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 30867
_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' . . . 30867 1
2 '2D 1H-1H NOESY' . . . 30867 1
3 '2D 1H-1H COSY' . . . 30867 1
4 '3D 1H-15N NOESY' . . . 30867 1
5 '3D 1H-15N TOCSY' . . . 30867 1
6 '3D C(CO)NH' . . . 30867 1
7 '3D HCCH-TOCSY' . . . 30867 1
8 '3D H(CCO)NH' . . . 30867 1
9 '3D HNCA' . . . 30867 1
10 '2D 1H-13C HSQC' . . . 30867 1
11 '3D HNCO' . . . 30867 1
12 '3D HNCACB' . . . 30867 1
13 '2D 1H-15N HSQC' . . . 30867 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 MET C C 13 172.368 0.000 . . . . . . A 1 MET C . 30867 1
2 . 1 . 1 1 1 MET CA C 13 55.263 0.078 . . . . . . A 1 MET CA . 30867 1
3 . 1 . 1 1 1 MET CB C 13 30.827 0.000 . . . . . . A 1 MET CB . 30867 1
4 . 1 . 1 1 1 MET N N 15 119.975 0.044 . . . . . . A 1 MET N . 30867 1
5 . 1 . 1 2 2 ARG H H 1 8.841 0.001 . . . . . . A 2 ARG H . 30867 1
6 . 1 . 1 2 2 ARG HA H 1 4.419 0.003 . . . . . . A 2 ARG HA . 30867 1
7 . 1 . 1 2 2 ARG HB2 H 1 1.838 0.000 . . . . . . A 2 ARG HB2 . 30867 1
8 . 1 . 1 2 2 ARG HB3 H 1 1.838 0.000 . . . . . . A 2 ARG HB3 . 30867 1
9 . 1 . 1 2 2 ARG HG2 H 1 1.693 0.000 . . . . . . A 2 ARG HG2 . 30867 1
10 . 1 . 1 2 2 ARG HG3 H 1 1.693 0.000 . . . . . . A 2 ARG HG3 . 30867 1
11 . 1 . 1 2 2 ARG HD2 H 1 3.226 0.000 . . . . . . A 2 ARG HD2 . 30867 1
12 . 1 . 1 2 2 ARG HD3 H 1 3.226 0.000 . . . . . . A 2 ARG HD3 . 30867 1
13 . 1 . 1 2 2 ARG HE H 1 7.206 0.001 . . . . . . A 2 ARG HE . 30867 1
14 . 1 . 1 2 2 ARG C C 13 176.433 0.000 . . . . . . A 2 ARG C . 30867 1
15 . 1 . 1 2 2 ARG CA C 13 56.735 0.032 . . . . . . A 2 ARG CA . 30867 1
16 . 1 . 1 2 2 ARG CB C 13 30.782 0.016 . . . . . . A 2 ARG CB . 30867 1
17 . 1 . 1 2 2 ARG CG C 13 27.170 0.000 . . . . . . A 2 ARG CG . 30867 1
18 . 1 . 1 2 2 ARG N N 15 124.261 0.085 . . . . . . A 2 ARG N . 30867 1
19 . 1 . 1 3 3 GLY H H 1 8.579 0.001 . . . . . . A 3 GLY H . 30867 1
20 . 1 . 1 3 3 GLY HA2 H 1 3.994 0.005 . . . . . . A 3 GLY HA2 . 30867 1
21 . 1 . 1 3 3 GLY HA3 H 1 3.994 0.005 . . . . . . A 3 GLY HA3 . 30867 1
22 . 1 . 1 3 3 GLY C C 13 173.938 0.000 . . . . . . A 3 GLY C . 30867 1
23 . 1 . 1 3 3 GLY CA C 13 45.205 0.053 . . . . . . A 3 GLY CA . 30867 1
24 . 1 . 1 3 3 GLY N N 15 110.755 0.052 . . . . . . A 3 GLY N . 30867 1
25 . 1 . 1 4 4 SER H H 1 8.187 0.004 . . . . . . A 4 SER H . 30867 1
26 . 1 . 1 4 4 SER HA H 1 4.415 0.008 . . . . . . A 4 SER HA . 30867 1
27 . 1 . 1 4 4 SER HB2 H 1 3.787 0.006 . . . . . . A 4 SER HB2 . 30867 1
28 . 1 . 1 4 4 SER HB3 H 1 3.787 0.006 . . . . . . A 4 SER HB3 . 30867 1
29 . 1 . 1 4 4 SER C C 13 174.561 0.000 . . . . . . A 4 SER C . 30867 1
30 . 1 . 1 4 4 SER CA C 13 58.286 0.040 . . . . . . A 4 SER CA . 30867 1
31 . 1 . 1 4 4 SER CB C 13 63.977 0.025 . . . . . . A 4 SER CB . 30867 1
32 . 1 . 1 4 4 SER N N 15 114.920 0.032 . . . . . . A 4 SER N . 30867 1
33 . 1 . 1 5 5 HIS H H 1 8.613 0.002 . . . . . . A 5 HIS H . 30867 1
34 . 1 . 1 5 5 HIS HA H 1 4.695 0.000 . . . . . . A 5 HIS HA . 30867 1
35 . 1 . 1 5 5 HIS HB2 H 1 3.097 0.000 . . . . . . A 5 HIS HB2 . 30867 1
36 . 1 . 1 5 5 HIS HB3 H 1 3.237 0.000 . . . . . . A 5 HIS HB3 . 30867 1
37 . 1 . 1 5 5 HIS C C 13 174.227 0.000 . . . . . . A 5 HIS C . 30867 1
38 . 1 . 1 5 5 HIS CA C 13 55.308 0.025 . . . . . . A 5 HIS CA . 30867 1
39 . 1 . 1 5 5 HIS CB C 13 29.011 0.071 . . . . . . A 5 HIS CB . 30867 1
40 . 1 . 1 5 5 HIS N N 15 119.925 0.064 . . . . . . A 5 HIS N . 30867 1
41 . 1 . 1 6 6 HIS N N 15 118.921 0.046 . . . . . . A 6 HIS N . 30867 1
42 . 1 . 1 10 10 HIS H H 1 8.526 0.003 . . . . . . A 10 HIS H . 30867 1
43 . 1 . 1 10 10 HIS HA H 1 4.691 0.003 . . . . . . A 10 HIS HA . 30867 1
44 . 1 . 1 10 10 HIS HB2 H 1 3.108 0.002 . . . . . . A 10 HIS HB2 . 30867 1
45 . 1 . 1 10 10 HIS HB3 H 1 3.223 0.001 . . . . . . A 10 HIS HB3 . 30867 1
46 . 1 . 1 10 10 HIS CA C 13 55.578 0.085 . . . . . . A 10 HIS CA . 30867 1
47 . 1 . 1 10 10 HIS CB C 13 29.334 0.015 . . . . . . A 10 HIS CB . 30867 1
48 . 1 . 1 10 10 HIS N N 15 120.987 0.033 . . . . . . A 10 HIS N . 30867 1
49 . 1 . 1 11 11 GLY H H 1 8.556 0.001 . . . . . . A 11 GLY H . 30867 1
50 . 1 . 1 11 11 GLY HA2 H 1 4.033 0.006 . . . . . . A 11 GLY HA2 . 30867 1
51 . 1 . 1 11 11 GLY HA3 H 1 4.033 0.006 . . . . . . A 11 GLY HA3 . 30867 1
52 . 1 . 1 11 11 GLY C C 13 173.942 0.000 . . . . . . A 11 GLY C . 30867 1
53 . 1 . 1 11 11 GLY CA C 13 45.210 0.066 . . . . . . A 11 GLY CA . 30867 1
54 . 1 . 1 11 11 GLY N N 15 110.904 0.068 . . . . . . A 11 GLY N . 30867 1
55 . 1 . 1 12 12 SER H H 1 8.343 0.005 . . . . . . A 12 SER H . 30867 1
56 . 1 . 1 12 12 SER HA H 1 4.525 0.000 . . . . . . A 12 SER HA . 30867 1
57 . 1 . 1 12 12 SER HB2 H 1 3.873 0.000 . . . . . . A 12 SER HB2 . 30867 1
58 . 1 . 1 12 12 SER HB3 H 1 3.873 0.000 . . . . . . A 12 SER HB3 . 30867 1
59 . 1 . 1 12 12 SER C C 13 174.689 0.000 . . . . . . A 12 SER C . 30867 1
60 . 1 . 1 12 12 SER CA C 13 58.493 0.032 . . . . . . A 12 SER CA . 30867 1
61 . 1 . 1 12 12 SER CB C 13 63.905 0.155 . . . . . . A 12 SER CB . 30867 1
62 . 1 . 1 12 12 SER N N 15 115.958 0.053 . . . . . . A 12 SER N . 30867 1
63 . 1 . 1 13 13 ILE H H 1 8.317 0.001 . . . . . . A 13 ILE H . 30867 1
64 . 1 . 1 13 13 ILE HA H 1 4.214 0.000 . . . . . . A 13 ILE HA . 30867 1
65 . 1 . 1 13 13 ILE HB H 1 1.876 0.000 . . . . . . A 13 ILE HB . 30867 1
66 . 1 . 1 13 13 ILE HG12 H 1 1.447 0.000 . . . . . . A 13 ILE HG12 . 30867 1
67 . 1 . 1 13 13 ILE HG21 H 1 1.163 0.000 . . . . . . A 13 ILE HG21 . 30867 1
68 . 1 . 1 13 13 ILE HG22 H 1 1.163 0.000 . . . . . . A 13 ILE HG22 . 30867 1
69 . 1 . 1 13 13 ILE HG23 H 1 1.163 0.000 . . . . . . A 13 ILE HG23 . 30867 1
70 . 1 . 1 13 13 ILE HD11 H 1 0.885 0.000 . . . . . . A 13 ILE HD11 . 30867 1
71 . 1 . 1 13 13 ILE HD12 H 1 0.885 0.000 . . . . . . A 13 ILE HD12 . 30867 1
72 . 1 . 1 13 13 ILE HD13 H 1 0.885 0.000 . . . . . . A 13 ILE HD13 . 30867 1
