Content for NMR-STAR saveframe, "shift_set_1"
save_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_1
_Assigned_chem_shift_list.Entry_ID 4799
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Ex-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 'DQF COSY' 1 $sample_1 . 4799 1
2 TOCSY 1 $sample_1 . 4799 1
3 NOESY 1 $sample_1 . 4799 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 ACE H1 H 1 1.978 . . 1 . . . . . . . . 4799 1
2 . 1 1 1 1 ACE H2 H 1 1.978 . . 1 . . . . . . . . 4799 1
3 . 1 1 1 1 ACE H3 H 1 1.978 . . 1 . . . . . . . . 4799 1
4 . 1 1 2 2 GLU H H 1 8.259 . . 1 . . . . . . . . 4799 1
5 . 1 1 2 2 GLU HA H 1 4.516 . . 1 . . . . . . . . 4799 1
6 . 1 1 2 2 GLU HB2 H 1 1.817 . . 2 . . . . . . . . 4799 1
7 . 1 1 2 2 GLU HB3 H 1 1.696 . . 2 . . . . . . . . 4799 1
8 . 1 1 2 2 GLU HG2 H 1 2.430 . . 1 . . . . . . . . 4799 1
9 . 1 1 2 2 GLU HG3 H 1 2.430 . . 1 . . . . . . . . 4799 1
10 . 1 1 3 3 PRO HA H 1 4.412 . . 1 . . . . . . . . 4799 1
11 . 1 1 3 3 PRO HB2 H 1 2.071 . . 2 . . . . . . . . 4799 1
12 . 1 1 3 3 PRO HB3 H 1 1.799 . . 2 . . . . . . . . 4799 1
13 . 1 1 3 3 PRO HG2 H 1 1.921 . . 2 . . . . . . . . 4799 1
14 . 1 1 3 3 PRO HG3 H 1 1.678 . . 2 . . . . . . . . 4799 1
15 . 1 1 3 3 PRO HD2 H 1 3.679 . . 1 . . . . . . . . 4799 1
16 . 1 1 3 3 PRO HD3 H 1 3.679 . . 1 . . . . . . . . 4799 1
17 . 1 1 4 4 TYR H H 1 7.890 . . 1 . . . . . . . . 4799 1
18 . 1 1 4 4 TYR HA H 1 4.299 . . 1 . . . . . . . . 4799 1
19 . 1 1 4 4 TYR HB2 H 1 2.989 . . 2 . . . . . . . . 4799 1
20 . 1 1 4 4 TYR HB3 H 1 2.888 . . 2 . . . . . . . . 4799 1
21 . 1 1 4 4 TYR HD1 H 1 7.043 . . 1 . . . . . . . . 4799 1
22 . 1 1 4 4 TYR HD2 H 1 7.043 . . 1 . . . . . . . . 4799 1
23 . 1 1 4 4 TYR HE1 H 1 6.772 . . 1 . . . . . . . . 4799 1
24 . 1 1 4 4 TYR HE2 H 1 6.772 . . 1 . . . . . . . . 4799 1
25 . 1 1 5 5 ASN H H 1 8.587 . . 1 . . . . . . . . 4799 1
26 . 1 1 5 5 ASN HA H 1 4.478 . . 1 . . . . . . . . 4799 1
27 . 1 1 5 5 ASN HB2 H 1 2.876 . . 2 . . . . . . . . 4799 1
28 . 1 1 5 5 ASN HB3 H 1 2.791 . . 2 . . . . . . . . 4799 1
29 . 1 1 5 5 ASN HD21 H 1 6.876 . . 2 . . . . . . . . 4799 1
30 . 1 1 5 5 ASN HD22 H 1 7.826 . . 2 . . . . . . . . 4799 1
