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 17823
_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 0.01
_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
3 '2D 1H-1H NOESY' . . . 17823 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 LEU HA H 1 3.979 0.01 . 1 . . . A 1 LEU HA . 17823 1
2 . 1 1 1 1 LEU HB2 H 1 1.586 0.01 . 2 . . . A 1 LEU HB2 . 17823 1
3 . 1 1 1 1 LEU HB3 H 1 1.691 0.01 . 2 . . . A 1 LEU HB3 . 17823 1
4 . 1 1 1 1 LEU HG H 1 1.430 0.01 . 1 . . . A 1 LEU HG . 17823 1
5 . 1 1 1 1 LEU HD11 H 1 0.870 0.01 . 2 . . . A 1 LEU HD11 . 17823 1
6 . 1 1 1 1 LEU HD12 H 1 0.870 0.01 . 2 . . . A 1 LEU HD12 . 17823 1
7 . 1 1 1 1 LEU HD13 H 1 0.870 0.01 . 2 . . . A 1 LEU HD13 . 17823 1
8 . 1 1 1 1 LEU HD21 H 1 0.840 0.01 . 2 . . . A 1 LEU HD21 . 17823 1
9 . 1 1 1 1 LEU HD22 H 1 0.840 0.01 . 2 . . . A 1 LEU HD22 . 17823 1
10 . 1 1 1 1 LEU HD23 H 1 0.840 0.01 . 2 . . . A 1 LEU HD23 . 17823 1
11 . 1 1 2 2 VAL H H 1 8.658 0.01 . 1 . . . A 2 VAL H . 17823 1
12 . 1 1 2 2 VAL HA H 1 4.431 0.01 . 1 . . . A 2 VAL HA . 17823 1
13 . 1 1 2 2 VAL HB H 1 1.868 0.01 . 1 . . . A 2 VAL HB . 17823 1
14 . 1 1 2 2 VAL HG11 H 1 0.697 0.01 . 2 . . . A 2 VAL HG11 . 17823 1
15 . 1 1 2 2 VAL HG12 H 1 0.697 0.01 . 2 . . . A 2 VAL HG12 . 17823 1
16 . 1 1 2 2 VAL HG13 H 1 0.697 0.01 . 2 . . . A 2 VAL HG13 . 17823 1
17 . 1 1 2 2 VAL HG21 H 1 0.869 0.01 . 2 . . . A 2 VAL HG21 . 17823 1
18 . 1 1 2 2 VAL HG22 H 1 0.869 0.01 . 2 . . . A 2 VAL HG22 . 17823 1
19 . 1 1 2 2 VAL HG23 H 1 0.869 0.01 . 2 . . . A 2 VAL HG23 . 17823 1
20 . 1 1 3 3 LEU H H 1 8.823 0.01 . 1 . . . A 3 LEU H . 17823 1
21 . 1 1 3 3 LEU HA H 1 4.592 0.01 . 1 . . . A 3 LEU HA . 17823 1
22 . 1 1 3 3 LEU HB2 H 1 1.450 0.01 . 2 . . . A 3 LEU HB2 . 17823 1
23 . 1 1 3 3 LEU HB3 H 1 1.655 0.01 . 4 . . . A 3 LEU HB3 . 17823 1
24 . 1 1 3 3 LEU HG H 1 1.655 0.01 . 4 . . . A 3 LEU HG . 17823 1
25 . 1 1 3 3 LEU HD11 H 1 0.936 0.01 . 2 . . . A 3 LEU HD11 . 17823 1
26 . 1 1 3 3 LEU HD12 H 1 0.936 0.01 . 2 . . . A 3 LEU HD12 . 17823 1
27 . 1 1 3 3 LEU HD13 H 1 0.936 0.01 . 2 . . . A 3 LEU HD13 . 17823 1
28 . 1 1 3 3 LEU HD21 H 1 0.696 0.01 . 2 . . . A 3 LEU HD21 . 17823 1
29 . 1 1 3 3 LEU HD22 H 1 0.696 0.01 . 2 . . . A 3 LEU HD22 . 17823 1
30 . 1 1 3 3 LEU HD23 H 1 0.696 0.01 . 2 . . . A 3 LEU HD23 . 17823 1
31 . 1 1 4 4 LYS H H 1 8.943 0.01 . 1 . . . A 4 LYS H . 17823 1
32 . 1 1 4 4 LYS HA H 1 3.989 0.01 . 1 . . . A 4 LYS HA . 17823 1
33 . 1 1 4 4 LYS HB2 H 1 1.733 0.01 . 2 . . . A 4 LYS HB2 . 17823 1
34 . 1 1 4 4 LYS HB3 H 1 1.858 0.01 . 2 . . . A 4 LYS HB3 . 17823 1
35 . 1 1 4 4 LYS HG2 H 1 1.415 0.01 . 2 . . . A 4 LYS HG2 . 17823 1
