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 31161
_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-1H TOCSY' . . . 31161 1
2 '2D 1H-1H COSY' . . . 31161 1
3 '2D 1H-1H NOESY' . . . 31161 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 LEU HA H 1 4.253 . . 1 . . . . A 1 LEU HA . 31161 1
2 . 1 . 1 1 1 LEU HB2 H 1 1.736 . . 2 . . . . A 1 LEU HB2 . 31161 1
3 . 1 . 1 1 1 LEU HB3 H 1 1.671 . . 2 . . . . A 1 LEU HB3 . 31161 1
4 . 1 . 1 1 1 LEU HG H 1 1.742 . . 1 . . . . A 1 LEU HG . 31161 1
5 . 1 . 1 1 1 LEU HD11 H 1 0.891 . . 2 . . . . A 1 LEU HD11 . 31161 1
6 . 1 . 1 1 1 LEU HD12 H 1 0.891 . . 2 . . . . A 1 LEU HD12 . 31161 1
7 . 1 . 1 1 1 LEU HD13 H 1 0.891 . . 2 . . . . A 1 LEU HD13 . 31161 1
8 . 1 . 1 1 1 LEU HD21 H 1 0.933 . . 2 . . . . A 1 LEU HD21 . 31161 1
9 . 1 . 1 1 1 LEU HD22 H 1 0.933 . . 2 . . . . A 1 LEU HD22 . 31161 1
10 . 1 . 1 1 1 LEU HD23 H 1 0.933 . . 2 . . . . A 1 LEU HD23 . 31161 1
11 . 1 . 1 2 2 LYS H H 1 8.129 . . 1 . . . . A 2 LYS H . 31161 1
12 . 1 . 1 2 2 LYS HA H 1 4.189 . . 1 . . . . A 2 LYS HA . 31161 1
13 . 1 . 1 2 2 LYS HB2 H 1 1.811 . . 2 . . . . A 2 LYS HB2 . 31161 1
14 . 1 . 1 2 2 LYS HB3 H 1 1.811 . . 2 . . . . A 2 LYS HB3 . 31161 1
15 . 1 . 1 2 2 LYS HG2 H 1 1.467 . . 2 . . . . A 2 LYS HG2 . 31161 1
16 . 1 . 1 2 2 LYS HG3 H 1 1.467 . . 2 . . . . A 2 LYS HG3 . 31161 1
17 . 1 . 1 2 2 LYS HD2 H 1 1.685 . . 2 . . . . A 2 LYS HD2 . 31161 1
18 . 1 . 1 2 2 LYS HD3 H 1 1.685 . . 2 . . . . A 2 LYS HD3 . 31161 1
19 . 1 . 1 2 2 LYS HE2 H 1 2.975 . . 2 . . . . A 2 LYS HE2 . 31161 1
20 . 1 . 1 2 2 LYS HE3 H 1 2.975 . . 2 . . . . A 2 LYS HE3 . 31161 1
21 . 1 . 1 3 3 ASN H H 1 8.678 . . 1 . . . . A 3 ASN H . 31161 1
22 . 1 . 1 3 3 ASN HA H 1 4.649 . . 1 . . . . A 3 ASN HA . 31161 1
23 . 1 . 1 3 3 ASN HB2 H 1 2.954 . . 2 . . . . A 3 ASN HB2 . 31161 1
24 . 1 . 1 3 3 ASN HB3 H 1 2.818 . . 2 . . . . A 3 ASN HB3 . 31161 1
25 . 1 . 1 3 3 ASN HD21 H 1 7.082 . . 2 . . . . A 3 ASN HD21 . 31161 1
26 . 1 . 1 3 3 ASN HD22 H 1 7.771 . . 2 . . . . A 3 ASN HD22 . 31161 1
27 . 1 . 1 4 4 ALA H H 1 8.250 . . 1 . . . . A 4 ALA H . 31161 1
28 . 1 . 1 4 4 ALA HA H 1 4.175 . . 1 . . . . A 4 ALA HA . 31161 1
29 . 1 . 1 4 4 ALA HB1 H 1 1.410 . . 1 . . . . A 4 ALA HB1 . 31161 1
30 . 1 . 1 4 4 ALA HB2 H 1 1.410 . . 1 . . . . A 4 ALA HB2 . 31161 1
31 . 1 . 1 4 4 ALA HB3 H 1 1.410 . . 1 . . . . A 4 ALA HB3 . 31161 1
32 . 1 . 1 5 5 LYS H H 1 8.361 . . 1 . . . . A 5 LYS H . 31161 1
33 . 1 . 1 5 5 LYS HA H 1 3.819 . . 1 . . . . A 5 LYS HA . 31161 1
34 . 1 . 1 5 5 LYS HB2 H 1 1.915 . . 2 . . . . A 5 LYS HB2 . 31161 1
35 . 1 . 1 5 5 LYS HB3 H 1 1.761 . . 2 . . . . A 5 LYS HB3 . 31161 1
36 . 1 . 1 5 5 LYS HG2 H 1 1.403 . . 2 . . . . A 5 LYS HG2 . 31161 1
37 . 1 . 1 5 5 LYS HG3 H 1 1.281 . . 2 . . . . A 5 LYS HG3 . 31161 1
38 . 1 . 1 5 5 LYS HD2 H 1 1.806 . . 2 . . . . A 5 LYS HD2 . 31161 1
39 . 1 . 1 5 5 LYS HD3 H 1 1.696 . . 2 . . . . A 5 LYS HD3 . 31161 1
40 . 1 . 1 5 5 LYS HE2 H 1 3.142 . . 2 . . . . A 5 LYS HE2 . 31161 1
41 . 1 . 1 5 5 LYS HE3 H 1 2.774 . . 2 . . . . A 5 LYS HE3 . 31161 1
42 . 1 . 1 6 6 GLU H H 1 8.181 . . 1 . . . . A 6 GLU H . 31161 1
