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 34697
_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 TOCSY' . . . 34697 1
2 '2D NOESY' . . . 34697 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 1 1 CYS HA H 1 4.154 0.000 . . . . . . A 1 CYS HA . 34697 1
2 . 1 . 1 1 1 CYS HB2 H 1 3.093 0.000 . . . . . . A 1 CYS HB2 . 34697 1
3 . 1 . 1 1 1 CYS HB3 H 1 2.867 0.001 . . . . . . A 1 CYS HB3 . 34697 1
4 . 1 . 1 1 1 CYS CA C 13 54.16 0.000 . . . . . . A 1 CYS CA . 34697 1
5 . 1 . 1 1 1 CYS CB C 13 38.05 0.000 . . . . . . A 1 CYS CB . 34697 1
6 . 1 . 1 2 2 GLY H H 1 8.774 0.000 . . . . . . A 2 GLY H . 34697 1
7 . 1 . 1 2 2 GLY HA2 H 1 3.753 0.000 . . . . . . A 2 GLY HA2 . 34697 1
8 . 1 . 1 2 2 GLY HA3 H 1 3.785 0.000 . . . . . . A 2 GLY HA3 . 34697 1
9 . 1 . 1 2 2 GLY CA C 13 42.78 0.000 . . . . . . A 2 GLY CA . 34697 1
10 . 1 . 1 3 3 GLN H H 1 8.253 0.000 . . . . . . A 3 GLN H . 34697 1
11 . 1 . 1 3 3 GLN HA H 1 4.044 0.003 . . . . . . A 3 GLN HA . 34697 1
12 . 1 . 1 3 3 GLN HB2 H 1 1.729 0.000 . . . . . . A 3 GLN HB2 . 34697 1
13 . 1 . 1 3 3 GLN HB3 H 1 1.816 0.072 . . . . . . A 3 GLN HB3 . 34697 1
14 . 1 . 1 3 3 GLN HG2 H 1 3.386 0.928 . . . . . . A 3 GLN HG2 . 34697 1
15 . 1 . 1 3 3 GLN HE21 H 1 7.355 0.000 . . . . . . A 3 GLN HE21 . 34697 1
16 . 1 . 1 3 3 GLN HE22 H 1 6.684 0.011 . . . . . . A 3 GLN HE22 . 34697 1
17 . 1 . 1 3 3 GLN CA C 13 53.96 0.000 . . . . . . A 3 GLN CA . 34697 1
18 . 1 . 1 3 3 GLN CB C 13 26.59 0.000 . . . . . . A 3 GLN CB . 34697 1
19 . 1 . 1 3 3 GLN CG C 13 30.97 0.000 . . . . . . A 3 GLN CG . 34697 1
20 . 1 . 1 4 4 ARG H H 1 8.234 0.000 . . . . . . A 4 ARG H . 34697 1
21 . 1 . 1 4 4 ARG HA H 1 3.965 0.000 . . . . . . A 4 ARG HA . 34697 1
22 . 1 . 1 4 4 ARG HB2 H 1 1.233 0.000 . . . . . . A 4 ARG HB2 . 34697 1
23 . 1 . 1 4 4 ARG HB3 H 1 1.374 0.000 . . . . . . A 4 ARG HB3 . 34697 1
24 . 1 . 1 4 4 ARG HG2 H 1 1.504 0.000 . . . . . . A 4 ARG HG2 . 34697 1
25 . 1 . 1 4 4 ARG HD2 H 1 2.770 0.000 . . . . . . A 4 ARG HD2 . 34697 1
26 . 1 . 1 4 4 ARG HE H 1 6.879 0.000 . . . . . . A 4 ARG HE . 34697 1
27 . 1 . 1 4 4 ARG CA C 13 54.18 0.000 . . . . . . A 4 ARG CA . 34697 1
28 . 1 . 1 4 4 ARG CB C 13 28.09 0.000 . . . . . . A 4 ARG CB . 34697 1
29 . 1 . 1 4 4 ARG CG C 13 24.66 0.000 . . . . . . A 4 ARG CG . 34697 1
30 . 1 . 1 4 4 ARG CD C 13 40.34 0.000 . . . . . . A 4 ARG CD . 34697 1