73 . 1 . 1 13 13 ILE C C 13 176.128 0.000 . . . . . . A 13 ILE C . 30867 1
74 . 1 . 1 13 13 ILE CA C 13 61.294 0.046 . . . . . . A 13 ILE CA . 30867 1
75 . 1 . 1 13 13 ILE CB C 13 38.878 0.018 . . . . . . A 13 ILE CB . 30867 1
76 . 1 . 1 13 13 ILE N N 15 122.088 0.055 . . . . . . A 13 ILE N . 30867 1
77 . 1 . 1 14 14 GLU H H 1 8.411 0.001 . . . . . . A 14 GLU H . 30867 1
78 . 1 . 1 14 14 GLU HA H 1 4.374 0.000 . . . . . . A 14 GLU HA . 30867 1
79 . 1 . 1 14 14 GLU HB2 H 1 1.924 0.000 . . . . . . A 14 GLU HB2 . 30867 1
80 . 1 . 1 14 14 GLU HB3 H 1 1.974 0.000 . . . . . . A 14 GLU HB3 . 30867 1
81 . 1 . 1 14 14 GLU HG2 H 1 2.089 0.000 . . . . . . A 14 GLU HG2 . 30867 1
82 . 1 . 1 14 14 GLU HG3 H 1 2.448 0.000 . . . . . . A 14 GLU HG3 . 30867 1
83 . 1 . 1 14 14 GLU C C 13 176.645 0.000 . . . . . . A 14 GLU C . 30867 1
84 . 1 . 1 14 14 GLU CA C 13 56.702 0.020 . . . . . . A 14 GLU CA . 30867 1
85 . 1 . 1 14 14 GLU CB C 13 30.087 0.003 . . . . . . A 14 GLU CB . 30867 1
86 . 1 . 1 14 14 GLU N N 15 124.463 0.071 . . . . . . A 14 GLU N . 30867 1
87 . 1 . 1 15 15 GLY H H 1 8.370 0.001 . . . . . . A 15 GLY H . 30867 1
88 . 1 . 1 15 15 GLY HA2 H 1 3.853 0.005 . . . . . . A 15 GLY HA2 . 30867 1
89 . 1 . 1 15 15 GLY HA3 H 1 3.940 0.002 . . . . . . A 15 GLY HA3 . 30867 1
90 . 1 . 1 15 15 GLY C C 13 173.417 0.000 . . . . . . A 15 GLY C . 30867 1
91 . 1 . 1 15 15 GLY CA C 13 45.599 0.030 . . . . . . A 15 GLY CA . 30867 1
92 . 1 . 1 15 15 GLY N N 15 110.073 0.072 . . . . . . A 15 GLY N . 30867 1
93 . 1 . 1 16 16 ARG H H 1 8.031 0.000 . . . . . . A 16 ARG H . 30867 1
94 . 1 . 1 16 16 ARG HA H 1 4.594 0.000 . . . . . . A 16 ARG HA . 30867 1
95 . 1 . 1 16 16 ARG HB2 H 1 1.664 0.000 . . . . . . A 16 ARG HB2 . 30867 1
96 . 1 . 1 16 16 ARG HB3 H 1 1.568 0.000 . . . . . . A 16 ARG HB3 . 30867 1
97 . 1 . 1 16 16 ARG HG3 H 1 1.851 0.000 . . . . . . A 16 ARG HG3 . 30867 1
98 . 1 . 1 16 16 ARG HD2 H 1 3.128 0.000 . . . . . . A 16 ARG HD2 . 30867 1
99 . 1 . 1 16 16 ARG HD3 H 1 3.128 0.000 . . . . . . A 16 ARG HD3 . 30867 1
100 . 1 . 1 16 16 ARG HE H 1 7.163 0.000 . . . . . . A 16 ARG HE . 30867 1
101 . 1 . 1 16 16 ARG C C 13 175.250 0.000 . . . . . . A 16 ARG C . 30867 1
102 . 1 . 1 16 16 ARG CA C 13 55.668 0.094 . . . . . . A 16 ARG CA . 30867 1
103 . 1 . 1 16 16 ARG CB C 13 32.445 0.000 . . . . . . A 16 ARG CB . 30867 1
104 . 1 . 1 16 16 ARG N N 15 119.772 0.063 . . . . . . A 16 ARG N . 30867 1
105 . 1 . 1 17 17 MET H H 1 8.393 0.003 . . . . . . A 17 MET H . 30867 1
106 . 1 . 1 17 17 MET HA H 1 4.660 0.002 . . . . . . A 17 MET HA . 30867 1
107 . 1 . 1 17 17 MET HB3 H 1 2.024 0.000 . . . . . . A 17 MET HB3 . 30867 1
108 . 1 . 1 17 17 MET HG2 H 1 2.400 0.000 . . . . . . A 17 MET HG2 . 30867 1
109 . 1 . 1 17 17 MET HG3 H 1 2.400 0.000 . . . . . . A 17 MET HG3 . 30867 1
110 . 1 . 1 17 17 MET HE1 H 1 1.936 0.005 . . . . . . A 17 MET HE1 . 30867 1
111 . 1 . 1 17 17 MET HE2 H 1 1.936 0.005 . . . . . . A 17 MET HE2 . 30867 1
112 . 1 . 1 17 17 MET HE3 H 1 1.936 0.005 . . . . . . A 17 MET HE3 . 30867 1
113 . 1 . 1 17 17 MET C C 13 173.757 0.000 . . . . . . A 17 MET C . 30867 1
114 . 1 . 1 17 17 MET CA C 13 55.153 0.041 . . . . . . A 17 MET CA . 30867 1
115 . 1 . 1 17 17 MET CB C 13 35.909 0.069 . . . . . . A 17 MET CB . 30867 1
116 . 1 . 1 17 17 MET N N 15 122.066 0.043 . . . . . . A 17 MET N . 30867 1
117 . 1 . 1 18 18 ILE H H 1 7.731 0.004 . . . . . . A 18 ILE H . 30867 1
118 . 1 . 1 18 18 ILE HA H 1 4.755 0.004 . . . . . . A 18 ILE HA . 30867 1
119 . 1 . 1 18 18 ILE HG12 H 1 1.035 0.003 . . . . . . A 18 ILE HG12 . 30867 1
120 . 1 . 1 18 18 ILE HG13 H 1 1.438 0.005 . . . . . . A 18 ILE HG13 . 30867 1
121 . 1 . 1 18 18 ILE HG21 H 1 0.739 0.005 . . . . . . A 18 ILE HG21 . 30867 1
122 . 1 . 1 18 18 ILE HG22 H 1 0.739 0.005 . . . . . . A 18 ILE HG22 . 30867 1
123 . 1 . 1 18 18 ILE HG23 H 1 0.739 0.005 . . . . . . A 18 ILE HG23 . 30867 1
124 . 1 . 1 18 18 ILE HD11 H 1 0.647 0.004 . . . . . . A 18 ILE HD11 . 30867 1
125 . 1 . 1 18 18 ILE HD12 H 1 0.647 0.004 . . . . . . A 18 ILE HD12 . 30867 1
126 . 1 . 1 18 18 ILE HD13 H 1 0.647 0.004 . . . . . . A 18 ILE HD13 . 30867 1
127 . 1 . 1 18 18 ILE C C 13 175.455 0.000 . . . . . . A 18 ILE C . 30867 1
128 . 1 . 1 18 18 ILE CA C 13 59.930 0.053 . . . . . . A 18 ILE CA . 30867 1
129 . 1 . 1 18 18 ILE CB C 13 39.269 0.026 . . . . . . A 18 ILE CB . 30867 1
130 . 1 . 1 18 18 ILE N N 15 123.962 0.083 . . . . . . A 18 ILE N . 30867 1
131 . 1 . 1 19 19 CYS H H 1 8.566 0.005 . . . . . . A 19 CYS H . 30867 1
132 . 1 . 1 19 19 CYS HA H 1 5.101 0.004 . . . . . . A 19 CYS HA . 30867 1
133 . 1 . 1 19 19 CYS HB2 H 1 2.246 0.004 . . . . . . A 19 CYS HB2 . 30867 1
134 . 1 . 1 19 19 CYS HB3 H 1 2.989 0.001 . . . . . . A 19 CYS HB3 . 30867 1
135 . 1 . 1 19 19 CYS C C 13 175.442 0.000 . . . . . . A 19 CYS C . 30867 1
136 . 1 . 1 19 19 CYS CA C 13 51.310 0.008 . . . . . . A 19 CYS CA . 30867 1
137 . 1 . 1 19 19 CYS CB C 13 40.564 0.008 . . . . . . A 19 CYS CB . 30867 1
138 . 1 . 1 19 19 CYS N N 15 123.137 0.056 . . . . . . A 19 CYS N . 30867 1
139 . 1 . 1 20 20 TYR H H 1 9.289 0.003 . . . . . . A 20 TYR H . 30867 1
140 . 1 . 1 20 20 TYR HA H 1 5.181 0.004 . . . . . . A 20 TYR HA . 30867 1
141 . 1 . 1 20 20 TYR HB2 H 1 2.367 0.000 . . . . . . A 20 TYR HB2 . 30867 1
142 . 1 . 1 20 20 TYR HB3 H 1 3.802 0.001 . . . . . . A 20 TYR HB3 . 30867 1
143 . 1 . 1 20 20 TYR HE1 H 1 7.165 0.007 . . . . . . A 20 TYR HE1 . 30867 1
144 . 1 . 1 20 20 TYR C C 13 177.778 0.000 . . . . . . A 20 TYR C . 30867 1
145 . 1 . 1 20 20 TYR CA C 13 60.417 0.041 . . . . . . A 20 TYR CA . 30867 1
146 . 1 . 1 20 20 TYR CB C 13 37.683 0.084 . . . . . . A 20 TYR CB . 30867 1
147 . 1 . 1 20 20 TYR N N 15 121.456 0.048 . . . . . . A 20 TYR N . 30867 1
148 . 1 . 1 21 21 ASN H H 1 8.893 0.000 . . . . . . A 21 ASN H . 30867 1
