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 11050
_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 .
_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-15N HSQC' 1 $sample_1 isotropic 11050 1
2 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11050 1
3 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 11050 1
5 '2D 1H-1H NOESY' 1 $sample_1 isotropic 11050 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 MET HA H 1 4.095 . 0.005 1 . . . . 1 MET HA . 11050 1
2 . 1 1 1 1 MET HB2 H 1 2.122 . 0.005 2 . . . . 1 MET HB2 . 11050 1
3 . 1 1 1 1 MET HB3 H 1 2.123 . 0.005 2 . . . . 1 MET HB3 . 11050 1
4 . 1 1 1 1 MET HG2 H 1 2.597 . 0.005 2 . . . . 1 MET HG2 . 11050 1
5 . 1 1 1 1 MET HG3 H 1 2.598 . 0.005 2 . . . . 1 MET HG3 . 11050 1
6 . 1 1 2 2 ALA H H 1 8.341 . 0.005 1 . . . . 2 ALA HN . 11050 1
7 . 1 1 2 2 ALA HA H 1 4.257 . 0.005 1 . . . . 2 ALA HA . 11050 1
8 . 1 1 2 2 ALA HB1 H 1 1.342 . 0.005 1 . . . . 2 ALA HB* . 11050 1
9 . 1 1 2 2 ALA HB2 H 1 1.342 . 0.005 1 . . . . 2 ALA HB* . 11050 1
10 . 1 1 2 2 ALA HB3 H 1 1.342 . 0.005 1 . . . . 2 ALA HB* . 11050 1
11 . 1 1 2 2 ALA N N 15 128.151 . 0.020 1 . . . . 2 ALA N . 11050 1
12 . 1 1 3 3 GLU H H 1 8.123 . 0.005 1 . . . . 3 GLU HN . 11050 1
13 . 1 1 3 3 GLU HA H 1 4.291 . 0.005 1 . . . . 3 GLU HA . 11050 1
14 . 1 1 3 3 GLU HB2 H 1 1.939 . 0.005 2 . . . . 3 GLU HB2 . 11050 1
15 . 1 1 3 3 GLU HB3 H 1 2.049 . 0.005 2 . . . . 3 GLU HB3 . 11050 1
16 . 1 1 3 3 GLU HG2 H 1 2.407 . 0.005 2 . . . . 3 GLU HG2 . 11050 1
17 . 1 1 3 3 GLU HG3 H 1 2.408 . 0.005 2 . . . . 3 GLU HG3 . 11050 1
18 . 1 1 3 3 GLU N N 15 119.217 . 0.020 1 . . . . 3 GLU N . 11050 1
19 . 1 1 4 4 MET H H 1 8.182 . 0.005 1 . . . . 4 MET HN . 11050 1
20 . 1 1 4 4 MET HA H 1 4.354 . 0.005 1 . . . . 4 MET HA . 11050 1
21 . 1 1 4 4 MET HB2 H 1 1.998 . 0.005 2 . . . . 4 MET HB2 . 11050 1
22 . 1 1 4 4 MET HB3 H 1 1.000 . 0.005 2 . . . . 4 MET HB3 . 11050 1
23 . 1 1 4 4 MET HG2 H 1 2.469 . 0.005 2 . . . . 4 MET HG2 . 11050 1
24 . 1 1 4 4 MET HG3 H 1 2.534 . 0.005 2 . . . . 4 MET HG3 . 11050 1
25 . 1 1 4 4 MET N N 15 122.534 . 0.020 1 . . . . 4 MET N . 11050 1
26 . 1 1 5 5 GLY H H 1 8.264 . 0.005 1 . . . . 5 GLY HN . 11050 1
27 . 1 1 5 5 GLY HA2 H 1 4.008 . 0.005 2 . . . . 5 GLY HA1 . 11050 1
28 . 1 1 5 5 GLY HA3 H 1 3.935 . 0.005 2 . . . . 5 GLY HA2 . 11050 1
29 . 1 1 5 5 GLY N N 15 111.280 . 0.020 1 . . . . 5 GLY N . 11050 1
30 . 1 1 6 6 SER H H 1 8.159 . 0.005 1 . . . . 6 SER HN . 11050 1
31 . 1 1 6 6 SER HA H 1 4.342 . 0.005 1 . . . . 6 SER HA . 11050 1
32 . 1 1 6 6 SER HB2 H 1 3.829 . 0.005 2 . . . . 6 SER HB2 . 11050 1
33 . 1 1 6 6 SER HB3 H 1 3.890 . 0.005 2 . . . . 6 SER HB3 . 11050 1