36 . 1 1 4 4 LYS HG3 H 1 1.415 0.01 . 2 . . . A 4 LYS HG3 . 17823 1
37 . 1 1 4 4 LYS HD2 H 1 1.548 0.01 . 2 . . . A 4 LYS HD2 . 17823 1
38 . 1 1 4 4 LYS HD3 H 1 1.548 0.01 . 2 . . . A 4 LYS HD3 . 17823 1
39 . 1 1 4 4 LYS HE2 H 1 3.023 0.01 . 2 . . . A 4 LYS HE2 . 17823 1
40 . 1 1 4 4 LYS HE3 H 1 3.023 0.01 . 2 . . . A 4 LYS HE3 . 17823 1
41 . 1 1 5 5 TYR H H 1 7.196 0.01 . 1 . . . A 5 TYR H . 17823 1
42 . 1 1 5 5 TYR HA H 1 4.649 0.01 . 1 . . . A 5 TYR HA . 17823 1
43 . 1 1 5 5 TYR HB2 H 1 2.851 0.01 . 2 . . . A 5 TYR HB2 . 17823 1
44 . 1 1 5 5 TYR HB3 H 1 3.199 0.01 . 2 . . . A 5 TYR HB3 . 17823 1
45 . 1 1 5 5 TYR HD1 H 1 6.844 0.01 . 4 . . . A 5 TYR HD1 . 17823 1
46 . 1 1 5 5 TYR HD2 H 1 6.844 0.01 . 4 . . . A 5 TYR HD2 . 17823 1
47 . 1 1 5 5 TYR HE1 H 1 6.844 0.01 . 4 . . . A 5 TYR HE1 . 17823 1
48 . 1 1 5 5 TYR HE2 H 1 6.844 0.01 . 4 . . . A 5 TYR HE2 . 17823 1
49 . 1 1 6 6 CYS H H 1 9.152 0.01 . 1 . . . A 6 CYS H . 17823 1
50 . 1 1 6 6 CYS HA H 1 5.044 0.01 . 1 . . . A 6 CYS HA . 17823 1
51 . 1 1 6 6 CYS HB2 H 1 2.791 0.01 . 2 . . . A 6 CYS HB2 . 17823 1
52 . 1 1 6 6 CYS HB3 H 1 3.138 0.01 . 2 . . . A 6 CYS HB3 . 17823 1
53 . 1 1 7 7 PRO HA H 1 4.524 0.01 . 1 . . . A 7 PRO HA . 17823 1
54 . 1 1 7 7 PRO HB2 H 1 1.879 0.01 . 2 . . . A 7 PRO HB2 . 17823 1
55 . 1 1 7 7 PRO HB3 H 1 2.471 0.01 . 2 . . . A 7 PRO HB3 . 17823 1
56 . 1 1 7 7 PRO HG2 H 1 1.414 0.01 . 2 . . . A 7 PRO HG2 . 17823 1
57 . 1 1 7 7 PRO HG3 H 1 1.754 0.01 . 2 . . . A 7 PRO HG3 . 17823 1
58 . 1 1 7 7 PRO HD2 H 1 3.234 0.01 . 2 . . . A 7 PRO HD2 . 17823 1
59 . 1 1 7 7 PRO HD3 H 1 4.079 0.01 . 2 . . . A 7 PRO HD3 . 17823 1
60 . 1 1 8 8 LYS H H 1 8.703 0.01 . 1 . . . A 8 LYS H . 17823 1
61 . 1 1 8 8 LYS HA H 1 4.143 0.01 . 1 . . . A 8 LYS HA . 17823 1
62 . 1 1 8 8 LYS HB2 H 1 1.933 0.01 . 2 . . . A 8 LYS HB2 . 17823 1
63 . 1 1 8 8 LYS HB3 H 1 1.933 0.01 . 2 . . . A 8 LYS HB3 . 17823 1
64 . 1 1 8 8 LYS HG2 H 1 1.588 0.01 . 2 . . . A 8 LYS HG2 . 17823 1
65 . 1 1 8 8 LYS HG3 H 1 1.588 0.01 . 2 . . . A 8 LYS HG3 . 17823 1
66 . 1 1 8 8 LYS HD2 H 1 1.719 0.01 . 2 . . . A 8 LYS HD2 . 17823 1
67 . 1 1 8 8 LYS HD3 H 1 1.719 0.01 . 2 . . . A 8 LYS HD3 . 17823 1
68 . 1 1 8 8 LYS HE2 H 1 3.038 0.01 . 2 . . . A 8 LYS HE2 . 17823 1
69 . 1 1 8 8 LYS HE3 H 1 3.038 0.01 . 2 . . . A 8 LYS HE3 . 17823 1
70 . 1 1 9 9 ILE H H 1 7.171 0.01 . 1 . . . A 9 ILE H . 17823 1
71 . 1 1 9 9 ILE HA H 1 4.341 0.01 . 1 . . . A 9 ILE HA . 17823 1
72 . 1 1 9 9 ILE HB H 1 2.025 0.01 . 1 . . . A 9 ILE HB . 17823 1
73 . 1 1 9 9 ILE HG12 H 1 1.337 0.01 . 2 . . . A 9 ILE HG12 . 17823 1
74 . 1 1 9 9 ILE HG13 H 1 1.337 0.01 . 2 . . . A 9 ILE HG13 . 17823 1
