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 25974
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.3
_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' . . . 25974 1
2 '2D 1H-13C HSQC' . . . 25974 1
3 '2D 1H-1H NOESY' . . . 25974 1
4 '3D 1H-15N NOESY' . . . 25974 1
5 '3D 1H-15N TOCSY' . . . 25974 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
4 $CCPN_Analysis . . 25974 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 2 2 LYS H H 1 8.167 0.003 . 1 . . . . A 2 LYS H . 25974 1
2 . 1 . 1 2 2 LYS HA H 1 5.230 0.002 . 1 . . . . A 2 LYS HA . 25974 1
3 . 1 . 1 2 2 LYS HB2 H 1 1.586 0.02 . 2 . . . . A 2 LYS HB2 . 25974 1
4 . 1 . 1 2 2 LYS HD2 H 1 0.406 0.002 . 1 . . . . A 2 LYS HD2 . 25974 1
5 . 1 . 1 2 2 LYS HE2 H 1 2.895 0.02 . 1 . . . . A 2 LYS HE2 . 25974 1
6 . 1 . 1 2 2 LYS N N 15 119.918 0.012 . 1 . . . . A 2 LYS N . 25974 1
7 . 1 . 1 3 3 TYR H H 1 8.939 0.021 . 1 . . . . A 3 TYR H . 25974 1
8 . 1 . 1 3 3 TYR HA H 1 4.809 0.002 . 1 . . . . A 3 TYR HA . 25974 1
9 . 1 . 1 3 3 TYR HB2 H 1 2.790 0.02 . 2 . . . . A 3 TYR HB2 . 25974 1
10 . 1 . 1 3 3 TYR HB3 H 1 1.802 0.02 . 2 . . . . A 3 TYR HB3 . 25974 1
11 . 1 . 1 3 3 TYR HD1 H 1 6.869 0.02 . 1 . . . . A 3 TYR HD1 . 25974 1
12 . 1 . 1 3 3 TYR HD2 H 1 6.869 0.02 . 1 . . . . A 3 TYR HD2 . 25974 1
13 . 1 . 1 3 3 TYR HE1 H 1 6.739 0.02 . 1 . . . . A 3 TYR HE1 . 25974 1
14 . 1 . 1 3 3 TYR HE2 H 1 6.739 0.02 . 1 . . . . A 3 TYR HE2 . 25974 1
15 . 1 . 1 3 3 TYR N N 15 122.493 0.125 . 1 . . . . A 3 TYR N . 25974 1
16 . 1 . 1 4 4 THR H H 1 8.885 0.019 . 1 . . . . A 4 THR H . 25974 1
17 . 1 . 1 4 4 THR HA H 1 5.042 0.02 . 1 . . . . A 4 THR HA . 25974 1
18 . 1 . 1 4 4 THR HB H 1 4.032 0.02 . 1 . . . . A 4 THR HB . 25974 1
19 . 1 . 1 4 4 THR HG21 H 1 1.284 0.02 . 1 . . . . A 4 THR HG21 . 25974 1
20 . 1 . 1 4 4 THR HG22 H 1 1.284 0.02 . 1 . . . . A 4 THR HG22 . 25974 1
21 . 1 . 1 4 4 THR HG23 H 1 1.284 0.02 . 1 . . . . A 4 THR HG23 . 25974 1
22 . 1 . 1 4 4 THR N N 15 117.297 0.153 . 1 . . . . A 4 THR N . 25974 1
23 . 1 . 1 5 5 GLY H H 1 9.135 0.016 . 1 . . . . A 5 GLY H . 25974 1
24 . 1 . 1 5 5 GLY HA2 H 1 4.633 0.02 . 2 . . . . A 5 GLY HA2 . 25974 1
25 . 1 . 1 5 5 GLY HA3 H 1 3.972 0.02 . 2 . . . . A 5 GLY HA3 . 25974 1
26 . 1 . 1 5 5 GLY N N 15 115.452 0.128 . 1 . . . . A 5 GLY N . 25974 1
27 . 1 . 1 6 6 LYS H H 1 8.422 0.019 . 1 . . . . A 6 LYS H . 25974 1
28 . 1 . 1 6 6 LYS HA H 1 5.378 0.002 . 1 . . . . A 6 LYS HA . 25974 1
29 . 1 . 1 6 6 LYS HB2 H 1 1.643 0.02 . 2 . . . . A 6 LYS HB2 . 25974 1
30 . 1 . 1 6 6 LYS HB3 H 1 1.576 0.02 . 2 . . . . A 6 LYS HB3 . 25974 1
31 . 1 . 1 6 6 LYS HG2 H 1 1.355 0.02 . 2 . . . . A 6 LYS HG2 . 25974 1
32 . 1 . 1 6 6 LYS HG3 H 1 1.296 0.02 . 2 . . . . A 6 LYS HG3 . 25974 1
33 . 1 . 1 6 6 LYS N N 15 121.001 0.178 . 1 . . . . A 6 LYS N . 25974 1
34 . 1 . 1 7 7 CYS H H 1 9.767 0.016 . 1 . . . . A 7 CYS H . 25974 1
35 . 1 . 1 7 7 CYS HA H 1 6.297 0.02 . 1 . . . . A 7 CYS HA . 25974 1
36 . 1 . 1 7 7 CYS HB2 H 1 2.849 0.02 . 2 . . . . A 7 CYS HB2 . 25974 1
37 . 1 . 1 7 7 CYS HB3 H 1 3.375 0.02 . 2 . . . . A 7 CYS HB3 . 25974 1
38 . 1 . 1 7 7 CYS N N 15 122.647 0.103 . 1 . . . . A 7 CYS N . 25974 1
39 . 1 . 1 8 8 THR H H 1 8.716 0.015 . 1 . . . . A 8 THR H . 25974 1
40 . 1 . 1 8 8 THR HA H 1 4.704 0.02 . 1 . . . . A 8 THR HA . 25974 1
41 . 1 . 1 8 8 THR HB H 1 4.085 0.02 . 1 . . . . A 8 THR HB . 25974 1