43 . 1 . 1 6 6 GLU HA H 1 3.901 . . 1 . . . . A 6 GLU HA . 31161 1
44 . 1 . 1 6 6 GLU HB2 H 1 2.035 . . 2 . . . . A 6 GLU HB2 . 31161 1
45 . 1 . 1 6 6 GLU HB3 H 1 2.035 . . 2 . . . . A 6 GLU HB3 . 31161 1
46 . 1 . 1 6 6 GLU HG2 H 1 2.415 . . 2 . . . . A 6 GLU HG2 . 31161 1
47 . 1 . 1 6 6 GLU HG3 H 1 2.266 . . 2 . . . . A 6 GLU HG3 . 31161 1
48 . 1 . 1 7 7 ASP H H 1 8.544 . . 1 . . . . A 7 ASP H . 31161 1
49 . 1 . 1 7 7 ASP HA H 1 4.426 . . 1 . . . . A 7 ASP HA . 31161 1
50 . 1 . 1 7 7 ASP HB2 H 1 2.686 . . 2 . . . . A 7 ASP HB2 . 31161 1
51 . 1 . 1 7 7 ASP HB3 H 1 2.686 . . 2 . . . . A 7 ASP HB3 . 31161 1
52 . 1 . 1 8 8 ALA H H 1 8.032 . . 1 . . . . A 8 ALA H . 31161 1
53 . 1 . 1 8 8 ALA HA H 1 4.121 . . 1 . . . . A 8 ALA HA . 31161 1
54 . 1 . 1 8 8 ALA HB1 H 1 1.420 . . 1 . . . . A 8 ALA HB1 . 31161 1
55 . 1 . 1 8 8 ALA HB2 H 1 1.420 . . 1 . . . . A 8 ALA HB2 . 31161 1
56 . 1 . 1 8 8 ALA HB3 H 1 1.420 . . 1 . . . . A 8 ALA HB3 . 31161 1
57 . 1 . 1 9 9 ILE H H 1 8.424 . . 1 . . . . A 9 ILE H . 31161 1
58 . 1 . 1 9 9 ILE HA H 1 3.547 . . 1 . . . . A 9 ILE HA . 31161 1
59 . 1 . 1 9 9 ILE HB H 1 1.834 . . 1 . . . . A 9 ILE HB . 31161 1
60 . 1 . 1 9 9 ILE HG12 H 1 1.786 . . 2 . . . . A 9 ILE HG12 . 31161 1
61 . 1 . 1 9 9 ILE HG13 H 1 1.111 . . 2 . . . . A 9 ILE HG13 . 31161 1
62 . 1 . 1 9 9 ILE HG21 H 1 0.567 . . 1 . . . . A 9 ILE HG21 . 31161 1
63 . 1 . 1 9 9 ILE HG22 H 1 0.567 . . 1 . . . . A 9 ILE HG22 . 31161 1
64 . 1 . 1 9 9 ILE HG23 H 1 0.567 . . 1 . . . . A 9 ILE HG23 . 31161 1
65 . 1 . 1 9 9 ILE HD11 H 1 0.840 . . 1 . . . . A 9 ILE HD11 . 31161 1
66 . 1 . 1 9 9 ILE HD12 H 1 0.840 . . 1 . . . . A 9 ILE HD12 . 31161 1
67 . 1 . 1 9 9 ILE HD13 H 1 0.840 . . 1 . . . . A 9 ILE HD13 . 31161 1
68 . 1 . 1 10 10 ALA H H 1 8.024 . . 1 . . . . A 10 ALA H . 31161 1
69 . 1 . 1 10 10 ALA HA H 1 4.055 . . 1 . . . . A 10 ALA HA . 31161 1
70 . 1 . 1 10 10 ALA HB1 H 1 1.522 . . 1 . . . . A 10 ALA HB1 . 31161 1
71 . 1 . 1 10 10 ALA HB2 H 1 1.522 . . 1 . . . . A 10 ALA HB2 . 31161 1
72 . 1 . 1 10 10 ALA HB3 H 1 1.522 . . 1 . . . . A 10 ALA HB3 . 31161 1
73 . 1 . 1 11 11 GLU H H 1 8.019 . . 1 . . . . A 11 GLU H . 31161 1
74 . 1 . 1 11 11 GLU HA H 1 4.026 . . 1 . . . . A 11 GLU HA . 31161 1
75 . 1 . 1 11 11 GLU HB2 H 1 2.253 . . 2 . . . . A 11 GLU HB2 . 31161 1
76 . 1 . 1 11 11 GLU HB3 H 1 2.123 . . 2 . . . . A 11 GLU HB3 . 31161 1
77 . 1 . 1 11 11 GLU HG2 H 1 2.471 . . 2 . . . . A 11 GLU HG2 . 31161 1
78 . 1 . 1 11 11 GLU HG3 H 1 2.207 . . 2 . . . . A 11 GLU HG3 . 31161 1
79 . 1 . 1 12 12 LEU H H 1 8.465 . . 1 . . . . A 12 LEU H . 31161 1
80 . 1 . 1 12 12 LEU HA H 1 4.039 . . 1 . . . . A 12 LEU HA . 31161 1
81 . 1 . 1 12 12 LEU HB2 H 1 2.370 . . 2 . . . . A 12 LEU HB2 . 31161 1
82 . 1 . 1 12 12 LEU HB3 H 1 1.328 . . 2 . . . . A 12 LEU HB3 . 31161 1
83 . 1 . 1 12 12 LEU HG H 1 2.164 . . 1 . . . . A 12 LEU HG . 31161 1
84 . 1 . 1 12 12 LEU HD11 H 1 0.853 . . 2 . . . . A 12 LEU HD11 . 31161 1
85 . 1 . 1 12 12 LEU HD12 H 1 0.853 . . 2 . . . . A 12 LEU HD12 . 31161 1
86 . 1 . 1 12 12 LEU HD13 H 1 0.853 . . 2 . . . . A 12 LEU HD13 . 31161 1
87 . 1 . 1 12 12 LEU HD21 H 1 0.876 . . 2 . . . . A 12 LEU HD21 . 31161 1