75 . 1 1 9 9 ILE HG21 H 1 0.871 0.01 . 1 . . . A 9 ILE HG21 . 17823 1
76 . 1 1 9 9 ILE HG22 H 1 0.871 0.01 . 1 . . . A 9 ILE HG22 . 17823 1
77 . 1 1 9 9 ILE HG23 H 1 0.871 0.01 . 1 . . . A 9 ILE HG23 . 17823 1
78 . 1 1 9 9 ILE HD11 H 1 0.977 0.01 . 1 . . . A 9 ILE HD11 . 17823 1
79 . 1 1 9 9 ILE HD12 H 1 0.977 0.01 . 1 . . . A 9 ILE HD12 . 17823 1
80 . 1 1 9 9 ILE HD13 H 1 0.977 0.01 . 1 . . . A 9 ILE HD13 . 17823 1
81 . 1 1 10 10 GLY H H 1 8.237 0.01 . 1 . . . A 10 GLY H . 17823 1
82 . 1 1 10 10 GLY HA2 H 1 3.257 0.01 . 2 . . . A 10 GLY HA2 . 17823 1
83 . 1 1 10 10 GLY HA3 H 1 4.655 0.01 . 2 . . . A 10 GLY HA3 . 17823 1
84 . 1 1 11 11 TYR H H 1 7.230 0.01 . 1 . . . A 11 TYR H . 17823 1
85 . 1 1 11 11 TYR HA H 1 4.767 0.01 . 1 . . . A 11 TYR HA . 17823 1
86 . 1 1 11 11 TYR HB2 H 1 2.862 0.01 . 2 . . . A 11 TYR HB2 . 17823 1
87 . 1 1 11 11 TYR HB3 H 1 3.129 0.01 . 2 . . . A 11 TYR HB3 . 17823 1
88 . 1 1 11 11 TYR HD1 H 1 6.837 0.01 . 3 . . . A 11 TYR HD1 . 17823 1
89 . 1 1 11 11 TYR HD2 H 1 6.837 0.01 . 3 . . . A 11 TYR HD2 . 17823 1
90 . 1 1 11 11 TYR HE1 H 1 6.724 0.01 . 3 . . . A 11 TYR HE1 . 17823 1
91 . 1 1 11 11 TYR HE2 H 1 6.724 0.01 . 3 . . . A 11 TYR HE2 . 17823 1
92 . 1 1 12 12 CYS H H 1 8.956 0.01 . 1 . . . A 12 CYS H . 17823 1
93 . 1 1 12 12 CYS HA H 1 5.897 0.01 . 1 . . . A 12 CYS HA . 17823 1
94 . 1 1 12 12 CYS HB2 H 1 2.774 0.01 . 2 . . . A 12 CYS HB2 . 17823 1
95 . 1 1 12 12 CYS HB3 H 1 3.431 0.01 . 2 . . . A 12 CYS HB3 . 17823 1
96 . 1 1 13 13 SER HA H 1 4.692 0.01 . 1 . . . A 13 SER HA . 17823 1
97 . 1 1 13 13 SER HB2 H 1 3.771 0.01 . 2 . . . A 13 SER HB2 . 17823 1
98 . 1 1 13 13 SER HB3 H 1 3.924 0.01 . 2 . . . A 13 SER HB3 . 17823 1
99 . 1 1 14 14 ASN H H 1 8.721 0.01 . 1 . . . A 14 ASN H . 17823 1
100 . 1 1 14 14 ASN HA H 1 4.757 0.01 . 1 . . . A 14 ASN HA . 17823 1
101 . 1 1 14 14 ASN HB2 H 1 2.983 0.01 . 2 . . . A 14 ASN HB2 . 17823 1
102 . 1 1 14 14 ASN HB3 H 1 2.983 0.01 . 2 . . . A 14 ASN HB3 . 17823 1
103 . 1 1 14 14 ASN HD21 H 1 7.733 0.01 . 2 . . . A 14 ASN HD21 . 17823 1
104 . 1 1 14 14 ASN HD22 H 1 6.980 0.01 . 2 . . . A 14 ASN HD22 . 17823 1
105 . 1 1 15 15 THR H H 1 7.640 0.01 . 1 . . . A 15 THR H . 17823 1
106 . 1 1 15 15 THR HA H 1 4.111 0.01 . 1 . . . A 15 THR HA . 17823 1
107 . 1 1 15 15 THR HB H 1 4.046 0.01 . 1 . . . A 15 THR HB . 17823 1
108 . 1 1 15 15 THR HG21 H 1 1.237 0.01 . 1 . . . A 15 THR HG21 . 17823 1
109 . 1 1 15 15 THR HG22 H 1 1.237 0.01 . 1 . . . A 15 THR HG22 . 17823 1
110 . 1 1 15 15 THR HG23 H 1 1.237 0.01 . 1 . . . A 15 THR HG23 . 17823 1
111 . 1 1 16 16 CYS H H 1 4.379 0.01 . 1 . . . A 16 CYS H . 17823 1
