HE3 H 1 3.00 0.01 . 1 . . . . 14 LYS HE3 . 15050 1
101 . 1 1 15 15 THR H H 1 8.04 0.01 . 1 . . . . 15 THR H . 15050 1
102 . 1 1 15 15 THR HA H 1 3.94 0.01 . 1 . . . . 15 THR HA . 15050 1
103 . 1 1 15 15 THR HB H 1 4.36 0.01 . 1 . . . . 15 THR HB . 15050 1
104 . 1 1 15 15 THR HG21 H 1 1.24 0.01 . 1 . . . . 15 THR HG1 . 15050 1
105 . 1 1 15 15 THR HG22 H 1 1.24 0.01 . 1 . . . . 15 THR HG1 . 15050 1
106 . 1 1 15 15 THR HG23 H 1 1.24 0.01 . 1 . . . . 15 THR HG1 . 15050 1
107 . 1 1 16 16 ILE H H 1 8.54 0.01 . 1 . . . . 16 ILE H . 15050 1
108 . 1 1 16 16 ILE HA H 1 3.65 0.01 . 1 . . . . 16 ILE HA . 15050 1
109 . 1 1 16 16 ILE HB H 1 1.99 0.01 . 1 . . . . 16 ILE HB . 15050 1
110 . 1 1 16 16 ILE HG12 H 1 1.85 0.01 . 2 . . . . 16 ILE HG12 . 15050 1
111 . 1 1 16 16 ILE HG13 H 1 1.13 0.01 . 2 . . . . 16 ILE HG13 . 15050 1
112 . 1 1 16 16 ILE HG21 H 1 0.81 0.01 . 1 . . . . 16 ILE HG2 . 15050 1
113 . 1 1 16 16 ILE HG22 H 1 0.81 0.01 . 1 . . . . 16 ILE HG2 . 15050 1
114 . 1 1 16 16 ILE HG23 H 1 0.81 0.01 . 1 . . . . 16 ILE HG2 . 15050 1
115 . 1 1 16 16 ILE HD11 H 1 0.96 0.01 . 1 . . . . 16 ILE HD1 . 15050 1
116 . 1 1 16 16 ILE HD12 H 1 0.96 0.01 . 1 . . . . 16 ILE HD1 . 15050 1
117 . 1 1 16 16 ILE HD13 H 1 0.96 0.01 . 1 . . . . 16 ILE HD1 . 15050 1
118 . 1 1 17 17 HIS H H 1 8.59 0.01 . 1 . . . . 17 HIS H . 15050 1
119 . 1 1 17 17 HIS HA H 1 4.13 0.01 . 1 . . . . 17 HIS HA . 15050 1
120 . 1 1 17 17 HIS HB2 H 1 3.42 0.01 . 1 . . . . 17 HIS HB2 . 15050 1
121 . 1 1 17 17 HIS HB3 H 1 3.22 0.01 . 1 . . . . 17 HIS HB3 . 15050 1
122 . 1 1 18 18 ARG H H 1 8.08 0.01 . 1 . . . . 18 ARG H . 15050 1
123 . 1 1 18 18 ARG HA H 1 3.95 0.01 . 1 . . . . 18 ARG HA . 15050 1
124 . 1 1 18 18 ARG HB2 H 1 2.05 0.01 . 2 . . . . 18 ARG HB2 . 15050 1
125 . 1 1 18 18 ARG HB3 H 1 1.99 0.01 . 2 . . . . 18 ARG HB3 . 15050 1
126 . 1 1 18 18 ARG HG2 H 1 1.71 0.01 . 2 . . . . 18 ARG HG2 . 15050 1
127 . 1 1 18 18 ARG HG3 H 1 1.63 0.01 . 2 . . . . 18 ARG HG3 . 15050 1
128 . 1 1 18 18 ARG HD2 H 1 3.27 0.01 . 2 . . . . 18 ARG HD2 . 15050 1
129 . 1 1 18 18 ARG HD3 H 1 3.30 0.01 . 2 . . . . 18 ARG HD3 . 15050 1
130 . 1 1 19 19 LEU H H 1 8.08 0.01 . 1 . . . . 19 LEU H . 15050 1