42 . 1 . 1 8 8 THR HG21 H 1 1.268 0.02 . 1 . . . . A 8 THR HG21 . 25974 1
43 . 1 . 1 8 8 THR HG22 H 1 1.268 0.02 . 1 . . . . A 8 THR HG22 . 25974 1
44 . 1 . 1 8 8 THR HG23 H 1 1.268 0.02 . 1 . . . . A 8 THR HG23 . 25974 1
45 . 1 . 1 8 8 THR N N 15 113.493 0.080 . 1 . . . . A 8 THR N . 25974 1
46 . 1 . 1 9 9 LYS H H 1 8.947 0.012 . 1 . . . . A 9 LYS H . 25974 1
47 . 1 . 1 9 9 LYS HA H 1 3.493 0.002 . 1 . . . . A 9 LYS HA . 25974 1
48 . 1 . 1 9 9 LYS HB2 H 1 1.743 0.02 . 1 . . . . A 9 LYS HB2 . 25974 1
49 . 1 . 1 9 9 LYS HG2 H 1 1.262 0.02 . 2 . . . . A 9 LYS HG2 . 25974 1
50 . 1 . 1 9 9 LYS HG3 H 1 1.108 0.02 . 2 . . . . A 9 LYS HG3 . 25974 1
51 . 1 . 1 9 9 LYS N N 15 127.640 0.087 . 1 . . . . A 9 LYS N . 25974 1
52 . 1 . 1 10 10 SER H H 1 9.484 0.001 . 1 . . . . A 10 SER H . 25974 1
53 . 1 . 1 10 10 SER HA H 1 4.006 0.005 . 1 . . . . A 10 SER HA . 25974 1
54 . 1 . 1 10 10 SER HB2 H 1 3.885 0.02 . 2 . . . . A 10 SER HB2 . 25974 1
55 . 1 . 1 10 10 SER HB3 H 1 3.839 0.02 . 2 . . . . A 10 SER HB3 . 25974 1
56 . 1 . 1 10 10 SER N N 15 116.726 0.016 . 1 . . . . A 10 SER N . 25974 1
57 . 1 . 1 11 11 LYS H H 1 7.051 0.003 . 1 . . . . A 11 LYS H . 25974 1
58 . 1 . 1 11 11 LYS HA H 1 4.153 0.02 . 1 . . . . A 11 LYS HA . 25974 1
59 . 1 . 1 11 11 LYS HB2 H 1 1.354 0.02 . 2 . . . . A 11 LYS HB2 . 25974 1
60 . 1 . 1 11 11 LYS HB3 H 1 1.685 0.02 . 2 . . . . A 11 LYS HB3 . 25974 1
61 . 1 . 1 11 11 LYS N N 15 116.973 0.035 . 1 . . . . A 11 LYS N . 25974 1
62 . 1 . 1 12 12 ASN H H 1 7.590 0.010 . 1 . . . . A 12 ASN H . 25974 1
63 . 1 . 1 12 12 ASN HA H 1 4.566 0.02 . 1 . . . . A 12 ASN HA . 25974 1
64 . 1 . 1 12 12 ASN HB2 H 1 3.190 0.02 . 2 . . . . A 12 ASN HB2 . 25974 1
65 . 1 . 1 12 12 ASN HB3 H 1 2.263 0.02 . 2 . . . . A 12 ASN HB3 . 25974 1
66 . 1 . 1 12 12 ASN HD21 H 1 5.906 0.02 . 1 . . . . A 12 ASN HD21 . 25974 1
67 . 1 . 1 12 12 ASN HD22 H 1 6.960 0.02 . 1 . . . . A 12 ASN HD22 . 25974 1
68 . 1 . 1 12 12 ASN N N 15 120.652 0.083 . 1 . . . . A 12 ASN N . 25974 1
69 . 1 . 1 13 13 GLU H H 1 7.290 0.013 . 1 . . . . A 13 GLU H . 25974 1
70 . 1 . 1 13 13 GLU HA H 1 4.896 0.02 . 1 . . . . A 13 GLU HA . 25974 1
71 . 1 . 1 13 13 GLU HB2 H 1 1.708 0.02 . 2 . . . . A 13 GLU HB2 . 25974 1
72 . 1 . 1 13 13 GLU HB3 H 1 1.797 0.02 . 2 . . . . A 13 GLU HB3 . 25974 1
73 . 1 . 1 13 13 GLU HG2 H 1 2.046 0.002 . 2 . . . . A 13 GLU HG2 . 25974 1
74 . 1 . 1 13 13 GLU HG3 H 1 1.951 0.02 . 2 . . . . A 13 GLU HG3 . 25974 1
75 . 1 . 1 13 13 GLU N N 15 115.322 0.145 . 1 . . . . A 13 GLU N . 25974 1
76 . 1 . 1 14 14 CYS H H 1 9.588 0.014 . 1 . . . . A 14 CYS H . 25974 1
77 . 1 . 1 14 14 CYS HA H 1 4.639 0.02 . 1 . . . . A 14 CYS HA . 25974 1
78 . 1 . 1 14 14 CYS HB2 H 1 2.654 0.02 . 2 . . . . A 14 CYS HB2 . 25974 1
79 . 1 . 1 14 14 CYS HB3 H 1 2.894 0.02 . 2 . . . . A 14 CYS HB3 . 25974 1
80 . 1 . 1 14 14 CYS N N 15 123.345 0.131 . 1 . . . . A 14 CYS N . 25974 1
81 . 1 . 1 15 15 LYS H H 1 8.636 0.003 . 1 . . . . A 15 LYS H . 25974 1
82 . 1 . 1 15 15 LYS HA H 1 4.946 0.02 . 1 . . . . A 15 LYS HA . 25974 1
83 . 1 . 1 15 15 LYS HB2 H 1 1.723 0.02 . 2 . . . . A 15 LYS HB2 . 25974 1
84 . 1 . 1 15 15 LYS HB3 H 1 1.440 0.002 . 2 . . . . A 15 LYS HB3 . 25974 1
85 . 1 . 1 15 15 LYS HG2 H 1 0.178 0.02 . 1 . . . . A 15 LYS HG2 . 25974 1
86 . 1 . 1 15 15 LYS HD2 H 1 0.555 0.02 . 1 . . . . A 15 LYS HD2 . 25974 1