112 . 1 1 16 16 CYS HA H 1 4.858 0.01 . 1 . . . A 16 CYS HA . 17823 1
113 . 1 1 16 16 CYS HB2 H 1 -0.488 0.01 . 2 . . . A 16 CYS HB2 . 17823 1
114 . 1 1 16 16 CYS HB3 H 1 2.730 0.01 . 2 . . . A 16 CYS HB3 . 17823 1
115 . 1 1 17 17 SER H H 1 8.375 0.01 . 1 . . . A 17 SER H . 17823 1
116 . 1 1 17 17 SER HA H 1 4.639 0.01 . 1 . . . A 17 SER HA . 17823 1
117 . 1 1 17 17 SER HB2 H 1 3.782 0.01 . 2 . . . A 17 SER HB2 . 17823 1
118 . 1 1 17 17 SER HB3 H 1 4.076 0.01 . 2 . . . A 17 SER HB3 . 17823 1
119 . 1 1 18 18 LYS H H 1 8.794 0.01 . 1 . . . A 18 LYS H . 17823 1
120 . 1 1 18 18 LYS HA H 1 4.406 0.01 . 1 . . . A 18 LYS HA . 17823 1
121 . 1 1 18 18 LYS HB2 H 1 2.011 0.01 . 2 . . . A 18 LYS HB2 . 17823 1
122 . 1 1 18 18 LYS HB3 H 1 2.011 0.01 . 2 . . . A 18 LYS HB3 . 17823 1
123 . 1 1 18 18 LYS HG2 H 1 1.639 0.01 . 2 . . . A 18 LYS HG2 . 17823 1
124 . 1 1 18 18 LYS HG3 H 1 1.639 0.01 . 2 . . . A 18 LYS HG3 . 17823 1
125 . 1 1 18 18 LYS HD2 H 1 1.754 0.01 . 2 . . . A 18 LYS HD2 . 17823 1
126 . 1 1 18 18 LYS HD3 H 1 1.754 0.01 . 2 . . . A 18 LYS HD3 . 17823 1
127 . 1 1 18 18 LYS HE2 H 1 3.060 0.01 . 2 . . . A 18 LYS HE2 . 17823 1
128 . 1 1 18 18 LYS HE3 H 1 3.060 0.01 . 2 . . . A 18 LYS HE3 . 17823 1
129 . 1 1 19 19 THR H H 1 8.057 0.01 . 1 . . . A 19 THR H . 17823 1
130 . 1 1 19 19 THR HA H 1 4.471 0.01 . 1 . . . A 19 THR HA . 17823 1
131 . 1 1 19 19 THR HB H 1 4.586 0.01 . 1 . . . A 19 THR HB . 17823 1
132 . 1 1 19 19 THR HG21 H 1 1.227 0.01 . 1 . . . A 19 THR HG21 . 17823 1
133 . 1 1 19 19 THR HG22 H 1 1.227 0.01 . 1 . . . A 19 THR HG22 . 17823 1
134 . 1 1 19 19 THR HG23 H 1 1.227 0.01 . 1 . . . A 19 THR HG23 . 17823 1
135 . 1 1 20 20 GLN H H 1 7.264 0.01 . 1 . . . A 20 GLN H . 17823 1
136 . 1 1 20 20 GLN HA H 1 4.577 0.01 . 1 . . . A 20 GLN HA . 17823 1
137 . 1 1 20 20 GLN HB2 H 1 1.844 0.01 . 2 . . . A 20 GLN HB2 . 17823 1
138 . 1 1 20 20 GLN HB3 H 1 1.925 0.01 . 2 . . . A 20 GLN HB3 . 17823 1
139 . 1 1 20 20 GLN HG2 H 1 2.253 0.01 . 2 . . . A 20 GLN HG2 . 17823 1
140 . 1 1 20 20 GLN HG3 H 1 2.374 0.01 . 2 . . . A 20 GLN HG3 . 17823 1
141 . 1 1 20 20 GLN HE21 H 1 7.642 0.01 . 2 . . . A 20 GLN HE21 . 17823 1
142 . 1 1 20 20 GLN HE22 H 1 6.991 0.01 . 2 . . . A 20 GLN HE22 . 17823 1
143 . 1 1 21 21 ILE H H 1 9.161 0.01 . 1 . . . A 21 ILE H . 17823 1
144 . 1 1 21 21 ILE HA H 1 4.267 0.01 . 1 . . . A 21 ILE HA . 17823 1
145 . 1 1 21 21 ILE HB H 1 1.707 0.01 . 1 . . . A 21 ILE HB . 17823 1
146 . 1 1 21 21 ILE HG12 H 1 1.289 0.01 . 2 . . . A 21 ILE HG12 . 17823 1
147 . 1 1 21 21 ILE HG13 H 1 1.643 0.01 . 2 . . . A 21 ILE HG13 . 17823 1