34 . 1 1 6 6 SER N N 15 117.242 . 0.020 1 . . . . 6 SER N . 11050 1
35 . 1 1 7 7 LYS H H 1 8.188 . 0.005 1 . . . . 7 LYS HN . 11050 1
36 . 1 1 7 7 LYS HA H 1 4.236 . 0.005 1 . . . . 7 LYS HA . 11050 1
37 . 1 1 7 7 LYS HB2 H 1 1.838 . 0.005 2 . . . . 7 LYS HB2 . 11050 1
38 . 1 1 7 7 LYS HB3 H 1 1.839 . 0.005 2 . . . . 7 LYS HB3 . 11050 1
39 . 1 1 7 7 LYS HD2 H 1 1.616 . 0.005 2 . . . . 7 LYS HD2 . 11050 1
40 . 1 1 7 7 LYS HD3 H 1 1.617 . 0.005 2 . . . . 7 LYS HD3 . 11050 1
41 . 1 1 7 7 LYS HE2 H 1 2.927 . 0.005 2 . . . . 7 LYS HE* . 11050 1
42 . 1 1 7 7 LYS HE3 H 1 2.927 . 0.005 2 . . . . 7 LYS HE* . 11050 1
43 . 1 1 7 7 LYS HG2 H 1 1.405 . 0.005 2 . . . . 7 LYS HG2 . 11050 1
44 . 1 1 7 7 LYS HG3 H 1 1.448 . 0.005 2 . . . . 7 LYS HG3 . 11050 1
45 . 1 1 7 7 LYS N N 15 123.055 . 0.020 1 . . . . 7 LYS N . 11050 1
46 . 1 1 8 8 GLY H H 1 8.049 . 0.005 1 . . . . 8 GLY HN . 11050 1
47 . 1 1 8 8 GLY HA2 H 1 3.913 . 0.005 2 . . . . 8 GLY HA1 . 11050 1
48 . 1 1 8 8 GLY HA3 H 1 3.806 . 0.005 2 . . . . 8 GLY HA2 . 11050 1
49 . 1 1 8 8 GLY N N 15 109.733 . 0.020 1 . . . . 8 GLY N . 11050 1
50 . 1 1 9 9 VAL H H 1 7.768 . 0.005 1 . . . . 9 VAL HN . 11050 1
51 . 1 1 9 9 VAL HA H 1 3.891 . 0.005 1 . . . . 9 VAL HA . 11050 1
52 . 1 1 9 9 VAL HB H 1 2.070 . 0.005 1 . . . . 9 VAL HB . 11050 1
53 . 1 1 9 9 VAL HG11 H 1 0.910 . 0.005 2 . . . . 9 VAL HG1* . 11050 1
54 . 1 1 9 9 VAL HG12 H 1 0.910 . 0.005 2 . . . . 9 VAL HG1* . 11050 1
55 . 1 1 9 9 VAL HG13 H 1 0.910 . 0.005 2 . . . . 9 VAL HG1* . 11050 1
56 . 1 1 9 9 VAL HG21 H 1 0.871 . 0.005 2 . . . . 9 VAL HG2* . 11050 1
57 . 1 1 9 9 VAL HG22 H 1 0.871 . 0.005 2 . . . . 9 VAL HG2* . 11050 1
58 . 1 1 9 9 VAL HG23 H 1 0.871 . 0.005 2 . . . . 9 VAL HG2* . 11050 1
59 . 1 1 9 9 VAL N N 15 121.474 . 0.020 1 . . . . 9 VAL N . 11050 1
60 . 1 1 10 10 THR H H 1 7.715 . 0.005 1 . . . . 10 THR HN . 11050 1
61 . 1 1 10 10 THR HA H 1 4.204 . 0.005 1 . . . . 10 THR HA . 11050 1
62 . 1 1 10 10 THR HB H 1 4.282 . 0.005 1 . . . . 10 THR HB . 11050 1
63 . 1 1 10 10 THR HG21 H 1 1.159 . 0.005 1 . . . . 10 THR HG2* . 11050 1
64 . 1 1 10 10 THR HG22 H 1 1.159 . 0.005 1 . . . . 10 THR HG2* . 11050 1
65 . 1 1 10 10 THR HG23 H 1 1.159 . 0.005 1 . . . . 10 THR HG2* . 11050 1
66 . 1 1 10 10 THR N N 15 117.703 . 0.020 1 . . . . 10 THR N . 11050 1
67 . 1 1 11 11 ALA H H 1 8.389 . 0.005 1 . . . . 11 ALA HN . 11050 1
68 . 1 1 11 11 ALA HA H 1 4.008 . 0.005 1 . . . . 11 ALA HA . 11050 1
69 . 1 1 11 11 ALA HB1 H 1 1.379 . 0.005 1 . . . . 11 ALA HB* . 11050 1
70 . 1 1 11 11 ALA HB2 H 1 1.379 . 0.005 1 . . . . 11 ALA HB* . 11050 1
71 . 1 1 11 11 ALA HB3 H 1 1.379 . 0.005 1 . . . . 11 ALA HB* . 11050 1