149 . 1 . 1 21 21 ASN HA H 1 4.883 0.000 . . . . . . A 21 ASN HA . 30867 1
150 . 1 . 1 21 21 ASN HB2 H 1 2.072 0.000 . . . . . . A 21 ASN HB2 . 30867 1
151 . 1 . 1 21 21 ASN HB3 H 1 3.058 0.000 . . . . . . A 21 ASN HB3 . 30867 1
152 . 1 . 1 21 21 ASN HD21 H 1 6.836 0.007 . . . . . . A 21 ASN HD21 . 30867 1
153 . 1 . 1 21 21 ASN HD22 H 1 7.496 0.001 . . . . . . A 21 ASN HD22 . 30867 1
154 . 1 . 1 21 21 ASN C C 13 174.660 0.000 . . . . . . A 21 ASN C . 30867 1
155 . 1 . 1 21 21 ASN CA C 13 51.960 0.007 . . . . . . A 21 ASN CA . 30867 1
156 . 1 . 1 21 21 ASN CB C 13 40.004 0.050 . . . . . . A 21 ASN CB . 30867 1
157 . 1 . 1 21 21 ASN N N 15 116.541 0.064 . . . . . . A 21 ASN N . 30867 1
158 . 1 . 1 22 22 GLN H H 1 9.503 0.000 . . . . . . A 22 GLN H . 30867 1
159 . 1 . 1 22 22 GLN HA H 1 4.592 0.003 . . . . . . A 22 GLN HA . 30867 1
160 . 1 . 1 22 22 GLN HB2 H 1 2.069 0.000 . . . . . . A 22 GLN HB2 . 30867 1
161 . 1 . 1 22 22 GLN HB3 H 1 1.923 0.002 . . . . . . A 22 GLN HB3 . 30867 1
162 . 1 . 1 22 22 GLN HG2 H 1 2.640 0.003 . . . . . . A 22 GLN HG2 . 30867 1
163 . 1 . 1 22 22 GLN HG3 H 1 2.372 0.001 . . . . . . A 22 GLN HG3 . 30867 1
164 . 1 . 1 22 22 GLN HE21 H 1 6.273 0.006 . . . . . . A 22 GLN HE21 . 30867 1
165 . 1 . 1 22 22 GLN HE22 H 1 7.654 0.001 . . . . . . A 22 GLN HE22 . 30867 1
166 . 1 . 1 22 22 GLN CA C 13 55.899 0.012 . . . . . . A 22 GLN CA . 30867 1
167 . 1 . 1 22 22 GLN CB C 13 27.165 0.076 . . . . . . A 22 GLN CB . 30867 1
168 . 1 . 1 22 22 GLN N N 15 126.823 0.068 . . . . . . A 22 GLN N . 30867 1
169 . 1 . 1 23 23 GLN H H 1 8.403 0.000 . . . . . . A 23 GLN H . 30867 1
170 . 1 . 1 23 23 GLN HA H 1 4.858 0.000 . . . . . . A 23 GLN HA . 30867 1
171 . 1 . 1 23 23 GLN HB2 H 1 2.083 0.003 . . . . . . A 23 GLN HB2 . 30867 1
172 . 1 . 1 23 23 GLN HB3 H 1 2.176 0.004 . . . . . . A 23 GLN HB3 . 30867 1
173 . 1 . 1 23 23 GLN HG3 H 1 2.592 0.008 . . . . . . A 23 GLN HG3 . 30867 1
174 . 1 . 1 23 23 GLN HE21 H 1 6.915 0.006 . . . . . . A 23 GLN HE21 . 30867 1
175 . 1 . 1 23 23 GLN HE22 H 1 7.487 0.004 . . . . . . A 23 GLN HE22 . 30867 1
176 . 1 . 1 23 23 GLN C C 13 176.811 0.000 . . . . . . A 23 GLN C . 30867 1
177 . 1 . 1 23 23 GLN CA C 13 54.622 0.062 . . . . . . A 23 GLN CA . 30867 1
178 . 1 . 1 23 23 GLN CB C 13 30.949 0.016 . . . . . . A 23 GLN CB . 30867 1
179 . 1 . 1 23 23 GLN N N 15 121.731 0.082 . . . . . . A 23 GLN N . 30867 1
180 . 1 . 1 24 24 SER H H 1 9.696 0.000 . . . . . . A 24 SER H . 30867 1
181 . 1 . 1 24 24 SER HA H 1 4.158 0.004 . . . . . . A 24 SER HA . 30867 1
182 . 1 . 1 24 24 SER HB2 H 1 4.018 0.004 . . . . . . A 24 SER HB2 . 30867 1
183 . 1 . 1 24 24 SER HB3 H 1 3.953 0.000 . . . . . . A 24 SER HB3 . 30867 1
184 . 1 . 1 24 24 SER CA C 13 60.205 0.013 . . . . . . A 24 SER CA . 30867 1
185 . 1 . 1 24 24 SER CB C 13 62.478 0.031 . . . . . . A 24 SER CB . 30867 1
186 . 1 . 1 24 24 SER N N 15 116.230 0.047 . . . . . . A 24 SER N . 30867 1
187 . 1 . 1 25 25 SER H H 1 8.332 0.002 . . . . . . A 25 SER H . 30867 1
188 . 1 . 1 25 25 SER HA H 1 4.713 0.000 . . . . . . A 25 SER HA . 30867 1
189 . 1 . 1 25 25 SER HB2 H 1 3.988 0.000 . . . . . . A 25 SER HB2 . 30867 1
190 . 1 . 1 25 25 SER HB3 H 1 4.052 0.000 . . . . . . A 25 SER HB3 . 30867 1
191 . 1 . 1 25 25 SER C C 13 174.017 0.000 . . . . . . A 25 SER C . 30867 1
192 . 1 . 1 25 25 SER CA C 13 57.726 0.015 . . . . . . A 25 SER CA . 30867 1
193 . 1 . 1 25 25 SER CB C 13 62.979 0.000 . . . . . . A 25 SER CB . 30867 1
194 . 1 . 1 25 25 SER N N 15 119.560 0.106 . . . . . . A 25 SER N . 30867 1
195 . 1 . 1 26 26 GLN H H 1 8.087 0.000 . . . . . . A 26 GLN H . 30867 1
196 . 1 . 1 26 26 GLN HA H 1 4.368 0.001 . . . . . . A 26 GLN HA . 30867 1
197 . 1 . 1 26 26 GLN HB2 H 1 2.060 0.000 . . . . . . A 26 GLN HB2 . 30867 1
198 . 1 . 1 26 26 GLN HB3 H 1 2.320 0.003 . . . . . . A 26 GLN HB3 . 30867 1
199 . 1 . 1 26 26 GLN HG2 H 1 2.502 0.002 . . . . . . A 26 GLN HG2 . 30867 1
200 . 1 . 1 26 26 GLN HG3 H 1 2.646 0.004 . . . . . . A 26 GLN HG3 . 30867 1
201 . 1 . 1 26 26 GLN HE21 H 1 6.951 0.002 . . . . . . A 26 GLN HE21 . 30867 1
202 . 1 . 1 26 26 GLN HE22 H 1 7.649 0.004 . . . . . . A 26 GLN HE22 . 30867 1
203 . 1 . 1 26 26 GLN CA C 13 55.289 0.008 . . . . . . A 26 GLN CA . 30867 1
204 . 1 . 1 26 26 GLN CB C 13 27.425 0.000 . . . . . . A 26 GLN CB . 30867 1
205 . 1 . 1 26 26 GLN N N 15 121.091 0.033 . . . . . . A 26 GLN N . 30867 1
206 . 1 . 1 27 27 PRO HB3 H 1 2.085 0.000 . . . . . . A 27 PRO HB3 . 30867 1
207 . 1 . 1 27 27 PRO HG2 H 1 1.840 0.000 . . . . . . A 27 PRO HG2 . 30867 1
208 . 1 . 1 27 27 PRO HG3 H 1 1.840 0.000 . . . . . . A 27 PRO HG3 . 30867 1
209 . 1 . 1 27 27 PRO HD2 H 1 3.641 0.000 . . . . . . A 27 PRO HD2 . 30867 1
210 . 1 . 1 28 28 PRO HB2 H 1 1.922 0.000 . . . . . . A 28 PRO HB2 . 30867 1
211 . 1 . 1 28 28 PRO HB3 H 1 2.091 0.000 . . . . . . A 28 PRO HB3 . 30867 1
212 . 1 . 1 28 28 PRO HG2 H 1 1.840 0.000 . . . . . . A 28 PRO HG2 . 30867 1
213 . 1 . 1 28 28 PRO HG3 H 1 1.840 0.000 . . . . . . A 28 PRO HG3 . 30867 1
214 . 1 . 1 28 28 PRO HD2 H 1 3.850 0.001 . . . . . . A 28 PRO HD2 . 30867 1
215 . 1 . 1 28 28 PRO HD3 H 1 3.604 0.000 . . . . . . A 28 PRO HD3 . 30867 1
216 . 1 . 1 28 28 PRO C C 13 176.821 0.000 . . . . . . A 28 PRO C . 30867 1
217 . 1 . 1 28 28 PRO CA C 13 63.851 0.000 . . . . . . A 28 PRO CA . 30867 1
218 . 1 . 1 28 28 PRO CB C 13 32.513 0.000 . . . . . . A 28 PRO CB . 30867 1
219 . 1 . 1 28 28 PRO CG C 13 27.960 0.000 . . . . . . A 28 PRO CG . 30867 1
220 . 1 . 1 29 29 THR H H 1 8.093 0.005 . . . . . . A 29 THR H . 30867 1
221 . 1 . 1 29 29 THR HA H 1 4.731 0.001 . . . . . . A 29 THR HA . 30867 1
222 . 1 . 1 29 29 THR HB H 1 4.490 0.005 . . . . . . A 29 THR HB . 30867 1
223 . 1 . 1 29 29 THR HG21 H 1 1.260 0.003 . . . . . . A 29 THR HG21 . 30867 1
224 . 1 . 1 29 29 THR HG22 H 1 1.260 0.003 . . . . . . A 29 THR HG22 . 30867 1