88 . 1 . 1 12 12 LEU HD22 H 1 0.876 . . 2 . . . . A 12 LEU HD22 . 31161 1
89 . 1 . 1 12 12 LEU HD23 H 1 0.876 . . 2 . . . . A 12 LEU HD23 . 31161 1
90 . 1 . 1 13 13 LYS H H 1 8.573 . . 1 . . . . A 13 LYS H . 31161 1
91 . 1 . 1 13 13 LYS HA H 1 4.368 . . 1 . . . . A 13 LYS HA . 31161 1
92 . 1 . 1 13 13 LYS HB2 H 1 1.857 . . 2 . . . . A 13 LYS HB2 . 31161 1
93 . 1 . 1 13 13 LYS HB3 H 1 1.857 . . 2 . . . . A 13 LYS HB3 . 31161 1
94 . 1 . 1 13 13 LYS HG2 H 1 1.408 . . 2 . . . . A 13 LYS HG2 . 31161 1
95 . 1 . 1 13 13 LYS HG3 H 1 1.408 . . 2 . . . . A 13 LYS HG3 . 31161 1
96 . 1 . 1 13 13 LYS HE2 H 1 2.891 . . 2 . . . . A 13 LYS HE2 . 31161 1
97 . 1 . 1 13 13 LYS HE3 H 1 2.891 . . 2 . . . . A 13 LYS HE3 . 31161 1
98 . 1 . 1 14 14 LYS H H 1 8.180 . . 1 . . . . A 14 LYS H . 31161 1
99 . 1 . 1 14 14 LYS HA H 1 4.069 . . 1 . . . . A 14 LYS HA . 31161 1
100 . 1 . 1 14 14 LYS HB2 H 1 1.987 . . 2 . . . . A 14 LYS HB2 . 31161 1
101 . 1 . 1 14 14 LYS HB3 H 1 1.927 . . 2 . . . . A 14 LYS HB3 . 31161 1
102 . 1 . 1 14 14 LYS HG2 H 1 1.474 . . 2 . . . . A 14 LYS HG2 . 31161 1
103 . 1 . 1 14 14 LYS HG3 H 1 1.474 . . 2 . . . . A 14 LYS HG3 . 31161 1
104 . 1 . 1 14 14 LYS HD2 H 1 1.700 . . 2 . . . . A 14 LYS HD2 . 31161 1
105 . 1 . 1 14 14 LYS HD3 H 1 1.700 . . 2 . . . . A 14 LYS HD3 . 31161 1
106 . 1 . 1 14 14 LYS HE2 H 1 2.969 . . 2 . . . . A 14 LYS HE2 . 31161 1
107 . 1 . 1 14 14 LYS HE3 H 1 2.969 . . 2 . . . . A 14 LYS HE3 . 31161 1
108 . 1 . 1 15 15 ALA H H 1 7.587 . . 1 . . . . A 15 ALA H . 31161 1
109 . 1 . 1 15 15 ALA HA H 1 4.375 . . 1 . . . . A 15 ALA HA . 31161 1
110 . 1 . 1 15 15 ALA HB1 H 1 1.519 . . 1 . . . . A 15 ALA HB1 . 31161 1
111 . 1 . 1 15 15 ALA HB2 H 1 1.519 . . 1 . . . . A 15 ALA HB2 . 31161 1
112 . 1 . 1 15 15 ALA HB3 H 1 1.519 . . 1 . . . . A 15 ALA HB3 . 31161 1
113 . 1 . 1 16 16 GLY H H 1 7.787 . . 1 . . . . A 16 GLY H . 31161 1
114 . 1 . 1 16 16 GLY HA2 H 1 4.444 . . 2 . . . . A 16 GLY HA2 . 31161 1
115 . 1 . 1 16 16 GLY HA3 H 1 3.708 . . 2 . . . . A 16 GLY HA3 . 31161 1
116 . 1 . 1 17 17 ILE H H 1 7.843 . . 1 . . . . A 17 ILE H . 31161 1
117 . 1 . 1 17 17 ILE HA H 1 3.856 . . 1 . . . . A 17 ILE HA . 31161 1
118 . 1 . 1 17 17 ILE HB H 1 1.704 . . 1 . . . . A 17 ILE HB . 31161 1
119 . 1 . 1 17 17 ILE HG12 H 1 0.996 . . 2 . . . . A 17 ILE HG12 . 31161 1
120 . 1 . 1 17 17 ILE HG13 H 1 0.996 . . 2 . . . . A 17 ILE HG13 . 31161 1
121 . 1 . 1 17 17 ILE HG21 H 1 0.661 . . 1 . . . . A 17 ILE HG21 . 31161 1
122 . 1 . 1 17 17 ILE HG22 H 1 0.661 . . 1 . . . . A 17 ILE HG22 . 31161 1
123 . 1 . 1 17 17 ILE HG23 H 1 0.661 . . 1 . . . . A 17 ILE HG23 . 31161 1
124 . 1 . 1 17 17 ILE HD11 H 1 0.529 . . 1 . . . . A 17 ILE HD11 . 31161 1
125 . 1 . 1 17 17 ILE HD12 H 1 0.529 . . 1 . . . . A 17 ILE HD12 . 31161 1
126 . 1 . 1 17 17 ILE HD13 H 1 0.529 . . 1 . . . . A 17 ILE HD13 . 31161 1
127 . 1 . 1 18 18 THR H H 1 8.403 . . 1 . . . . A 18 THR H . 31161 1
128 . 1 . 1 18 18 THR HA H 1 4.607 . . 1 . . . . A 18 THR HA . 31161 1
129 . 1 . 1 18 18 THR HB H 1 4.437 . . 1 . . . . A 18 THR HB . 31161 1
130 . 1 . 1 18 18 THR HG21 H 1 1.169 . . 1 . . . . A 18 THR HG21 . 31161 1
