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 34027
_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 NOESY . . . 34027 1
2 '2D 1H-1H TOCSY' . . . 34027 1
3 '3D 1H-15N NOESY' . . . 34027 1
4 '3D 1H-15N TOCSY' . . . 34027 1
5 '2D 1H-15N HSQC' . . . 34027 1
6 '2D 1H-13C HSQC' . . . 34027 1
7 '2D DQF-COSY' . . . 34027 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 3 3 ASP H H 1 8.460 0.020 . 1 . . . . A 3 ASP H . 34027 1
2 . 1 . 1 3 3 ASP HA H 1 4.683 0.020 . 1 . . . . A 3 ASP HA . 34027 1
3 . 1 . 1 3 3 ASP HB2 H 1 2.842 0.020 . 2 . . . . A 3 ASP HB2 . 34027 1
4 . 1 . 1 3 3 ASP HB3 H 1 2.722 0.020 . 2 . . . . A 3 ASP HB3 . 34027 1
5 . 1 . 1 3 3 ASP N N 15 122.927 0.400 . 1 . . . . A 3 ASP N . 34027 1
6 . 1 . 1 4 4 ARG H H 1 8.409 0.020 . 1 . . . . A 4 ARG H . 34027 1
7 . 1 . 1 4 4 ARG HA H 1 3.986 0.020 . 1 . . . . A 4 ARG HA . 34027 1
8 . 1 . 1 4 4 ARG HB2 H 1 1.935 0.020 . 2 . . . . A 4 ARG HB2 . 34027 1
9 . 1 . 1 4 4 ARG HB3 H 1 1.864 0.020 . 2 . . . . A 4 ARG HB3 . 34027 1
10 . 1 . 1 4 4 ARG HG2 H 1 1.716 0.020 . 2 . . . . A 4 ARG HG2 . 34027 1
11 . 1 . 1 4 4 ARG HG3 H 1 1.638 0.020 . 2 . . . . A 4 ARG HG3 . 34027 1
12 . 1 . 1 4 4 ARG HD2 H 1 3.200 0.020 . 2 . . . . A 4 ARG HD2 . 34027 1
13 . 1 . 1 4 4 ARG HD3 H 1 3.200 0.020 . 2 . . . . A 4 ARG HD3 . 34027 1
14 . 1 . 1 4 4 ARG HE H 1 7.469 0.020 . 1 . . . . A 4 ARG HE . 34027 1
15 . 1 . 1 4 4 ARG N N 15 120.908 0.400 . 1 . . . . A 4 ARG N . 34027 1
16 . 1 . 1 4 4 ARG NE N 15 84.739 0.400 . 1 . . . . A 4 ARG NE . 34027 1
17 . 1 . 1 5 5 CYS H H 1 8.383 0.020 . 1 . . . . A 5 CYS H . 34027 1
18 . 1 . 1 5 5 CYS HA H 1 4.373 0.020 . 1 . . . . A 5 CYS HA . 34027 1
19 . 1 . 1 5 5 CYS HB2 H 1 3.105 0.020 . 2 . . . . A 5 CYS HB2 . 34027 1
20 . 1 . 1 5 5 CYS HB3 H 1 3.105 0.020 . 2 . . . . A 5 CYS HB3 . 34027 1
21 . 1 . 1 5 5 CYS N N 15 118.903 0.400 . 1 . . . . A 5 CYS N . 34027 1
22 . 1 . 1 6 6 TYR H H 1 7.941 0.020 . 1 . . . . A 6 TYR H . 34027 1
23 . 1 . 1 6 6 TYR HA H 1 4.056 0.020 . 1 . . . . A 6 TYR HA . 34027 1
24 . 1 . 1 6 6 TYR HB2 H 1 3.105 0.020 . 2 . . . . A 6 TYR HB2 . 34027 1