72 . 1 1 11 11 ALA N N 15 125.631 . 0.020 1 . . . . 11 ALA N . 11050 1
73 . 1 1 12 12 GLY H H 1 8.261 . 0.005 1 . . . . 12 GLY HN . 11050 1
74 . 1 1 12 12 GLY HA2 H 1 3.912 . 0.005 2 . . . . 12 GLY HA1 . 11050 1
75 . 1 1 12 12 GLY HA3 H 1 3.809 . 0.005 2 . . . . 12 GLY HA2 . 11050 1
76 . 1 1 12 12 GLY N N 15 107.084 . 0.020 1 . . . . 12 GLY N . 11050 1
77 . 1 1 13 13 LYS H H 1 7.878 . 0.005 1 . . . . 13 LYS HN . 11050 1
78 . 1 1 13 13 LYS HA H 1 4.051 . 0.005 1 . . . . 13 LYS HA . 11050 1
79 . 1 1 13 13 LYS HB2 H 1 1.874 . 0.005 2 . . . . 13 LYS HB2 . 11050 1
80 . 1 1 13 13 LYS HB3 H 1 1.875 . 0.005 2 . . . . 13 LYS HB3 . 11050 1
81 . 1 1 13 13 LYS HD2 H 1 1.666 . 0.005 2 . . . . 13 LYS HD2 . 11050 1
82 . 1 1 13 13 LYS HD3 H 1 1.682 . 0.005 2 . . . . 13 LYS HD3 . 11050 1
83 . 1 1 13 13 LYS HE2 H 1 2.912 . 0.005 2 . . . . 13 LYS HE* . 11050 1
84 . 1 1 13 13 LYS HE3 H 1 2.912 . 0.005 2 . . . . 13 LYS HE* . 11050 1
85 . 1 1 13 13 LYS HG2 H 1 1.365 . 0.005 2 . . . . 13 LYS HG2 . 11050 1
86 . 1 1 13 13 LYS HG3 H 1 1.477 . 0.005 2 . . . . 13 LYS HG3 . 11050 1
87 . 1 1 13 13 LYS N N 15 124.174 . 0.020 1 . . . . 13 LYS N . 11050 1
88 . 1 1 14 14 ILE H H 1 7.981 . 0.005 1 . . . . 14 ILE HN . 11050 1
89 . 1 1 14 14 ILE HA H 1 3.739 . 0.005 1 . . . . 14 ILE HA . 11050 1
90 . 1 1 14 14 ILE HB H 1 1.950 . 0.005 1 . . . . 14 ILE HB . 11050 1
91 . 1 1 14 14 ILE HD11 H 1 0.796 . 0.005 1 . . . . 14 ILE HD1* . 11050 1
92 . 1 1 14 14 ILE HD12 H 1 0.796 . 0.005 1 . . . . 14 ILE HD1* . 11050 1
93 . 1 1 14 14 ILE HD13 H 1 0.796 . 0.005 1 . . . . 14 ILE HD1* . 11050 1
94 . 1 1 14 14 ILE HG12 H 1 1.124 . 0.005 2 . . . . 14 ILE HG12 . 11050 1
95 . 1 1 14 14 ILE HG13 H 1 1.125 . 0.005 2 . . . . 14 ILE HG13 . 11050 1
96 . 1 1 14 14 ILE HG21 H 1 0.823 . 0.005 1 . . . . 14 ILE HG2* . 11050 1
97 . 1 1 14 14 ILE HG22 H 1 0.823 . 0.005 1 . . . . 14 ILE HG2* . 11050 1
98 . 1 1 14 14 ILE HG23 H 1 0.823 . 0.005 1 . . . . 14 ILE HG2* . 11050 1
99 . 1 1 14 14 ILE N N 15 121.478 . 0.020 1 . . . . 14 ILE N . 11050 1
100 . 1 1 15 15 ALA H H 1 8.445 . 0.005 1 . . . . 15 ALA HN . 11050 1
101 . 1 1 15 15 ALA HA H 1 3.846 . 0.005 1 . . . . 15 ALA HA . 11050 1
102 . 1 1 15 15 ALA HB1 H 1 1.412 . 0.005 1 . . . . 15 ALA HB* . 11050 1
103 . 1 1 15 15 ALA HB2 H 1 1.412 . 0.005 1 . . . . 15 ALA HB* . 11050 1
104 . 1 1 15 15 ALA HB3 H 1 1.412 . 0.005 1 . . . . 15 ALA HB* . 11050 1
105 . 1 1 15 15 ALA N N 15 123.052 . 0.020 1 . . . . 15 ALA N . 11050 1
106 . 1 1 16 16 SER H H 1 8.011 . 0.005 1 . . . . 16 SER HN . 11050 1
107 . 1 1 16 16 SER HA H 1 4.185 . 0.005 1 . . . . 16 SER HA . 11050 1