87 . 1 . 1 15 15 LYS HE2 H 1 2.678 0.02 . 2 . . . . A 15 LYS HE2 . 25974 1
88 . 1 . 1 15 15 LYS HE3 H 1 2.574 0.02 . 2 . . . . A 15 LYS HE3 . 25974 1
89 . 1 . 1 15 15 LYS N N 15 110.722 0.026 . 1 . . . . A 15 LYS N . 25974 1
90 . 1 . 1 16 16 TYR H H 1 8.998 0.016 . 1 . . . . A 16 TYR H . 25974 1
91 . 1 . 1 16 16 TYR HA H 1 4.899 0.02 . 1 . . . . A 16 TYR HA . 25974 1
92 . 1 . 1 16 16 TYR HB2 H 1 2.300 0.02 . 2 . . . . A 16 TYR HB2 . 25974 1
93 . 1 . 1 16 16 TYR HB3 H 1 2.649 0.02 . 2 . . . . A 16 TYR HB3 . 25974 1
94 . 1 . 1 16 16 TYR HD1 H 1 6.270 0.02 . 1 . . . . A 16 TYR HD1 . 25974 1
95 . 1 . 1 16 16 TYR HD2 H 1 6.270 0.02 . 1 . . . . A 16 TYR HD2 . 25974 1
96 . 1 . 1 16 16 TYR HE1 H 1 5.760 0.02 . 1 . . . . A 16 TYR HE1 . 25974 1
97 . 1 . 1 16 16 TYR HE2 H 1 5.760 0.02 . 1 . . . . A 16 TYR HE2 . 25974 1
98 . 1 . 1 16 16 TYR N N 15 126.630 0.102 . 1 . . . . A 16 TYR N . 25974 1
99 . 1 . 1 17 17 LYS H H 1 8.421 0.018 . 1 . . . . A 17 LYS H . 25974 1
100 . 1 . 1 17 17 LYS HA H 1 4.406 0.002 . 1 . . . . A 17 LYS HA . 25974 1
101 . 1 . 1 17 17 LYS HB2 H 1 1.658 0.02 . 2 . . . . A 17 LYS HB2 . 25974 1
102 . 1 . 1 17 17 LYS HB3 H 1 1.442 0.02 . 2 . . . . A 17 LYS HB3 . 25974 1
103 . 1 . 1 17 17 LYS HG2 H 1 1.227 0.02 . 1 . . . . A 17 LYS HG2 . 25974 1
104 . 1 . 1 17 17 LYS N N 15 120.977 0.178 . 1 . . . . A 17 LYS N . 25974 1
105 . 1 . 1 18 18 ASN H H 1 7.735 0.013 . 1 . . . . A 18 ASN H . 25974 1
106 . 1 . 1 18 18 ASN HA H 1 4.102 0.02 . 1 . . . . A 18 ASN HA . 25974 1
107 . 1 . 1 18 18 ASN HB2 H 1 3.350 0.02 . 2 . . . . A 18 ASN HB2 . 25974 1
108 . 1 . 1 18 18 ASN HB3 H 1 2.583 0.02 . 2 . . . . A 18 ASN HB3 . 25974 1
109 . 1 . 1 18 18 ASN HD21 H 1 6.740 0.02 . 1 . . . . A 18 ASN HD21 . 25974 1
110 . 1 . 1 18 18 ASN HD22 H 1 7.353 0.02 . 1 . . . . A 18 ASN HD22 . 25974 1
111 . 1 . 1 18 18 ASN N N 15 122.224 0.136 . 1 . . . . A 18 ASN N . 25974 1
112 . 1 . 1 19 19 ASP H H 1 8.238 0.002 . 1 . . . . A 19 ASP H . 25974 1
113 . 1 . 1 19 19 ASP HA H 1 4.384 0.02 . 1 . . . . A 19 ASP HA . 25974 1
114 . 1 . 1 19 19 ASP HB2 H 1 2.681 0.02 . 2 . . . . A 19 ASP HB2 . 25974 1
115 . 1 . 1 19 19 ASP HB3 H 1 2.829 0.02 . 2 . . . . A 19 ASP HB3 . 25974 1
116 . 1 . 1 19 19 ASP N N 15 117.436 0.018 . 1 . . . . A 19 ASP N . 25974 1
117 . 1 . 1 20 20 ALA H H 1 7.419 0.015 . 1 . . . . A 20 ALA H . 25974 1
118 . 1 . 1 20 20 ALA HA H 1 4.409 0.02 . 1 . . . . A 20 ALA HA . 25974 1
119 . 1 . 1 20 20 ALA HB1 H 1 1.341 0.02 . 1 . . . . A 20 ALA HB1 . 25974 1
120 . 1 . 1 20 20 ALA HB2 H 1 1.341 0.02 . 1 . . . . A 20 ALA HB2 . 25974 1
121 . 1 . 1 20 20 ALA HB3 H 1 1.341 0.02 . 1 . . . . A 20 ALA HB3 . 25974 1
122 . 1 . 1 20 20 ALA N N 15 120.895 0.130 . 1 . . . . A 20 ALA N . 25974 1
123 . 1 . 1 21 21 GLY H H 1 8.170 0.001 . 1 . . . . A 21 GLY H . 25974 1
124 . 1 . 1 21 21 GLY HA2 H 1 4.079 0.02 . 2 . . . . A 21 GLY HA2 . 25974 1
125 . 1 . 1 21 21 GLY HA3 H 1 3.512 0.02 . 2 . . . . A 21 GLY HA3 . 25974 1
126 . 1 . 1 21 21 GLY N N 15 127.668 0.011 . 1 . . . . A 21 GLY N . 25974 1
127 . 1 . 1 22 22 LYS H H 1 7.682 0.023 . 1 . . . . A 22 LYS H . 25974 1
128 . 1 . 1 22 22 LYS HA H 1 4.309 0.02 . 1 . . . . A 22 LYS HA . 25974 1
129 . 1 . 1 22 22 LYS HB2 H 1 1.468 0.02 . 2 . . . . A 22 LYS HB2 . 25974 1
130 . 1 . 1 22 22 LYS HB3 H 1 1.581 0.02 . 2 . . . . A 22 LYS HB3 . 25974 1