31 . 1 . 1 5 5 GLU H H 1 8.237 0.000 . . . . . . A 5 GLU H . 34697 1
32 . 1 . 1 5 5 GLU HA H 1 4.145 0.000 . . . . . . A 5 GLU HA . 34697 1
33 . 1 . 1 5 5 GLU HB2 H 1 1.679 0.000 . . . . . . A 5 GLU HB2 . 34697 1
34 . 1 . 1 5 5 GLU HB3 H 1 1.804 0.000 . . . . . . A 5 GLU HB3 . 34697 1
35 . 1 . 1 5 5 GLU HG2 H 1 2.053 0.000 . . . . . . A 5 GLU HG2 . 34697 1
36 . 1 . 1 5 5 GLU HG3 H 1 2.119 0.000 . . . . . . A 5 GLU HG3 . 34697 1
37 . 1 . 1 5 5 GLU CA C 13 54.73 0.000 . . . . . . A 5 GLU CA . 34697 1
38 . 1 . 1 5 5 GLU CB C 13 27.39 0.000 . . . . . . A 5 GLU CB . 34697 1
39 . 1 . 1 5 5 GLU CG C 13 32.00 0.000 . . . . . . A 5 GLU CG . 34697 1
40 . 1 . 1 6 6 THR H H 1 8.008 0.000 . . . . . . A 6 THR H . 34697 1
41 . 1 . 1 6 6 THR HA H 1 4.363 0.000 . . . . . . A 6 THR HA . 34697 1
42 . 1 . 1 6 6 THR HB H 1 3.968 0.000 . . . . . . A 6 THR HB . 34697 1
43 . 1 . 1 6 6 THR HG21 H 1 0.968 0.000 . . . . . . A 6 THR HG21 . 34697 1
44 . 1 . 1 6 6 THR HG22 H 1 0.968 0.000 . . . . . . A 6 THR HG22 . 34697 1
45 . 1 . 1 6 6 THR HG23 H 1 0.968 0.000 . . . . . . A 6 THR HG23 . 34697 1
46 . 1 . 1 6 6 THR CA C 13 59.61 0.000 . . . . . . A 6 THR CA . 34697 1
47 . 1 . 1 6 6 THR CB C 13 66.99 0.000 . . . . . . A 6 THR CB . 34697 1
48 . 1 . 1 6 6 THR CG2 C 13 18.99 0.000 . . . . . . A 6 THR CG2 . 34697 1
49 . 1 . 1 7 7 PRO HA H 1 4.122 0.000 . . . . . . A 7 PRO HA . 34697 1
50 . 1 . 1 7 7 PRO HB2 H 1 1.684 0.000 . . . . . . A 7 PRO HB2 . 34697 1
51 . 1 . 1 7 7 PRO HB3 H 1 1.794 0.000 . . . . . . A 7 PRO HB3 . 34697 1
52 . 1 . 1 7 7 PRO HG2 H 1 2.062 0.000 . . . . . . A 7 PRO HG2 . 34697 1
53 . 1 . 1 7 7 PRO HD2 H 1 3.573 0.000 . . . . . . A 7 PRO HD2 . 34697 1
54 . 1 . 1 7 7 PRO HD3 H 1 3.421 0.000 . . . . . . A 7 PRO HD3 . 34697 1
55 . 1 . 1 7 7 PRO CA C 13 60.73 0.000 . . . . . . A 7 PRO CA . 34697 1
56 . 1 . 1 7 7 PRO CB C 13 29.29 0.000 . . . . . . A 7 PRO CB . 34697 1
57 . 1 . 1 7 7 PRO CG C 13 24.68 0.000 . . . . . . A 7 PRO CG . 34697 1
58 . 1 . 1 7 7 PRO CD C 13 47.74 0.000 . . . . . . A 7 PRO CD . 34697 1
59 . 1 . 1 8 8 GLU H H 1 8.277 0.000 . . . . . . A 8 GLU H . 34697 1
60 . 1 . 1 8 8 GLU HA H 1 4.022 0.000 . . . . . . A 8 GLU HA . 34697 1
61 . 1 . 1 8 8 GLU HB2 H 1 1.704 0.000 . . . . . . A 8 GLU HB2 . 34697 1
62 . 1 . 1 8 8 GLU HB3 H 1 1.816 0.000 . . . . . . A 8 GLU HB3 . 34697 1
63 . 1 . 1 8 8 GLU HG2 H 1 2.124 0.000 . . . . . . A 8 GLU HG2 . 34697 1