108 . 1 1 16 16 SER HB2 H 1 3.904 . 0.005 2 . . . . 16 SER HB2 . 11050 1
109 . 1 1 16 16 SER HB3 H 1 3.905 . 0.005 2 . . . . 16 SER HB3 . 11050 1
110 . 1 1 16 16 SER N N 15 112.930 . 0.020 1 . . . . 16 SER N . 11050 1
111 . 1 1 17 17 ASN H H 1 7.851 . 0.005 1 . . . . 17 ASN HN . 11050 1
112 . 1 1 17 17 ASN HA H 1 4.489 . 0.005 1 . . . . 17 ASN HA . 11050 1
113 . 1 1 17 17 ASN HB2 H 1 2.777 . 0.005 2 . . . . 17 ASN HB2 . 11050 1
114 . 1 1 17 17 ASN HB3 H 1 2.944 . 0.005 2 . . . . 17 ASN HB3 . 11050 1
115 . 1 1 17 17 ASN HD21 H 1 7.509 . 0.005 2 . . . . 17 ASN HD21 . 11050 1
116 . 1 1 17 17 ASN HD22 H 1 6.857 . 0.005 2 . . . . 17 ASN HD22 . 11050 1
117 . 1 1 17 17 ASN N N 15 122.427 . 0.020 1 . . . . 17 ASN N . 11050 1
118 . 1 1 17 17 ASN ND2 N 15 114.308 . 0.020 1 . . . . 17 ASN ND2 . 11050 1
119 . 1 1 18 18 VAL H H 1 8.433 . 0.005 1 . . . . 18 VAL HN . 11050 1
120 . 1 1 18 18 VAL HA H 1 3.564 . 0.005 1 . . . . 18 VAL HA . 11050 1
121 . 1 1 18 18 VAL HB H 1 2.177 . 0.005 1 . . . . 18 VAL HB . 11050 1
122 . 1 1 18 18 VAL HG11 H 1 0.992 . 0.005 2 . . . . 18 VAL HG1* . 11050 1
123 . 1 1 18 18 VAL HG12 H 1 0.992 . 0.005 2 . . . . 18 VAL HG1* . 11050 1
124 . 1 1 18 18 VAL HG13 H 1 0.992 . 0.005 2 . . . . 18 VAL HG1* . 11050 1
125 . 1 1 18 18 VAL HG21 H 1 0.868 . 0.005 2 . . . . 18 VAL HG2* . 11050 1
126 . 1 1 18 18 VAL HG22 H 1 0.868 . 0.005 2 . . . . 18 VAL HG2* . 11050 1
127 . 1 1 18 18 VAL HG23 H 1 0.868 . 0.005 2 . . . . 18 VAL HG2* . 11050 1
128 . 1 1 18 18 VAL N N 15 121.996 . 0.020 1 . . . . 18 VAL N . 11050 1
129 . 1 1 19 19 GLN H H 1 8.360 . 0.005 1 . . . . 19 GLN HN . 11050 1
130 . 1 1 19 19 GLN HA H 1 3.842 . 0.005 1 . . . . 19 GLN HA . 11050 1
131 . 1 1 19 19 GLN HB2 H 1 2.194 . 0.005 2 . . . . 19 GLN HB2 . 11050 1
132 . 1 1 19 19 GLN HB3 H 1 2.092 . 0.005 2 . . . . 19 GLN HB3 . 11050 1
133 . 1 1 19 19 GLN HE21 H 1 7.163 . 0.005 2 . . . . 19 GLN HE21 . 11050 1
134 . 1 1 19 19 GLN HE22 H 1 6.611 . 0.005 2 . . . . 19 GLN HE22 . 11050 1
135 . 1 1 19 19 GLN HG2 H 1 2.261 . 0.005 2 . . . . 19 GLN HG2 . 11050 1
136 . 1 1 19 19 GLN HG3 H 1 2.425 . 0.005 2 . . . . 19 GLN HG3 . 11050 1
137 . 1 1 19 19 GLN N N 15 121.013 . 0.020 1 . . . . 19 GLN N . 11050 1
138 . 1 1 19 19 GLN NE2 N 15 112.333 . 0.020 1 . . . . 19 GLN NE2 . 11050 1
139 . 1 1 20 20 LYS H H 1 7.664 . 0.005 1 . . . . 20 LYS HN . 11050 1
140 . 1 1 20 20 LYS HA H 1 4.003 . 0.005 1 . . . . 20 LYS HA . 11050 1
141 . 1 1 20 20 LYS HB2 H 1 1.900 . 0.005 2 . . . . 20 LYS HB2 . 11050 1
142 . 1 1 20 20 LYS HB3 H 1 1.905 . 0.005 2 . . . . 20 LYS HB3 . 11050 1
143 . 1 1 20 20 LYS HD2 H 1 1.624 . 0.005 2 . . . . 20 LYS HD2 . 11050 1
144 . 1 1 20 20 LYS HD3 H 1 1.625 . 0.005 2 . . . . 20 LYS HD3 . 11050 1