131 . 1 . 1 22 22 LYS HG2 H 1 1.278 0.02 . 2 . . . . A 22 LYS HG2 . 25974 1
132 . 1 . 1 22 22 LYS HG3 H 1 1.182 0.02 . 2 . . . . A 22 LYS HG3 . 25974 1
133 . 1 . 1 22 22 LYS HE2 H 1 2.890 0.02 . 1 . . . . A 22 LYS HE2 . 25974 1
134 . 1 . 1 22 22 LYS N N 15 120.354 0.191 . 1 . . . . A 22 LYS N . 25974 1
135 . 1 . 1 23 23 ASP H H 1 8.610 0.020 . 1 . . . . A 23 ASP H . 25974 1
136 . 1 . 1 23 23 ASP HA H 1 4.256 0.02 . 1 . . . . A 23 ASP HA . 25974 1
137 . 1 . 1 23 23 ASP HB2 H 1 2.391 0.02 . 2 . . . . A 23 ASP HB2 . 25974 1
138 . 1 . 1 23 23 ASP HB3 H 1 1.851 0.02 . 2 . . . . A 23 ASP HB3 . 25974 1
139 . 1 . 1 23 23 ASP N N 15 126.398 0.246 . 1 . . . . A 23 ASP N . 25974 1
140 . 1 . 1 24 24 THR H H 1 8.782 0.020 . 1 . . . . A 24 THR H . 25974 1
141 . 1 . 1 24 24 THR HA H 1 4.012 0.02 . 1 . . . . A 24 THR HA . 25974 1
142 . 1 . 1 24 24 THR HB H 1 2.287 0.02 . 1 . . . . A 24 THR HB . 25974 1
143 . 1 . 1 24 24 THR HG21 H 1 0.799 0.02 . 1 . . . . A 24 THR HG21 . 25974 1
144 . 1 . 1 24 24 THR HG22 H 1 0.799 0.02 . 1 . . . . A 24 THR HG22 . 25974 1
145 . 1 . 1 24 24 THR HG23 H 1 0.799 0.02 . 1 . . . . A 24 THR HG23 . 25974 1
146 . 1 . 1 24 24 THR N N 15 122.770 0.155 . 1 . . . . A 24 THR N . 25974 1
147 . 1 . 1 25 25 PHE H H 1 8.328 0.021 . 1 . . . . A 25 PHE H . 25974 1
148 . 1 . 1 25 25 PHE HA H 1 5.404 0.02 . 1 . . . . A 25 PHE HA . 25974 1
149 . 1 . 1 25 25 PHE HB2 H 1 2.684 0.02 . 1 . . . . A 25 PHE HB2 . 25974 1
150 . 1 . 1 25 25 PHE HD1 H 1 7.005 0.02 . 1 . . . . A 25 PHE HD1 . 25974 1
151 . 1 . 1 25 25 PHE HD2 H 1 7.005 0.02 . 1 . . . . A 25 PHE HD2 . 25974 1
152 . 1 . 1 25 25 PHE HE1 H 1 7.163 0.02 . 1 . . . . A 25 PHE HE1 . 25974 1
153 . 1 . 1 25 25 PHE HE2 H 1 7.163 0.02 . 1 . . . . A 25 PHE HE2 . 25974 1
154 . 1 . 1 25 25 PHE N N 15 122.423 0.161 . 1 . . . . A 25 PHE N . 25974 1
155 . 1 . 1 26 26 ILE H H 1 9.138 0.016 . 1 . . . . A 26 ILE H . 25974 1
156 . 1 . 1 26 26 ILE HA H 1 4.614 0.02 . 1 . . . . A 26 ILE HA . 25974 1
157 . 1 . 1 26 26 ILE HB H 1 1.800 0.02 . 1 . . . . A 26 ILE HB . 25974 1
158 . 1 . 1 26 26 ILE HG12 H 1 1.351 0.017 . 1 . . . . A 26 ILE HG12 . 25974 1
159 . 1 . 1 26 26 ILE HG21 H 1 0.833 0.02 . 1 . . . . A 26 ILE HG21 . 25974 1
160 . 1 . 1 26 26 ILE HG22 H 1 0.833 0.02 . 1 . . . . A 26 ILE HG22 . 25974 1
161 . 1 . 1 26 26 ILE HG23 H 1 0.833 0.02 . 1 . . . . A 26 ILE HG23 . 25974 1
162 . 1 . 1 26 26 ILE HD11 H 1 1.705 0.02 . 1 . . . . A 26 ILE HD11 . 25974 1
163 . 1 . 1 26 26 ILE HD12 H 1 1.705 0.02 . 1 . . . . A 26 ILE HD12 . 25974 1
164 . 1 . 1 26 26 ILE HD13 H 1 1.705 0.02 . 1 . . . . A 26 ILE HD13 . 25974 1
165 . 1 . 1 26 26 ILE N N 15 123.029 0.100 . 1 . . . . A 26 ILE N . 25974 1
166 . 1 . 1 27 27 LYS H H 1 8.335 0.015 . 1 . . . . A 27 LYS H . 25974 1
167 . 1 . 1 27 27 LYS HA H 1 4.163 0.002 . 1 . . . . A 27 LYS HA . 25974 1
168 . 1 . 1 27 27 LYS HB2 H 1 1.897 0.02 . 2 . . . . A 27 LYS HB2 . 25974 1
169 . 1 . 1 27 27 LYS HB3 H 1 1.731 0.02 . 2 . . . . A 27 LYS HB3 . 25974 1
170 . 1 . 1 27 27 LYS HG2 H 1 1.577 0.02 . 1 . . . . A 27 LYS HG2 . 25974 1
171 . 1 . 1 27 27 LYS HD2 H 1 1.689 0.02 . 1 . . . . A 27 LYS HD2 . 25974 1
172 . 1 . 1 27 27 LYS N N 15 127.077 0.112 . 1 . . . . A 27 LYS N . 25974 1
173 . 1 . 1 28 28 CYS H H 1 8.618 0.015 . 1 . . . . A 28 CYS H . 25974 1
174 . 1 . 1 28 28 CYS HA H 1 4.659 0.02 . 1 . . . . A 28 CYS HA . 25974 1