25 . 1 . 1 6 6 TYR HB3 H 1 3.105 0.020 . 2 . . . . A 6 TYR HB3 . 34027 1
26 . 1 . 1 6 6 TYR HD1 H 1 7.101 0.020 . 1 . . . . A 6 TYR HD1 . 34027 1
27 . 1 . 1 6 6 TYR HD2 H 1 7.101 0.020 . 1 . . . . A 6 TYR HD2 . 34027 1
28 . 1 . 1 6 6 TYR HE1 H 1 6.837 0.020 . 1 . . . . A 6 TYR HE1 . 34027 1
29 . 1 . 1 6 6 TYR HE2 H 1 6.837 0.020 . 1 . . . . A 6 TYR HE2 . 34027 1
30 . 1 . 1 6 6 TYR CD1 C 13 132.117 0.400 . 3 . . . . A 6 TYR CD1 . 34027 1
31 . 1 . 1 6 6 TYR CE1 C 13 117.739 0.400 . 3 . . . . A 6 TYR CE1 . 34027 1
32 . 1 . 1 6 6 TYR N N 15 119.354 0.400 . 1 . . . . A 6 TYR N . 34027 1
33 . 1 . 1 7 7 ARG H H 1 8.222 0.020 . 1 . . . . A 7 ARG H . 34027 1
34 . 1 . 1 7 7 ARG HA H 1 4.012 0.020 . 1 . . . . A 7 ARG HA . 34027 1
35 . 1 . 1 7 7 ARG HB2 H 1 1.946 0.020 . 2 . . . . A 7 ARG HB2 . 34027 1
36 . 1 . 1 7 7 ARG HB3 H 1 1.880 0.020 . 2 . . . . A 7 ARG HB3 . 34027 1
37 . 1 . 1 7 7 ARG HG2 H 1 1.673 0.020 . 2 . . . . A 7 ARG HG2 . 34027 1
38 . 1 . 1 7 7 ARG HG3 H 1 1.804 0.020 . 2 . . . . A 7 ARG HG3 . 34027 1
39 . 1 . 1 7 7 ARG HD2 H 1 3.179 0.020 . 2 . . . . A 7 ARG HD2 . 34027 1
40 . 1 . 1 7 7 ARG HD3 H 1 3.244 0.020 . 2 . . . . A 7 ARG HD3 . 34027 1
41 . 1 . 1 7 7 ARG HE H 1 7.441 0.020 . 1 . . . . A 7 ARG HE . 34027 1
42 . 1 . 1 7 7 ARG N N 15 118.475 0.400 . 1 . . . . A 7 ARG N . 34027 1
43 . 1 . 1 7 7 ARG NE N 15 84.759 0.400 . 1 . . . . A 7 ARG NE . 34027 1
44 . 1 . 1 8 8 MET H H 1 8.128 0.020 . 1 . . . . A 8 MET H . 34027 1
45 . 1 . 1 8 8 MET HA H 1 4.273 0.020 . 1 . . . . A 8 MET HA . 34027 1
46 . 1 . 1 8 8 MET HB2 H 1 2.313 0.020 . 2 . . . . A 8 MET HB2 . 34027 1
47 . 1 . 1 8 8 MET HB3 H 1 2.266 0.020 . 2 . . . . A 8 MET HB3 . 34027 1
48 . 1 . 1 8 8 MET HG2 H 1 2.627 0.020 . 2 . . . . A 8 MET HG2 . 34027 1
49 . 1 . 1 8 8 MET HG3 H 1 2.750 0.020 . 2 . . . . A 8 MET HG3 . 34027 1
50 . 1 . 1 8 8 MET N N 15 118.925 0.400 . 1 . . . . A 8 MET N . 34027 1
51 . 1 . 1 9 9 CYS H H 1 7.873 0.020 . 1 . . . . A 9 CYS H . 34027 1
52 . 1 . 1 9 9 CYS HA H 1 4.941 0.020 . 1 . . . . A 9 CYS HA . 34027 1
53 . 1 . 1 9 9 CYS HB2 H 1 3.330 0.020 . 2 . . . . A 9 CYS HB2 . 34027 1