145 . 1 1 20 20 LYS HE2 H 1 2.903 . 0.005 2 . . . . 20 LYS HE* . 11050 1
146 . 1 1 20 20 LYS HE3 H 1 2.903 . 0.005 2 . . . . 20 LYS HE* . 11050 1
147 . 1 1 20 20 LYS HG2 H 1 1.426 . 0.005 2 . . . . 20 LYS HG2 . 11050 1
148 . 1 1 20 20 LYS HG3 H 1 1.427 . 0.005 2 . . . . 20 LYS HG3 . 11050 1
149 . 1 1 20 20 LYS N N 15 119.657 . 0.020 1 . . . . 20 LYS N . 11050 1
150 . 1 1 21 21 LYS H H 1 7.712 . 0.005 1 . . . . 21 LYS HN . 11050 1
151 . 1 1 21 21 LYS HA H 1 4.135 . 0.005 1 . . . . 21 LYS HA . 11050 1
152 . 1 1 21 21 LYS HB2 H 1 1.814 . 0.005 2 . . . . 21 LYS HB2 . 11050 1
153 . 1 1 21 21 LYS HB3 H 1 1.911 . 0.005 2 . . . . 21 LYS HB3 . 11050 1
154 . 1 1 21 21 LYS HD2 H 1 1.577 . 0.005 2 . . . . 21 LYS HD2 . 11050 1
155 . 1 1 21 21 LYS HD3 H 1 1.578 . 0.005 2 . . . . 21 LYS HD3 . 11050 1
156 . 1 1 21 21 LYS HE2 H 1 2.935 . 0.005 2 . . . . 21 LYS HE* . 11050 1
157 . 1 1 21 21 LYS HE3 H 1 2.935 . 0.005 2 . . . . 21 LYS HE* . 11050 1
158 . 1 1 21 21 LYS HG2 H 1 1.484 . 0.005 2 . . . . 21 LYS HG2 . 11050 1
159 . 1 1 21 21 LYS HG3 H 1 1.485 . 0.005 2 . . . . 21 LYS HG3 . 11050 1
160 . 1 1 21 21 LYS N N 15 120.661 . 0.020 1 . . . . 21 LYS N . 11050 1
161 . 1 1 22 22 LEU H H 1 8.192 . 0.005 1 . . . . 22 LEU HN . 11050 1
162 . 1 1 22 22 LEU HA H 1 4.182 . 0.005 1 . . . . 22 LEU HA . 11050 1
163 . 1 1 22 22 LEU HB2 H 1 1.792 . 0.005 2 . . . . 22 LEU HB2 . 11050 1
164 . 1 1 22 22 LEU HB3 H 1 1.793 . 0.005 2 . . . . 22 LEU HB3 . 11050 1
165 . 1 1 22 22 LEU HD11 H 1 0.786 . 0.005 2 . . . . 22 LEU HD1* . 11050 1
166 . 1 1 22 22 LEU HD12 H 1 0.786 . 0.005 2 . . . . 22 LEU HD1* . 11050 1
167 . 1 1 22 22 LEU HD13 H 1 0.786 . 0.005 2 . . . . 22 LEU HD1* . 11050 1
168 . 1 1 22 22 LEU HD21 H 1 0.785 . 0.005 2 . . . . 22 LEU HD2* . 11050 1
169 . 1 1 22 22 LEU HD22 H 1 0.785 . 0.005 2 . . . . 22 LEU HD2* . 11050 1
170 . 1 1 22 22 LEU HD23 H 1 0.785 . 0.005 2 . . . . 22 LEU HD2* . 11050 1
171 . 1 1 22 22 LEU HG H 1 1.556 . 0.005 1 . . . . 22 LEU HG . 11050 1
172 . 1 1 22 22 LEU N N 15 120.581 . 0.020 1 . . . . 22 LEU N . 11050 1
173 . 1 1 23 23 THR H H 1 7.990 . 0.005 1 . . . . 23 THR HN . 11050 1
174 . 1 1 23 23 THR HA H 1 4.045 . 0.005 1 . . . . 23 THR HA . 11050 1
175 . 1 1 23 23 THR HB H 1 4.195 . 0.005 1 . . . . 23 THR HB . 11050 1
176 . 1 1 23 23 THR HG21 H 1 1.208 . 0.005 1 . . . . 23 THR HG2* . 11050 1
177 . 1 1 23 23 THR HG22 H 1 1.208 . 0.005 1 . . . . 23 THR HG2* . 11050 1
178 . 1 1 23 23 THR HG23 H 1 1.208 . 0.005 1 . . . . 23 THR HG2* . 11050 1
179 . 1 1 23 23 THR N N 15 115.621 . 0.020 1 . . . . 23 THR N . 11050 1
180 . 1 1 24 24 ARG H H 1 7.799 . 0.005 1 . . . . 24 ARG HN . 11050 1