175 . 1 . 1 28 28 CYS HB2 H 1 3.290 0.02 . 2 . . . . A 28 CYS HB2 . 25974 1
176 . 1 . 1 28 28 CYS HB3 H 1 2.846 0.02 . 2 . . . . A 28 CYS HB3 . 25974 1
177 . 1 . 1 28 28 CYS N N 15 120.248 0.173 . 1 . . . . A 28 CYS N . 25974 1
178 . 1 . 1 29 29 PRO HA H 1 4.426 0.02 . 1 . . . . A 29 PRO HA . 25974 1
179 . 1 . 1 29 29 PRO HB2 H 1 2.546 0.02 . 2 . . . . A 29 PRO HB2 . 25974 1
180 . 1 . 1 29 29 PRO HB3 H 1 1.532 0.02 . 2 . . . . A 29 PRO HB3 . 25974 1
181 . 1 . 1 29 29 PRO HG2 H 1 2.279 0.02 . 2 . . . . A 29 PRO HG2 . 25974 1
182 . 1 . 1 29 29 PRO HG3 H 1 2.140 0.02 . 2 . . . . A 29 PRO HG3 . 25974 1
183 . 1 . 1 29 29 PRO HD2 H 1 3.689 0.002 . 1 . . . . A 29 PRO HD2 . 25974 1
184 . 1 . 1 30 30 LYS H H 1 8.002 0.012 . 1 . . . . A 30 LYS H . 25974 1
185 . 1 . 1 30 30 LYS HA H 1 3.949 0.02 . 1 . . . . A 30 LYS HA . 25974 1
186 . 1 . 1 30 30 LYS HB2 H 1 1.414 0.02 . 2 . . . . A 30 LYS HB2 . 25974 1
187 . 1 . 1 30 30 LYS HB3 H 1 1.560 0.02 . 2 . . . . A 30 LYS HB3 . 25974 1
188 . 1 . 1 30 30 LYS HG2 H 1 1.023 0.02 . 1 . . . . A 30 LYS HG2 . 25974 1
189 . 1 . 1 30 30 LYS N N 15 115.643 0.125 . 1 . . . . A 30 LYS N . 25974 1
190 . 1 . 1 31 31 PHE H H 1 6.308 0.014 . 1 . . . . A 31 PHE H . 25974 1
191 . 1 . 1 31 31 PHE HA H 1 4.504 0.02 . 1 . . . . A 31 PHE HA . 25974 1
192 . 1 . 1 31 31 PHE HB2 H 1 3.460 0.003 . 2 . . . . A 31 PHE HB2 . 25974 1
193 . 1 . 1 31 31 PHE HB3 H 1 2.514 0.005 . 2 . . . . A 31 PHE HB3 . 25974 1
194 . 1 . 1 31 31 PHE HE1 H 1 7.239 0.02 . 1 . . . . A 31 PHE HE1 . 25974 1
195 . 1 . 1 31 31 PHE HE2 H 1 7.239 0.02 . 1 . . . . A 31 PHE HE2 . 25974 1
196 . 1 . 1 31 31 PHE HZ H 1 7.430 0.02 . 1 . . . . A 31 PHE HZ . 25974 1
197 . 1 . 1 31 31 PHE N N 15 116.470 0.114 . 1 . . . . A 31 PHE N . 25974 1
198 . 1 . 1 32 32 ASP HA H 1 4.144 0.02 . 1 . . . . A 32 ASP HA . 25974 1
199 . 1 . 1 32 32 ASP HB2 H 1 2.599 0.02 . 1 . . . . A 32 ASP HB2 . 25974 1
200 . 1 . 1 33 33 ASN H H 1 8.564 0.002 . 1 . . . . A 33 ASN H . 25974 1
201 . 1 . 1 33 33 ASN HA H 1 4.673 0.02 . 1 . . . . A 33 ASN HA . 25974 1
202 . 1 . 1 33 33 ASN HB2 H 1 3.134 0.02 . 2 . . . . A 33 ASN HB2 . 25974 1
203 . 1 . 1 33 33 ASN HB3 H 1 2.879 0.02 . 2 . . . . A 33 ASN HB3 . 25974 1
204 . 1 . 1 33 33 ASN HD21 H 1 6.798 0.02 . 1 . . . . A 33 ASN HD21 . 25974 1
205 . 1 . 1 33 33 ASN HD22 H 1 7.519 0.02 . 1 . . . . A 33 ASN HD22 . 25974 1
206 . 1 . 1 33 33 ASN N N 15 113.110 0.004 . 1 . . . . A 33 ASN N . 25974 1
207 . 1 . 1 34 34 LYS H H 1 7.914 0.018 . 1 . . . . A 34 LYS H . 25974 1
208 . 1 . 1 34 34 LYS HA H 1 4.984 0.02 . 1 . . . . A 34 LYS HA . 25974 1
209 . 1 . 1 34 34 LYS HB2 H 1 2.289 0.02 . 2 . . . . A 34 LYS HB2 . 25974 1
210 . 1 . 1 34 34 LYS HB3 H 1 1.600 0.02 . 2 . . . . A 34 LYS HB3 . 25974 1
211 . 1 . 1 34 34 LYS HG2 H 1 1.410 0.02 . 1 . . . . A 34 LYS HG2 . 25974 1
212 . 1 . 1 34 34 LYS HD2 H 1 1.825 0.02 . 1 . . . . A 34 LYS HD2 . 25974 1
213 . 1 . 1 34 34 LYS N N 15 120.347 0.186 . 1 . . . . A 34 LYS N . 25974 1
214 . 1 . 1 35 35 LYS H H 1 7.005 0.012 . 1 . . . . A 35 LYS H . 25974 1
215 . 1 . 1 35 35 LYS HA H 1 4.608 0.02 . 1 . . . . A 35 LYS HA . 25974 1
216 . 1 . 1 35 35 LYS HB2 H 1 1.793 0.02 . 2 . . . . A 35 LYS HB2 . 25974 1
217 . 1 . 1 35 35 LYS HB3 H 1 1.631 0.02 . 2 . . . . A 35 LYS HB3 . 25974 1
218 . 1 . 1 35 35 LYS HG2 H 1 0.819 0.02 . 1 . . . . A 35 LYS HG2 . 25974 1