54 . 1 . 1 9 9 CYS HB3 H 1 3.007 0.020 . 2 . . . . A 9 CYS HB3 . 34027 1
55 . 1 . 1 9 9 CYS N N 15 115.894 0.400 . 1 . . . . A 9 CYS N . 34027 1
56 . 1 . 1 10 10 GLN H H 1 7.658 0.020 . 1 . . . . A 10 GLN H . 34027 1
57 . 1 . 1 10 10 GLN HA H 1 4.056 0.020 . 1 . . . . A 10 GLN HA . 34027 1
58 . 1 . 1 10 10 GLN HB2 H 1 2.099 0.020 . 2 . . . . A 10 GLN HB2 . 34027 1
59 . 1 . 1 10 10 GLN HB3 H 1 2.099 0.020 . 2 . . . . A 10 GLN HB3 . 34027 1
60 . 1 . 1 10 10 GLN HG2 H 1 2.416 0.020 . 2 . . . . A 10 GLN HG2 . 34027 1
61 . 1 . 1 10 10 GLN HG3 H 1 2.416 0.020 . 2 . . . . A 10 GLN HG3 . 34027 1
62 . 1 . 1 10 10 GLN HE21 H 1 7.327 0.020 . 2 . . . . A 10 GLN HE21 . 34027 1
63 . 1 . 1 10 10 GLN HE22 H 1 6.894 0.020 . 2 . . . . A 10 GLN HE22 . 34027 1
64 . 1 . 1 10 10 GLN N N 15 118.095 0.400 . 1 . . . . A 10 GLN N . 34027 1
65 . 1 . 1 10 10 GLN NE2 N 15 111.561 0.400 . 1 . . . . A 10 GLN NE2 . 34027 1
66 . 1 . 1 11 11 ARG H H 1 7.403 0.020 . 1 . . . . A 11 ARG H . 34027 1
67 . 1 . 1 11 11 ARG HA H 1 4.078 0.020 . 1 . . . . A 11 ARG HA . 34027 1
68 . 1 . 1 11 11 ARG HB2 H 1 1.673 0.020 . 2 . . . . A 11 ARG HB2 . 34027 1
69 . 1 . 1 11 11 ARG HB3 H 1 1.618 0.020 . 2 . . . . A 11 ARG HB3 . 34027 1
70 . 1 . 1 11 11 ARG HG2 H 1 0.875 0.020 . 2 . . . . A 11 ARG HG2 . 34027 1
71 . 1 . 1 11 11 ARG HG3 H 1 1.356 0.020 . 2 . . . . A 11 ARG HG3 . 34027 1
72 . 1 . 1 11 11 ARG HD2 H 1 3.006 0.020 . 2 . . . . A 11 ARG HD2 . 34027 1
73 . 1 . 1 11 11 ARG HD3 H 1 3.006 0.020 . 2 . . . . A 11 ARG HD3 . 34027 1
74 . 1 . 1 11 11 ARG HE H 1 6.933 0.020 . 1 . . . . A 11 ARG HE . 34027 1
75 . 1 . 1 11 11 ARG N N 15 115.466 0.400 . 1 . . . . A 11 ARG N . 34027 1
76 . 1 . 1 11 11 ARG NE N 15 84.715 0.400 . 1 . . . . A 11 ARG NE . 34027 1
77 . 1 . 1 12 12 TYR H H 1 7.276 0.020 . 1 . . . . A 12 TYR H . 34027 1
78 . 1 . 1 12 12 TYR HA H 1 4.471 0.020 . 1 . . . . A 12 TYR HA . 34027 1
79 . 1 . 1 12 12 TYR HB2 H 1 3.033 0.020 . 2 . . . . A 12 TYR HB2 . 34027 1
80 . 1 . 1 12 12 TYR HB3 H 1 2.766 0.020 . 2 . . . . A 12 TYR HB3 . 34027 1
81 . 1 . 1 12 12 TYR HD1 H 1 7.273 0.020 . 1 . . . . A 12 TYR HD1 . 34027 1
