Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 5609
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 '2D NOESY' 1 $sample_1 . 5609 1
2 DQF-COSY 1 $sample_1 . 5609 1
3 E-COSY 1 $sample_1 . 5609 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.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 ALA H H 1 8.578 0.003 . 1 . . . . . . . . . 5609 1
2 . 1 1 1 1 ALA HA H 1 4.037 0.003 . 1 . . . . . . . . . 5609 1
3 . 1 1 1 1 ALA HB1 H 1 1.338 0.003 . 1 . . . . . . . . . 5609 1
4 . 1 1 1 1 ALA HB2 H 1 1.338 0.003 . 1 . . . . . . . . . 5609 1
5 . 1 1 1 1 ALA HB3 H 1 1.338 0.003 . 1 . . . . . . . . . 5609 1
6 . 1 1 2 2 GLY H H 1 8.737 0.003 . 1 . . . . . . . . . 5609 1
7 . 1 1 2 2 GLY HA2 H 1 4.063 0.003 . 2 . . . . . . . . . 5609 1
8 . 1 1 2 2 GLY HA3 H 1 3.737 0.003 . 2 . . . . . . . . . 5609 1
9 . 1 1 3 3 GLU H H 1 7.729 0.003 . 1 . . . . . . . . . 5609 1
10 . 1 1 3 3 GLU HA H 1 4.722 0.003 . 1 . . . . . . . . . 5609 1
11 . 1 1 3 3 GLU HB2 H 1 2.055 0.003 . 2 . . . . . . . . . 5609 1
12 . 1 1 3 3 GLU HB3 H 1 1.847 0.020 . 2 . . . . . . . . . 5609 1
13 . 1 1 3 3 GLU HG2 H 1 2.443 0.003 . 2 . . . . . . . . . 5609 1
14 . 1 1 3 3 GLU HG3 H 1 2.356 0.003 . 2 . . . . . . . . . 5609 1
15 . 1 1 4 4 THR H H 1 8.547 0.003 . 1 . . . . . . . . . 5609 1
16 . 1 1 4 4 THR HA H 1 4.714 0.003 . 1 . . . . . . . . . 5609 1
17 . 1 1 4 4 THR HB H 1 4.294 0.016 . 1 . . . . . . . . . 5609 1
18 . 1 1 4 4 THR HG21 H 1 1.106 0.001 . 1 . . . . . . . . . 5609 1
19 . 1 1 4 4 THR HG22 H 1 1.106 0.001 . 1 . . . . . . . . . 5609 1
20 . 1 1 4 4 THR HG23 H 1 1.106 0.001 . 1 . . . . . . . . . 5609 1
21 . 1 1 5 5 CYS H H 1 8.286 0.003 . 1 . . . . . . . . . 5609 1
22 . 1 1 5 5 CYS HA H 1 4.839 0.006 . 1 . . . . . . . . . 5609 1
23 . 1 1 5 5 CYS HB2 H 1 3.111 0.003 . 2 . . . . . . . . . 5609 1
24 . 1 1 6 6 VAL H H 1 8.604 0.003 . 1 . . . . . . . . . 5609 1
25 . 1 1 6 6 VAL HA H 1 4.022 0.003 . 1 . . . . . . . . . 5609 1
26 . 1 1 6 6 VAL HB H 1 2.013 0.003 . 1 . . . . . . . . . 5609 1
27 . 1 1 6 6 VAL HG11 H 1 0.956 0.014 . 2 . . . . . . . . . 5609 1
28 . 1 1 6 6 VAL HG12 H 1 0.956 0.014 . 2 . . . . . . . . . 5609 1
29 . 1 1 6 6 VAL HG13 H 1 0.956 0.014 . 2 . . . . . . . . . 5609 1
30 . 1 1 7 7 GLY H H 1 8.972 0.003 . 1 . . . . . . . . . 5609 1
31 . 1 1 7 7 GLY HA2 H 1 4.163 0.003 . 2 . . . . . . . . . 5609 1
32 . 1 1 7 7 GLY HA3 H 1 3.865 0.003 . 2 . . . . . . . . . 5609 1
33 . 1 1 8 8 GLY H H 1 8.324 0.003 . 1 . . . . . . . . . 5609 1
34 . 1 1 8 8 GLY HA2 H 1 4.390 0.003 . 2 . . . . . . . . . 5609 1
35 . 1 1 8 8 GLY HA3 H 1 3.955 0.003 . 2 . . . . . . . . . 5609 1
36 . 1 1 9 9 THR H H 1 7.855 0.003 . 1 . . . . . . . . . 5609 1