131 . 1 . 1 18 18 THR HG22 H 1 1.169 . . 1 . . . . A 18 THR HG22 . 31161 1
132 . 1 . 1 18 18 THR HG23 H 1 1.169 . . 1 . . . . A 18 THR HG23 . 31161 1
133 . 1 . 1 19 19 SER H H 1 7.018 . . 1 . . . . A 19 SER H . 31161 1
134 . 1 . 1 19 19 SER HA H 1 4.292 . . 1 . . . . A 19 SER HA . 31161 1
135 . 1 . 1 19 19 SER HB2 H 1 3.888 . . 2 . . . . A 19 SER HB2 . 31161 1
136 . 1 . 1 19 19 SER HB3 H 1 3.456 . . 2 . . . . A 19 SER HB3 . 31161 1
137 . 1 . 1 20 20 ASP H H 1 8.719 . . 1 . . . . A 20 ASP H . 31161 1
138 . 1 . 1 20 20 ASP HA H 1 4.363 . . 1 . . . . A 20 ASP HA . 31161 1
139 . 1 . 1 20 20 ASP HB2 H 1 2.608 . . 2 . . . . A 20 ASP HB2 . 31161 1
140 . 1 . 1 20 20 ASP HB3 H 1 2.537 . . 2 . . . . A 20 ASP HB3 . 31161 1
141 . 1 . 1 21 21 PHE H H 1 7.854 . . 1 . . . . A 21 PHE H . 31161 1
142 . 1 . 1 21 21 PHE HA H 1 4.246 . . 1 . . . . A 21 PHE HA . 31161 1
143 . 1 . 1 21 21 PHE HB2 H 1 3.079 . . 2 . . . . A 21 PHE HB2 . 31161 1
144 . 1 . 1 21 21 PHE HB3 H 1 2.897 . . 2 . . . . A 21 PHE HB3 . 31161 1
145 . 1 . 1 21 21 PHE HD1 H 1 7.202 . . 3 . . . . A 21 PHE HD1 . 31161 1
146 . 1 . 1 21 21 PHE HD2 H 1 7.202 . . 3 . . . . A 21 PHE HD2 . 31161 1
147 . 1 . 1 21 21 PHE HE1 H 1 7.347 . . 3 . . . . A 21 PHE HE1 . 31161 1
148 . 1 . 1 21 21 PHE HE2 H 1 7.347 . . 3 . . . . A 21 PHE HE2 . 31161 1
149 . 1 . 1 22 22 XCP H H 1 7.211 . . 1 . . . . A 22 XCP H . 31161 1
150 . 1 . 1 22 22 XCP HA H 1 2.518 . . 1 . . . . A 22 XCP HA . 31161 1
151 . 1 . 1 22 22 XCP HB H 1 4.179 . . 1 . . . . A 22 XCP HB . 31161 1
152 . 1 . 1 22 22 XCP HD H 1 1.704 . . 1 . . . . A 22 XCP HD . 31161 1
153 . 1 . 1 22 22 XCP HDA H 1 1.704 . . 1 . . . . A 22 XCP HDA . 31161 1
154 . 1 . 1 22 22 XCP HE H 1 1.464 . . 1 . . . . A 22 XCP HE . 31161 1
155 . 1 . 1 22 22 XCP HEA H 1 1.866 . . 1 . . . . A 22 XCP HEA . 31161 1
156 . 1 . 1 22 22 XCP HG H 1 1.379 . . 1 . . . . A 22 XCP HG . 31161 1
157 . 1 . 1 22 22 XCP HGA H 1 2.051 . . 1 . . . . A 22 XCP HGA . 31161 1
158 . 1 . 1 23 23 PHE H H 1 7.693 . . 1 . . . . A 23 PHE H . 31161 1
159 . 1 . 1 23 23 PHE HA H 1 4.231 . . 1 . . . . A 23 PHE HA . 31161 1
160 . 1 . 1 23 23 PHE HB2 H 1 3.298 . . 2 . . . . A 23 PHE HB2 . 31161 1
161 . 1 . 1 23 23 PHE HB3 H 1 3.136 . . 2 . . . . A 23 PHE HB3 . 31161 1
162 . 1 . 1 23 23 PHE HD1 H 1 7.165 . . 3 . . . . A 23 PHE HD1 . 31161 1
163 . 1 . 1 23 23 PHE HD2 H 1 7.165 . . 3 . . . . A 23 PHE HD2 . 31161 1
164 . 1 . 1 23 23 PHE HE1 H 1 7.130 . . 3 . . . . A 23 PHE HE1 . 31161 1
165 . 1 . 1 23 23 PHE HE2 H 1 7.130 . . 3 . . . . A 23 PHE HE2 . 31161 1
166 . 1 . 1 23 23 PHE HZ H 1 7.226 . . 1 . . . . A 23 PHE HZ . 31161 1
167 . 1 . 1 24 24 ASN H H 1 8.596 . . 1 . . . . A 24 ASN H . 31161 1
168 . 1 . 1 24 24 ASN HA H 1 4.562 . . 1 . . . . A 24 ASN HA . 31161 1
169 . 1 . 1 24 24 ASN HB2 H 1 2.951 . . 2 . . . . A 24 ASN HB2 . 31161 1
170 . 1 . 1 24 24 ASN HB3 H 1 2.770 . . 2 . . . . A 24 ASN HB3 . 31161 1
171 . 1 . 1 24 24 ASN HD21 H 1 7.081 . . 2 . . . . A 24 ASN HD21 . 31161 1
172 . 1 . 1 24 24 ASN HD22 H 1 7.673 . . 2 . . . . A 24 ASN HD22 . 31161 1
173 . 1 . 1 25 25 ALA H H 1 7.368 . . 1 . . . . A 25 ALA H . 31161 1
174 . 1 . 1 25 25 ALA HA H 1 3.974 . . 1 . . . . A 25 ALA HA . 31161 1