82 . 1 . 1 12 12 TYR HD2 H 1 7.273 0.020 . 1 . . . . A 12 TYR HD2 . 34027 1
83 . 1 . 1 12 12 TYR HE1 H 1 6.898 0.020 . 1 . . . . A 12 TYR HE1 . 34027 1
84 . 1 . 1 12 12 TYR HE2 H 1 6.898 0.020 . 1 . . . . A 12 TYR HE2 . 34027 1
85 . 1 . 1 12 12 TYR CD1 C 13 132.425 0.400 . 3 . . . . A 12 TYR CD1 . 34027 1
86 . 1 . 1 12 12 TYR CE1 C 13 117.566 0.400 . 3 . . . . A 12 TYR CE1 . 34027 1
87 . 1 . 1 12 12 TYR N N 15 119.284 0.400 . 1 . . . . A 12 TYR N . 34027 1
88 . 1 . 1 13 13 HIS H H 1 8.536 0.020 . 1 . . . . A 13 HIS H . 34027 1
89 . 1 . 1 13 13 HIS HA H 1 4.626 0.020 . 1 . . . . A 13 HIS HA . 34027 1
90 . 1 . 1 13 13 HIS HB2 H 1 3.311 0.020 . 2 . . . . A 13 HIS HB2 . 34027 1
91 . 1 . 1 13 13 HIS HB3 H 1 3.197 0.020 . 2 . . . . A 13 HIS HB3 . 34027 1
92 . 1 . 1 13 13 HIS HD2 H 1 7.249 0.020 . 1 . . . . A 13 HIS HD2 . 34027 1
93 . 1 . 1 13 13 HIS HE1 H 1 8.392 0.020 . 1 . . . . A 13 HIS HE1 . 34027 1
94 . 1 . 1 13 13 HIS CB C 13 29.114 0.400 . 1 . . . . A 13 HIS CB . 34027 1
95 . 1 . 1 13 13 HIS CD2 C 13 119.183 0.400 . 1 . . . . A 13 HIS CD2 . 34027 1
96 . 1 . 1 13 13 HIS CE1 C 13 136.347 0.400 . 1 . . . . A 13 HIS CE1 . 34027 1
97 . 1 . 1 13 13 HIS N N 15 120.352 0.400 . 1 . . . . A 13 HIS N . 34027 1
98 . 1 . 1 14 14 ASP H H 1 8.358 0.020 . 1 . . . . A 14 ASP H . 34027 1
99 . 1 . 1 14 14 ASP HA H 1 4.681 0.020 . 1 . . . . A 14 ASP HA . 34027 1
100 . 1 . 1 14 14 ASP HB2 H 1 2.806 0.020 . 2 . . . . A 14 ASP HB2 . 34027 1
101 . 1 . 1 14 14 ASP HB3 H 1 2.747 0.020 . 2 . . . . A 14 ASP HB3 . 34027 1
102 . 1 . 1 14 14 ASP N N 15 121.060 0.400 . 1 . . . . A 14 ASP N . 34027 1
103 . 1 . 1 15 15 ARG H H 1 8.853 0.020 . 1 . . . . A 15 ARG H . 34027 1
104 . 1 . 1 15 15 ARG HA H 1 3.946 0.020 . 1 . . . . A 15 ARG HA . 34027 1
105 . 1 . 1 15 15 ARG HB2 H 1 1.924 0.020 . 2 . . . . A 15 ARG HB2 . 34027 1
106 . 1 . 1 15 15 ARG HB3 H 1 1.924 0.020 . 2 . . . . A 15 ARG HB3 . 34027 1
107 . 1 . 1 15 15 ARG HG2 H 1 1.793 0.020 . 2 . . . . A 15 ARG HG2 . 34027 1
108 . 1 . 1 15 15 ARG HG3 H 1 1.690 0.020 . 2 . . . . A 15 ARG HG3 . 34027 1
109 . 1 . 1 15 15 ARG HD2 H 1 3.236 0.020 . 2 . . . . A 15 ARG HD2 . 34027 1