31 . 1 1 6 6 GLU H H 1 8.185 . . 1 . . . . . . . . 4799 1
32 . 1 1 6 6 GLU HA H 1 4.128 . . 1 . . . . . . . . 4799 1
33 . 1 1 6 6 GLU HB2 H 1 2.065 . . 1 . . . . . . . . 4799 1
34 . 1 1 6 6 GLU HB3 H 1 2.065 . . 1 . . . . . . . . 4799 1
35 . 1 1 6 6 GLU HG2 H 1 2.405 . . 1 . . . . . . . . 4799 1
36 . 1 1 6 6 GLU HG3 H 1 2.405 . . 1 . . . . . . . . 4799 1
37 . 1 1 7 7 TRP H H 1 8.328 . . 1 . . . . . . . . 4799 1
38 . 1 1 7 7 TRP HA H 1 4.424 . . 1 . . . . . . . . 4799 1
39 . 1 1 7 7 TRP HB2 H 1 3.363 . . 2 . . . . . . . . 4799 1
40 . 1 1 7 7 TRP HB3 H 1 3.254 . . 2 . . . . . . . . 4799 1
41 . 1 1 7 7 TRP HD1 H 1 7.285 . . 1 . . . . . . . . 4799 1
42 . 1 1 7 7 TRP HE1 H 1 10.622 . . 1 . . . . . . . . 4799 1
43 . 1 1 7 7 TRP HE3 H 1 7.459 . . 1 . . . . . . . . 4799 1
44 . 1 1 7 7 TRP HZ2 H 1 7.445 . . 1 . . . . . . . . 4799 1
45 . 1 1 7 7 TRP HZ3 H 1 6.937 . . 1 . . . . . . . . 4799 1
46 . 1 1 7 7 TRP HH2 H 1 7.05 . . 1 . . . . . . . . 4799 1
47 . 1 1 8 8 THR H H 1 7.952 . . 1 . . . . . . . . 4799 1
48 . 1 1 8 8 THR HA H 1 3.699 . . 1 . . . . . . . . 4799 1
49 . 1 1 8 8 THR HB H 1 4.195 . . 1 . . . . . . . . 4799 1
50 . 1 1 8 8 THR HG21 H 1 1.066 . . 1 . . . . . . . . 4799 1
51 . 1 1 8 8 THR HG22 H 1 1.066 . . 1 . . . . . . . . 4799 1
52 . 1 1 8 8 THR HG23 H 1 1.066 . . 1 . . . . . . . . 4799 1
53 . 1 1 9 9 LEU H H 1 8.113 . . 1 . . . . . . . . 4799 1
54 . 1 1 9 9 LEU HA H 1 4.001 . . 1 . . . . . . . . 4799 1
55 . 1 1 9 9 LEU HB2 H 1 1.754 . . 1 . . . . . . . . 4799 1
56 . 1 1 9 9 LEU HB3 H 1 1.754 . . 1 . . . . . . . . 4799 1
57 . 1 1 9 9 LEU HG H 1 1.694 . . 1 . . . . . . . . 4799 1
58 . 1 1 9 9 LEU HD11 H 1 0.859 . . 2 . . . . . . . . 4799 1
59 . 1 1 9 9 LEU HD12 H 1 0.859 . . 2 . . . . . . . . 4799 1
60 . 1 1 9 9 LEU HD13 H 1 0.859 . . 2 . . . . . . . . 4799 1
61 . 1 1 9 9 LEU HD21 H 1 0.91 . . 2 . . . . . . . . 4799 1
62 . 1 1 9 9 LEU HD22 H 1 0.91 . . 2 . . . . . . . . 4799 1
63 . 1 1 9 9 LEU HD23 H 1 0.91 . . 2 . . . . . . . . 4799 1
64 . 1 1 10 10 GLU H H 1 8.107 . . 1 . . . . . . . . 4799 1
65 . 1 1 10 10 GLU HA H 1 4.032 . . 1 . . . . . . . . 4799 1