181 . 1 1 24 24 ARG HA H 1 4.078 . 0.005 1 . . . . 24 ARG HA . 11050 1
182 . 1 1 24 24 ARG HB2 H 1 1.906 . 0.005 2 . . . . 24 ARG HB2 . 11050 1
183 . 1 1 24 24 ARG HB3 H 1 1.907 . 0.005 2 . . . . 24 ARG HB3 . 11050 1
184 . 1 1 24 24 ARG HD2 H 1 3.168 . 0.005 2 . . . . 24 ARG HD2 . 11050 1
185 . 1 1 24 24 ARG HD3 H 1 3.169 . 0.005 2 . . . . 24 ARG HD3 . 11050 1
186 . 1 1 24 24 ARG HE H 1 7.085 . 0.005 1 . . . . 24 ARG HE . 11050 1
187 . 1 1 24 24 ARG HG2 H 1 1.608 . 0.005 2 . . . . 24 ARG HG2 . 11050 1
188 . 1 1 24 24 ARG HG3 H 1 1.716 . 0.005 2 . . . . 24 ARG HG3 . 11050 1
189 . 1 1 24 24 ARG N N 15 123.192 . 0.020 1 . . . . 24 ARG N . 11050 1
190 . 1 1 24 24 ARG NE N 15 109.031 . 0.020 1 . . . . 24 ARG NE . 11050 1
191 . 1 1 25 25 ALA H H 1 8.080 . 0.005 1 . . . . 25 ALA HN . 11050 1
192 . 1 1 25 25 ALA HA H 1 4.023 . 0.005 1 . . . . 25 ALA HA . 11050 1
193 . 1 1 25 25 ALA HB1 H 1 1.426 . 0.005 1 . . . . 25 ALA HB* . 11050 1
194 . 1 1 25 25 ALA HB2 H 1 1.426 . 0.005 1 . . . . 25 ALA HB* . 11050 1
195 . 1 1 25 25 ALA HB3 H 1 1.426 . 0.005 1 . . . . 25 ALA HB* . 11050 1
196 . 1 1 25 25 ALA N N 15 123.717 . 0.020 1 . . . . 25 ALA N . 11050 1
197 . 1 1 26 26 GLN H H 1 8.317 . 0.005 1 . . . . 26 GLN HN . 11050 1
198 . 1 1 26 26 GLN HA H 1 3.841 . 0.005 1 . . . . 26 GLN HA . 11050 1
199 . 1 1 26 26 GLN HB2 H 1 2.086 . 0.005 2 . . . . 26 GLN HB2 . 11050 1
200 . 1 1 26 26 GLN HB3 H 1 2.217 . 0.005 2 . . . . 26 GLN HB3 . 11050 1
201 . 1 1 26 26 GLN HE21 H 1 6.876 . 0.005 2 . . . . 26 GLN HE21 . 11050 1
202 . 1 1 26 26 GLN HE22 H 1 6.666 . 0.005 2 . . . . 26 GLN HE22 . 11050 1
203 . 1 1 26 26 GLN HG2 H 1 2.217 . 0.005 2 . . . . 26 GLN HG2 . 11050 1
204 . 1 1 26 26 GLN HG3 H 1 2.324 . 0.005 2 . . . . 26 GLN HG3 . 11050 1
205 . 1 1 26 26 GLN N N 15 118.677 . 0.020 1 . . . . 26 GLN N . 11050 1
206 . 1 1 26 26 GLN NE2 N 15 111.262 . 0.020 1 . . . . 26 GLN NE2 . 11050 1
207 . 1 1 27 27 GLU H H 1 7.913 . 0.005 1 . . . . 27 GLU HN . 11050 1
208 . 1 1 27 27 GLU HA H 1 4.004 . 0.005 1 . . . . 27 GLU HA . 11050 1
209 . 1 1 27 27 GLU HB2 H 1 2.079 . 0.005 2 . . . . 27 GLU HB2 . 11050 1
210 . 1 1 27 27 GLU HB3 H 1 2.153 . 0.005 2 . . . . 27 GLU HB3 . 11050 1
211 . 1 1 27 27 GLU HG2 H 1 2.455 . 0.005 2 . . . . 27 GLU HG2 . 11050 1
212 . 1 1 27 27 GLU HG3 H 1 2.576 . 0.005 2 . . . . 27 GLU HG3 . 11050 1
213 . 1 1 27 27 GLU N N 15 118.496 . 0.020 1 . . . . 27 GLU N . 11050 1
214 . 1 1 28 28 LYS H H 1 7.857 . 0.005 1 . . . . 28 LYS HN . 11050 1
215 . 1 1 28 28 LYS HA H 1 4.068 . 0.005 1 . . . . 28 LYS HA . 11050 1
216 . 1 1 28 28 LYS HB2 H 1 1.839 . 0.005 2 . . . . 28 LYS HB2 . 11050 1