148 . 1 1 21 21 ILE HG21 H 1 0.967 0.01 . 1 . . . A 21 ILE HG21 . 17823 1
149 . 1 1 21 21 ILE HG22 H 1 0.967 0.01 . 1 . . . A 21 ILE HG22 . 17823 1
150 . 1 1 21 21 ILE HG23 H 1 0.967 0.01 . 1 . . . A 21 ILE HG23 . 17823 1
151 . 1 1 21 21 ILE HD11 H 1 1.114 0.01 . 1 . . . A 21 ILE HD11 . 17823 1
152 . 1 1 21 21 ILE HD12 H 1 1.114 0.01 . 1 . . . A 21 ILE HD12 . 17823 1
153 . 1 1 21 21 ILE HD13 H 1 1.114 0.01 . 1 . . . A 21 ILE HD13 . 17823 1
154 . 1 1 22 22 TRP H H 1 9.220 0.01 . 1 . . . A 22 TRP H . 17823 1
155 . 1 1 22 22 TRP HA H 1 4.894 0.01 . 1 . . . A 22 TRP HA . 17823 1
156 . 1 1 22 22 TRP HB2 H 1 2.534 0.01 . 2 . . . A 22 TRP HB2 . 17823 1
157 . 1 1 22 22 TRP HB3 H 1 2.979 0.01 . 2 . . . A 22 TRP HB3 . 17823 1
158 . 1 1 22 22 TRP HD1 H 1 7.370 0.01 . 1 . . . A 22 TRP HD1 . 17823 1
159 . 1 1 22 22 TRP HE1 H 1 9.569 0.01 . 1 . . . A 22 TRP HE1 . 17823 1
160 . 1 1 22 22 TRP HE3 H 1 5.686 0.01 . 1 . . . A 22 TRP HE3 . 17823 1
161 . 1 1 22 22 TRP HZ2 H 1 7.281 0.01 . 1 . . . A 22 TRP HZ2 . 17823 1
162 . 1 1 22 22 TRP HZ3 H 1 6.925 0.01 . 1 . . . A 22 TRP HZ3 . 17823 1
163 . 1 1 22 22 TRP HH2 H 1 7.225 0.01 . 1 . . . A 22 TRP HH2 . 17823 1
164 . 1 1 23 23 ALA H H 1 8.124 0.01 . 1 . . . A 23 ALA H . 17823 1
165 . 1 1 23 23 ALA HA H 1 4.857 0.01 . 1 . . . A 23 ALA HA . 17823 1
166 . 1 1 23 23 ALA HB1 H 1 1.400 0.01 . 1 . . . A 23 ALA HB1 . 17823 1
167 . 1 1 23 23 ALA HB2 H 1 1.400 0.01 . 1 . . . A 23 ALA HB2 . 17823 1
168 . 1 1 23 23 ALA HB3 H 1 1.400 0.01 . 1 . . . A 23 ALA HB3 . 17823 1
169 . 1 1 24 24 THR H H 1 8.577 0.01 . 1 . . . A 24 THR H . 17823 1
170 . 1 1 24 24 THR HA H 1 4.686 0.01 . 1 . . . A 24 THR HA . 17823 1
171 . 1 1 24 24 THR HB H 1 4.214 0.01 . 1 . . . A 24 THR HB . 17823 1
172 . 1 1 24 24 THR HG21 H 1 1.257 0.01 . 1 . . . A 24 THR HG21 . 17823 1
173 . 1 1 24 24 THR HG22 H 1 1.257 0.01 . 1 . . . A 24 THR HG22 . 17823 1
174 . 1 1 24 24 THR HG23 H 1 1.257 0.01 . 1 . . . A 24 THR HG23 . 17823 1
175 . 1 1 25 25 SER H H 1 9.536 0.01 . 1 . . . A 25 SER H . 17823 1
176 . 1 1 25 25 SER HA H 1 5.093 0.01 . 1 . . . A 25 SER HA . 17823 1
177 . 1 1 25 25 SER HB2 H 1 3.172 0.01 . 2 . . . A 25 SER HB2 . 17823 1
178 . 1 1 25 25 SER HB3 H 1 3.370 0.01 . 2 . . . A 25 SER HB3 . 17823 1
179 . 1 1 26 26 HIS H H 1 7.845 0.01 . 1 . . . A 26 HIS H . 17823 1
180 . 1 1 26 26 HIS HA H 1 4.497 0.01 . 1 . . . A 26 HIS HA . 17823 1
181 . 1 1 26 26 HIS HB2 H 1 3.190 0.01 . 2 . . . A 26 HIS HB2 . 17823 1
182 . 1 1 26 26 HIS HB3 H 1 3.251 0.01 . 2 . . . A 26 HIS HB3 . 17823 1
183 . 1 1 27 27 GLY HA2 H 1 3.717 0.01 . 2 . . . A 27 GLY HA2 . 17823 1
184 . 1 1 27 27 GLY HA3 H 1 4.121 0.01 . 2 . . . A 27 GLY HA3 . 17823 1