37 . 1 1 9 9 THR HA H 1 4.712 0.003 . 1 . . . . . . . . . 5609 1
38 . 1 1 9 9 THR HB H 1 4.158 0.001 . 1 . . . . . . . . . 5609 1
39 . 1 1 9 9 THR HG21 H 1 1.173 0.003 . 1 . . . . . . . . . 5609 1
40 . 1 1 9 9 THR HG22 H 1 1.173 0.003 . 1 . . . . . . . . . 5609 1
41 . 1 1 9 9 THR HG23 H 1 1.173 0.003 . 1 . . . . . . . . . 5609 1
42 . 1 1 10 10 CYS H H 1 8.793 0.003 . 1 . . . . . . . . . 5609 1
43 . 1 1 10 10 CYS HA H 1 4.817 0.003 . 1 . . . . . . . . . 5609 1
44 . 1 1 10 10 CYS HB2 H 1 2.837 0.003 . 1 . . . . . . . . . 5609 1
45 . 1 1 10 10 CYS HB3 H 1 3.242 0.003 . 1 . . . . . . . . . 5609 1
46 . 1 1 11 11 ASN H H 1 8.775 0.003 . 1 . . . . . . . . . 5609 1
47 . 1 1 11 11 ASN HA H 1 4.627 0.003 . 1 . . . . . . . . . 5609 1
48 . 1 1 11 11 ASN HB2 H 1 2.767 0.002 . 2 . . . . . . . . . 5609 1
49 . 1 1 12 12 THR H H 1 7.819 0.014 . 1 . . . . . . . . . 5609 1
50 . 1 1 12 12 THR HA H 1 4.574 0.002 . 1 . . . . . . . . . 5609 1
51 . 1 1 12 12 THR HB H 1 4.021 0.020 . 1 . . . . . . . . . 5609 1
52 . 1 1 12 12 THR HG21 H 1 1.209 0.003 . 1 . . . . . . . . . 5609 1
53 . 1 1 12 12 THR HG22 H 1 1.209 0.003 . 1 . . . . . . . . . 5609 1
54 . 1 1 12 12 THR HG23 H 1 1.209 0.003 . 1 . . . . . . . . . 5609 1
55 . 1 1 13 13 PRO HA H 1 4.342 0.003 . 1 . . . . . . . . . 5609 1
56 . 1 1 13 13 PRO HB2 H 1 1.915 0.003 . 1 . . . . . . . . . 5609 1
57 . 1 1 13 13 PRO HB3 H 1 2.334 0.003 . 1 . . . . . . . . . 5609 1
58 . 1 1 13 13 PRO HG2 H 1 2.136 0.003 . 2 . . . . . . . . . 5609 1
59 . 1 1 13 13 PRO HG3 H 1 2.008 0.003 . 2 . . . . . . . . . 5609 1
60 . 1 1 13 13 PRO HD2 H 1 4.108 0.003 . 2 . . . . . . . . . 5609 1
61 . 1 1 13 13 PRO HD3 H 1 3.703 0.003 . 2 . . . . . . . . . 5609 1
62 . 1 1 14 14 GLY H H 1 8.891 0.003 . 1 . . . . . . . . . 5609 1
63 . 1 1 14 14 GLY HA2 H 1 4.176 0.003 . 2 . . . . . . . . . 5609 1
64 . 1 1 14 14 GLY HA3 H 1 3.717 0.006 . 2 . . . . . . . . . 5609 1
65 . 1 1 15 15 ALA H H 1 7.768 0.003 . 1 . . . . . . . . . 5609 1
66 . 1 1 15 15 ALA HA H 1 4.968 0.003 . 1 . . . . . . . . . 5609 1
67 . 1 1 15 15 ALA HB1 H 1 1.269 0.022 . 1 . . . . . . . . . 5609 1
68 . 1 1 15 15 ALA HB2 H 1 1.269 0.022 . 1 . . . . . . . . . 5609 1
69 . 1 1 15 15 ALA HB3 H 1 1.269 0.022 . 1 . . . . . . . . . 5609 1
70 . 1 1 16 16 THR H H 1 9.373 0.003 . 1 . . . . . . . . . 5609 1
71 . 1 1 16 16 THR HA H 1 4.461 0.003 . 1 . . . . . . . . . 5609 1
72 . 1 1 16 16 THR HB H 1 3.997 0.022 . 1 . . . . . . . . . 5609 1
73 . 1 1 16 16 THR HG21 H 1 1.124 0.003 . 1 . . . . . . . . . 5609 1
74 . 1 1 16 16 THR HG22 H 1 1.124 0.003 . 1 . . . . . . . . . 5609 1
75 . 1 1 16 16 THR HG23 H 1 1.124 0.003 . 1 . . . . . . . . . 5609 1