217 . 1 1 28 28 LYS HB3 H 1 1.895 . 0.005 2 . . . . 28 LYS HB3 . 11050 1
218 . 1 1 28 28 LYS HD2 H 1 1.642 . 0.005 2 . . . . 28 LYS HD2 . 11050 1
219 . 1 1 28 28 LYS HD3 H 1 1.643 . 0.005 2 . . . . 28 LYS HD3 . 11050 1
220 . 1 1 28 28 LYS HE2 H 1 2.896 . 0.005 2 . . . . 28 LYS HE* . 11050 1
221 . 1 1 28 28 LYS HE3 H 1 2.896 . 0.005 2 . . . . 28 LYS HE* . 11050 1
222 . 1 1 28 28 LYS HG2 H 1 1.433 . 0.005 2 . . . . 28 LYS HG2 . 11050 1
223 . 1 1 28 28 LYS HG3 H 1 1.434 . 0.005 2 . . . . 28 LYS HG3 . 11050 1
224 . 1 1 28 28 LYS N N 15 120.774 . 0.020 1 . . . . 28 LYS N . 11050 1
225 . 1 1 29 29 VAL H H 1 8.035 . 0.005 1 . . . . 29 VAL HN . 11050 1
226 . 1 1 29 29 VAL HA H 1 3.597 . 0.005 1 . . . . 29 VAL HA . 11050 1
227 . 1 1 29 29 VAL HB H 1 2.138 . 0.005 1 . . . . 29 VAL HB . 11050 1
228 . 1 1 29 29 VAL HG11 H 1 0.986 . 0.005 2 . . . . 29 VAL HG1* . 11050 1
229 . 1 1 29 29 VAL HG12 H 1 0.986 . 0.005 2 . . . . 29 VAL HG1* . 11050 1
230 . 1 1 29 29 VAL HG13 H 1 0.986 . 0.005 2 . . . . 29 VAL HG1* . 11050 1
231 . 1 1 29 29 VAL HG21 H 1 0.880 . 0.005 2 . . . . 29 VAL HG2* . 11050 1
232 . 1 1 29 29 VAL HG22 H 1 0.880 . 0.005 2 . . . . 29 VAL HG2* . 11050 1
233 . 1 1 29 29 VAL HG23 H 1 0.880 . 0.005 2 . . . . 29 VAL HG2* . 11050 1
234 . 1 1 29 29 VAL N N 15 120.353 . 0.020 1 . . . . 29 VAL N . 11050 1
235 . 1 1 30 30 LEU H H 1 8.105 . 0.005 1 . . . . 30 LEU HN . 11050 1
236 . 1 1 30 30 LEU HA H 1 4.011 . 0.005 1 . . . . 30 LEU HA . 11050 1
237 . 1 1 30 30 LEU HB2 H 1 1.794 . 0.005 2 . . . . 30 LEU HB2 . 11050 1
238 . 1 1 30 30 LEU HB3 H 1 1.795 . 0.005 2 . . . . 30 LEU HB3 . 11050 1
239 . 1 1 30 30 LEU HD11 H 1 0.875 . 0.005 2 . . . . 30 LEU HD1* . 11050 1
240 . 1 1 30 30 LEU HD12 H 1 0.875 . 0.005 2 . . . . 30 LEU HD1* . 11050 1
241 . 1 1 30 30 LEU HD13 H 1 0.875 . 0.005 2 . . . . 30 LEU HD1* . 11050 1
242 . 1 1 30 30 LEU HD21 H 1 0.845 . 0.005 2 . . . . 30 LEU HD2* . 11050 1
243 . 1 1 30 30 LEU HD22 H 1 0.845 . 0.005 2 . . . . 30 LEU HD2* . 11050 1
244 . 1 1 30 30 LEU HD23 H 1 0.845 . 0.005 2 . . . . 30 LEU HD2* . 11050 1
245 . 1 1 30 30 LEU HG H 1 1.522 . 0.005 1 . . . . 30 LEU HG . 11050 1
246 . 1 1 30 30 LEU N N 15 120.674 . 0.020 1 . . . . 30 LEU N . 11050 1
247 . 1 1 31 31 GLN H H 1 7.741 . 0.005 1 . . . . 31 GLN HN . 11050 1
248 . 1 1 31 31 GLN HA H 1 4.007 . 0.005 1 . . . . 31 GLN HA . 11050 1
249 . 1 1 31 31 GLN HB2 H 1 2.089 . 0.005 2 . . . . 31 GLN HB2 . 11050 1
250 . 1 1 31 31 GLN HB3 H 1 2.090 . 0.005 2 . . . . 31 GLN HB3 . 11050 1
251 . 1 1 31 31 GLN HE21 H 1 7.381 . 0.005 2 . . . . 31 GLN HE21 . 11050 1
252 . 1 1 31 31 GLN HE22 H 1 6.764 . 0.005 2 . . . . 31 GLN HE22 . 11050 1
