Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30232
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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
1 '2D 1H-13C HSQC' . . . 30232 1
2 '2D 1H-1H TOCSY' . . . 30232 1
3 '2D 1H-1H NOESY' . . . 30232 1
4 '2D 1H-1H COSY' . . . 30232 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 3 3 ASP H H 1 7.129 0.001 . . . . . . A 3 ASP H . 30232 1
2 . 1 . 1 3 3 ASP HA H 1 5.029 0.000 . . . . . . A 3 ASP HA . 30232 1
3 . 1 . 1 3 3 ASP HB2 H 1 2.850 0.001 . . . . . . A 3 ASP HB2 . 30232 1
4 . 1 . 1 3 3 ASP HB3 H 1 2.605 0.000 . . . . . . A 3 ASP HB3 . 30232 1
5 . 1 . 1 3 3 ASP CB C 13 40.241 0.000 . . . . . . A 3 ASP CB . 30232 1
6 . 1 . 1 4 4 PRO HA H 1 4.415 0.000 . . . . . . A 4 PRO HA . 30232 1
7 . 1 . 1 4 4 PRO HB2 H 1 2.242 0.003 . . . . . . A 4 PRO HB2 . 30232 1
8 . 1 . 1 4 4 PRO HB3 H 1 1.931 0.000 . . . . . . A 4 PRO HB3 . 30232 1
9 . 1 . 1 4 4 PRO HG2 H 1 2.016 0.000 . . . . . . A 4 PRO HG2 . 30232 1
10 . 1 . 1 4 4 PRO HG3 H 1 2.016 0.000 . . . . . . A 4 PRO HG3 . 30232 1
11 . 1 . 1 4 4 PRO HD2 H 1 3.885 0.005 . . . . . . A 4 PRO HD2 . 30232 1
12 . 1 . 1 4 4 PRO HD3 H 1 3.885 0.005 . . . . . . A 4 PRO HD3 . 30232 1
13 . 1 . 1 4 4 PRO CD C 13 48.287 0.000 . . . . . . A 4 PRO CD . 30232 1
14 . 1 . 1 5 5 VAL H H 1 7.491 0.000 . . . . . . A 5 VAL H . 30232 1
15 . 1 . 1 5 5 VAL HA H 1 3.872 0.002 . . . . . . A 5 VAL HA . 30232 1
16 . 1 . 1 5 5 VAL HB H 1 1.875 0.008 . . . . . . A 5 VAL HB . 30232 1
17 . 1 . 1 5 5 VAL HG11 H 1 0.619 0.001 . . . . . . A 5 VAL HG11 . 30232 1
18 . 1 . 1 5 5 VAL HG12 H 1 0.619 0.001 . . . . . . A 5 VAL HG12 . 30232 1
19 . 1 . 1 5 5 VAL HG13 H 1 0.619 0.001 . . . . . . A 5 VAL HG13 . 30232 1
20 . 1 . 1 5 5 VAL HG21 H 1 0.764 0.000 . . . . . . A 5 VAL HG21 . 30232 1
21 . 1 . 1 5 5 VAL HG22 H 1 0.764 0.000 . . . . . . A 5 VAL HG22 . 30232 1
22 . 1 . 1 5 5 VAL HG23 H 1 0.764 0.000 . . . . . . A 5 VAL HG23 . 30232 1
23 . 1 . 1 5 5 VAL CA C 13 60.731 0.000 . . . . . . A 5 VAL CA . 30232 1
24 . 1 . 1 5 5 VAL CB C 13 29.282 0.000 . . . . . . A 5 VAL CB . 30232 1
25 . 1 . 1 5 5 VAL CG1 C 13 18.215 0.012 . . . . . . A 5 VAL CG1 . 30232 1
26 . 1 . 1 5 5 VAL CG2 C 13 18.215 0.012 . . . . . . A 5 VAL CG2 . 30232 1
27 . 1 . 1 6 6 TYR H H 1 7.649 0.001 . . . . . . A 6 TYR H . 30232 1
28 . 1 . 1 6 6 TYR HA H 1 4.629 0.011 . . . . . . A 6 TYR HA . 30232 1
29 . 1 . 1 6 6 TYR HB2 H 1 2.713 0.001 . . . . . . A 6 TYR HB2 . 30232 1