110 . 1 . 1 15 15 ARG HD3 H 1 3.236 0.020 . 2 . . . . A 15 ARG HD3 . 34027 1
111 . 1 . 1 15 15 ARG HE H 1 7.427 0.020 . 1 . . . . A 15 ARG HE . 34027 1
112 . 1 . 1 15 15 ARG N N 15 125.597 0.400 . 1 . . . . A 15 ARG N . 34027 1
113 . 1 . 1 15 15 ARG NE N 15 84.657 0.400 . 1 . . . . A 15 ARG NE . 34027 1
114 . 1 . 1 16 16 ARG H H 1 8.396 0.020 . 1 . . . . A 16 ARG H . 34027 1
115 . 1 . 1 16 16 ARG HA H 1 4.078 0.020 . 1 . . . . A 16 ARG HA . 34027 1
116 . 1 . 1 16 16 ARG HB2 H 1 1.935 0.020 . 2 . . . . A 16 ARG HB2 . 34027 1
117 . 1 . 1 16 16 ARG HB3 H 1 1.935 0.020 . 2 . . . . A 16 ARG HB3 . 34027 1
118 . 1 . 1 16 16 ARG HG2 H 1 1.574 0.020 . 2 . . . . A 16 ARG HG2 . 34027 1
119 . 1 . 1 16 16 ARG HG3 H 1 1.673 0.020 . 2 . . . . A 16 ARG HG3 . 34027 1
120 . 1 . 1 16 16 ARG HD2 H 1 3.217 0.020 . 2 . . . . A 16 ARG HD2 . 34027 1
121 . 1 . 1 16 16 ARG HD3 H 1 3.217 0.020 . 2 . . . . A 16 ARG HD3 . 34027 1
122 . 1 . 1 16 16 ARG HE H 1 7.416 0.020 . 1 . . . . A 16 ARG HE . 34027 1
123 . 1 . 1 16 16 ARG N N 15 120.656 0.400 . 1 . . . . A 16 ARG N . 34027 1
124 . 1 . 1 16 16 ARG NE N 15 84.490 0.400 . 1 . . . . A 16 ARG NE . 34027 1
125 . 1 . 1 17 17 GLU H H 1 8.153 0.020 . 1 . . . . A 17 GLU H . 34027 1
126 . 1 . 1 17 17 GLU HA H 1 3.878 0.020 . 1 . . . . A 17 GLU HA . 34027 1
127 . 1 . 1 17 17 GLU HB2 H 1 1.735 0.020 . 2 . . . . A 17 GLU HB2 . 34027 1
128 . 1 . 1 17 17 GLU HB3 H 1 2.037 0.020 . 2 . . . . A 17 GLU HB3 . 34027 1
129 . 1 . 1 17 17 GLU HG2 H 1 2.300 0.020 . 2 . . . . A 17 GLU HG2 . 34027 1
130 . 1 . 1 17 17 GLU HG3 H 1 2.300 0.020 . 2 . . . . A 17 GLU HG3 . 34027 1
131 . 1 . 1 17 17 GLU N N 15 120.503 0.400 . 1 . . . . A 17 GLU N . 34027 1
132 . 1 . 1 18 18 LYS H H 1 8.497 0.020 . 1 . . . . A 18 LYS H . 34027 1
133 . 1 . 1 18 18 LYS HA H 1 3.883 0.020 . 1 . . . . A 18 LYS HA . 34027 1
134 . 1 . 1 18 18 LYS HB2 H 1 1.960 0.020 . 2 . . . . A 18 LYS HB2 . 34027 1
135 . 1 . 1 18 18 LYS HB3 H 1 1.812 0.020 . 2 . . . . A 18 LYS HB3 . 34027 1
136 . 1 . 1 18 18 LYS HG2 H 1 1.559 0.020 . 2 . . . . A 18 LYS HG2 . 34027 1