185 . 1 1 28 28 CYS H H 1 7.329 0.01 . 1 . . . A 28 CYS H . 17823 1
186 . 1 1 28 28 CYS HA H 1 5.139 0.01 . 1 . . . A 28 CYS HA . 17823 1
187 . 1 1 28 28 CYS HB2 H 1 2.582 0.01 . 2 . . . A 28 CYS HB2 . 17823 1
188 . 1 1 28 28 CYS HB3 H 1 3.024 0.01 . 2 . . . A 28 CYS HB3 . 17823 1
189 . 1 1 29 29 LYS H H 1 9.020 0.01 . 1 . . . A 29 LYS H . 17823 1
190 . 1 1 29 29 LYS HA H 1 4.061 0.01 . 1 . . . A 29 LYS HA . 17823 1
191 . 1 1 29 29 LYS HB2 H 1 1.784 0.01 . 2 . . . A 29 LYS HB2 . 17823 1
192 . 1 1 29 29 LYS HB3 H 1 1.784 0.01 . 2 . . . A 29 LYS HB3 . 17823 1
193 . 1 1 29 29 LYS HG2 H 1 1.413 0.01 . 2 . . . A 29 LYS HG2 . 17823 1
194 . 1 1 29 29 LYS HG3 H 1 1.490 0.01 . 2 . . . A 29 LYS HG3 . 17823 1
195 . 1 1 29 29 LYS HD2 H 1 1.684 0.01 . 2 . . . A 29 LYS HD2 . 17823 1
196 . 1 1 29 29 LYS HD3 H 1 1.684 0.01 . 2 . . . A 29 LYS HD3 . 17823 1
197 . 1 1 29 29 LYS HE2 H 1 2.990 0.01 . 2 . . . A 29 LYS HE2 . 17823 1
198 . 1 1 29 29 LYS HE3 H 1 2.990 0.01 . 2 . . . A 29 LYS HE3 . 17823 1
199 . 1 1 30 30 MET HA H 1 4.501 0.01 . 1 . . . A 30 MET HA . 17823 1
200 . 1 1 30 30 MET HB2 H 1 1.910 0.01 . 2 . . . A 30 MET HB2 . 17823 1
201 . 1 1 30 30 MET HB3 H 1 1.910 0.01 . 2 . . . A 30 MET HB3 . 17823 1
202 . 1 1 30 30 MET HG2 H 1 2.364 0.01 . 2 . . . A 30 MET HG2 . 17823 1
203 . 1 1 30 30 MET HG3 H 1 2.364 0.01 . 2 . . . A 30 MET HG3 . 17823 1
204 . 1 1 30 30 MET HE1 H 1 2.080 0.01 . 1 . . . A 30 MET HE1 . 17823 1
205 . 1 1 30 30 MET HE2 H 1 2.080 0.01 . 1 . . . A 30 MET HE2 . 17823 1
206 . 1 1 30 30 MET HE3 H 1 2.080 0.01 . 1 . . . A 30 MET HE3 . 17823 1
207 . 1 1 31 31 TYR H H 1 7.863 0.01 . 1 . . . A 31 TYR H . 17823 1
208 . 1 1 31 31 TYR HA H 1 5.115 0.01 . 1 . . . A 31 TYR HA . 17823 1
209 . 1 1 31 31 TYR HB2 H 1 2.516 0.01 . 2 . . . A 31 TYR HB2 . 17823 1
210 . 1 1 31 31 TYR HB3 H 1 2.804 0.01 . 2 . . . A 31 TYR HB3 . 17823 1
211 . 1 1 31 31 TYR HD1 H 1 7.001 0.01 . 4 . . . A 31 TYR HD1 . 17823 1
212 . 1 1 31 31 TYR HD2 H 1 7.001 0.01 . 4 . . . A 31 TYR HD2 . 17823 1
213 . 1 1 31 31 TYR HE1 H 1 7.001 0.01 . 4 . . . A 31 TYR HE1 . 17823 1
214 . 1 1 31 31 TYR HE2 H 1 7.001 0.01 . 4 . . . A 31 TYR HE2 . 17823 1
215 . 1 1 32 32 CYS H H 1 8.876 0.01 . 1 . . . A 32 CYS H . 17823 1
216 . 1 1 32 32 CYS HA H 1 4.880 0.01 . 1 . . . A 32 CYS HA . 17823 1
217 . 1 1 32 32 CYS HB2 H 1 2.266 0.01 . 2 . . . A 32 CYS HB2 . 17823 1
218 . 1 1 32 32 CYS HB3 H 1 2.828 0.01 . 2 . . . A 32 CYS HB3 . 17823 1
219 . 1 1 33 33 CYS H H 1 8.657 0.01 . 1 . . . A 33 CYS H . 17823 1
220 . 1 1 33 33 CYS HA H 1 4.890 0.01 . 1 . . . A 33 CYS HA . 17823 1
221 . 1 1 33 33 CYS HB2 H 1 1.461 0.01 . 2 . . . A 33 CYS HB2 . 17823 1