30 . 1 . 1 6 6 TYR HB3 H 1 3.071 0.000 . . . . . . A 6 TYR HB3 . 30232 1
31 . 1 . 1 6 6 TYR HD1 H 1 7.052 0.000 . . . . . . A 6 TYR HD1 . 30232 1
32 . 1 . 1 6 6 TYR HD2 H 1 7.052 0.000 . . . . . . A 6 TYR HD2 . 30232 1
33 . 1 . 1 6 6 TYR HE1 H 1 6.821 0.000 . . . . . . A 6 TYR HE1 . 30232 1
34 . 1 . 1 6 6 TYR HE2 H 1 6.821 0.000 . . . . . . A 6 TYR HE2 . 30232 1
35 . 1 . 1 6 6 TYR CA C 13 55.803 0.000 . . . . . . A 6 TYR CA . 30232 1
36 . 1 . 1 6 6 TYR CB C 13 36.928 0.000 . . . . . . A 6 TYR CB . 30232 1
37 . 1 . 1 7 7 THR H H 1 8.200 0.000 . . . . . . A 7 THR H . 30232 1
38 . 1 . 1 7 7 THR HA H 1 4.411 0.002 . . . . . . A 7 THR HA . 30232 1
39 . 1 . 1 7 7 THR HB H 1 4.083 0.000 . . . . . . A 7 THR HB . 30232 1
40 . 1 . 1 7 7 THR HG21 H 1 1.162 0.002 . . . . . . A 7 THR HG21 . 30232 1
41 . 1 . 1 7 7 THR HG22 H 1 1.162 0.002 . . . . . . A 7 THR HG22 . 30232 1
42 . 1 . 1 7 7 THR HG23 H 1 1.162 0.002 . . . . . . A 7 THR HG23 . 30232 1
43 . 1 . 1 7 7 THR CA C 13 61.320 0.000 . . . . . . A 7 THR CA . 30232 1
44 . 1 . 1 7 7 THR CB C 13 67.688 0.000 . . . . . . A 7 THR CB . 30232 1
45 . 1 . 1 7 7 THR CG2 C 13 18.793 0.000 . . . . . . A 7 THR CG2 . 30232 1
46 . 1 . 1 8 8 CYS H H 1 8.352 0.000 . . . . . . A 8 CYS H . 30232 1
47 . 1 . 1 8 8 CYS HA H 1 5.075 0.000 . . . . . . A 8 CYS HA . 30232 1
48 . 1 . 1 8 8 CYS HB2 H 1 3.258 0.000 . . . . . . A 8 CYS HB2 . 30232 1
49 . 1 . 1 8 8 CYS HB3 H 1 2.618 0.000 . . . . . . A 8 CYS HB3 . 30232 1
50 . 1 . 1 9 9 ARG H H 1 8.492 0.001 . . . . . . A 9 ARG H . 30232 1
51 . 1 . 1 9 9 ARG HA H 1 4.531 0.003 . . . . . . A 9 ARG HA . 30232 1
52 . 1 . 1 9 9 ARG HB2 H 1 1.712 0.004 . . . . . . A 9 ARG HB2 . 30232 1
53 . 1 . 1 9 9 ARG HB3 H 1 1.895 0.000 . . . . . . A 9 ARG HB3 . 30232 1
54 . 1 . 1 9 9 ARG HG2 H 1 1.587 0.000 . . . . . . A 9 ARG HG2 . 30232 1
55 . 1 . 1 9 9 ARG HG3 H 1 1.587 0.000 . . . . . . A 9 ARG HG3 . 30232 1
56 . 1 . 1 9 9 ARG HD2 H 1 3.205 0.001 . . . . . . A 9 ARG HD2 . 30232 1
57 . 1 . 1 9 9 ARG HD3 H 1 3.205 0.001 . . . . . . A 9 ARG HD3 . 30232 1
58 . 1 . 1 9 9 ARG HE H 1 7.242 0.000 . . . . . . A 9 ARG HE . 30232 1
59 . 1 . 1 9 9 ARG CA C 13 52.324 0.000 . . . . . . A 9 ARG CA . 30232 1
60 . 1 . 1 9 9 ARG CG C 13 24.617 0.000 . . . . . . A 9 ARG CG . 30232 1
61 . 1 . 1 10 10 PRO HA H 1 4.359 0.001 . . . . . . A 10 PRO HA . 30232 1
62 . 1 . 1 10 10 PRO HB2 H 1 2.340 0.001 . . . . . . A 10 PRO HB2 . 30232 1
63 . 1 . 1 10 10 PRO HB3 H 1 1.875 0.002 . . . . . . A 10 PRO HB3 . 30232 1