137 . 1 . 1 18 18 LYS HG3 H 1 1.460 0.020 . 2 . . . . A 18 LYS HG3 . 34027 1
138 . 1 . 1 18 18 LYS HD2 H 1 1.702 0.020 . 2 . . . . A 18 LYS HD2 . 34027 1
139 . 1 . 1 18 18 LYS HD3 H 1 1.702 0.020 . 2 . . . . A 18 LYS HD3 . 34027 1
140 . 1 . 1 18 18 LYS HE2 H 1 2.975 0.020 . 2 . . . . A 18 LYS HE2 . 34027 1
141 . 1 . 1 18 18 LYS HE3 H 1 2.975 0.020 . 2 . . . . A 18 LYS HE3 . 34027 1
142 . 1 . 1 18 18 LYS N N 15 120.720 0.400 . 1 . . . . A 18 LYS N . 34027 1
143 . 1 . 1 19 19 LYS H H 1 7.899 0.020 . 1 . . . . A 19 LYS H . 34027 1
144 . 1 . 1 19 19 LYS HA H 1 3.996 0.020 . 1 . . . . A 19 LYS HA . 34027 1
145 . 1 . 1 19 19 LYS HB3 H 1 1.944 0.020 . 2 . . . . A 19 LYS HB3 . 34027 1
146 . 1 . 1 19 19 LYS HG2 H 1 1.386 0.020 . 2 . . . . A 19 LYS HG2 . 34027 1
147 . 1 . 1 19 19 LYS HG3 H 1 1.507 0.020 . 2 . . . . A 19 LYS HG3 . 34027 1
148 . 1 . 1 19 19 LYS HD2 H 1 1.662 0.020 . 2 . . . . A 19 LYS HD2 . 34027 1
149 . 1 . 1 19 19 LYS HD3 H 1 1.706 0.020 . 2 . . . . A 19 LYS HD3 . 34027 1
150 . 1 . 1 19 19 LYS HE2 H 1 2.995 0.020 . 2 . . . . A 19 LYS HE2 . 34027 1
151 . 1 . 1 19 19 LYS HE3 H 1 2.995 0.020 . 2 . . . . A 19 LYS HE3 . 34027 1
152 . 1 . 1 19 19 LYS N N 15 120.025 0.400 . 1 . . . . A 19 LYS N . 34027 1
153 . 1 . 1 20 20 GLN H H 1 8.001 0.020 . 1 . . . . A 20 GLN H . 34027 1
154 . 1 . 1 20 20 GLN HA H 1 4.067 0.020 . 1 . . . . A 20 GLN HA . 34027 1
155 . 1 . 1 20 20 GLN HB2 H 1 2.050 0.020 . 2 . . . . A 20 GLN HB2 . 34027 1
156 . 1 . 1 20 20 GLN HB3 H 1 2.019 0.020 . 2 . . . . A 20 GLN HB3 . 34027 1
157 . 1 . 1 20 20 GLN HG2 H 1 2.429 0.020 . 2 . . . . A 20 GLN HG2 . 34027 1
158 . 1 . 1 20 20 GLN HG3 H 1 2.341 0.020 . 2 . . . . A 20 GLN HG3 . 34027 1
159 . 1 . 1 20 20 GLN HE21 H 1 7.403 0.020 . 2 . . . . A 20 GLN HE21 . 34027 1
160 . 1 . 1 20 20 GLN HE22 H 1 6.805 0.020 . 2 . . . . A 20 GLN HE22 . 34027 1
161 . 1 . 1 20 20 GLN N N 15 118.181 0.400 . 1 . . . . A 20 GLN N . 34027 1
162 . 1 . 1 20 20 GLN NE2 N 15 111.328 0.400 . 1 . . . . A 20 GLN NE2 . 34027 1
163 . 1 . 1 21 21 CYS H H 1 7.976 0.020 . 1 . . . . A 21 CYS H . 34027 1
164 . 1 . 1 21 21 CYS HA H 1 4.215 0.020 . 1 . . . . A 21 CYS HA . 34027 1