225 . 1 . 1 29 29 THR HG23 H 1 1.260 0.003 . . . . . . A 29 THR HG23 . 30867 1
226 . 1 . 1 29 29 THR C C 13 173.368 0.000 . . . . . . A 29 THR C . 30867 1
227 . 1 . 1 29 29 THR CA C 13 60.359 0.045 . . . . . . A 29 THR CA . 30867 1
228 . 1 . 1 29 29 THR CB C 13 72.788 0.052 . . . . . . A 29 THR CB . 30867 1
229 . 1 . 1 29 29 THR N N 15 114.732 0.058 . . . . . . A 29 THR N . 30867 1
230 . 1 . 1 30 30 THR H H 1 8.304 0.001 . . . . . . A 30 THR H . 30867 1
231 . 1 . 1 30 30 THR HA H 1 5.240 0.004 . . . . . . A 30 THR HA . 30867 1
232 . 1 . 1 30 30 THR HB H 1 3.800 0.002 . . . . . . A 30 THR HB . 30867 1
233 . 1 . 1 30 30 THR HG21 H 1 0.588 0.005 . . . . . . A 30 THR HG21 . 30867 1
234 . 1 . 1 30 30 THR HG22 H 1 0.588 0.005 . . . . . . A 30 THR HG22 . 30867 1
235 . 1 . 1 30 30 THR HG23 H 1 0.588 0.005 . . . . . . A 30 THR HG23 . 30867 1
236 . 1 . 1 30 30 THR C C 13 173.959 0.000 . . . . . . A 30 THR C . 30867 1
237 . 1 . 1 30 30 THR CA C 13 59.146 0.050 . . . . . . A 30 THR CA . 30867 1
238 . 1 . 1 30 30 THR CB C 13 72.650 0.008 . . . . . . A 30 THR CB . 30867 1
239 . 1 . 1 30 30 THR N N 15 108.824 0.054 . . . . . . A 30 THR N . 30867 1
240 . 1 . 1 31 31 LYS H H 1 8.787 0.003 . . . . . . A 31 LYS H . 30867 1
241 . 1 . 1 31 31 LYS HA H 1 4.676 0.001 . . . . . . A 31 LYS HA . 30867 1
242 . 1 . 1 31 31 LYS HB2 H 1 1.752 0.006 . . . . . . A 31 LYS HB2 . 30867 1
243 . 1 . 1 31 31 LYS HB3 H 1 1.752 0.006 . . . . . . A 31 LYS HB3 . 30867 1
244 . 1 . 1 31 31 LYS HG2 H 1 1.307 0.001 . . . . . . A 31 LYS HG2 . 30867 1
245 . 1 . 1 31 31 LYS HG3 H 1 1.307 0.001 . . . . . . A 31 LYS HG3 . 30867 1
246 . 1 . 1 31 31 LYS HD2 H 1 1.597 0.002 . . . . . . A 31 LYS HD2 . 30867 1
247 . 1 . 1 31 31 LYS HD3 H 1 1.597 0.002 . . . . . . A 31 LYS HD3 . 30867 1
248 . 1 . 1 31 31 LYS C C 13 173.970 0.000 . . . . . . A 31 LYS C . 30867 1
249 . 1 . 1 31 31 LYS CA C 13 54.505 0.011 . . . . . . A 31 LYS CA . 30867 1
250 . 1 . 1 31 31 LYS CB C 13 36.376 0.033 . . . . . . A 31 LYS CB . 30867 1
251 . 1 . 1 31 31 LYS N N 15 118.468 0.052 . . . . . . A 31 LYS N . 30867 1
252 . 1 . 1 32 32 THR H H 1 8.243 0.000 . . . . . . A 32 THR H . 30867 1
253 . 1 . 1 32 32 THR HA H 1 4.843 0.002 . . . . . . A 32 THR HA . 30867 1
254 . 1 . 1 32 32 THR HB H 1 4.053 0.002 . . . . . . A 32 THR HB . 30867 1
255 . 1 . 1 32 32 THR HG21 H 1 1.165 0.000 . . . . . . A 32 THR HG21 . 30867 1
256 . 1 . 1 32 32 THR HG22 H 1 1.165 0.000 . . . . . . A 32 THR HG22 . 30867 1
257 . 1 . 1 32 32 THR HG23 H 1 1.165 0.000 . . . . . . A 32 THR HG23 . 30867 1
258 . 1 . 1 32 32 THR C C 13 174.874 0.000 . . . . . . A 32 THR C . 30867 1
259 . 1 . 1 32 32 THR CA C 13 61.884 0.011 . . . . . . A 32 THR CA . 30867 1
260 . 1 . 1 32 32 THR CB C 13 69.501 0.112 . . . . . . A 32 THR CB . 30867 1
261 . 1 . 1 32 32 THR N N 15 115.112 0.062 . . . . . . A 32 THR N . 30867 1
262 . 1 . 1 33 33 CYS H H 1 9.233 0.000 . . . . . . A 33 CYS H . 30867 1
263 . 1 . 1 33 33 CYS HA H 1 5.146 0.000 . . . . . . A 33 CYS HA . 30867 1
264 . 1 . 1 33 33 CYS HB2 H 1 2.892 0.003 . . . . . . A 33 CYS HB2 . 30867 1
265 . 1 . 1 33 33 CYS HB3 H 1 3.493 0.002 . . . . . . A 33 CYS HB3 . 30867 1
266 . 1 . 1 33 33 CYS C C 13 174.488 0.000 . . . . . . A 33 CYS C . 30867 1
267 . 1 . 1 33 33 CYS CA C 13 53.112 0.008 . . . . . . A 33 CYS CA . 30867 1
268 . 1 . 1 33 33 CYS CB C 13 40.980 0.032 . . . . . . A 33 CYS CB . 30867 1
269 . 1 . 1 33 33 CYS N N 15 123.950 0.064 . . . . . . A 33 CYS N . 30867 1
270 . 1 . 1 34 34 SER H H 1 8.950 0.000 . . . . . . A 34 SER H . 30867 1
271 . 1 . 1 34 34 SER HA H 1 4.657 0.004 . . . . . . A 34 SER HA . 30867 1
272 . 1 . 1 34 34 SER HB2 H 1 3.910 0.003 . . . . . . A 34 SER HB2 . 30867 1
273 . 1 . 1 34 34 SER HB3 H 1 3.982 0.000 . . . . . . A 34 SER HB3 . 30867 1
274 . 1 . 1 34 34 SER CA C 13 59.448 0.546 . . . . . . A 34 SER CA . 30867 1
275 . 1 . 1 34 34 SER CB C 13 66.278 4.532 . . . . . . A 34 SER CB . 30867 1
276 . 1 . 1 34 34 SER N N 15 119.184 0.071 . . . . . . A 34 SER N . 30867 1
277 . 1 . 1 35 35 GLU H H 1 7.964 0.004 . . . . . . A 35 GLU H . 30867 1
278 . 1 . 1 35 35 GLU HA H 1 4.588 0.005 . . . . . . A 35 GLU HA . 30867 1
279 . 1 . 1 35 35 GLU HB2 H 1 1.984 0.002 . . . . . . A 35 GLU HB2 . 30867 1
280 . 1 . 1 35 35 GLU HB3 H 1 2.410 0.002 . . . . . . A 35 GLU HB3 . 30867 1
281 . 1 . 1 35 35 GLU HG2 H 1 2.499 0.001 . . . . . . A 35 GLU HG2 . 30867 1
282 . 1 . 1 35 35 GLU HG3 H 1 2.581 0.002 . . . . . . A 35 GLU HG3 . 30867 1
283 . 1 . 1 35 35 GLU C C 13 174.935 0.000 . . . . . . A 35 GLU C . 30867 1
284 . 1 . 1 35 35 GLU CA C 13 56.822 0.033 . . . . . . A 35 GLU CA . 30867 1
285 . 1 . 1 35 35 GLU CB C 13 31.247 0.046 . . . . . . A 35 GLU CB . 30867 1
286 . 1 . 1 35 35 GLU N N 15 118.968 5.148 . . . . . . A 35 GLU N . 30867 1
287 . 1 . 1 36 36 THR H H 1 8.137 0.001 . . . . . . A 36 THR H . 30867 1
288 . 1 . 1 36 36 THR HA H 1 4.640 0.000 . . . . . . A 36 THR HA . 30867 1
289 . 1 . 1 36 36 THR HB H 1 4.428 0.000 . . . . . . A 36 THR HB . 30867 1
290 . 1 . 1 36 36 THR HG21 H 1 1.190 0.002 . . . . . . A 36 THR HG21 . 30867 1
291 . 1 . 1 36 36 THR HG22 H 1 1.190 0.002 . . . . . . A 36 THR HG22 . 30867 1
292 . 1 . 1 36 36 THR HG23 H 1 1.190 0.002 . . . . . . A 36 THR HG23 . 30867 1
293 . 1 . 1 36 36 THR C C 13 174.079 0.000 . . . . . . A 36 THR C . 30867 1
294 . 1 . 1 36 36 THR CA C 13 60.907 0.033 . . . . . . A 36 THR CA . 30867 1
295 . 1 . 1 36 36 THR CB C 13 67.996 0.298 . . . . . . A 36 THR CB . 30867 1
296 . 1 . 1 36 36 THR N N 15 106.792 0.061 . . . . . . A 36 THR N . 30867 1
297 . 1 . 1 37 37 SER H H 1 7.233 0.006 . . . . . . A 37 SER H . 30867 1
298 . 1 . 1 37 37 SER HA H 1 5.046 0.000 . . . . . . A 37 SER HA . 30867 1
299 . 1 . 1 37 37 SER HB2 H 1 3.615 0.000 . . . . . . A 37 SER HB2 . 30867 1
300 . 1 . 1 37 37 SER HB3 H 1 3.615 0.000 . . . . . . A 37 SER HB3 . 30867 1
301 . 1 . 1 37 37 SER C C 13 172.177 0.000 . . . . . . A 37 SER C . 30867 1