175 . 1 . 1 25 25 ALA HB1 H 1 1.421 . . 1 . . . . A 25 ALA HB1 . 31161 1
176 . 1 . 1 25 25 ALA HB2 H 1 1.421 . . 1 . . . . A 25 ALA HB2 . 31161 1
177 . 1 . 1 25 25 ALA HB3 H 1 1.421 . . 1 . . . . A 25 ALA HB3 . 31161 1
178 . 1 . 1 26 26 XCP H H 1 7.100 . . 1 . . . . A 26 XCP H . 31161 1
179 . 1 . 1 26 26 XCP HA H 1 2.884 . . 1 . . . . A 26 XCP HA . 31161 1
180 . 1 . 1 26 26 XCP HB H 1 4.187 . . 1 . . . . A 26 XCP HB . 31161 1
181 . 1 . 1 26 26 XCP HD H 1 1.407 . . 1 . . . . A 26 XCP HD . 31161 1
182 . 1 . 1 26 26 XCP HDA H 1 1.407 . . 1 . . . . A 26 XCP HDA . 31161 1
183 . 1 . 1 26 26 XCP HE H 1 1.543 . . 1 . . . . A 26 XCP HE . 31161 1
184 . 1 . 1 26 26 XCP HEA H 1 1.682 . . 1 . . . . A 26 XCP HEA . 31161 1
185 . 1 . 1 26 26 XCP HG H 1 1.932 . . 1 . . . . A 26 XCP HG . 31161 1
186 . 1 . 1 26 26 XCP HGA H 1 1.932 . . 1 . . . . A 26 XCP HGA . 31161 1
187 . 1 . 1 27 27 ASN H H 1 7.991 . . 1 . . . . A 27 ASN H . 31161 1
188 . 1 . 1 27 27 ASN HA H 1 4.385 . . 1 . . . . A 27 ASN HA . 31161 1
189 . 1 . 1 27 27 ASN HB2 H 1 2.885 . . 2 . . . . A 27 ASN HB2 . 31161 1
190 . 1 . 1 27 27 ASN HB3 H 1 2.837 . . 2 . . . . A 27 ASN HB3 . 31161 1
191 . 1 . 1 27 27 ASN HD21 H 1 7.007 . . 2 . . . . A 27 ASN HD21 . 31161 1
192 . 1 . 1 27 27 ASN HD22 H 1 7.647 . . 2 . . . . A 27 ASN HD22 . 31161 1
193 . 1 . 1 28 28 LYS H H 1 7.784 . . 1 . . . . A 28 LYS H . 31161 1
194 . 1 . 1 28 28 LYS HA H 1 4.141 . . 1 . . . . A 28 LYS HA . 31161 1
195 . 1 . 1 28 28 LYS HB2 H 1 1.875 . . 2 . . . . A 28 LYS HB2 . 31161 1
196 . 1 . 1 28 28 LYS HB3 H 1 1.875 . . 2 . . . . A 28 LYS HB3 . 31161 1
197 . 1 . 1 28 28 LYS HG2 H 1 1.515 . . 2 . . . . A 28 LYS HG2 . 31161 1
198 . 1 . 1 28 28 LYS HG3 H 1 1.515 . . 2 . . . . A 28 LYS HG3 . 31161 1
199 . 1 . 1 28 28 LYS HD2 H 1 1.625 . . 2 . . . . A 28 LYS HD2 . 31161 1
200 . 1 . 1 28 28 LYS HD3 H 1 1.625 . . 2 . . . . A 28 LYS HD3 . 31161 1
201 . 1 . 1 28 28 LYS HE2 H 1 2.947 . . 2 . . . . A 28 LYS HE2 . 31161 1
202 . 1 . 1 28 28 LYS HE3 H 1 2.947 . . 2 . . . . A 28 LYS HE3 . 31161 1
203 . 1 . 1 29 29 ALA H H 1 7.459 . . 1 . . . . A 29 ALA H . 31161 1
204 . 1 . 1 29 29 ALA HA H 1 4.123 . . 1 . . . . A 29 ALA HA . 31161 1
205 . 1 . 1 29 29 ALA HB1 H 1 1.470 . . 1 . . . . A 29 ALA HB1 . 31161 1
206 . 1 . 1 29 29 ALA HB2 H 1 1.470 . . 1 . . . . A 29 ALA HB2 . 31161 1
207 . 1 . 1 29 29 ALA HB3 H 1 1.470 . . 1 . . . . A 29 ALA HB3 . 31161 1
208 . 1 . 1 30 30 LYS H H 1 9.046 . . 1 . . . . A 30 LYS H . 31161 1
209 . 1 . 1 30 30 LYS HA H 1 4.385 . . 1 . . . . A 30 LYS HA . 31161 1
210 . 1 . 1 30 30 LYS HB2 H 1 1.981 . . 2 . . . . A 30 LYS HB2 . 31161 1
211 . 1 . 1 30 30 LYS HB3 H 1 1.912 . . 2 . . . . A 30 LYS HB3 . 31161 1
212 . 1 . 1 30 30 LYS HG2 H 1 1.683 . . 2 . . . . A 30 LYS HG2 . 31161 1
213 . 1 . 1 30 30 LYS HG3 H 1 1.514 . . 2 . . . . A 30 LYS HG3 . 31161 1
214 . 1 . 1 30 30 LYS HD2 H 1 1.754 . . 2 . . . . A 30 LYS HD2 . 31161 1
215 . 1 . 1 30 30 LYS HD3 H 1 1.754 . . 2 . . . . A 30 LYS HD3 . 31161 1
216 . 1 . 1 30 30 LYS HE2 H 1 3.070 . . 2 . . . . A 30 LYS HE2 . 31161 1
217 . 1 . 1 30 30 LYS HE3 H 1 3.070 . . 2 . . . . A 30 LYS HE3 . 31161 1