165 . 1 . 1 21 21 CYS HB2 H 1 3.389 0.020 . 2 . . . . A 21 CYS HB2 . 34027 1
166 . 1 . 1 21 21 CYS HB3 H 1 2.864 0.020 . 2 . . . . A 21 CYS HB3 . 34027 1
167 . 1 . 1 21 21 CYS N N 15 120.093 0.400 . 1 . . . . A 21 CYS N . 34027 1
168 . 1 . 1 22 22 LYS H H 1 8.383 0.020 . 1 . . . . A 22 LYS H . 34027 1
169 . 1 . 1 22 22 LYS HA H 1 3.903 0.020 . 1 . . . . A 22 LYS HA . 34027 1
170 . 1 . 1 22 22 LYS HB2 H 1 1.935 0.020 . 2 . . . . A 22 LYS HB2 . 34027 1
171 . 1 . 1 22 22 LYS HB3 H 1 1.935 0.020 . 2 . . . . A 22 LYS HB3 . 34027 1
172 . 1 . 1 22 22 LYS HG2 H 1 1.268 0.020 . 2 . . . . A 22 LYS HG2 . 34027 1
173 . 1 . 1 22 22 LYS HG3 H 1 1.707 0.020 . 2 . . . . A 22 LYS HG3 . 34027 1
174 . 1 . 1 22 22 LYS HE2 H 1 2.777 0.020 . 2 . . . . A 22 LYS HE2 . 34027 1
175 . 1 . 1 22 22 LYS HE3 H 1 2.871 0.020 . 2 . . . . A 22 LYS HE3 . 34027 1
176 . 1 . 1 22 22 LYS CG C 13 25.659 0.400 . 1 . . . . A 22 LYS CG . 34027 1
177 . 1 . 1 22 22 LYS N N 15 121.661 0.400 . 1 . . . . A 22 LYS N . 34027 1
178 . 1 . 1 23 23 GLU H H 1 8.217 0.020 . 1 . . . . A 23 GLU H . 34027 1
179 . 1 . 1 23 23 GLU HA H 1 4.075 0.020 . 1 . . . . A 23 GLU HA . 34027 1
180 . 1 . 1 23 23 GLU HB2 H 1 2.123 0.020 . 2 . . . . A 23 GLU HB2 . 34027 1
181 . 1 . 1 23 23 GLU HB3 H 1 2.123 0.020 . 2 . . . . A 23 GLU HB3 . 34027 1
182 . 1 . 1 23 23 GLU HG2 H 1 2.347 0.020 . 2 . . . . A 23 GLU HG2 . 34027 1
183 . 1 . 1 23 23 GLU HG3 H 1 2.493 0.020 . 2 . . . . A 23 GLU HG3 . 34027 1
184 . 1 . 1 23 23 GLU N N 15 119.419 0.400 . 1 . . . . A 23 GLU N . 34027 1
185 . 1 . 1 24 24 GLY H H 1 7.899 0.020 . 1 . . . . A 24 GLY H . 34027 1
186 . 1 . 1 24 24 GLY HA2 H 1 4.099 0.020 . 2 . . . . A 24 GLY HA2 . 34027 1
187 . 1 . 1 24 24 GLY HA3 H 1 3.903 0.020 . 2 . . . . A 24 GLY HA3 . 34027 1
188 . 1 . 1 24 24 GLY N N 15 106.163 0.400 . 1 . . . . A 24 GLY N . 34027 1
189 . 1 . 1 25 25 CYS H H 1 7.673 0.020 . 1 . . . . A 25 CYS H . 34027 1
190 . 1 . 1 25 25 CYS HA H 1 4.570 0.020 . 1 . . . . A 25 CYS HA . 34027 1
191 . 1 . 1 25 25 CYS HB2 H 1 3.017 0.020 . 2 . . . . A 25 CYS HB2 . 34027 1