66 . 1 1 10 10 GLU HB2 H 1 2.406 . . 2 . . . . . . . . 4799 1
67 . 1 1 10 10 GLU HB3 H 1 2.062 . . 2 . . . . . . . . 4799 1
68 . 1 1 10 10 GLU HG2 H 1 2.622 . . 1 . . . . . . . . 4799 1
69 . 1 1 10 10 GLU HG3 H 1 2.622 . . 1 . . . . . . . . 4799 1
70 . 1 1 11 11 LEU H H 1 8.121 . . 1 . . . . . . . . 4799 1
71 . 1 1 11 11 LEU HA H 1 4.003 . . 1 . . . . . . . . 4799 1
72 . 1 1 11 11 LEU HB2 H 1 1.8 . . 1 . . . . . . . . 4799 1
73 . 1 1 11 11 LEU HB3 H 1 1.8 . . 1 . . . . . . . . 4799 1
74 . 1 1 11 11 LEU HG H 1 1.554 . . 1 . . . . . . . . 4799 1
75 . 1 1 11 11 LEU HD11 H 1 0.836 . . 2 . . . . . . . . 4799 1
76 . 1 1 11 11 LEU HD12 H 1 0.836 . . 2 . . . . . . . . 4799 1
77 . 1 1 11 11 LEU HD13 H 1 0.836 . . 2 . . . . . . . . 4799 1
78 . 1 1 11 11 LEU HD21 H 1 0.787 . . 2 . . . . . . . . 4799 1
79 . 1 1 11 11 LEU HD22 H 1 0.787 . . 2 . . . . . . . . 4799 1
80 . 1 1 11 11 LEU HD23 H 1 0.787 . . 2 . . . . . . . . 4799 1
81 . 1 1 12 12 LEU H H 1 8.253 . . 1 . . . . . . . . 4799 1
82 . 1 1 12 12 LEU HA H 1 3.952 . . 1 . . . . . . . . 4799 1
83 . 1 1 12 12 LEU HB2 H 1 1.915 . . 1 . . . . . . . . 4799 1
84 . 1 1 12 12 LEU HB3 H 1 1.872 . . 1 . . . . . . . . 4799 1
85 . 1 1 12 12 LEU HG H 1 1.565 . . 1 . . . . . . . . 4799 1
86 . 1 1 12 12 LEU HD11 H 1 0.844 . . 1 . . . . . . . . 4799 1
87 . 1 1 12 12 LEU HD12 H 1 0.844 . . 1 . . . . . . . . 4799 1
88 . 1 1 12 12 LEU HD13 H 1 0.844 . . 1 . . . . . . . . 4799 1
89 . 1 1 12 12 LEU HD21 H 1 0.844 . . 1 . . . . . . . . 4799 1
90 . 1 1 12 12 LEU HD22 H 1 0.844 . . 1 . . . . . . . . 4799 1
91 . 1 1 12 12 LEU HD23 H 1 0.844 . . 1 . . . . . . . . 4799 1
92 . 1 1 13 13 GLU H H 1 8.336 . . 1 . . . . . . . . 4799 1
93 . 1 1 13 13 GLU HA H 1 4.026 . . 1 . . . . . . . . 4799 1
94 . 1 1 13 13 GLU HB2 H 1 2.243 . . 2 . . . . . . . . 4799 1
95 . 1 1 13 13 GLU HB3 H 1 2.137 . . 2 . . . . . . . . 4799 1
96 . 1 1 13 13 GLU HG2 H 1 2.559 . . 1 . . . . . . . . 4799 1
97 . 1 1 13 13 GLU HG3 H 1 2.559 . . 1 . . . . . . . . 4799 1
98 . 1 1 14 14 GLU H H 1 8.159 . . 1 . . . . . . . . 4799 1
99 . 1 1 14 14 GLU HA H 1 4.225 . . 1 . . . . . . . . 4799 1
100 . 1 1 14 14 GLU HB2 H 1 2.153 . . 1 . . . . . . . . 4799 1