218 . 1 . 1 31 31 THR H H 1 7.411 . . 1 . . . . A 31 THR H . 31161 1
219 . 1 . 1 31 31 THR HA H 1 4.777 . . 1 . . . . A 31 THR HA . 31161 1
220 . 1 . 1 31 31 THR HB H 1 4.703 . . 1 . . . . A 31 THR HB . 31161 1
221 . 1 . 1 31 31 THR HG21 H 1 1.256 . . 1 . . . . A 31 THR HG21 . 31161 1
222 . 1 . 1 31 31 THR HG22 H 1 1.256 . . 1 . . . . A 31 THR HG22 . 31161 1
223 . 1 . 1 31 31 THR HG23 H 1 1.256 . . 1 . . . . A 31 THR HG23 . 31161 1
224 . 1 . 1 32 32 VAL H H 1 9.042 . . 1 . . . . A 32 VAL H . 31161 1
225 . 1 . 1 32 32 VAL HA H 1 3.539 . . 1 . . . . A 32 VAL HA . 31161 1
226 . 1 . 1 32 32 VAL HB H 1 2.060 . . 1 . . . . A 32 VAL HB . 31161 1
227 . 1 . 1 32 32 VAL HG11 H 1 0.956 . . 2 . . . . A 32 VAL HG11 . 31161 1
228 . 1 . 1 32 32 VAL HG12 H 1 0.956 . . 2 . . . . A 32 VAL HG12 . 31161 1
229 . 1 . 1 32 32 VAL HG13 H 1 0.956 . . 2 . . . . A 32 VAL HG13 . 31161 1
230 . 1 . 1 32 32 VAL HG21 H 1 1.063 . . 2 . . . . A 32 VAL HG21 . 31161 1
231 . 1 . 1 32 32 VAL HG22 H 1 1.063 . . 2 . . . . A 32 VAL HG22 . 31161 1
232 . 1 . 1 32 32 VAL HG23 H 1 1.063 . . 2 . . . . A 32 VAL HG23 . 31161 1
233 . 1 . 1 33 33 GLU H H 1 8.795 . . 1 . . . . A 33 GLU H . 31161 1
234 . 1 . 1 33 33 GLU HA H 1 4.083 . . 1 . . . . A 33 GLU HA . 31161 1
235 . 1 . 1 33 33 GLU HB2 H 1 2.112 . . 2 . . . . A 33 GLU HB2 . 31161 1
236 . 1 . 1 33 33 GLU HB3 H 1 1.958 . . 2 . . . . A 33 GLU HB3 . 31161 1
237 . 1 . 1 33 33 GLU HG2 H 1 2.470 . . 2 . . . . A 33 GLU HG2 . 31161 1
238 . 1 . 1 33 33 GLU HG3 H 1 2.299 . . 2 . . . . A 33 GLU HG3 . 31161 1
239 . 1 . 1 34 34 GLU H H 1 8.086 . . 1 . . . . A 34 GLU H . 31161 1
240 . 1 . 1 34 34 GLU HA H 1 4.177 . . 1 . . . . A 34 GLU HA . 31161 1
241 . 1 . 1 34 34 GLU HB2 H 1 2.335 . . 2 . . . . A 34 GLU HB2 . 31161 1
242 . 1 . 1 34 34 GLU HB3 H 1 2.168 . . 2 . . . . A 34 GLU HB3 . 31161 1
243 . 1 . 1 34 34 GLU HG2 H 1 2.476 . . 2 . . . . A 34 GLU HG2 . 31161 1
244 . 1 . 1 34 34 GLU HG3 H 1 2.476 . . 2 . . . . A 34 GLU HG3 . 31161 1
245 . 1 . 1 35 35 VAL H H 1 8.317 . . 1 . . . . A 35 VAL H . 31161 1
246 . 1 . 1 35 35 VAL HA H 1 3.284 . . 1 . . . . A 35 VAL HA . 31161 1
247 . 1 . 1 35 35 VAL HB H 1 2.384 . . 1 . . . . A 35 VAL HB . 31161 1
248 . 1 . 1 35 35 VAL HG11 H 1 0.787 . . 2 . . . . A 35 VAL HG11 . 31161 1
249 . 1 . 1 35 35 VAL HG12 H 1 0.787 . . 2 . . . . A 35 VAL HG12 . 31161 1
250 . 1 . 1 35 35 VAL HG13 H 1 0.787 . . 2 . . . . A 35 VAL HG13 . 31161 1
251 . 1 . 1 35 35 VAL HG21 H 1 0.998 . . 2 . . . . A 35 VAL HG21 . 31161 1
252 . 1 . 1 35 35 VAL HG22 H 1 0.998 . . 2 . . . . A 35 VAL HG22 . 31161 1
253 . 1 . 1 35 35 VAL HG23 H 1 0.998 . . 2 . . . . A 35 VAL HG23 . 31161 1
254 . 1 . 1 36 36 ASN H H 1 7.962 . . 1 . . . . A 36 ASN H . 31161 1
255 . 1 . 1 36 36 ASN HA H 1 4.334 . . 1 . . . . A 36 ASN HA . 31161 1
256 . 1 . 1 36 36 ASN HB2 H 1 2.808 . . 2 . . . . A 36 ASN HB2 . 31161 1
257 . 1 . 1 36 36 ASN HB3 H 1 2.808 . . 2 . . . . A 36 ASN HB3 . 31161 1
258 . 1 . 1 36 36 ASN HD21 H 1 7.057 . . 2 . . . . A 36 ASN HD21 . 31161 1
259 . 1 . 1 36 36 ASN HD22 H 1 7.712 . . 2 . . . . A 36 ASN HD22 . 31161 1
260 . 1 . 1 37 37 ALA H H 1 8.174 . . 1 . . . . A 37 ALA H . 31161 1
261 . 1 . 1 37 37 ALA HA H 1 4.192 . . 1 . . . . A 37 ALA HA . 31161 1