64 . 1 . 1 8 8 GLU CA C 13 54.73 0.000 . . . . . . A 8 GLU CA . 34697 1
65 . 1 . 1 8 8 GLU CB C 13 27.41 0.000 . . . . . . A 8 GLU CB . 34697 1
66 . 1 . 1 8 8 GLU CG C 13 31.95 0.000 . . . . . . A 8 GLU CG . 34697 1
67 . 1 . 1 9 9 GLY H H 1 8.257 0.000 . . . . . . A 9 GLY H . 34697 1
68 . 1 . 1 9 9 GLY HA2 H 1 3.632 0.000 . . . . . . A 9 GLY HA2 . 34697 1
69 . 1 . 1 9 9 GLY HA3 H 1 3.809 0.000 . . . . . . A 9 GLY HA3 . 34697 1
70 . 1 . 1 9 9 GLY CA C 13 42.78 0.000 . . . . . . A 9 GLY CA . 34697 1
71 . 1 . 1 10 10 ALA H H 1 7.943 0.000 . . . . . . A 10 ALA H . 34697 1
72 . 1 . 1 10 10 ALA HA H 1 4.089 0.000 . . . . . . A 10 ALA HA . 34697 1
73 . 1 . 1 10 10 ALA HB1 H 1 1.144 0.000 . . . . . . A 10 ALA HB1 . 34697 1
74 . 1 . 1 10 10 ALA HB2 H 1 1.144 0.000 . . . . . . A 10 ALA HB2 . 34697 1
75 . 1 . 1 10 10 ALA HB3 H 1 1.144 0.000 . . . . . . A 10 ALA HB3 . 34697 1
76 . 1 . 1 10 10 ALA CA C 13 49.69 0.000 . . . . . . A 10 ALA CA . 34697 1
77 . 1 . 1 10 10 ALA CB C 13 16.52 0.000 . . . . . . A 10 ALA CB . 34697 1
78 . 1 . 1 11 11 GLU H H 1 8.171 0.000 . . . . . . A 11 GLU H . 34697 1
79 . 1 . 1 11 11 GLU HA H 1 4.024 0.000 . . . . . . A 11 GLU HA . 34697 1
80 . 1 . 1 11 11 GLU HB2 H 1 1.712 0.000 . . . . . . A 11 GLU HB2 . 34697 1
81 . 1 . 1 11 11 GLU HB3 H 1 1.833 0.000 . . . . . . A 11 GLU HB3 . 34697 1
82 . 1 . 1 11 11 GLU HG2 H 1 2.100 0.000 . . . . . . A 11 GLU HG2 . 34697 1
83 . 1 . 1 11 11 GLU CA C 13 54.73 0.000 . . . . . . A 11 GLU CA . 34697 1
84 . 1 . 1 11 11 GLU CB C 13 27.40 0.000 . . . . . . A 11 GLU CB . 34697 1
85 . 1 . 1 11 11 GLU CG C 13 31.97 0.000 . . . . . . A 11 GLU CG . 34697 1
86 . 1 . 1 12 12 ALA H H 1 8.051 0.000 . . . . . . A 12 ALA H . 34697 1
87 . 1 . 1 12 12 ALA HA H 1 4.034 0.000 . . . . . . A 12 ALA HA . 34697 1
88 . 1 . 1 12 12 ALA HB1 H 1 1.121 0.000 . . . . . . A 12 ALA HB1 . 34697 1
89 . 1 . 1 12 12 ALA HB2 H 1 1.121 0.000 . . . . . . A 12 ALA HB2 . 34697 1
90 . 1 . 1 12 12 ALA HB3 H 1 1.121 0.000 . . . . . . A 12 ALA HB3 . 34697 1
91 . 1 . 1 12 12 ALA CA C 13 49.55 0.000 . . . . . . A 12 ALA CA . 34697 1
92 . 1 . 1 12 12 ALA CB C 13 16.32 0.000 . . . . . . A 12 ALA CB . 34697 1
93 . 1 . 1 13 13 LYS H H 1 7.881 0.000 . . . . . . A 13 LYS H . 34697 1
94 . 1 . 1 13 13 LYS HA H 1 4.265 0.000 . . . . . . A 13 LYS HA . 34697 1
95 . 1 . 1 13 13 LYS HB2 H 1 1.139 0.000 . . . . . . A 13 LYS HB2 . 34697 1