302 . 1 . 1 37 37 SER CA C 13 57.440 0.004 . . . . . . A 37 SER CA . 30867 1
303 . 1 . 1 37 37 SER CB C 13 66.935 0.051 . . . . . . A 37 SER CB . 30867 1
304 . 1 . 1 37 37 SER N N 15 112.687 0.051 . . . . . . A 37 SER N . 30867 1
305 . 1 . 1 38 38 CYS H H 1 9.165 0.000 . . . . . . A 38 CYS H . 30867 1
306 . 1 . 1 38 38 CYS HA H 1 5.748 0.003 . . . . . . A 38 CYS HA . 30867 1
307 . 1 . 1 38 38 CYS HB2 H 1 2.689 0.005 . . . . . . A 38 CYS HB2 . 30867 1
308 . 1 . 1 38 38 CYS HB3 H 1 3.450 0.000 . . . . . . A 38 CYS HB3 . 30867 1
309 . 1 . 1 38 38 CYS C C 13 175.393 0.000 . . . . . . A 38 CYS C . 30867 1
310 . 1 . 1 38 38 CYS CA C 13 52.769 0.027 . . . . . . A 38 CYS CA . 30867 1
311 . 1 . 1 38 38 CYS CB C 13 40.352 0.024 . . . . . . A 38 CYS CB . 30867 1
312 . 1 . 1 38 38 CYS N N 15 118.246 0.031 . . . . . . A 38 CYS N . 30867 1
313 . 1 . 1 39 39 TYR H H 1 8.715 0.000 . . . . . . A 39 TYR H . 30867 1
314 . 1 . 1 39 39 TYR HA H 1 5.172 0.000 . . . . . . A 39 TYR HA . 30867 1
315 . 1 . 1 39 39 TYR HB2 H 1 2.922 0.000 . . . . . . A 39 TYR HB2 . 30867 1
316 . 1 . 1 39 39 TYR HB3 H 1 3.792 0.000 . . . . . . A 39 TYR HB3 . 30867 1
317 . 1 . 1 39 39 TYR HD1 H 1 8.242 0.001 . . . . . . A 39 TYR HD1 . 30867 1
318 . 1 . 1 39 39 TYR HD2 H 1 8.027 0.001 . . . . . . A 39 TYR HD2 . 30867 1
319 . 1 . 1 39 39 TYR HE1 H 1 6.138 0.003 . . . . . . A 39 TYR HE1 . 30867 1
320 . 1 . 1 39 39 TYR HE2 H 1 6.138 0.003 . . . . . . A 39 TYR HE2 . 30867 1
321 . 1 . 1 39 39 TYR C C 13 175.309 0.000 . . . . . . A 39 TYR C . 30867 1
322 . 1 . 1 39 39 TYR CA C 13 56.627 0.051 . . . . . . A 39 TYR CA . 30867 1
323 . 1 . 1 39 39 TYR CB C 13 42.166 0.022 . . . . . . A 39 TYR CB . 30867 1
324 . 1 . 1 39 39 TYR N N 15 113.351 0.057 . . . . . . A 39 TYR N . 30867 1
325 . 1 . 1 40 40 LYS H H 1 9.083 0.001 . . . . . . A 40 LYS H . 30867 1
326 . 1 . 1 40 40 LYS HA H 1 5.175 0.005 . . . . . . A 40 LYS HA . 30867 1
327 . 1 . 1 40 40 LYS HB2 H 1 1.914 0.000 . . . . . . A 40 LYS HB2 . 30867 1
328 . 1 . 1 40 40 LYS HB3 H 1 1.699 0.003 . . . . . . A 40 LYS HB3 . 30867 1
329 . 1 . 1 40 40 LYS HG2 H 1 1.280 0.002 . . . . . . A 40 LYS HG2 . 30867 1
330 . 1 . 1 40 40 LYS HG3 H 1 1.540 0.001 . . . . . . A 40 LYS HG3 . 30867 1
331 . 1 . 1 40 40 LYS HD2 H 1 0.843 0.006 . . . . . . A 40 LYS HD2 . 30867 1
332 . 1 . 1 40 40 LYS HD3 H 1 1.182 0.000 . . . . . . A 40 LYS HD3 . 30867 1
333 . 1 . 1 40 40 LYS HZ1 H 1 6.722 0.002 . . . . . . A 40 LYS HZ1 . 30867 1
334 . 1 . 1 40 40 LYS HZ2 H 1 6.722 0.002 . . . . . . A 40 LYS HZ2 . 30867 1
335 . 1 . 1 40 40 LYS HZ3 H 1 6.722 0.002 . . . . . . A 40 LYS HZ3 . 30867 1
336 . 1 . 1 40 40 LYS CA C 13 56.226 0.023 . . . . . . A 40 LYS CA . 30867 1
337 . 1 . 1 40 40 LYS CB C 13 37.570 0.000 . . . . . . A 40 LYS CB . 30867 1
338 . 1 . 1 40 40 LYS N N 15 124.583 0.052 . . . . . . A 40 LYS N . 30867 1
339 . 1 . 1 41 41 LYS H H 1 10.094 0.002 . . . . . . A 41 LYS H . 30867 1
340 . 1 . 1 41 41 LYS HA H 1 5.666 0.001 . . . . . . A 41 LYS HA . 30867 1
341 . 1 . 1 41 41 LYS HB2 H 1 2.097 0.004 . . . . . . A 41 LYS HB2 . 30867 1
342 . 1 . 1 41 41 LYS HG2 H 1 1.929 0.003 . . . . . . A 41 LYS HG2 . 30867 1
343 . 1 . 1 41 41 LYS HG3 H 1 1.929 0.003 . . . . . . A 41 LYS HG3 . 30867 1
344 . 1 . 1 41 41 LYS HD2 H 1 1.551 0.004 . . . . . . A 41 LYS HD2 . 30867 1
345 . 1 . 1 41 41 LYS HD3 H 1 1.551 0.004 . . . . . . A 41 LYS HD3 . 30867 1
346 . 1 . 1 41 41 LYS HE2 H 1 2.580 0.002 . . . . . . A 41 LYS HE2 . 30867 1
347 . 1 . 1 41 41 LYS HE3 H 1 2.580 0.002 . . . . . . A 41 LYS HE3 . 30867 1
348 . 1 . 1 41 41 LYS HZ1 H 1 6.721 0.004 . . . . . . A 41 LYS HZ1 . 30867 1
349 . 1 . 1 41 41 LYS HZ2 H 1 6.721 0.004 . . . . . . A 41 LYS HZ2 . 30867 1
350 . 1 . 1 41 41 LYS HZ3 H 1 6.721 0.004 . . . . . . A 41 LYS HZ3 . 30867 1
351 . 1 . 1 41 41 LYS C C 13 174.532 0.000 . . . . . . A 41 LYS C . 30867 1
352 . 1 . 1 41 41 LYS CA C 13 54.867 0.059 . . . . . . A 41 LYS CA . 30867 1
353 . 1 . 1 41 41 LYS CB C 13 37.880 0.091 . . . . . . A 41 LYS CB . 30867 1
354 . 1 . 1 41 41 LYS N N 15 131.270 0.183 . . . . . . A 41 LYS N . 30867 1
355 . 1 . 1 42 42 THR H H 1 9.187 0.004 . . . . . . A 42 THR H . 30867 1
356 . 1 . 1 42 42 THR HA H 1 5.688 0.004 . . . . . . A 42 THR HA . 30867 1
357 . 1 . 1 42 42 THR HB H 1 4.020 0.002 . . . . . . A 42 THR HB . 30867 1
358 . 1 . 1 42 42 THR HG21 H 1 1.187 0.004 . . . . . . A 42 THR HG21 . 30867 1
359 . 1 . 1 42 42 THR HG22 H 1 1.187 0.004 . . . . . . A 42 THR HG22 . 30867 1
360 . 1 . 1 42 42 THR HG23 H 1 1.187 0.004 . . . . . . A 42 THR HG23 . 30867 1
361 . 1 . 1 42 42 THR C C 13 173.246 0.000 . . . . . . A 42 THR C . 30867 1
362 . 1 . 1 42 42 THR CA C 13 61.642 0.040 . . . . . . A 42 THR CA . 30867 1
363 . 1 . 1 42 42 THR CB C 13 71.373 0.019 . . . . . . A 42 THR CB . 30867 1
364 . 1 . 1 42 42 THR N N 15 119.711 0.045 . . . . . . A 42 THR N . 30867 1
365 . 1 . 1 43 43 TRP H H 1 9.079 0.003 . . . . . . A 43 TRP H . 30867 1
366 . 1 . 1 43 43 TRP HA H 1 5.089 0.004 . . . . . . A 43 TRP HA . 30867 1
367 . 1 . 1 43 43 TRP HB2 H 1 3.404 0.001 . . . . . . A 43 TRP HB2 . 30867 1
368 . 1 . 1 43 43 TRP HB3 H 1 3.586 0.005 . . . . . . A 43 TRP HB3 . 30867 1
369 . 1 . 1 43 43 TRP HD1 H 1 7.112 0.002 . . . . . . A 43 TRP HD1 . 30867 1
370 . 1 . 1 43 43 TRP HE1 H 1 10.161 0.004 . . . . . . A 43 TRP HE1 . 30867 1
371 . 1 . 1 43 43 TRP HE3 H 1 7.412 0.003 . . . . . . A 43 TRP HE3 . 30867 1
372 . 1 . 1 43 43 TRP HZ2 H 1 7.305 0.003 . . . . . . A 43 TRP HZ2 . 30867 1
373 . 1 . 1 43 43 TRP HZ3 H 1 6.839 0.008 . . . . . . A 43 TRP HZ3 . 30867 1
374 . 1 . 1 43 43 TRP HH2 H 1 7.011 0.004 . . . . . . A 43 TRP HH2 . 30867 1
375 . 1 . 1 43 43 TRP C C 13 172.104 0.000 . . . . . . A 43 TRP C . 30867 1
376 . 1 . 1 43 43 TRP CA C 13 56.985 0.005 . . . . . . A 43 TRP CA . 30867 1
377 . 1 . 1 43 43 TRP CB C 13 31.968 0.049 . . . . . . A 43 TRP CB . 30867 1