192 . 1 . 1 25 25 CYS HB3 H 1 3.017 0.020 . 2 . . . . A 25 CYS HB3 . 34027 1
193 . 1 . 1 25 25 CYS N N 15 118.720 0.400 . 1 . . . . A 25 CYS N . 34027 1
194 . 1 . 1 26 26 ARG H H 1 7.925 0.020 . 1 . . . . A 26 ARG H . 34027 1
195 . 1 . 1 26 26 ARG HA H 1 4.232 0.020 . 1 . . . . A 26 ARG HA . 34027 1
196 . 1 . 1 26 26 ARG HB2 H 1 1.713 0.020 . 2 . . . . A 26 ARG HB2 . 34027 1
197 . 1 . 1 26 26 ARG HG2 H 1 1.493 0.020 . 2 . . . . A 26 ARG HG2 . 34027 1
198 . 1 . 1 26 26 ARG HG3 H 1 1.425 0.020 . 2 . . . . A 26 ARG HG3 . 34027 1
199 . 1 . 1 26 26 ARG HD2 H 1 3.138 0.020 . 2 . . . . A 26 ARG HD2 . 34027 1
200 . 1 . 1 26 26 ARG HD3 H 1 3.138 0.020 . 2 . . . . A 26 ARG HD3 . 34027 1
201 . 1 . 1 26 26 ARG HE H 1 7.174 0.020 . 1 . . . . A 26 ARG HE . 34027 1
202 . 1 . 1 26 26 ARG N N 15 121.150 0.400 . 1 . . . . A 26 ARG N . 34027 1
203 . 1 . 1 26 26 ARG NE N 15 84.855 0.400 . 1 . . . . A 26 ARG NE . 34027 1
204 . 1 . 1 27 27 TYR H H 1 7.969 0.020 . 1 . . . . A 27 TYR H . 34027 1
205 . 1 . 1 27 27 TYR HA H 1 4.701 0.020 . 1 . . . . A 27 TYR HA . 34027 1
206 . 1 . 1 27 27 TYR HB2 H 1 3.236 0.020 . 2 . . . . A 27 TYR HB2 . 34027 1
207 . 1 . 1 27 27 TYR HB3 H 1 2.924 0.020 . 2 . . . . A 27 TYR HB3 . 34027 1
208 . 1 . 1 27 27 TYR HD1 H 1 7.194 0.020 . 1 . . . . A 27 TYR HD1 . 34027 1
209 . 1 . 1 27 27 TYR HD2 H 1 7.194 0.020 . 1 . . . . A 27 TYR HD2 . 34027 1
210 . 1 . 1 27 27 TYR HE1 H 1 6.861 0.020 . 1 . . . . A 27 TYR HE1 . 34027 1
211 . 1 . 1 27 27 TYR HE2 H 1 6.861 0.020 . 1 . . . . A 27 TYR HE2 . 34027 1
212 . 1 . 1 27 27 TYR CD1 C 13 132.630 0.400 . 3 . . . . A 27 TYR CD1 . 34027 1
213 . 1 . 1 27 27 TYR CE1 C 13 117.525 0.400 . 3 . . . . A 27 TYR CE1 . 34027 1
214 . 1 . 1 27 27 TYR N N 15 119.575 0.400 . 1 . . . . A 27 TYR N . 34027 1
215 . 1 . 1 28 28 GLY H H 1 7.823 0.020 . 1 . . . . A 28 GLY H . 34027 1
216 . 1 . 1 28 28 GLY HA2 H 1 3.792 0.020 . 2 . . . . A 28 GLY HA2 . 34027 1
217 . 1 . 1 28 28 GLY HA3 H 1 3.792 0.020 . 2 . . . . A 28 GLY HA3 . 34027 1
218 . 1 . 1 28 28 GLY N N 15 116.007 0.400 . 1 . . . . A 28 GLY N . 34027 1
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