96 . 1 . 1 13 13 LYS HB3 H 1 1.248 0.000 . . . . . . A 13 LYS HB3 . 34697 1
97 . 1 . 1 13 13 LYS HG2 H 1 1.376 0.000 . . . . . . A 13 LYS HG2 . 34697 1
98 . 1 . 1 13 13 LYS HG3 H 1 1.428 0.000 . . . . . . A 13 LYS HG3 . 34697 1
99 . 1 . 1 13 13 LYS HD2 H 1 1.207 0.000 . . . . . . A 13 LYS HD2 . 34697 1
100 . 1 . 1 13 13 LYS HE2 H 1 2.721 0.036 . . . . . . A 13 LYS HE2 . 34697 1
101 . 1 . 1 13 13 LYS HZ1 H 1 7.338 0.000 . . . . . . A 13 LYS HZ1 . 34697 1
102 . 1 . 1 13 13 LYS HZ2 H 1 7.338 0.000 . . . . . . A 13 LYS HZ2 . 34697 1
103 . 1 . 1 13 13 LYS HZ3 H 1 7.338 0.000 . . . . . . A 13 LYS HZ3 . 34697 1
104 . 1 . 1 13 13 LYS CA C 13 54.35 0.000 . . . . . . A 13 LYS CA . 34697 1
105 . 1 . 1 13 13 LYS CB C 13 30.19 0.000 . . . . . . A 13 LYS CB . 34697 1
106 . 1 . 1 13 13 LYS CG C 13 22.36 0.000 . . . . . . A 13 LYS CG . 34697 1
107 . 1 . 1 13 13 LYS CD C 13 26.40 0.000 . . . . . . A 13 LYS CD . 34697 1
108 . 1 . 1 13 13 LYS CE C 13 39.16 0.000 . . . . . . A 13 LYS CE . 34697 1
109 . 1 . 1 14 14 PRO HA H 1 4.107 0.000 . . . . . . A 14 PRO HA . 34697 1
110 . 1 . 1 14 14 PRO HB2 H 1 1.379 0.000 . . . . . . A 14 PRO HB2 . 34697 1
111 . 1 . 1 14 14 PRO HB3 H 1 1.716 0.000 . . . . . . A 14 PRO HB3 . 34697 1
112 . 1 . 1 14 14 PRO HG2 H 1 1.253 0.000 . . . . . . A 14 PRO HG2 . 34697 1
113 . 1 . 1 14 14 PRO HG3 H 1 1.896 0.000 . . . . . . A 14 PRO HG3 . 34697 1
114 . 1 . 1 14 14 PRO HD2 H 1 3.249 0.000 . . . . . . A 14 PRO HD2 . 34697 1
115 . 1 . 1 14 14 PRO HD3 H 1 3.496 0.000 . . . . . . A 14 PRO HD3 . 34697 1
116 . 1 . 1 14 14 PRO CA C 13 60.73 0.000 . . . . . . A 14 PRO CA . 34697 1
117 . 1 . 1 14 14 PRO CB C 13 29.29 0.000 . . . . . . A 14 PRO CB . 34697 1
118 . 1 . 1 14 14 PRO CG C 13 24.68 0.000 . . . . . . A 14 PRO CG . 34697 1
119 . 1 . 1 14 14 PRO CD C 13 47.74 0.000 . . . . . . A 14 PRO CD . 34697 1
120 . 1 . 1 15 15 TRP H H 1 7.696 0.001 . . . . . . A 15 TRP H . 34697 1
121 . 1 . 1 15 15 TRP HA H 1 4.366 0.000 . . . . . . A 15 TRP HA . 34697 1
122 . 1 . 1 15 15 TRP HB2 H 1 2.965 0.000 . . . . . . A 15 TRP HB2 . 34697 1
123 . 1 . 1 15 15 TRP HB3 H 1 3.030 0.000 . . . . . . A 15 TRP HB3 . 34697 1
124 . 1 . 1 15 15 TRP HD1 H 1 6.995 0.000 . . . . . . A 15 TRP HD1 . 34697 1
125 . 1 . 1 15 15 TRP HE1 H 1 9.977 0.004 . . . . . . A 15 TRP HE1 . 34697 1