64 . 1 . 1 10 10 PRO HG2 H 1 2.157 0.001 . . . . . . A 10 PRO HG2 . 30232 1
65 . 1 . 1 10 10 PRO HG3 H 1 2.035 0.003 . . . . . . A 10 PRO HG3 . 30232 1
66 . 1 . 1 10 10 PRO HD2 H 1 3.587 0.000 . . . . . . A 10 PRO HD2 . 30232 1
67 . 1 . 1 10 10 PRO HD3 H 1 3.884 0.003 . . . . . . A 10 PRO HD3 . 30232 1
68 . 1 . 1 10 10 PRO CA C 13 61.823 0.000 . . . . . . A 10 PRO CA . 30232 1
69 . 1 . 1 10 10 PRO CD C 13 47.880 0.005 . . . . . . A 10 PRO CD . 30232 1
70 . 1 . 1 11 11 GLY H H 1 8.897 0.000 . . . . . . A 11 GLY H . 30232 1
71 . 1 . 1 11 11 GLY HA2 H 1 4.320 0.001 . . . . . . A 11 GLY HA2 . 30232 1
72 . 1 . 1 11 11 GLY HA3 H 1 3.683 0.001 . . . . . . A 11 GLY HA3 . 30232 1
73 . 1 . 1 11 11 GLY CA C 13 42.316 0.000 . . . . . . A 11 GLY CA . 30232 1
74 . 1 . 1 12 12 GLN H H 1 8.093 0.001 . . . . . . A 12 GLN H . 30232 1
75 . 1 . 1 12 12 GLN HA H 1 4.813 0.000 . . . . . . A 12 GLN HA . 30232 1
76 . 1 . 1 12 12 GLN HB2 H 1 2.338 0.006 . . . . . . A 12 GLN HB2 . 30232 1
77 . 1 . 1 12 12 GLN HB3 H 1 2.262 0.003 . . . . . . A 12 GLN HB3 . 30232 1
78 . 1 . 1 12 12 GLN HG2 H 1 2.852 0.000 . . . . . . A 12 GLN HG2 . 30232 1
79 . 1 . 1 12 12 GLN HG3 H 1 3.039 0.000 . . . . . . A 12 GLN HG3 . 30232 1
80 . 1 . 1 12 12 GLN HE21 H 1 7.682 0.000 . . . . . . A 12 GLN HE21 . 30232 1
81 . 1 . 1 12 12 GLN HE22 H 1 6.747 0.000 . . . . . . A 12 GLN HE22 . 30232 1
82 . 1 . 1 12 12 GLN CB C 13 29.091 0.000 . . . . . . A 12 GLN CB . 30232 1
83 . 1 . 1 12 12 GLN CG C 13 31.765 0.000 . . . . . . A 12 GLN CG . 30232 1
84 . 1 . 1 13 13 THR H H 1 8.977 0.001 . . . . . . A 13 THR H . 30232 1
85 . 1 . 1 13 13 THR HA H 1 4.589 0.002 . . . . . . A 13 THR HA . 30232 1
86 . 1 . 1 13 13 THR HB H 1 4.054 0.001 . . . . . . A 13 THR HB . 30232 1
87 . 1 . 1 13 13 THR HG21 H 1 1.225 0.002 . . . . . . A 13 THR HG21 . 30232 1
88 . 1 . 1 13 13 THR HG22 H 1 1.225 0.002 . . . . . . A 13 THR HG22 . 30232 1
89 . 1 . 1 13 13 THR HG23 H 1 1.225 0.002 . . . . . . A 13 THR HG23 . 30232 1
90 . 1 . 1 13 13 THR CA C 13 57.738 0.000 . . . . . . A 13 THR CA . 30232 1
91 . 1 . 1 13 13 THR CB C 13 68.201 0.000 . . . . . . A 13 THR CB . 30232 1
92 . 1 . 1 13 13 THR CG2 C 13 18.733 0.000 . . . . . . A 13 THR CG2 . 30232 1
93 . 1 . 1 14 14 CYS H H 1 8.879 0.000 . . . . . . A 14 CYS H . 30232 1
94 . 1 . 1 14 14 CYS HA H 1 5.234 0.002 . . . . . . A 14 CYS HA . 30232 1
95 . 1 . 1 14 14 CYS HB2 H 1 3.337 0.000 . . . . . . A 14 CYS HB2 . 30232 1