253 . 1 1 31 31 GLN HG2 H 1 2.358 . 0.005 2 . . . . 31 GLN HG2 . 11050 1
254 . 1 1 31 31 GLN HG3 H 1 2.472 . 0.005 2 . . . . 31 GLN HG3 . 11050 1
255 . 1 1 31 31 GLN N N 15 117.642 . 0.020 1 . . . . 31 GLN N . 11050 1
256 . 1 1 31 31 GLN NE2 N 15 113.425 . 0.020 1 . . . . 31 GLN NE2 . 11050 1
257 . 1 1 32 32 LYS H H 1 7.581 . 0.005 1 . . . . 32 LYS HN . 11050 1
258 . 1 1 32 32 LYS HA H 1 4.176 . 0.005 1 . . . . 32 LYS HA . 11050 1
259 . 1 1 32 32 LYS HB2 H 1 1.863 . 0.005 2 . . . . 32 LYS HB2 . 11050 1
260 . 1 1 32 32 LYS HB3 H 1 1.864 . 0.005 2 . . . . 32 LYS HB3 . 11050 1
261 . 1 1 32 32 LYS HD2 H 1 1.641 . 0.005 2 . . . . 32 LYS HD2 . 11050 1
262 . 1 1 32 32 LYS HD3 H 1 1.642 . 0.005 2 . . . . 32 LYS HD3 . 11050 1
263 . 1 1 32 32 LYS HE2 H 1 2.895 . 0.005 2 . . . . 32 LYS HE* . 11050 1
264 . 1 1 32 32 LYS HE3 H 1 2.895 . 0.005 2 . . . . 32 LYS HE* . 11050 1
265 . 1 1 32 32 LYS HG2 H 1 1.407 . 0.005 2 . . . . 32 LYS HG2 . 11050 1
266 . 1 1 32 32 LYS HG3 H 1 1.408 . 0.005 2 . . . . 32 LYS HG3 . 11050 1
267 . 1 1 32 32 LYS N N 15 119.328 . 0.020 1 . . . . 32 LYS N . 11050 1
268 . 1 1 33 33 LEU H H 1 7.780 . 0.005 1 . . . . 33 LEU HN . 11050 1
269 . 1 1 33 33 LEU HA H 1 4.112 . 0.005 1 . . . . 33 LEU HA . 11050 1
270 . 1 1 33 33 LEU HB2 H 1 1.541 . 0.005 2 . . . . 33 LEU HB2 . 11050 1
271 . 1 1 33 33 LEU HB3 H 1 1.560 . 0.005 2 . . . . 33 LEU HB3 . 11050 1
272 . 1 1 33 33 LEU HD11 H 1 0.779 . 0.005 2 . . . . 33 LEU HD1* . 11050 1
273 . 1 1 33 33 LEU HD12 H 1 0.779 . 0.005 2 . . . . 33 LEU HD1* . 11050 1
274 . 1 1 33 33 LEU HD13 H 1 0.779 . 0.005 2 . . . . 33 LEU HD1* . 11050 1
275 . 1 1 33 33 LEU HD21 H 1 0.741 . 0.005 2 . . . . 33 LEU HD2* . 11050 1
276 . 1 1 33 33 LEU HD22 H 1 0.741 . 0.005 2 . . . . 33 LEU HD2* . 11050 1
277 . 1 1 33 33 LEU HD23 H 1 0.741 . 0.005 2 . . . . 33 LEU HD2* . 11050 1
278 . 1 1 33 33 LEU HG H 1 1.264 . 0.005 1 . . . . 33 LEU HG . 11050 1
279 . 1 1 33 33 LEU N N 15 119.522 . 0.020 1 . . . . 33 LEU N . 11050 1
280 . 1 1 34 34 TYR H H 1 7.600 . 0.005 1 . . . . 34 TYR HN . 11050 1
281 . 1 1 34 34 TYR HA H 1 4.581 . 0.005 1 . . . . 34 TYR HA . 11050 1
282 . 1 1 34 34 TYR HB2 H 1 2.881 . 0.005 2 . . . . 34 TYR HB2 . 11050 1
283 . 1 1 34 34 TYR HB3 H 1 3.068 . 0.005 2 . . . . 34 TYR HB3 . 11050 1
284 . 1 1 34 34 TYR HD1 H 1 7.048 . 0.005 3 . . . . 34 TYR HD* . 11050 1
285 . 1 1 34 34 TYR HD2 H 1 7.048 . 0.005 3 . . . . 34 TYR HD* . 11050 1
286 . 1 1 34 34 TYR HE1 H 1 6.705 . 0.005 3 . . . . 34 TYR HE* . 11050 1
287 . 1 1 34 34 TYR HE2 H 1 6.705 . 0.005 3 . . . . 34 TYR HE* . 11050 1
288 . 1 1 34 34 TYR N N 15 119.400 . 0.020 1 . . . . 34 TYR N . 11050 1
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