101 . 1 1 14 14 GLU HB3 H 1 2.153 . . 1 . . . . . . . . 4799 1
102 . 1 1 14 14 GLU HG2 H 1 2.475 . . 2 . . . . . . . . 4799 1
103 . 1 1 14 14 GLU HG3 H 1 2.306 . . 2 . . . . . . . . 4799 1
104 . 1 1 15 15 LEU H H 1 8.504 . . 1 . . . . . . . . 4799 1
105 . 1 1 15 15 LEU HA H 1 3.963 . . 1 . . . . . . . . 4799 1
106 . 1 1 15 15 LEU HB2 H 1 1.562 . . 1 . . . . . . . . 4799 1
107 . 1 1 15 15 LEU HB3 H 1 1.562 . . 1 . . . . . . . . 4799 1
108 . 1 1 15 15 LEU HG H 1 1.862 . . 1 . . . . . . . . 4799 1
109 . 1 1 15 15 LEU HD11 H 1 0.842 . . 2 . . . . . . . . 4799 1
110 . 1 1 15 15 LEU HD12 H 1 0.842 . . 2 . . . . . . . . 4799 1
111 . 1 1 15 15 LEU HD13 H 1 0.842 . . 2 . . . . . . . . 4799 1
112 . 1 1 15 15 LEU HD21 H 1 0.812 . . 2 . . . . . . . . 4799 1
113 . 1 1 15 15 LEU HD22 H 1 0.812 . . 2 . . . . . . . . 4799 1
114 . 1 1 15 15 LEU HD23 H 1 0.812 . . 2 . . . . . . . . 4799 1
115 . 1 1 16 16 LYS H H 1 8.415 . . 1 . . . . . . . . 4799 1
116 . 1 1 16 16 LYS HA H 1 3.839 . . 1 . . . . . . . . 4799 1
117 . 1 1 16 16 LYS HB2 H 1 2.005 . . 2 . . . . . . . . 4799 1
118 . 1 1 16 16 LYS HB3 H 1 1.857 . . 2 . . . . . . . . 4799 1
119 . 1 1 16 16 LYS HG2 H 1 1.496 . . 2 . . . . . . . . 4799 1
120 . 1 1 16 16 LYS HG3 H 1 1.403 . . 2 . . . . . . . . 4799 1
121 . 1 1 16 16 LYS HD2 H 1 1.693 . . 1 . . . . . . . . 4799 1
122 . 1 1 16 16 LYS HD3 H 1 1.693 . . 1 . . . . . . . . 4799 1
123 . 1 1 16 16 LYS HE2 H 1 2.867 . . 1 . . . . . . . . 4799 1
124 . 1 1 16 16 LYS HE3 H 1 2.867 . . 1 . . . . . . . . 4799 1
125 . 1 1 16 16 LYS HZ1 H 1 7.160 . . 1 . . . . . . . . 4799 1
126 . 1 1 16 16 LYS HZ2 H 1 7.160 . . 1 . . . . . . . . 4799 1
127 . 1 1 16 16 LYS HZ3 H 1 7.160 . . 1 . . . . . . . . 4799 1
128 . 1 1 17 17 SER H H 1 8.032 . . 1 . . . . . . . . 4799 1
129 . 1 1 17 17 SER HA H 1 4.201 . . 1 . . . . . . . . 4799 1
130 . 1 1 17 17 SER HB2 H 1 4.038 . . 2 . . . . . . . . 4799 1
131 . 1 1 17 17 SER HB3 H 1 4.012 . . 2 . . . . . . . . 4799 1
132 . 1 1 18 18 GLU H H 1 8.113 . . 1 . . . . . . . . 4799 1
133 . 1 1 18 18 GLU HA H 1 4.271 . . 1 . . . . . . . . 4799 1
134 . 1 1 18 18 GLU HB2 H 1 2.209 . . 2 . . . . . . . . 4799 1