262 . 1 . 1 37 37 ALA HB1 H 1 1.539 . . 1 . . . . A 37 ALA HB1 . 31161 1
263 . 1 . 1 37 37 ALA HB2 H 1 1.539 . . 1 . . . . A 37 ALA HB2 . 31161 1
264 . 1 . 1 37 37 ALA HB3 H 1 1.539 . . 1 . . . . A 37 ALA HB3 . 31161 1
265 . 1 . 1 38 38 LEU H H 1 8.751 . . 1 . . . . A 38 LEU H . 31161 1
266 . 1 . 1 38 38 LEU HA H 1 4.167 . . 1 . . . . A 38 LEU HA . 31161 1
267 . 1 . 1 38 38 LEU HB2 H 1 1.904 . . 2 . . . . A 38 LEU HB2 . 31161 1
268 . 1 . 1 38 38 LEU HB3 H 1 1.463 . . 2 . . . . A 38 LEU HB3 . 31161 1
269 . 1 . 1 38 38 LEU HG H 1 1.901 . . 1 . . . . A 38 LEU HG . 31161 1
270 . 1 . 1 38 38 LEU HD11 H 1 0.891 . . 2 . . . . A 38 LEU HD11 . 31161 1
271 . 1 . 1 38 38 LEU HD12 H 1 0.891 . . 2 . . . . A 38 LEU HD12 . 31161 1
272 . 1 . 1 38 38 LEU HD13 H 1 0.891 . . 2 . . . . A 38 LEU HD13 . 31161 1
273 . 1 . 1 38 38 LEU HD21 H 1 0.939 . . 2 . . . . A 38 LEU HD21 . 31161 1
274 . 1 . 1 38 38 LEU HD22 H 1 0.939 . . 2 . . . . A 38 LEU HD22 . 31161 1
275 . 1 . 1 38 38 LEU HD23 H 1 0.939 . . 2 . . . . A 38 LEU HD23 . 31161 1
276 . 1 . 1 39 39 LYS H H 1 8.599 . . 1 . . . . A 39 LYS H . 31161 1
277 . 1 . 1 39 39 LYS HA H 1 3.787 . . 1 . . . . A 39 LYS HA . 31161 1
278 . 1 . 1 39 39 LYS HB2 H 1 2.016 . . 2 . . . . A 39 LYS HB2 . 31161 1
279 . 1 . 1 39 39 LYS HB3 H 1 2.016 . . 2 . . . . A 39 LYS HB3 . 31161 1
280 . 1 . 1 39 39 LYS HG2 H 1 1.503 . . 2 . . . . A 39 LYS HG2 . 31161 1
281 . 1 . 1 39 39 LYS HG3 H 1 1.300 . . 2 . . . . A 39 LYS HG3 . 31161 1
282 . 1 . 1 39 39 LYS HD2 H 1 1.800 . . 2 . . . . A 39 LYS HD2 . 31161 1
283 . 1 . 1 39 39 LYS HD3 H 1 1.545 . . 2 . . . . A 39 LYS HD3 . 31161 1
284 . 1 . 1 39 39 LYS HE2 H 1 2.966 . . 2 . . . . A 39 LYS HE2 . 31161 1
285 . 1 . 1 39 39 LYS HE3 H 1 2.800 . . 2 . . . . A 39 LYS HE3 . 31161 1
286 . 1 . 1 40 40 ASN H H 1 8.102 . . 1 . . . . A 40 ASN H . 31161 1
287 . 1 . 1 40 40 ASN HA H 1 4.495 . . 1 . . . . A 40 ASN HA . 31161 1
288 . 1 . 1 40 40 ASN HB2 H 1 2.931 . . 2 . . . . A 40 ASN HB2 . 31161 1
289 . 1 . 1 40 40 ASN HB3 H 1 2.779 . . 2 . . . . A 40 ASN HB3 . 31161 1
290 . 1 . 1 40 40 ASN HD21 H 1 6.975 . . 2 . . . . A 40 ASN HD21 . 31161 1
291 . 1 . 1 40 40 ASN HD22 H 1 7.586 . . 2 . . . . A 40 ASN HD22 . 31161 1
292 . 1 . 1 41 41 GLU H H 1 8.100 . . 1 . . . . A 41 GLU H . 31161 1
293 . 1 . 1 41 41 GLU HA H 1 4.093 . . 1 . . . . A 41 GLU HA . 31161 1
294 . 1 . 1 41 41 GLU HB2 H 1 2.216 . . 2 . . . . A 41 GLU HB2 . 31161 1
295 . 1 . 1 41 41 GLU HB3 H 1 2.216 . . 2 . . . . A 41 GLU HB3 . 31161 1
296 . 1 . 1 41 41 GLU HG2 H 1 2.413 . . 2 . . . . A 41 GLU HG2 . 31161 1
297 . 1 . 1 41 41 GLU HG3 H 1 2.349 . . 2 . . . . A 41 GLU HG3 . 31161 1
298 . 1 . 1 42 42 ILE H H 1 8.504 . . 1 . . . . A 42 ILE H . 31161 1
299 . 1 . 1 42 42 ILE HA H 1 3.796 . . 1 . . . . A 42 ILE HA . 31161 1
300 . 1 . 1 42 42 ILE HB H 1 1.847 . . 1 . . . . A 42 ILE HB . 31161 1
301 . 1 . 1 42 42 ILE HG12 H 1 1.061 . . 2 . . . . A 42 ILE HG12 . 31161 1
302 . 1 . 1 42 42 ILE HG13 H 1 0.803 . . 2 . . . . A 42 ILE HG13 . 31161 1
303 . 1 . 1 42 42 ILE HG21 H 1 0.869 . . 1 . . . . A 42 ILE HG21 . 31161 1
304 . 1 . 1 42 42 ILE HG22 H 1 0.869 . . 1 . . . . A 42 ILE HG22 . 31161 1