378 . 1 . 1 43 43 TRP N N 15 126.392 0.060 . . . . . . A 43 TRP N . 30867 1
379 . 1 . 1 44 44 ARG H H 1 8.446 0.004 . . . . . . A 44 ARG H . 30867 1
380 . 1 . 1 44 44 ARG HA H 1 5.011 0.001 . . . . . . A 44 ARG HA . 30867 1
381 . 1 . 1 44 44 ARG HB2 H 1 1.819 0.000 . . . . . . A 44 ARG HB2 . 30867 1
382 . 1 . 1 44 44 ARG HB3 H 1 1.703 0.001 . . . . . . A 44 ARG HB3 . 30867 1
383 . 1 . 1 44 44 ARG HG2 H 1 1.576 0.002 . . . . . . A 44 ARG HG2 . 30867 1
384 . 1 . 1 44 44 ARG HG3 H 1 1.576 0.002 . . . . . . A 44 ARG HG3 . 30867 1
385 . 1 . 1 44 44 ARG HD2 H 1 3.148 0.004 . . . . . . A 44 ARG HD2 . 30867 1
386 . 1 . 1 44 44 ARG HD3 H 1 3.148 0.004 . . . . . . A 44 ARG HD3 . 30867 1
387 . 1 . 1 44 44 ARG HE H 1 7.085 0.002 . . . . . . A 44 ARG HE . 30867 1
388 . 1 . 1 44 44 ARG C C 13 176.121 0.000 . . . . . . A 44 ARG C . 30867 1
389 . 1 . 1 44 44 ARG CA C 13 54.889 0.047 . . . . . . A 44 ARG CA . 30867 1
390 . 1 . 1 44 44 ARG CB C 13 32.849 0.026 . . . . . . A 44 ARG CB . 30867 1
391 . 1 . 1 44 44 ARG N N 15 118.511 0.045 . . . . . . A 44 ARG N . 30867 1
392 . 1 . 1 45 45 ASP H H 1 8.565 0.003 . . . . . . A 45 ASP H . 30867 1
393 . 1 . 1 45 45 ASP HA H 1 4.888 0.005 . . . . . . A 45 ASP HA . 30867 1
394 . 1 . 1 45 45 ASP HB2 H 1 3.212 0.003 . . . . . . A 45 ASP HB2 . 30867 1
395 . 1 . 1 45 45 ASP HB3 H 1 2.831 0.003 . . . . . . A 45 ASP HB3 . 30867 1
396 . 1 . 1 45 45 ASP C C 13 177.001 0.000 . . . . . . A 45 ASP C . 30867 1
397 . 1 . 1 45 45 ASP CA C 13 52.839 0.039 . . . . . . A 45 ASP CA . 30867 1
398 . 1 . 1 45 45 ASP CB C 13 42.287 0.015 . . . . . . A 45 ASP CB . 30867 1
399 . 1 . 1 45 45 ASP N N 15 124.630 0.061 . . . . . . A 45 ASP N . 30867 1
400 . 1 . 1 46 46 HIS H H 1 8.838 0.001 . . . . . . A 46 HIS H . 30867 1
401 . 1 . 1 46 46 HIS HA H 1 4.416 0.003 . . . . . . A 46 HIS HA . 30867 1
402 . 1 . 1 46 46 HIS HB2 H 1 3.379 0.005 . . . . . . A 46 HIS HB2 . 30867 1
403 . 1 . 1 46 46 HIS HB3 H 1 3.217 0.002 . . . . . . A 46 HIS HB3 . 30867 1
404 . 1 . 1 46 46 HIS HD2 H 1 7.007 0.000 . . . . . . A 46 HIS HD2 . 30867 1
405 . 1 . 1 46 46 HIS HE1 H 1 7.378 0.000 . . . . . . A 46 HIS HE1 . 30867 1
406 . 1 . 1 46 46 HIS C C 13 175.668 0.000 . . . . . . A 46 HIS C . 30867 1
407 . 1 . 1 46 46 HIS CA C 13 58.483 0.054 . . . . . . A 46 HIS CA . 30867 1
408 . 1 . 1 46 46 HIS CB C 13 27.907 0.022 . . . . . . A 46 HIS CB . 30867 1
409 . 1 . 1 46 46 HIS N N 15 117.289 0.050 . . . . . . A 46 HIS N . 30867 1
410 . 1 . 1 47 47 ARG H H 1 8.414 0.001 . . . . . . A 47 ARG H . 30867 1
411 . 1 . 1 47 47 ARG HA H 1 4.252 0.000 . . . . . . A 47 ARG HA . 30867 1
412 . 1 . 1 47 47 ARG HB2 H 1 1.860 0.004 . . . . . . A 47 ARG HB2 . 30867 1
413 . 1 . 1 47 47 ARG HB3 H 1 1.585 0.000 . . . . . . A 47 ARG HB3 . 30867 1
414 . 1 . 1 47 47 ARG HG2 H 1 1.450 0.000 . . . . . . A 47 ARG HG2 . 30867 1
415 . 1 . 1 47 47 ARG HG3 H 1 1.450 0.000 . . . . . . A 47 ARG HG3 . 30867 1
416 . 1 . 1 47 47 ARG HD2 H 1 3.212 0.000 . . . . . . A 47 ARG HD2 . 30867 1
417 . 1 . 1 47 47 ARG HD3 H 1 3.212 0.000 . . . . . . A 47 ARG HD3 . 30867 1
418 . 1 . 1 47 47 ARG HE H 1 7.352 0.000 . . . . . . A 47 ARG HE . 30867 1
419 . 1 . 1 47 47 ARG C C 13 176.321 0.000 . . . . . . A 47 ARG C . 30867 1
420 . 1 . 1 47 47 ARG CA C 13 56.891 0.028 . . . . . . A 47 ARG CA . 30867 1
421 . 1 . 1 47 47 ARG CB C 13 30.558 0.000 . . . . . . A 47 ARG CB . 30867 1
422 . 1 . 1 47 47 ARG N N 15 118.051 0.060 . . . . . . A 47 ARG N . 30867 1
423 . 1 . 1 48 48 GLY H H 1 7.825 0.003 . . . . . . A 48 GLY H . 30867 1
424 . 1 . 1 48 48 GLY HA2 H 1 3.881 0.000 . . . . . . A 48 GLY HA2 . 30867 1
425 . 1 . 1 48 48 GLY HA3 H 1 4.278 0.002 . . . . . . A 48 GLY HA3 . 30867 1
426 . 1 . 1 48 48 GLY C C 13 172.022 0.000 . . . . . . A 48 GLY C . 30867 1
427 . 1 . 1 48 48 GLY CA C 13 44.534 0.011 . . . . . . A 48 GLY CA . 30867 1
428 . 1 . 1 48 48 GLY N N 15 108.198 0.042 . . . . . . A 48 GLY N . 30867 1
429 . 1 . 1 49 49 THR H H 1 8.364 0.002 . . . . . . A 49 THR H . 30867 1
430 . 1 . 1 49 49 THR HA H 1 4.518 0.002 . . . . . . A 49 THR HA . 30867 1
431 . 1 . 1 49 49 THR HB H 1 3.893 0.002 . . . . . . A 49 THR HB . 30867 1
432 . 1 . 1 49 49 THR HG21 H 1 1.037 0.006 . . . . . . A 49 THR HG21 . 30867 1
433 . 1 . 1 49 49 THR HG22 H 1 1.037 0.006 . . . . . . A 49 THR HG22 . 30867 1
434 . 1 . 1 49 49 THR HG23 H 1 1.037 0.006 . . . . . . A 49 THR HG23 . 30867 1
435 . 1 . 1 49 49 THR C C 13 173.652 0.000 . . . . . . A 49 THR C . 30867 1
436 . 1 . 1 49 49 THR CA C 13 63.244 0.070 . . . . . . A 49 THR CA . 30867 1
437 . 1 . 1 49 49 THR CB C 13 69.642 0.015 . . . . . . A 49 THR CB . 30867 1
438 . 1 . 1 49 49 THR N N 15 117.567 0.030 . . . . . . A 49 THR N . 30867 1
439 . 1 . 1 50 50 ILE H H 1 8.966 0.002 . . . . . . A 50 ILE H . 30867 1
440 . 1 . 1 50 50 ILE HA H 1 3.940 0.003 . . . . . . A 50 ILE HA . 30867 1
441 . 1 . 1 50 50 ILE HG12 H 1 0.702 0.005 . . . . . . A 50 ILE HG12 . 30867 1
442 . 1 . 1 50 50 ILE HG13 H 1 0.916 0.006 . . . . . . A 50 ILE HG13 . 30867 1
443 . 1 . 1 50 50 ILE HG21 H 1 0.436 0.007 . . . . . . A 50 ILE HG21 . 30867 1
444 . 1 . 1 50 50 ILE HG22 H 1 0.436 0.007 . . . . . . A 50 ILE HG22 . 30867 1
445 . 1 . 1 50 50 ILE HG23 H 1 0.436 0.007 . . . . . . A 50 ILE HG23 . 30867 1
446 . 1 . 1 50 50 ILE HD11 H 1 0.232 0.005 . . . . . . A 50 ILE HD11 . 30867 1
447 . 1 . 1 50 50 ILE HD12 H 1 0.232 0.005 . . . . . . A 50 ILE HD12 . 30867 1
448 . 1 . 1 50 50 ILE HD13 H 1 0.232 0.005 . . . . . . A 50 ILE HD13 . 30867 1
449 . 1 . 1 50 50 ILE C C 13 173.732 0.000 . . . . . . A 50 ILE C . 30867 1
450 . 1 . 1 50 50 ILE CA C 13 59.791 0.093 . . . . . . A 50 ILE CA . 30867 1
451 . 1 . 1 50 50 ILE CB C 13 38.695 0.046 . . . . . . A 50 ILE CB . 30867 1
452 . 1 . 1 50 50 ILE N N 15 130.782 0.040 . . . . . . A 50 ILE N . 30867 1
453 . 1 . 1 51 51 ILE H H 1 7.453 0.000 . . . . . . A 51 ILE H . 30867 1