222 . 1 1 33 33 CYS HB3 H 1 2.361 0.01 . 2 . . . A 33 CYS HB3 . 17823 1
223 . 1 1 34 34 LEU H H 1 8.783 0.01 . 1 . . . A 34 LEU H . 17823 1
224 . 1 1 34 34 LEU HA H 1 4.703 0.01 . 1 . . . A 34 LEU HA . 17823 1
225 . 1 1 34 34 LEU HB2 H 1 1.005 0.01 . 2 . . . A 34 LEU HB2 . 17823 1
226 . 1 1 34 34 LEU HB3 H 1 1.295 0.01 . 2 . . . A 34 LEU HB3 . 17823 1
227 . 1 1 34 34 LEU HG H 1 1.227 0.01 . 1 . . . A 34 LEU HG . 17823 1
228 . 1 1 34 34 LEU HD11 H 1 -0.027 0.01 . 2 . . . A 34 LEU HD11 . 17823 1
229 . 1 1 34 34 LEU HD12 H 1 -0.027 0.01 . 2 . . . A 34 LEU HD12 . 17823 1
230 . 1 1 34 34 LEU HD13 H 1 -0.027 0.01 . 2 . . . A 34 LEU HD13 . 17823 1
231 . 1 1 34 34 LEU HD21 H 1 -0.272 0.01 . 2 . . . A 34 LEU HD21 . 17823 1
232 . 1 1 34 34 LEU HD22 H 1 -0.272 0.01 . 2 . . . A 34 LEU HD22 . 17823 1
233 . 1 1 34 34 LEU HD23 H 1 -0.272 0.01 . 2 . . . A 34 LEU HD23 . 17823 1
234 . 1 1 35 35 PRO HA H 1 4.621 0.01 . 1 . . . A 35 PRO HA . 17823 1
235 . 1 1 35 35 PRO HB2 H 1 2.086 0.01 . 2 . . . A 35 PRO HB2 . 17823 1
236 . 1 1 35 35 PRO HB3 H 1 2.510 0.01 . 2 . . . A 35 PRO HB3 . 17823 1
237 . 1 1 35 35 PRO HG2 H 1 2.161 0.01 . 2 . . . A 35 PRO HG2 . 17823 1
238 . 1 1 35 35 PRO HG3 H 1 2.161 0.01 . 2 . . . A 35 PRO HG3 . 17823 1
239 . 1 1 35 35 PRO HD2 H 1 3.294 0.01 . 2 . . . A 35 PRO HD2 . 17823 1
240 . 1 1 35 35 PRO HD3 H 1 3.788 0.01 . 2 . . . A 35 PRO HD3 . 17823 1
241 . 1 1 36 36 ALA H H 1 8.623 0.01 . 1 . . . A 36 ALA H . 17823 1
242 . 1 1 36 36 ALA HA H 1 4.172 0.01 . 1 . . . A 36 ALA HA . 17823 1
243 . 1 1 36 36 ALA HB1 H 1 1.529 0.01 . 1 . . . A 36 ALA HB1 . 17823 1
244 . 1 1 36 36 ALA HB2 H 1 1.529 0.01 . 1 . . . A 36 ALA HB2 . 17823 1
245 . 1 1 36 36 ALA HB3 H 1 1.529 0.01 . 1 . . . A 36 ALA HB3 . 17823 1
246 . 1 1 37 37 SER H H 1 7.771 0.01 . 1 . . . A 37 SER H . 17823 1
247 . 1 1 37 37 SER HA H 1 4.281 0.01 . 1 . . . A 37 SER HA . 17823 1
248 . 1 1 37 37 SER HB2 H 1 3.847 0.01 . 2 . . . A 37 SER HB2 . 17823 1
249 . 1 1 37 37 SER HB3 H 1 4.110 0.01 . 2 . . . A 37 SER HB3 . 17823 1
250 . 1 1 38 38 TRP H H 1 8.073 0.01 . 1 . . . A 38 TRP H . 17823 1
251 . 1 1 38 38 TRP HA H 1 4.217 0.01 . 1 . . . A 38 TRP HA . 17823 1
252 . 1 1 38 38 TRP HB2 H 1 3.183 0.01 . 2 . . . A 38 TRP HB2 . 17823 1
253 . 1 1 38 38 TRP HB3 H 1 3.256 0.01 . 2 . . . A 38 TRP HB3 . 17823 1
254 . 1 1 38 38 TRP HD1 H 1 6.874 0.01 . 1 . . . A 38 TRP HD1 . 17823 1
255 . 1 1 38 38 TRP HE1 H 1 9.614 0.01 . 1 . . . A 38 TRP HE1 . 17823 1
256 . 1 1 38 38 TRP HE3 H 1 7.376 0.01 . 1 . . . A 38 TRP HE3 . 17823 1
257 . 1 1 38 38 TRP HZ2 H 1 7.346 0.01 . 1 . . . A 38 TRP HZ2 . 17823 1