126 . 1 . 1 15 15 TRP HE3 H 1 7.339 0.004 . . . . . . A 15 TRP HE3 . 34697 1
127 . 1 . 1 15 15 TRP HZ2 H 1 7.261 0.005 . . . . . . A 15 TRP HZ2 . 34697 1
128 . 1 . 1 15 15 TRP HZ3 H 1 6.915 0.001 . . . . . . A 15 TRP HZ3 . 34697 1
129 . 1 . 1 15 15 TRP HH2 H 1 7.004 0.009 . . . . . . A 15 TRP HH2 . 34697 1
130 . 1 . 1 15 15 TRP CA C 13 55.11 0.000 . . . . . . A 15 TRP CA . 34697 1
131 . 1 . 1 15 15 TRP CB C 13 26.85 0.000 . . . . . . A 15 TRP CB . 34697 1
132 . 1 . 1 15 15 TRP CD1 C 13 123.73 0.000 . . . . . . A 15 TRP CD1 . 34697 1
133 . 1 . 1 15 15 TRP CE3 C 13 117.58 0.000 . . . . . . A 15 TRP CE3 . 34697 1
134 . 1 . 1 15 15 TRP CZ2 C 13 111.44 0.000 . . . . . . A 15 TRP CZ2 . 34697 1
135 . 1 . 1 15 15 TRP CZ3 C 13 118.55 0.000 . . . . . . A 15 TRP CZ3 . 34697 1
136 . 1 . 1 15 15 TRP CH2 C 13 120.94 0.000 . . . . . . A 15 TRP CH2 . 34697 1
137 . 1 . 1 16 16 TYR H H 1 7.608 0.000 . . . . . . A 16 TYR H . 34697 1
138 . 1 . 1 16 16 TYR HA H 1 4.262 0.000 . . . . . . A 16 TYR HA . 34697 1
139 . 1 . 1 16 16 TYR HB2 H 1 2.465 0.000 . . . . . . A 16 TYR HB2 . 34697 1
140 . 1 . 1 16 16 TYR HB3 H 1 2.552 0.000 . . . . . . A 16 TYR HB3 . 34697 1
141 . 1 . 1 16 16 TYR HD1 H 1 6.647 0.000 . . . . . . A 16 TYR HD1 . 34697 1
142 . 1 . 1 16 16 TYR HD2 H 1 6.647 0.000 . . . . . . A 16 TYR HD2 . 34697 1
143 . 1 . 1 16 16 TYR HE1 H 1 6.556 0.053 . . . . . . A 16 TYR HE1 . 34697 1
144 . 1 . 1 16 16 TYR HE2 H 1 6.556 0.053 . . . . . . A 16 TYR HE2 . 34697 1
145 . 1 . 1 16 16 TYR CA C 13 55.44 0.000 . . . . . . A 16 TYR CA . 34697 1
146 . 1 . 1 16 16 TYR CB C 13 35.76 0.000 . . . . . . A 16 TYR CB . 34697 1
147 . 1 . 1 16 16 TYR CD1 C 13 129.77 0.000 . . . . . . A 16 TYR CD1 . 34697 1
148 . 1 . 1 16 16 TYR CD2 C 13 129.77 0.000 . . . . . . A 16 TYR CD2 . 34697 1
149 . 1 . 1 16 16 TYR CE1 C 13 115.14 0.000 . . . . . . A 16 TYR CE1 . 34697 1
150 . 1 . 1 16 16 TYR CE2 C 13 115.18 0.000 . . . . . . A 16 TYR CE2 . 34697 1
151 . 1 . 1 17 17 CYS H H 1 7.645 0.000 . . . . . . A 17 CYS H . 34697 1
152 . 1 . 1 17 17 CYS HA H 1 4.136 0.000 . . . . . . A 17 CYS HA . 34697 1
153 . 1 . 1 17 17 CYS HB2 H 1 2.747 0.000 . . . . . . A 17 CYS HB2 . 34697 1
154 . 1 . 1 17 17 CYS HB3 H 1 2.989 0.000 . . . . . . A 17 CYS HB3 . 34697 1
155 . 1 . 1 17 17 CYS CA C 13 57.36 0.000 . . . . . . A 17 CYS CA . 34697 1
156 . 1 . 1 17 17 CYS CB C 13 40.66 0.000 . . . . . . A 17 CYS CB . 34697 1
stop_
save_