454 . 1 . 1 51 51 ILE HA H 1 5.276 0.004 . . . . . . A 51 ILE HA . 30867 1
455 . 1 . 1 51 51 ILE HG12 H 1 1.397 0.005 . . . . . . A 51 ILE HG12 . 30867 1
456 . 1 . 1 51 51 ILE HG13 H 1 1.517 0.005 . . . . . . A 51 ILE HG13 . 30867 1
457 . 1 . 1 51 51 ILE HG21 H 1 1.175 0.000 . . . . . . A 51 ILE HG21 . 30867 1
458 . 1 . 1 51 51 ILE HG22 H 1 1.175 0.000 . . . . . . A 51 ILE HG22 . 30867 1
459 . 1 . 1 51 51 ILE HG23 H 1 1.175 0.000 . . . . . . A 51 ILE HG23 . 30867 1
460 . 1 . 1 51 51 ILE HD11 H 1 0.817 0.003 . . . . . . A 51 ILE HD11 . 30867 1
461 . 1 . 1 51 51 ILE HD12 H 1 0.817 0.003 . . . . . . A 51 ILE HD12 . 30867 1
462 . 1 . 1 51 51 ILE HD13 H 1 0.817 0.003 . . . . . . A 51 ILE HD13 . 30867 1
463 . 1 . 1 51 51 ILE C C 13 175.568 0.000 . . . . . . A 51 ILE C . 30867 1
464 . 1 . 1 51 51 ILE CA C 13 59.596 0.017 . . . . . . A 51 ILE CA . 30867 1
465 . 1 . 1 51 51 ILE CB C 13 42.271 0.000 . . . . . . A 51 ILE CB . 30867 1
466 . 1 . 1 51 51 ILE N N 15 122.171 0.073 . . . . . . A 51 ILE N . 30867 1
467 . 1 . 1 52 52 GLU H H 1 9.631 0.000 . . . . . . A 52 GLU H . 30867 1
468 . 1 . 1 52 52 GLU HA H 1 4.988 0.000 . . . . . . A 52 GLU HA . 30867 1
469 . 1 . 1 52 52 GLU HB2 H 1 2.441 0.006 . . . . . . A 52 GLU HB2 . 30867 1
470 . 1 . 1 52 52 GLU HB3 H 1 2.221 0.001 . . . . . . A 52 GLU HB3 . 30867 1
471 . 1 . 1 52 52 GLU HG2 H 1 2.554 0.000 . . . . . . A 52 GLU HG2 . 30867 1
472 . 1 . 1 52 52 GLU HG3 H 1 2.672 0.008 . . . . . . A 52 GLU HG3 . 30867 1
473 . 1 . 1 52 52 GLU C C 13 174.018 0.000 . . . . . . A 52 GLU C . 30867 1
474 . 1 . 1 52 52 GLU CA C 13 54.450 0.021 . . . . . . A 52 GLU CA . 30867 1
475 . 1 . 1 52 52 GLU CB C 13 35.590 1.199 . . . . . . A 52 GLU CB . 30867 1
476 . 1 . 1 52 52 GLU N N 15 128.701 0.044 . . . . . . A 52 GLU N . 30867 1
477 . 1 . 1 53 53 ARG H H 1 8.649 0.000 . . . . . . A 53 ARG H . 30867 1
478 . 1 . 1 53 53 ARG HA H 1 4.888 0.002 . . . . . . A 53 ARG HA . 30867 1
479 . 1 . 1 53 53 ARG HB2 H 1 1.543 0.000 . . . . . . A 53 ARG HB2 . 30867 1
480 . 1 . 1 53 53 ARG HB3 H 1 1.292 0.000 . . . . . . A 53 ARG HB3 . 30867 1
481 . 1 . 1 53 53 ARG HG2 H 1 1.199 0.000 . . . . . . A 53 ARG HG2 . 30867 1
482 . 1 . 1 53 53 ARG HG3 H 1 1.199 0.000 . . . . . . A 53 ARG HG3 . 30867 1
483 . 1 . 1 53 53 ARG HE H 1 7.301 0.001 . . . . . . A 53 ARG HE . 30867 1
484 . 1 . 1 53 53 ARG C C 13 175.184 0.000 . . . . . . A 53 ARG C . 30867 1
485 . 1 . 1 53 53 ARG CA C 13 53.974 0.053 . . . . . . A 53 ARG CA . 30867 1
486 . 1 . 1 53 53 ARG CB C 13 34.677 0.000 . . . . . . A 53 ARG CB . 30867 1
487 . 1 . 1 53 53 ARG N N 15 125.149 0.076 . . . . . . A 53 ARG N . 30867 1
488 . 1 . 1 54 54 GLY H H 1 6.385 0.000 . . . . . . A 54 GLY H . 30867 1
489 . 1 . 1 54 54 GLY HA2 H 1 3.871 0.000 . . . . . . A 54 GLY HA2 . 30867 1
490 . 1 . 1 54 54 GLY HA3 H 1 3.871 0.000 . . . . . . A 54 GLY HA3 . 30867 1
491 . 1 . 1 54 54 GLY C C 13 171.663 0.000 . . . . . . A 54 GLY C . 30867 1
492 . 1 . 1 54 54 GLY CA C 13 46.381 0.018 . . . . . . A 54 GLY CA . 30867 1
493 . 1 . 1 54 54 GLY N N 15 104.208 0.030 . . . . . . A 54 GLY N . 30867 1
494 . 1 . 1 55 55 CYS H H 1 8.630 0.000 . . . . . . A 55 CYS H . 30867 1
495 . 1 . 1 55 55 CYS HA H 1 5.152 0.000 . . . . . . A 55 CYS HA . 30867 1
496 . 1 . 1 55 55 CYS HB2 H 1 3.007 0.000 . . . . . . A 55 CYS HB2 . 30867 1
497 . 1 . 1 55 55 CYS HB3 H 1 3.354 0.005 . . . . . . A 55 CYS HB3 . 30867 1
498 . 1 . 1 55 55 CYS C C 13 175.787 0.000 . . . . . . A 55 CYS C . 30867 1
499 . 1 . 1 55 55 CYS CA C 13 54.377 0.152 . . . . . . A 55 CYS CA . 30867 1
500 . 1 . 1 55 55 CYS CB C 13 40.806 0.008 . . . . . . A 55 CYS CB . 30867 1
501 . 1 . 1 55 55 CYS N N 15 118.852 0.067 . . . . . . A 55 CYS N . 30867 1
502 . 1 . 1 56 56 GLY H H 1 9.118 0.000 . . . . . . A 56 GLY H . 30867 1
503 . 1 . 1 56 56 GLY HA2 H 1 3.451 0.001 . . . . . . A 56 GLY HA2 . 30867 1
504 . 1 . 1 56 56 GLY HA3 H 1 4.148 0.004 . . . . . . A 56 GLY HA3 . 30867 1
505 . 1 . 1 56 56 GLY C C 13 176.827 0.000 . . . . . . A 56 GLY C . 30867 1
506 . 1 . 1 56 56 GLY CA C 13 44.467 0.060 . . . . . . A 56 GLY CA . 30867 1
507 . 1 . 1 57 57 CYS H H 1 8.053 0.001 . . . . . . A 57 CYS H . 30867 1
508 . 1 . 1 57 57 CYS HA H 1 5.131 0.000 . . . . . . A 57 CYS HA . 30867 1
509 . 1 . 1 57 57 CYS HB2 H 1 2.883 0.000 . . . . . . A 57 CYS HB2 . 30867 1
510 . 1 . 1 57 57 CYS HB3 H 1 2.819 0.000 . . . . . . A 57 CYS HB3 . 30867 1
511 . 1 . 1 57 57 CYS CA C 13 53.303 0.087 . . . . . . A 57 CYS CA . 30867 1
512 . 1 . 1 57 57 CYS CB C 13 36.960 0.000 . . . . . . A 57 CYS CB . 30867 1
513 . 1 . 1 57 57 CYS N N 15 114.360 0.073 . . . . . . A 57 CYS N . 30867 1
514 . 1 . 1 58 58 PRO HA H 1 4.331 0.003 . . . . . . A 58 PRO HA . 30867 1
515 . 1 . 1 58 58 PRO HB2 H 1 1.001 0.003 . . . . . . A 58 PRO HB2 . 30867 1
516 . 1 . 1 58 58 PRO HB3 H 1 1.662 0.000 . . . . . . A 58 PRO HB3 . 30867 1
517 . 1 . 1 58 58 PRO HG2 H 1 0.845 0.004 . . . . . . A 58 PRO HG2 . 30867 1
518 . 1 . 1 58 58 PRO HG3 H 1 0.845 0.004 . . . . . . A 58 PRO HG3 . 30867 1
519 . 1 . 1 58 58 PRO HD2 H 1 2.891 0.003 . . . . . . A 58 PRO HD2 . 30867 1
520 . 1 . 1 58 58 PRO HD3 H 1 2.960 0.000 . . . . . . A 58 PRO HD3 . 30867 1
521 . 1 . 1 58 58 PRO C C 13 174.380 0.000 . . . . . . A 58 PRO C . 30867 1
522 . 1 . 1 58 58 PRO CA C 13 62.424 0.029 . . . . . . A 58 PRO CA . 30867 1
523 . 1 . 1 58 58 PRO CB C 13 32.310 0.000 . . . . . . A 58 PRO CB . 30867 1
524 . 1 . 1 58 58 PRO CG C 13 25.420 0.000 . . . . . . A 58 PRO CG . 30867 1
525 . 1 . 1 59 59 LYS H H 1 7.800 0.003 . . . . . . A 59 LYS H . 30867 1
526 . 1 . 1 59 59 LYS HA H 1 4.216 0.003 . . . . . . A 59 LYS HA . 30867 1
527 . 1 . 1 59 59 LYS HB2 H 1 1.689 0.003 . . . . . . A 59 LYS HB2 . 30867 1
528 . 1 . 1 59 59 LYS HB3 H 1 1.643 0.004 . . . . . . A 59 LYS HB3 . 30867 1
529 . 1 . 1 59 59 LYS HG2 H 1 1.392 0.000 . . . . . . A 59 LYS HG2 . 30867 1