135 . 1 1 18 18 GLU HB3 H 1 2.118 . . 2 . . . . . . . . 4799 1
136 . 1 1 18 18 GLU HG2 H 1 2.645 . . 2 . . . . . . . . 4799 1
137 . 1 1 18 18 GLU HG3 H 1 2.305 . . 2 . . . . . . . . 4799 1
138 . 1 1 19 19 ALA H H 1 8.355 . . 1 . . . . . . . . 4799 1
139 . 1 1 19 19 ALA HA H 1 4.057 . . 1 . . . . . . . . 4799 1
140 . 1 1 19 19 ALA HB1 H 1 1.498 . . 1 . . . . . . . . 4799 1
141 . 1 1 19 19 ALA HB2 H 1 1.498 . . 1 . . . . . . . . 4799 1
142 . 1 1 19 19 ALA HB3 H 1 1.498 . . 1 . . . . . . . . 4799 1
143 . 1 1 20 20 VAL H H 1 8.051 . . 1 . . . . . . . . 4799 1
144 . 1 1 20 20 VAL HA H 1 3.775 . . 1 . . . . . . . . 4799 1
145 . 1 1 20 20 VAL HB H 1 2.192 . . 1 . . . . . . . . 4799 1
146 . 1 1 20 20 VAL HG11 H 1 1.071 . . 2 . . . . . . . . 4799 1
147 . 1 1 20 20 VAL HG12 H 1 1.071 . . 2 . . . . . . . . 4799 1
148 . 1 1 20 20 VAL HG13 H 1 1.071 . . 2 . . . . . . . . 4799 1
149 . 1 1 20 20 VAL HG21 H 1 0.952 . . 2 . . . . . . . . 4799 1
150 . 1 1 20 20 VAL HG22 H 1 0.952 . . 2 . . . . . . . . 4799 1
151 . 1 1 20 20 VAL HG23 H 1 0.952 . . 2 . . . . . . . . 4799 1
152 . 1 1 21 21 ARG H H 1 7.742 . . 1 . . . . . . . . 4799 1
153 . 1 1 21 21 ARG HA H 1 4.090 . . 1 . . . . . . . . 4799 1
154 . 1 1 21 21 ARG HB2 H 1 1.782 . . 2 . . . . . . . . 4799 1
155 . 1 1 21 21 ARG HB3 H 1 1.673 . . 2 . . . . . . . . 4799 1
156 . 1 1 21 21 ARG HG2 H 1 1.591 . . 2 . . . . . . . . 4799 1
157 . 1 1 21 21 ARG HG3 H 1 1.454 . . 2 . . . . . . . . 4799 1
158 . 1 1 21 21 ARG HD2 H 1 3.128 . . 1 . . . . . . . . 4799 1
159 . 1 1 21 21 ARG HD3 H 1 3.128 . . 1 . . . . . . . . 4799 1
160 . 1 1 21 21 ARG HE H 1 7.120 . . 1 . . . . . . . . 4799 1
161 . 1 1 22 22 HIS H H 1 7.933 . . 1 . . . . . . . . 4799 1
162 . 1 1 22 22 HIS HA H 1 4.564 . . 1 . . . . . . . . 4799 1
163 . 1 1 22 22 HIS HB2 H 1 3.396 . . 2 . . . . . . . . 4799 1
164 . 1 1 22 22 HIS HB3 H 1 3.054 . . 2 . . . . . . . . 4799 1
165 . 1 1 22 22 HIS HD2 H 1 7.614 . . 1 . . . . . . . . 4799 1
166 . 1 1 22 22 HIS HE1 H 1 8.753 . . 1 . . . . . . . . 4799 1
167 . 1 1 23 23 NH2 HN1 H 1 7.328 . . 2 . . . . . . . . 4799 1
168 . 1 1 23 23 NH2 HN2 H 1 7.182 . . 2 . . . . . . . . 4799 1
stop_
save_