96 . 1 . 1 14 14 CYS HB3 H 1 3.172 0.000 . . . . . . A 14 CYS HB3 . 30232 1
97 . 1 . 1 14 14 CYS CA C 13 53.952 0.000 . . . . . . A 14 CYS CA . 30232 1
98 . 1 . 1 15 15 CYS H H 1 8.897 0.000 . . . . . . A 15 CYS H . 30232 1
99 . 1 . 1 15 15 CYS HA H 1 5.014 0.000 . . . . . . A 15 CYS HA . 30232 1
100 . 1 . 1 15 15 CYS HB2 H 1 3.086 0.000 . . . . . . A 15 CYS HB2 . 30232 1
101 . 1 . 1 15 15 CYS HB3 H 1 3.210 0.000 . . . . . . A 15 CYS HB3 . 30232 1
102 . 1 . 1 16 16 ARG H H 1 8.905 0.001 . . . . . . A 16 ARG H . 30232 1
103 . 1 . 1 16 16 ARG HA H 1 3.961 0.000 . . . . . . A 16 ARG HA . 30232 1
104 . 1 . 1 16 16 ARG HB2 H 1 1.488 0.002 . . . . . . A 16 ARG HB2 . 30232 1
105 . 1 . 1 16 16 ARG HB3 H 1 1.719 0.000 . . . . . . A 16 ARG HB3 . 30232 1
106 . 1 . 1 16 16 ARG HG2 H 1 1.211 0.004 . . . . . . A 16 ARG HG2 . 30232 1
107 . 1 . 1 16 16 ARG HG3 H 1 1.404 0.001 . . . . . . A 16 ARG HG3 . 30232 1
108 . 1 . 1 16 16 ARG HD2 H 1 2.977 0.002 . . . . . . A 16 ARG HD2 . 30232 1
109 . 1 . 1 16 16 ARG HD3 H 1 2.977 0.002 . . . . . . A 16 ARG HD3 . 30232 1
110 . 1 . 1 16 16 ARG CG C 13 24.586 0.037 . . . . . . A 16 ARG CG . 30232 1
111 . 1 . 1 16 16 ARG CD C 13 40.634 0.000 . . . . . . A 16 ARG CD . 30232 1
112 . 1 . 1 17 17 GLY H H 1 8.008 0.001 . . . . . . A 17 GLY H . 30232 1
113 . 1 . 1 17 17 GLY HA2 H 1 4.363 0.003 . . . . . . A 17 GLY HA2 . 30232 1
114 . 1 . 1 17 17 GLY HA3 H 1 3.763 0.001 . . . . . . A 17 GLY HA3 . 30232 1
115 . 1 . 1 17 17 GLY CA C 13 41.815 0.004 . . . . . . A 17 GLY CA . 30232 1
116 . 1 . 1 18 18 LEU H H 1 8.083 0.001 . . . . . . A 18 LEU H . 30232 1
117 . 1 . 1 18 18 LEU HA H 1 3.981 0.004 . . . . . . A 18 LEU HA . 30232 1
118 . 1 . 1 18 18 LEU HG H 1 1.930 0.000 . . . . . . A 18 LEU HG . 30232 1
119 . 1 . 1 18 18 LEU HD11 H 1 0.849 0.000 . . . . . . A 18 LEU HD11 . 30232 1
120 . 1 . 1 18 18 LEU HD12 H 1 0.849 0.000 . . . . . . A 18 LEU HD12 . 30232 1
121 . 1 . 1 18 18 LEU HD13 H 1 0.849 0.000 . . . . . . A 18 LEU HD13 . 30232 1
122 . 1 . 1 18 18 LEU HD21 H 1 0.849 0.000 . . . . . . A 18 LEU HD21 . 30232 1
123 . 1 . 1 18 18 LEU HD22 H 1 0.849 0.000 . . . . . . A 18 LEU HD22 . 30232 1
124 . 1 . 1 18 18 LEU HD23 H 1 0.849 0.000 . . . . . . A 18 LEU HD23 . 30232 1
125 . 1 . 1 18 18 LEU CA C 13 54.614 0.000 . . . . . . A 18 LEU CA . 30232 1
126 . 1 . 1 18 18 LEU CD1 C 13 21.776 0.000 . . . . . . A 18 LEU CD1 . 30232 1
127 . 1 . 1 18 18 LEU CD2 C 13 21.776 0.000 . . . . . . A 18 LEU CD2 . 30232 1