258 . 1 1 38 38 TRP HZ3 H 1 6.916 0.01 . 1 . . . A 38 TRP HZ3 . 17823 1
259 . 1 1 38 38 TRP HH2 H 1 7.072 0.01 . 1 . . . A 38 TRP HH2 . 17823 1
260 . 1 1 39 39 LYS H H 1 7.190 0.01 . 1 . . . A 39 LYS H . 17823 1
261 . 1 1 39 39 LYS HA H 1 4.059 0.01 . 1 . . . A 39 LYS HA . 17823 1
262 . 1 1 39 39 LYS HB2 H 1 1.365 0.01 . 2 . . . A 39 LYS HB2 . 17823 1
263 . 1 1 39 39 LYS HB3 H 1 1.365 0.01 . 2 . . . A 39 LYS HB3 . 17823 1
264 . 1 1 39 39 LYS HG2 H 1 1.164 0.01 . 2 . . . A 39 LYS HG2 . 17823 1
265 . 1 1 39 39 LYS HG3 H 1 1.164 0.01 . 2 . . . A 39 LYS HG3 . 17823 1
266 . 1 1 39 39 LYS HD2 H 1 1.519 0.01 . 2 . . . A 39 LYS HD2 . 17823 1
267 . 1 1 39 39 LYS HD3 H 1 1.519 0.01 . 2 . . . A 39 LYS HD3 . 17823 1
268 . 1 1 39 39 LYS HE2 H 1 2.878 0.01 . 2 . . . A 39 LYS HE2 . 17823 1
269 . 1 1 39 39 LYS HE3 H 1 2.878 0.01 . 2 . . . A 39 LYS HE3 . 17823 1
270 . 1 1 40 40 TRP H H 1 7.669 0.01 . 1 . . . A 40 TRP H . 17823 1
271 . 1 1 40 40 TRP HA H 1 4.202 0.01 . 1 . . . A 40 TRP HA . 17823 1
272 . 1 1 40 40 TRP HB2 H 1 3.170 0.01 . 2 . . . A 40 TRP HB2 . 17823 1
273 . 1 1 40 40 TRP HB3 H 1 3.170 0.01 . 2 . . . A 40 TRP HB3 . 17823 1
274 . 1 1 40 40 TRP HD1 H 1 7.244 0.01 . 1 . . . A 40 TRP HD1 . 17823 1
275 . 1 1 40 40 TRP HE1 H 1 10.216 0.01 . 1 . . . A 40 TRP HE1 . 17823 1
276 . 1 1 40 40 TRP HE3 H 1 7.717 0.01 . 1 . . . A 40 TRP HE3 . 17823 1
277 . 1 1 40 40 TRP HZ2 H 1 7.523 0.01 . 1 . . . A 40 TRP HZ2 . 17823 1
278 . 1 1 40 40 TRP HZ3 H 1 7.197 0.01 . 1 . . . A 40 TRP HZ3 . 17823 1
279 . 1 1 40 40 TRP HH2 H 1 7.175 0.01 . 1 . . . A 40 TRP HH2 . 17823 1
280 . 1 1 41 41 LYS H H 1 7.297 0.01 . 1 . . . A 41 LYS H . 17823 1
281 . 1 1 41 41 LYS HA H 1 4.020 0.01 . 1 . . . A 41 LYS HA . 17823 1
282 . 1 1 41 41 LYS HB2 H 1 1.634 0.01 . 2 . . . A 41 LYS HB2 . 17823 1
283 . 1 1 41 41 LYS HB3 H 1 1.634 0.01 . 2 . . . A 41 LYS HB3 . 17823 1
284 . 1 1 41 41 LYS HG2 H 1 1.133 0.01 . 2 . . . A 41 LYS HG2 . 17823 1
285 . 1 1 41 41 LYS HG3 H 1 1.133 0.01 . 2 . . . A 41 LYS HG3 . 17823 1
286 . 1 1 41 41 LYS HD2 H 1 1.543 0.01 . 2 . . . A 41 LYS HD2 . 17823 1
287 . 1 1 41 41 LYS HD3 H 1 1.543 0.01 . 2 . . . A 41 LYS HD3 . 17823 1
288 . 1 1 41 41 LYS HE2 H 1 2.862 0.01 . 2 . . . A 41 LYS HE2 . 17823 1
289 . 1 1 41 41 LYS HE3 H 1 2.862 0.01 . 2 . . . A 41 LYS HE3 . 17823 1
stop_
loop_
_Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
_Ambiguous_atom_chem_shift.Atom_chem_shift_ID
_Ambiguous_atom_chem_shift.Entry_ID
_Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID
1 23 17823 1
1 24 17823 1
2 45 17823 1
2 46 17823 1
2 47 17823 1
2 48 17823 1
3 211 17823 1
3 212 17823 1
3 213 17823 1
3 214 17823 1
stop_
save_