219 . 1 . 1 35 35 LYS HD2 H 1 1.314 0.02 . 1 . . . . A 35 LYS HD2 . 25974 1
220 . 1 . 1 35 35 LYS N N 15 117.863 0.129 . 1 . . . . A 35 LYS N . 25974 1
221 . 1 . 1 36 36 CYS H H 1 8.817 0.016 . 1 . . . . A 36 CYS H . 25974 1
222 . 1 . 1 36 36 CYS HA H 1 4.857 0.02 . 1 . . . . A 36 CYS HA . 25974 1
223 . 1 . 1 36 36 CYS HB2 H 1 3.209 0.02 . 2 . . . . A 36 CYS HB2 . 25974 1
224 . 1 . 1 36 36 CYS HB3 H 1 2.959 0.02 . 2 . . . . A 36 CYS HB3 . 25974 1
225 . 1 . 1 36 36 CYS N N 15 118.915 0.131 . 1 . . . . A 36 CYS N . 25974 1
226 . 1 . 1 37 37 THR H H 1 9.980 0.012 . 1 . . . . A 37 THR H . 25974 1
227 . 1 . 1 37 37 THR HA H 1 4.300 0.02 . 1 . . . . A 37 THR HA . 25974 1
228 . 1 . 1 37 37 THR HG21 H 1 1.113 0.02 . 1 . . . . A 37 THR HG21 . 25974 1
229 . 1 . 1 37 37 THR HG22 H 1 1.113 0.02 . 1 . . . . A 37 THR HG22 . 25974 1
230 . 1 . 1 37 37 THR HG23 H 1 1.113 0.02 . 1 . . . . A 37 THR HG23 . 25974 1
231 . 1 . 1 37 37 THR N N 15 121.008 0.120 . 1 . . . . A 37 THR N . 25974 1
232 . 1 . 1 38 38 LYS H H 1 7.287 0.012 . 1 . . . . A 38 LYS H . 25974 1
233 . 1 . 1 38 38 LYS HA H 1 4.137 0.02 . 1 . . . . A 38 LYS HA . 25974 1
234 . 1 . 1 38 38 LYS HB2 H 1 1.760 0.02 . 2 . . . . A 38 LYS HB2 . 25974 1
235 . 1 . 1 38 38 LYS HB3 H 1 1.491 0.02 . 2 . . . . A 38 LYS HB3 . 25974 1
236 . 1 . 1 38 38 LYS HG2 H 1 1.264 0.02 . 1 . . . . A 38 LYS HG2 . 25974 1
237 . 1 . 1 38 38 LYS HD2 H 1 1.346 0.005 . 1 . . . . A 38 LYS HD2 . 25974 1
238 . 1 . 1 38 38 LYS HE2 H 1 2.921 0.02 . 1 . . . . A 38 LYS HE2 . 25974 1
239 . 1 . 1 38 38 LYS N N 15 122.326 0.134 . 1 . . . . A 38 LYS N . 25974 1
240 . 1 . 1 39 39 ASP H H 1 8.817 0.014 . 1 . . . . A 39 ASP H . 25974 1
241 . 1 . 1 39 39 ASP HA H 1 4.578 0.02 . 1 . . . . A 39 ASP HA . 25974 1
242 . 1 . 1 39 39 ASP HB2 H 1 2.600 0.02 . 2 . . . . A 39 ASP HB2 . 25974 1
243 . 1 . 1 39 39 ASP HB3 H 1 2.531 0.02 . 2 . . . . A 39 ASP HB3 . 25974 1
244 . 1 . 1 39 39 ASP N N 15 125.238 0.125 . 1 . . . . A 39 ASP N . 25974 1
245 . 1 . 1 40 40 ASN H H 1 9.532 0.016 . 1 . . . . A 40 ASN H . 25974 1
246 . 1 . 1 40 40 ASN HA H 1 4.272 0.02 . 1 . . . . A 40 ASN HA . 25974 1
247 . 1 . 1 40 40 ASN HB2 H 1 3.175 0.02 . 2 . . . . A 40 ASN HB2 . 25974 1
248 . 1 . 1 40 40 ASN HB3 H 1 3.070 0.02 . 2 . . . . A 40 ASN HB3 . 25974 1
249 . 1 . 1 40 40 ASN HD21 H 1 7.000 0.02 . 1 . . . . A 40 ASN HD21 . 25974 1
250 . 1 . 1 40 40 ASN HD22 H 1 7.557 0.02 . 1 . . . . A 40 ASN HD22 . 25974 1
251 . 1 . 1 40 40 ASN N N 15 114.713 0.142 . 1 . . . . A 40 ASN N . 25974 1
252 . 1 . 1 41 41 ASN H H 1 7.742 0.013 . 1 . . . . A 41 ASN H . 25974 1
253 . 1 . 1 41 41 ASN HA H 1 4.717 0.02 . 1 . . . . A 41 ASN HA . 25974 1
254 . 1 . 1 41 41 ASN HB2 H 1 2.835 0.02 . 2 . . . . A 41 ASN HB2 . 25974 1
255 . 1 . 1 41 41 ASN HB3 H 1 3.339 0.02 . 2 . . . . A 41 ASN HB3 . 25974 1
256 . 1 . 1 41 41 ASN HD21 H 1 7.572 0.02 . 1 . . . . A 41 ASN HD21 . 25974 1
257 . 1 . 1 41 41 ASN HD22 H 1 6.444 0.02 . 1 . . . . A 41 ASN HD22 . 25974 1
258 . 1 . 1 41 41 ASN N N 15 120.080 0.142 . 1 . . . . A 41 ASN N . 25974 1
259 . 1 . 1 42 42 LYS H H 1 8.397 0.016 . 1 . . . . A 42 LYS H . 25974 1
260 . 1 . 1 42 42 LYS HA H 1 4.346 0.005 . 1 . . . . A 42 LYS HA . 25974 1
261 . 1 . 1 42 42 LYS HB2 H 1 1.735 0.02 . 1 . . . . A 42 LYS HB2 . 25974 1
262 . 1 . 1 42 42 LYS HG2 H 1 1.356 0.019 . 2 . . . . A 42 LYS HG2 . 25974 1