128 . 1 . 1 19 19 HIS H H 1 8.649 0.001 . . . . . . A 19 HIS H . 30232 1
129 . 1 . 1 19 19 HIS HA H 1 4.873 0.000 . . . . . . A 19 HIS HA . 30232 1
130 . 1 . 1 19 19 HIS HB2 H 1 3.042 0.000 . . . . . . A 19 HIS HB2 . 30232 1
131 . 1 . 1 19 19 HIS HB3 H 1 3.421 0.000 . . . . . . A 19 HIS HB3 . 30232 1
132 . 1 . 1 19 19 HIS HD2 H 1 7.301 0.000 . . . . . . A 19 HIS HD2 . 30232 1
133 . 1 . 1 19 19 HIS HE1 H 1 8.631 0.000 . . . . . . A 19 HIS HE1 . 30232 1
134 . 1 . 1 19 19 HIS CB C 13 25.822 0.005 . . . . . . A 19 HIS CB . 30232 1
135 . 1 . 1 20 20 GLY H H 1 7.607 0.000 . . . . . . A 20 GLY H . 30232 1
136 . 1 . 1 20 20 GLY HA2 H 1 3.647 0.000 . . . . . . A 20 GLY HA2 . 30232 1
137 . 1 . 1 20 20 GLY HA3 H 1 4.271 0.001 . . . . . . A 20 GLY HA3 . 30232 1
138 . 1 . 1 20 20 GLY CA C 13 42.268 0.000 . . . . . . A 20 GLY CA . 30232 1
139 . 1 . 1 21 21 TYR H H 1 8.141 0.001 . . . . . . A 21 TYR H . 30232 1
140 . 1 . 1 21 21 TYR HA H 1 4.627 0.000 . . . . . . A 21 TYR HA . 30232 1
141 . 1 . 1 21 21 TYR HB2 H 1 2.766 0.000 . . . . . . A 21 TYR HB2 . 30232 1
142 . 1 . 1 21 21 TYR HB3 H 1 2.567 0.000 . . . . . . A 21 TYR HB3 . 30232 1
143 . 1 . 1 21 21 TYR HD1 H 1 6.950 0.000 . . . . . . A 21 TYR HD1 . 30232 1
144 . 1 . 1 21 21 TYR HD2 H 1 6.950 0.000 . . . . . . A 21 TYR HD2 . 30232 1
145 . 1 . 1 21 21 TYR HE1 H 1 6.799 0.000 . . . . . . A 21 TYR HE1 . 30232 1
146 . 1 . 1 21 21 TYR HE2 H 1 6.799 0.000 . . . . . . A 21 TYR HE2 . 30232 1
147 . 1 . 1 22 22 GLY H H 1 8.295 0.001 . . . . . . A 22 GLY H . 30232 1
148 . 1 . 1 22 22 GLY HA2 H 1 4.134 0.001 . . . . . . A 22 GLY HA2 . 30232 1
149 . 1 . 1 22 22 GLY HA3 H 1 3.798 0.000 . . . . . . A 22 GLY HA3 . 30232 1
150 . 1 . 1 22 22 GLY CA C 13 42.294 0.013 . . . . . . A 22 GLY CA . 30232 1
151 . 1 . 1 23 23 CYS H H 1 8.541 0.001 . . . . . . A 23 CYS H . 30232 1
152 . 1 . 1 23 23 CYS HA H 1 5.353 0.004 . . . . . . A 23 CYS HA . 30232 1
153 . 1 . 1 23 23 CYS HB2 H 1 2.847 0.000 . . . . . . A 23 CYS HB2 . 30232 1
154 . 1 . 1 23 23 CYS HB3 H 1 2.779 0.000 . . . . . . A 23 CYS HB3 . 30232 1
155 . 1 . 1 23 23 CYS CA C 13 52.179 0.000 . . . . . . A 23 CYS CA . 30232 1
156 . 1 . 1 24 24 CYS H H 1 9.446 0.000 . . . . . . A 24 CYS H . 30232 1
157 . 1 . 1 24 24 CYS HA H 1 4.757 0.000 . . . . . . A 24 CYS HA . 30232 1
158 . 1 . 1 24 24 CYS HB2 H 1 3.048 0.000 . . . . . . A 24 CYS HB2 . 30232 1
159 . 1 . 1 24 24 CYS HB3 H 1 3.048 0.000 . . . . . . A 24 CYS HB3 . 30232 1
stop_
save_