131 . 1 1 19 19 LEU HA H 1 4.14 0.01 . 1 . . . . 19 LEU HA . 15050 1
132 . 1 1 19 19 LEU HB2 H 1 1.95 0.01 . 1 . . . . 19 LEU HB2 . 15050 1
133 . 1 1 19 19 LEU HB3 H 1 1.95 0.01 . 1 . . . . 19 LEU HB3 . 15050 1
134 . 1 1 19 19 LEU HG H 1 1.57 0.01 . 1 . . . . 19 LEU HG . 15050 1
135 . 1 1 19 19 LEU HD11 H 1 0.91 0.01 . 1 . . . . 19 LEU HD1 . 15050 1
136 . 1 1 19 19 LEU HD12 H 1 0.91 0.01 . 1 . . . . 19 LEU HD1 . 15050 1
137 . 1 1 19 19 LEU HD13 H 1 0.91 0.01 . 1 . . . . 19 LEU HD1 . 15050 1
138 . 1 1 19 19 LEU HD21 H 1 0.91 0.01 . 1 . . . . 19 LEU HD2 . 15050 1
139 . 1 1 19 19 LEU HD22 H 1 0.91 0.01 . 1 . . . . 19 LEU HD2 . 15050 1
140 . 1 1 19 19 LEU HD23 H 1 0.91 0.01 . 1 . . . . 19 LEU HD2 . 15050 1
141 . 1 1 20 20 VAL H H 1 8.08 0.01 . 1 . . . . 20 VAL H . 15050 1
142 . 1 1 20 20 VAL HA H 1 3.95 0.01 . 1 . . . . 20 VAL HA . 15050 1
143 . 1 1 20 20 VAL HB H 1 2.21 0.01 . 1 . . . . 20 VAL HB . 15050 1
144 . 1 1 20 20 VAL HG11 H 1 1.05 0.01 . 2 . . . . 20 VAL HG1 . 15050 1
145 . 1 1 20 20 VAL HG12 H 1 1.05 0.01 . 2 . . . . 20 VAL HG1 . 15050 1
146 . 1 1 20 20 VAL HG13 H 1 1.05 0.01 . 2 . . . . 20 VAL HG1 . 15050 1
147 . 1 1 20 20 VAL HG21 H 1 0.96 0.01 . 2 . . . . 20 VAL HG2 . 15050 1
148 . 1 1 20 20 VAL HG22 H 1 0.96 0.01 . 2 . . . . 20 VAL HG2 . 15050 1
149 . 1 1 20 20 VAL HG23 H 1 0.96 0.01 . 2 . . . . 20 VAL HG2 . 15050 1
150 . 1 1 21 21 THR H H 1 7.73 0.01 . 1 . . . . 21 THR H . 15050 1
151 . 1 1 21 21 THR HA H 1 4.31 0.01 . 1 . . . . 21 THR HA . 15050 1
152 . 1 1 21 21 THR HB H 1 4.24 0.01 . 1 . . . . 21 THR HB . 15050 1
153 . 1 1 21 21 THR HG21 H 1 1.1 0.01 . 1 . . . . 21 THR HG1 . 15050 1
154 . 1 1 21 21 THR HG22 H 1 1.1 0.01 . 1 . . . . 21 THR HG1 . 15050 1
155 . 1 1 21 21 THR HG23 H 1 1.1 0.01 . 1 . . . . 21 THR HG1 . 15050 1
156 . 1 1 22 22 GLY H H 1 7.99 0.01 . 1 . . . . 22 GLY H . 15050 1
157 . 1 1 22 22 GLY HA2 H 1 4.01 0.01 . 2 . . . . 22 GLY HA2 . 15050 1
158 . 1 1 22 22 GLY HA3 H 1 3.90 0.01 . 2 . . . . 22 GLY HA3 . 15050 1
159 . 1 1 23 23 NH2 HN1 H 1 7.44 0.01 . 1 . . . . 23 NH2 HN1 . 15050 1
160 . 1 1 23 23 NH2 HN2 H 1 7.27 0.01 . 1 . . . . 23 NH2 HN2 . 15050 1
stop_
save_