263 . 1 . 1 42 42 LYS HG3 H 1 1.282 0.02 . 2 . . . . A 42 LYS HG3 . 25974 1
264 . 1 . 1 42 42 LYS N N 15 118.956 0.125 . 1 . . . . A 42 LYS N . 25974 1
265 . 1 . 1 43 43 CYS H H 1 7.397 0.017 . 1 . . . . A 43 CYS H . 25974 1
266 . 1 . 1 43 43 CYS HA H 1 5.335 0.02 . 1 . . . . A 43 CYS HA . 25974 1
267 . 1 . 1 43 43 CYS HB2 H 1 3.703 0.02 . 2 . . . . A 43 CYS HB2 . 25974 1
268 . 1 . 1 43 43 CYS HB3 H 1 2.664 0.02 . 2 . . . . A 43 CYS HB3 . 25974 1
269 . 1 . 1 43 43 CYS N N 15 112.235 0.209 . 1 . . . . A 43 CYS N . 25974 1
270 . 1 . 1 44 44 THR H H 1 8.674 0.015 . 1 . . . . A 44 THR H . 25974 1
271 . 1 . 1 44 44 THR HA H 1 5.221 0.02 . 1 . . . . A 44 THR HA . 25974 1
272 . 1 . 1 44 44 THR HB H 1 4.036 0.002 . 1 . . . . A 44 THR HB . 25974 1
273 . 1 . 1 44 44 THR HG21 H 1 1.095 0.02 . 1 . . . . A 44 THR HG21 . 25974 1
274 . 1 . 1 44 44 THR HG22 H 1 1.095 0.02 . 1 . . . . A 44 THR HG22 . 25974 1
275 . 1 . 1 44 44 THR HG23 H 1 1.095 0.02 . 1 . . . . A 44 THR HG23 . 25974 1
276 . 1 . 1 44 44 THR N N 15 112.586 0.092 . 1 . . . . A 44 THR N . 25974 1
277 . 1 . 1 45 45 VAL H H 1 8.555 0.016 . 1 . . . . A 45 VAL H . 25974 1
278 . 1 . 1 45 45 VAL HA H 1 4.430 0.02 . 1 . . . . A 45 VAL HA . 25974 1
279 . 1 . 1 45 45 VAL HB H 1 1.202 0.002 . 1 . . . . A 45 VAL HB . 25974 1
280 . 1 . 1 45 45 VAL HG11 H 1 0.450 0.02 . 2 . . . . A 45 VAL HG11 . 25974 1
281 . 1 . 1 45 45 VAL HG12 H 1 0.450 0.02 . 2 . . . . A 45 VAL HG12 . 25974 1
282 . 1 . 1 45 45 VAL HG13 H 1 0.450 0.02 . 2 . . . . A 45 VAL HG13 . 25974 1
283 . 1 . 1 45 45 VAL HG21 H 1 0.419 0.02 . 2 . . . . A 45 VAL HG21 . 25974 1
284 . 1 . 1 45 45 VAL HG22 H 1 0.419 0.02 . 2 . . . . A 45 VAL HG22 . 25974 1
285 . 1 . 1 45 45 VAL HG23 H 1 0.419 0.02 . 2 . . . . A 45 VAL HG23 . 25974 1
286 . 1 . 1 45 45 VAL N N 15 121.814 0.171 . 1 . . . . A 45 VAL N . 25974 1
287 . 1 . 1 46 46 ASP H H 1 8.519 0.017 . 1 . . . . A 46 ASP H . 25974 1
288 . 1 . 1 46 46 ASP HA H 1 5.334 0.02 . 1 . . . . A 46 ASP HA . 25974 1
289 . 1 . 1 46 46 ASP HB2 H 1 2.402 0.02 . 2 . . . . A 46 ASP HB2 . 25974 1
290 . 1 . 1 46 46 ASP HB3 H 1 3.302 0.02 . 2 . . . . A 46 ASP HB3 . 25974 1
291 . 1 . 1 46 46 ASP N N 15 126.626 0.160 . 1 . . . . A 46 ASP N . 25974 1
292 . 1 . 1 47 47 THR H H 1 9.116 0.015 . 1 . . . . A 47 THR H . 25974 1
293 . 1 . 1 47 47 THR HA H 1 4.187 0.02 . 1 . . . . A 47 THR HA . 25974 1
294 . 1 . 1 47 47 THR HB H 1 4.589 0.002 . 1 . . . . A 47 THR HB . 25974 1
295 . 1 . 1 47 47 THR HG21 H 1 1.296 0.02 . 1 . . . . A 47 THR HG21 . 25974 1
296 . 1 . 1 47 47 THR HG22 H 1 1.296 0.02 . 1 . . . . A 47 THR HG22 . 25974 1
297 . 1 . 1 47 47 THR HG23 H 1 1.296 0.02 . 1 . . . . A 47 THR HG23 . 25974 1
298 . 1 . 1 47 47 THR N N 15 114.334 0.120 . 1 . . . . A 47 THR N . 25974 1
299 . 1 . 1 48 48 TYR H H 1 8.803 0.013 . 1 . . . . A 48 TYR H . 25974 1
300 . 1 . 1 48 48 TYR HA H 1 4.374 0.02 . 1 . . . . A 48 TYR HA . 25974 1
301 . 1 . 1 48 48 TYR HB2 H 1 3.106 0.02 . 2 . . . . A 48 TYR HB2 . 25974 1
302 . 1 . 1 48 48 TYR HB3 H 1 2.872 0.02 . 2 . . . . A 48 TYR HB3 . 25974 1
303 . 1 . 1 48 48 TYR HD1 H 1 7.017 0.02 . 1 . . . . A 48 TYR HD1 . 25974 1
304 . 1 . 1 48 48 TYR HD2 H 1 7.017 0.02 . 1 . . . . A 48 TYR HD2 . 25974 1
305 . 1 . 1 48 48 TYR HE1 H 1 6.758 0.02 . 1 . . . . A 48 TYR HE1 . 25974 1
306 . 1 . 1 48 48 TYR HE2 H 1 6.758 0.02 . 1 . . . . A 48 TYR HE2 . 25974 1