76 . 1 1 17 17 CYS H H 1 9.064 0.003 . 1 . . . . . . . . . 5609 1
77 . 1 1 17 17 CYS HA H 1 4.691 0.003 . 1 . . . . . . . . . 5609 1
78 . 1 1 17 17 CYS HB2 H 1 2.871 0.003 . 1 . . . . . . . . . 5609 1
79 . 1 1 17 17 CYS HB3 H 1 3.143 0.003 . 1 . . . . . . . . . 5609 1
80 . 1 1 18 18 SER H H 1 8.890 0.003 . 1 . . . . . . . . . 5609 1
81 . 1 1 18 18 SER HA H 1 4.685 0.007 . 1 . . . . . . . . . 5609 1
82 . 1 1 18 18 SER HB2 H 1 3.849 0.003 . 2 . . . . . . . . . 5609 1
83 . 1 1 18 18 SER HB3 H 1 3.677 0.012 . 2 . . . . . . . . . 5609 1
84 . 1 1 19 19 TRP H H 1 8.195 0.013 . 1 . . . . . . . . . 5609 1
85 . 1 1 19 19 TRP HA H 1 4.155 0.016 . 1 . . . . . . . . . 5609 1
86 . 1 1 19 19 TRP HB2 H 1 3.255 0.018 . 2 . . . . . . . . . 5609 1
87 . 1 1 19 19 TRP HD1 H 1 7.306 0.022 . 1 . . . . . . . . . 5609 1
88 . 1 1 19 19 TRP HE3 H 1 7.502 0.014 . 1 . . . . . . . . . 5609 1
89 . 1 1 19 19 TRP HE1 H 1 10.367 0.001 . 1 . . . . . . . . . 5609 1
90 . 1 1 19 19 TRP HZ2 H 1 7.562 0.023 . 1 . . . . . . . . . 5609 1
91 . 1 1 20 20 PRO HA H 1 3.475 0.003 . 1 . . . . . . . . . 5609 1
92 . 1 1 20 20 PRO HB2 H 1 1.703 0.003 . 1 . . . . . . . . . 5609 1
93 . 1 1 20 20 PRO HB3 H 1 0.150 0.005 . 1 . . . . . . . . . 5609 1
94 . 1 1 20 20 PRO HG2 H 1 1.499 0.022 . 2 . . . . . . . . . 5609 1
95 . 1 1 20 20 PRO HG3 H 1 1.407 0.026 . 2 . . . . . . . . . 5609 1
96 . 1 1 20 20 PRO HD2 H 1 3.342 0.019 . 2 . . . . . . . . . 5609 1
97 . 1 1 20 20 PRO HD3 H 1 3.175 0.021 . 2 . . . . . . . . . 5609 1
98 . 1 1 21 21 VAL H H 1 8.108 0.014 . 1 . . . . . . . . . 5609 1
99 . 1 1 21 21 VAL HA H 1 4.326 0.020 . 1 . . . . . . . . . 5609 1
100 . 1 1 21 21 VAL HB H 1 2.251 0.024 . 1 . . . . . . . . . 5609 1
101 . 1 1 21 21 VAL HG11 H 1 0.808 0.007 . 2 . . . . . . . . . 5609 1
102 . 1 1 21 21 VAL HG12 H 1 0.808 0.007 . 2 . . . . . . . . . 5609 1
103 . 1 1 21 21 VAL HG13 H 1 0.808 0.007 . 2 . . . . . . . . . 5609 1
104 . 1 1 22 22 CYS H H 1 7.928 0.003 . 1 . . . . . . . . . 5609 1
105 . 1 1 22 22 CYS HA H 1 5.150 0.019 . 1 . . . . . . . . . 5609 1
106 . 1 1 22 22 CYS HB2 H 1 2.916 0.003 . 1 . . . . . . . . . 5609 1
107 . 1 1 22 22 CYS HB3 H 1 2.582 0.003 . 1 . . . . . . . . . 5609 1
108 . 1 1 23 23 THR H H 1 9.384 0.003 . 1 . . . . . . . . . 5609 1
109 . 1 1 23 23 THR HA H 1 5.078 0.003 . 1 . . . . . . . . . 5609 1
110 . 1 1 23 23 THR HB H 1 3.643 0.018 . 1 . . . . . . . . . 5609 1
111 . 1 1 23 23 THR HG21 H 1 0.913 0.017 . 1 . . . . . . . . . 5609 1
112 . 1 1 23 23 THR HG22 H 1 0.913 0.017 . 1 . . . . . . . . . 5609 1
113 . 1 1 23 23 THR HG23 H 1 0.913 0.017 . 1 . . . . . . . . . 5609 1
114 . 1 1 24 24 ARG H H 1 9.010 0.003 . 1 . . . . . . . . . 5609 1