305 . 1 . 1 42 42 ILE HG23 H 1 0.869 . . 1 . . . . A 42 ILE HG23 . 31161 1
306 . 1 . 1 42 42 ILE HD11 H 1 0.947 . . 1 . . . . A 42 ILE HD11 . 31161 1
307 . 1 . 1 42 42 ILE HD12 H 1 0.947 . . 1 . . . . A 42 ILE HD12 . 31161 1
308 . 1 . 1 42 42 ILE HD13 H 1 0.947 . . 1 . . . . A 42 ILE HD13 . 31161 1
309 . 1 . 1 43 43 LEU H H 1 8.453 . . 1 . . . . A 43 LEU H . 31161 1
310 . 1 . 1 43 43 LEU HA H 1 4.055 . . 1 . . . . A 43 LEU HA . 31161 1
311 . 1 . 1 43 43 LEU HB2 H 1 1.962 . . 2 . . . . A 43 LEU HB2 . 31161 1
312 . 1 . 1 43 43 LEU HB3 H 1 1.518 . . 2 . . . . A 43 LEU HB3 . 31161 1
313 . 1 . 1 43 43 LEU HG H 1 1.796 . . 1 . . . . A 43 LEU HG . 31161 1
314 . 1 . 1 43 43 LEU HD11 H 1 0.824 . . 2 . . . . A 43 LEU HD11 . 31161 1
315 . 1 . 1 43 43 LEU HD12 H 1 0.824 . . 2 . . . . A 43 LEU HD12 . 31161 1
316 . 1 . 1 43 43 LEU HD13 H 1 0.824 . . 2 . . . . A 43 LEU HD13 . 31161 1
317 . 1 . 1 43 43 LEU HD21 H 1 0.879 . . 2 . . . . A 43 LEU HD21 . 31161 1
318 . 1 . 1 43 43 LEU HD22 H 1 0.879 . . 2 . . . . A 43 LEU HD22 . 31161 1
319 . 1 . 1 43 43 LEU HD23 H 1 0.879 . . 2 . . . . A 43 LEU HD23 . 31161 1
320 . 1 . 1 44 44 LYS H H 1 8.085 . . 1 . . . . A 44 LYS H . 31161 1
321 . 1 . 1 44 44 LYS HA H 1 4.104 . . 1 . . . . A 44 LYS HA . 31161 1
322 . 1 . 1 44 44 LYS HB2 H 1 1.926 . . 2 . . . . A 44 LYS HB2 . 31161 1
323 . 1 . 1 44 44 LYS HB3 H 1 1.926 . . 2 . . . . A 44 LYS HB3 . 31161 1
324 . 1 . 1 44 44 LYS HG2 H 1 1.417 . . 2 . . . . A 44 LYS HG2 . 31161 1
325 . 1 . 1 44 44 LYS HG3 H 1 1.417 . . 2 . . . . A 44 LYS HG3 . 31161 1
326 . 1 . 1 44 44 LYS HD2 H 1 1.691 . . 2 . . . . A 44 LYS HD2 . 31161 1
327 . 1 . 1 44 44 LYS HD3 H 1 1.691 . . 2 . . . . A 44 LYS HD3 . 31161 1
328 . 1 . 1 44 44 LYS HE2 H 1 2.966 . . 2 . . . . A 44 LYS HE2 . 31161 1
329 . 1 . 1 44 44 LYS HE3 H 1 2.966 . . 2 . . . . A 44 LYS HE3 . 31161 1
330 . 1 . 1 45 45 ALA H H 1 7.957 . . 1 . . . . A 45 ALA H . 31161 1
331 . 1 . 1 45 45 ALA HA H 1 4.218 . . 1 . . . . A 45 ALA HA . 31161 1
332 . 1 . 1 45 45 ALA HB1 H 1 1.506 . . 1 . . . . A 45 ALA HB1 . 31161 1
333 . 1 . 1 45 45 ALA HB2 H 1 1.506 . . 1 . . . . A 45 ALA HB2 . 31161 1
334 . 1 . 1 45 45 ALA HB3 H 1 1.506 . . 1 . . . . A 45 ALA HB3 . 31161 1
335 . 1 . 1 46 46 HIS H H 1 8.132 . . 1 . . . . A 46 HIS H . 31161 1
336 . 1 . 1 46 46 HIS HA H 1 4.475 . . 1 . . . . A 46 HIS HA . 31161 1
337 . 1 . 1 46 46 HIS HB2 H 1 3.301 . . 2 . . . . A 46 HIS HB2 . 31161 1
338 . 1 . 1 46 46 HIS HB3 H 1 3.125 . . 2 . . . . A 46 HIS HB3 . 31161 1
339 . 1 . 1 46 46 HIS HD2 H 1 7.265 . . 1 . . . . A 46 HIS HD2 . 31161 1
340 . 1 . 1 47 47 ALA H H 1 7.841 . . 1 . . . . A 47 ALA H . 31161 1
341 . 1 . 1 47 47 ALA HA H 1 4.179 . . 1 . . . . A 47 ALA HA . 31161 1
342 . 1 . 1 47 47 ALA HB1 H 1 1.496 . . 1 . . . . A 47 ALA HB1 . 31161 1
343 . 1 . 1 47 47 ALA HB2 H 1 1.496 . . 1 . . . . A 47 ALA HB2 . 31161 1
344 . 1 . 1 47 47 ALA HB3 H 1 1.496 . . 1 . . . . A 47 ALA HB3 . 31161 1
345 . 1 . 1 48 48 NH2 HN1 H 1 7.265 . . 2 . . . . A 48 NH2 HN1 . 31161 1
346 . 1 . 1 48 48 NH2 HN2 H 1 7.349 . . 2 . . . . A 48 NH2 HN2 . 31161 1
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