307 . 1 . 1 48 48 TYR N N 15 124.010 0.151 . 1 . . . . A 48 TYR N . 25974 1
308 . 1 . 1 49 49 ASN H H 1 7.433 0.011 . 1 . . . . A 49 ASN H . 25974 1
309 . 1 . 1 49 49 ASN HA H 1 4.475 0.02 . 1 . . . . A 49 ASN HA . 25974 1
310 . 1 . 1 49 49 ASN HB2 H 1 2.475 0.02 . 2 . . . . A 49 ASN HB2 . 25974 1
311 . 1 . 1 49 49 ASN HB3 H 1 2.739 0.02 . 2 . . . . A 49 ASN HB3 . 25974 1
312 . 1 . 1 49 49 ASN HD21 H 1 6.695 0.02 . 1 . . . . A 49 ASN HD21 . 25974 1
313 . 1 . 1 49 49 ASN HD22 H 1 7.593 0.02 . 1 . . . . A 49 ASN HD22 . 25974 1
314 . 1 . 1 49 49 ASN N N 15 113.668 0.121 . 1 . . . . A 49 ASN N . 25974 1
315 . 1 . 1 50 50 ASN H H 1 7.863 0.016 . 1 . . . . A 50 ASN H . 25974 1
316 . 1 . 1 50 50 ASN HA H 1 4.199 0.02 . 1 . . . . A 50 ASN HA . 25974 1
317 . 1 . 1 50 50 ASN HB2 H 1 2.925 0.02 . 2 . . . . A 50 ASN HB2 . 25974 1
318 . 1 . 1 50 50 ASN HB3 H 1 2.690 0.02 . 2 . . . . A 50 ASN HB3 . 25974 1
319 . 1 . 1 50 50 ASN HD21 H 1 6.586 0.02 . 1 . . . . A 50 ASN HD21 . 25974 1
320 . 1 . 1 50 50 ASN HD22 H 1 7.387 0.02 . 1 . . . . A 50 ASN HD22 . 25974 1
321 . 1 . 1 50 50 ASN N N 15 117.403 0.152 . 1 . . . . A 50 ASN N . 25974 1
322 . 1 . 1 51 51 ALA H H 1 7.853 0.014 . 1 . . . . A 51 ALA H . 25974 1
323 . 1 . 1 51 51 ALA HA H 1 4.437 0.02 . 1 . . . . A 51 ALA HA . 25974 1
324 . 1 . 1 51 51 ALA HB1 H 1 1.294 0.02 . 1 . . . . A 51 ALA HB1 . 25974 1
325 . 1 . 1 51 51 ALA HB2 H 1 1.294 0.02 . 1 . . . . A 51 ALA HB2 . 25974 1
326 . 1 . 1 51 51 ALA HB3 H 1 1.294 0.02 . 1 . . . . A 51 ALA HB3 . 25974 1
327 . 1 . 1 51 51 ALA N N 15 121.102 0.133 . 1 . . . . A 51 ALA N . 25974 1
328 . 1 . 1 52 52 VAL H H 1 8.297 0.018 . 1 . . . . A 52 VAL H . 25974 1
329 . 1 . 1 52 52 VAL HA H 1 4.875 0.02 . 1 . . . . A 52 VAL HA . 25974 1
330 . 1 . 1 52 52 VAL HB H 1 1.929 0.02 . 1 . . . . A 52 VAL HB . 25974 1
331 . 1 . 1 52 52 VAL HG11 H 1 0.998 0.02 . 2 . . . . A 52 VAL HG11 . 25974 1
332 . 1 . 1 52 52 VAL HG12 H 1 0.998 0.02 . 2 . . . . A 52 VAL HG12 . 25974 1
333 . 1 . 1 52 52 VAL HG13 H 1 0.998 0.02 . 2 . . . . A 52 VAL HG13 . 25974 1
334 . 1 . 1 52 52 VAL HG21 H 1 0.916 0.02 . 2 . . . . A 52 VAL HG21 . 25974 1
335 . 1 . 1 52 52 VAL HG22 H 1 0.916 0.02 . 2 . . . . A 52 VAL HG22 . 25974 1
336 . 1 . 1 52 52 VAL HG23 H 1 0.916 0.02 . 2 . . . . A 52 VAL HG23 . 25974 1
337 . 1 . 1 52 52 VAL N N 15 126.326 0.124 . 1 . . . . A 52 VAL N . 25974 1
338 . 1 . 1 53 53 ASP H H 1 8.519 0.016 . 1 . . . . A 53 ASP H . 25974 1
339 . 1 . 1 53 53 ASP HA H 1 4.795 0.02 . 1 . . . . A 53 ASP HA . 25974 1
340 . 1 . 1 53 53 ASP HB2 H 1 2.816 0.02 . 2 . . . . A 53 ASP HB2 . 25974 1
341 . 1 . 1 53 53 ASP HB3 H 1 2.310 0.02 . 2 . . . . A 53 ASP HB3 . 25974 1
342 . 1 . 1 53 53 ASP N N 15 125.100 0.161 . 1 . . . . A 53 ASP N . 25974 1
343 . 1 . 1 54 54 CYS H H 1 8.609 0.019 . 1 . . . . A 54 CYS H . 25974 1
344 . 1 . 1 54 54 CYS HA H 1 4.678 0.02 . 1 . . . . A 54 CYS HA . 25974 1
345 . 1 . 1 54 54 CYS HB2 H 1 3.496 0.001 . 1 . . . . A 54 CYS HB2 . 25974 1
346 . 1 . 1 54 54 CYS N N 15 126.377 0.247 . 1 . . . . A 54 CYS N . 25974 1
347 . 1 . 1 55 55 ASP H H 1 7.579 0.015 . 1 . . . . A 55 ASP H . 25974 1
348 . 1 . 1 55 55 ASP HA H 1 4.861 0.02 . 1 . . . . A 55 ASP HA . 25974 1
349 . 1 . 1 55 55 ASP HB2 H 1 2.688 0.02 . 1 . . . . A 55 ASP HB2 . 25974 1
350 . 1 . 1 55 55 ASP N N 15 128.711 0.095 . 1 . . . . A 55 ASP N . 25974 1
stop_
save_