115 . 1 1 24 24 ARG HA H 1 4.630 0.003 . 1 . . . . . . . . . 5609 1
116 . 1 1 24 24 ARG HB2 H 1 1.714 0.008 . 2 . . . . . . . . . 5609 1
117 . 1 1 24 24 ARG HB3 H 1 1.374 0.001 . 2 . . . . . . . . . 5609 1
118 . 1 1 24 24 ARG HG2 H 1 1.497 0.026 . 2 . . . . . . . . . 5609 1
119 . 1 1 24 24 ARG HG3 H 1 1.438 0.028 . 2 . . . . . . . . . 5609 1
120 . 1 1 24 24 ARG HD2 H 1 3.145 0.002 . 2 . . . . . . . . . 5609 1
121 . 1 1 24 24 ARG HD3 H 1 3.039 0.002 . 2 . . . . . . . . . 5609 1
122 . 1 1 24 24 ARG HE H 1 7.222 0.002 . 1 . . . . . . . . . 5609 1
123 . 1 1 25 25 ASN H H 1 9.637 0.003 . 1 . . . . . . . . . 5609 1
124 . 1 1 25 25 ASN HA H 1 4.401 0.003 . 1 . . . . . . . . . 5609 1
125 . 1 1 25 25 ASN HB2 H 1 3.075 0.003 . 2 . . . . . . . . . 5609 1
126 . 1 1 25 25 ASN HB3 H 1 2.839 0.003 . 2 . . . . . . . . . 5609 1
127 . 1 1 26 26 GLY H H 1 8.728 0.003 . 1 . . . . . . . . . 5609 1
128 . 1 1 26 26 GLY HA2 H 1 4.202 0.003 . 2 . . . . . . . . . 5609 1
129 . 1 1 26 26 GLY HA3 H 1 3.555 0.003 . 2 . . . . . . . . . 5609 1
130 . 1 1 27 27 LEU H H 1 7.636 0.003 . 1 . . . . . . . . . 5609 1
131 . 1 1 27 27 LEU HB2 H 1 1.751 0.026 . 2 . . . . . . . . . 5609 1
132 . 1 1 27 27 LEU HB3 H 1 1.602 0.016 . 2 . . . . . . . . . 5609 1
133 . 1 1 27 27 LEU HG H 1 1.608 0.056 . 1 . . . . . . . . . 5609 1
134 . 1 1 27 27 LEU HD11 H 1 0.955 0.003 . 2 . . . . . . . . . 5609 1
135 . 1 1 27 27 LEU HD12 H 1 0.955 0.003 . 2 . . . . . . . . . 5609 1
136 . 1 1 27 27 LEU HD13 H 1 0.955 0.003 . 2 . . . . . . . . . 5609 1
137 . 1 1 28 28 PRO HA H 1 4.504 0.003 . 1 . . . . . . . . . 5609 1
138 . 1 1 28 28 PRO HB2 H 1 1.800 0.003 . 1 . . . . . . . . . 5609 1
139 . 1 1 28 28 PRO HB3 H 1 2.195 0.003 . 1 . . . . . . . . . 5609 1
140 . 1 1 28 28 PRO HG2 H 1 2.139 0.003 . 2 . . . . . . . . . 5609 1
141 . 1 1 28 28 PRO HG3 H 1 1.950 0.003 . 2 . . . . . . . . . 5609 1
142 . 1 1 28 28 PRO HD2 H 1 3.915 0.003 . 2 . . . . . . . . . 5609 1
143 . 1 1 28 28 PRO HD3 H 1 3.666 0.017 . 2 . . . . . . . . . 5609 1
144 . 1 1 29 29 VAL H H 1 8.615 0.001 . 1 . . . . . . . . . 5609 1
145 . 1 1 29 29 VAL HA H 1 3.970 0.002 . 1 . . . . . . . . . 5609 1
146 . 1 1 29 29 VAL HB H 1 1.811 0.020 . 1 . . . . . . . . . 5609 1
147 . 1 1 29 29 VAL HG11 H 1 0.827 0.006 . 2 . . . . . . . . . 5609 1
148 . 1 1 29 29 VAL HG12 H 1 0.827 0.006 . 2 . . . . . . . . . 5609 1
149 . 1 1 29 29 VAL HG13 H 1 0.827 0.006 . 2 . . . . . . . . . 5609 1
150 . 1 1 29 29 VAL HG21 H 1 0.764 0.021 . 2 . . . . . . . . . 5609 1
151 . 1 1 29 29 VAL HG22 H 1 0.764 0.021 . 2 . . . . . . . . . 5609 1
152 . 1 1 29 29 VAL HG23 H 1 0.764 0.021 . 2 . . . . . . . . . 5609 1
stop_
save_