530 . 1 . 1 59 59 LYS HG3 H 1 1.392 0.000 . . . . . . A 59 LYS HG3 . 30867 1
531 . 1 . 1 59 59 LYS HD2 H 1 1.480 0.000 . . . . . . A 59 LYS HD2 . 30867 1
532 . 1 . 1 59 59 LYS HD3 H 1 1.480 0.000 . . . . . . A 59 LYS HD3 . 30867 1
533 . 1 . 1 59 59 LYS HE2 H 1 2.994 0.000 . . . . . . A 59 LYS HE2 . 30867 1
534 . 1 . 1 59 59 LYS HE3 H 1 2.994 0.000 . . . . . . A 59 LYS HE3 . 30867 1
535 . 1 . 1 59 59 LYS C C 13 177.299 0.000 . . . . . . A 59 LYS C . 30867 1
536 . 1 . 1 59 59 LYS CA C 13 56.105 0.011 . . . . . . A 59 LYS CA . 30867 1
537 . 1 . 1 59 59 LYS CB C 13 32.660 0.060 . . . . . . A 59 LYS CB . 30867 1
538 . 1 . 1 59 59 LYS CG C 13 24.952 0.000 . . . . . . A 59 LYS CG . 30867 1
539 . 1 . 1 59 59 LYS N N 15 117.087 0.074 . . . . . . A 59 LYS N . 30867 1
540 . 1 . 1 60 60 VAL H H 1 8.187 0.001 . . . . . . A 60 VAL H . 30867 1
541 . 1 . 1 60 60 VAL HA H 1 4.446 0.004 . . . . . . A 60 VAL HA . 30867 1
542 . 1 . 1 60 60 VAL HB H 1 2.078 0.005 . . . . . . A 60 VAL HB . 30867 1
543 . 1 . 1 60 60 VAL HG11 H 1 0.783 0.000 . . . . . . A 60 VAL HG11 . 30867 1
544 . 1 . 1 60 60 VAL HG12 H 1 0.783 0.000 . . . . . . A 60 VAL HG12 . 30867 1
545 . 1 . 1 60 60 VAL HG13 H 1 0.783 0.000 . . . . . . A 60 VAL HG13 . 30867 1
546 . 1 . 1 60 60 VAL HG21 H 1 0.853 0.000 . . . . . . A 60 VAL HG21 . 30867 1
547 . 1 . 1 60 60 VAL HG22 H 1 0.853 0.000 . . . . . . A 60 VAL HG22 . 30867 1
548 . 1 . 1 60 60 VAL HG23 H 1 0.853 0.000 . . . . . . A 60 VAL HG23 . 30867 1
549 . 1 . 1 60 60 VAL C C 13 175.218 0.000 . . . . . . A 60 VAL C . 30867 1
550 . 1 . 1 60 60 VAL CA C 13 59.632 0.027 . . . . . . A 60 VAL CA . 30867 1
551 . 1 . 1 60 60 VAL CB C 13 35.117 0.017 . . . . . . A 60 VAL CB . 30867 1
552 . 1 . 1 60 60 VAL CG1 C 13 19.646 0.000 . . . . . . A 60 VAL CG1 . 30867 1
553 . 1 . 1 60 60 VAL CG2 C 13 22.432 0.000 . . . . . . A 60 VAL CG2 . 30867 1
554 . 1 . 1 60 60 VAL N N 15 117.205 0.089 . . . . . . A 60 VAL N . 30867 1
555 . 1 . 1 61 61 LYS H H 1 7.772 0.000 . . . . . . A 61 LYS H . 30867 1
556 . 1 . 1 61 61 LYS HA H 1 4.519 0.000 . . . . . . A 61 LYS HA . 30867 1
557 . 1 . 1 61 61 LYS HB2 H 1 1.806 0.003 . . . . . . A 61 LYS HB2 . 30867 1
558 . 1 . 1 61 61 LYS HB3 H 1 1.806 0.003 . . . . . . A 61 LYS HB3 . 30867 1
559 . 1 . 1 61 61 LYS HG2 H 1 1.420 0.002 . . . . . . A 61 LYS HG2 . 30867 1
560 . 1 . 1 61 61 LYS HG3 H 1 1.420 0.002 . . . . . . A 61 LYS HG3 . 30867 1
561 . 1 . 1 61 61 LYS HD2 H 1 1.575 0.004 . . . . . . A 61 LYS HD2 . 30867 1
562 . 1 . 1 61 61 LYS HD3 H 1 1.575 0.004 . . . . . . A 61 LYS HD3 . 30867 1
563 . 1 . 1 61 61 LYS CA C 13 54.449 0.007 . . . . . . A 61 LYS CA . 30867 1
564 . 1 . 1 61 61 LYS CB C 13 32.428 0.000 . . . . . . A 61 LYS CB . 30867 1
565 . 1 . 1 61 61 LYS N N 15 122.870 0.080 . . . . . . A 61 LYS N . 30867 1
566 . 1 . 1 62 62 PRO HB2 H 1 2.012 0.000 . . . . . . A 62 PRO HB2 . 30867 1
567 . 1 . 1 62 62 PRO HB3 H 1 2.348 0.000 . . . . . . A 62 PRO HB3 . 30867 1
568 . 1 . 1 62 62 PRO HG2 H 1 1.845 0.000 . . . . . . A 62 PRO HG2 . 30867 1
569 . 1 . 1 62 62 PRO HG3 H 1 1.845 0.000 . . . . . . A 62 PRO HG3 . 30867 1
570 . 1 . 1 62 62 PRO HD2 H 1 3.581 0.003 . . . . . . A 62 PRO HD2 . 30867 1
571 . 1 . 1 62 62 PRO HD3 H 1 3.831 0.004 . . . . . . A 62 PRO HD3 . 30867 1
572 . 1 . 1 62 62 PRO C C 13 177.351 0.000 . . . . . . A 62 PRO C . 30867 1
573 . 1 . 1 62 62 PRO CA C 13 64.124 0.009 . . . . . . A 62 PRO CA . 30867 1
574 . 1 . 1 62 62 PRO CB C 13 31.799 0.033 . . . . . . A 62 PRO CB . 30867 1
575 . 1 . 1 62 62 PRO CG C 13 27.920 0.000 . . . . . . A 62 PRO CG . 30867 1
576 . 1 . 1 63 63 GLY H H 1 8.675 0.000 . . . . . . A 63 GLY H . 30867 1
577 . 1 . 1 63 63 GLY HA2 H 1 4.334 0.010 . . . . . . A 63 GLY HA2 . 30867 1
578 . 1 . 1 63 63 GLY HA3 H 1 3.693 0.000 . . . . . . A 63 GLY HA3 . 30867 1
579 . 1 . 1 63 63 GLY C C 13 173.973 0.000 . . . . . . A 63 GLY C . 30867 1
580 . 1 . 1 63 63 GLY CA C 13 45.161 0.044 . . . . . . A 63 GLY CA . 30867 1
581 . 1 . 1 63 63 GLY N N 15 111.082 0.051 . . . . . . A 63 GLY N . 30867 1
582 . 1 . 1 64 64 ILE H H 1 7.523 0.000 . . . . . . A 64 ILE H . 30867 1
583 . 1 . 1 64 64 ILE HA H 1 4.420 0.004 . . . . . . A 64 ILE HA . 30867 1
584 . 1 . 1 64 64 ILE HB H 1 1.946 0.003 . . . . . . A 64 ILE HB . 30867 1
585 . 1 . 1 64 64 ILE HG12 H 1 0.978 0.000 . . . . . . A 64 ILE HG12 . 30867 1
586 . 1 . 1 64 64 ILE HG13 H 1 1.270 0.004 . . . . . . A 64 ILE HG13 . 30867 1
587 . 1 . 1 64 64 ILE HG21 H 1 0.830 0.002 . . . . . . A 64 ILE HG21 . 30867 1
588 . 1 . 1 64 64 ILE HG22 H 1 0.830 0.002 . . . . . . A 64 ILE HG22 . 30867 1
589 . 1 . 1 64 64 ILE HG23 H 1 0.830 0.002 . . . . . . A 64 ILE HG23 . 30867 1
590 . 1 . 1 64 64 ILE HD11 H 1 0.432 0.003 . . . . . . A 64 ILE HD11 . 30867 1
591 . 1 . 1 64 64 ILE HD12 H 1 0.432 0.003 . . . . . . A 64 ILE HD12 . 30867 1
592 . 1 . 1 64 64 ILE HD13 H 1 0.432 0.003 . . . . . . A 64 ILE HD13 . 30867 1
593 . 1 . 1 64 64 ILE C C 13 175.578 0.000 . . . . . . A 64 ILE C . 30867 1
594 . 1 . 1 64 64 ILE CA C 13 60.189 0.051 . . . . . . A 64 ILE CA . 30867 1
595 . 1 . 1 64 64 ILE CB C 13 38.477 0.024 . . . . . . A 64 ILE CB . 30867 1
596 . 1 . 1 64 64 ILE N N 15 121.104 0.056 . . . . . . A 64 ILE N . 30867 1
597 . 1 . 1 65 65 LYS H H 1 8.696 0.001 . . . . . . A 65 LYS H . 30867 1
598 . 1 . 1 65 65 LYS HA H 1 4.520 0.005 . . . . . . A 65 LYS HA . 30867 1
599 . 1 . 1 65 65 LYS HB2 H 1 1.970 0.001 . . . . . . A 65 LYS HB2 . 30867 1
600 . 1 . 1 65 65 LYS HB3 H 1 1.970 0.001 . . . . . . A 65 LYS HB3 . 30867 1
601 . 1 . 1 65 65 LYS HG2 H 1 1.469 0.000 . . . . . . A 65 LYS HG2 . 30867 1
602 . 1 . 1 65 65 LYS HG3 H 1 1.543 0.004 . . . . . . A 65 LYS HG3 . 30867 1
603 . 1 . 1 65 65 LYS HD2 H 1 1.701 0.006 . . . . . . A 65 LYS HD2 . 30867 1
604 . 1 . 1 65 65 LYS HD3 H 1 1.701 0.006 . . . . . . A 65 LYS HD3 . 30867 1
605 . 1 . 1 65 65 LYS HZ1 H 1 7.008 0.001 . . . . . . A 65 LYS HZ1 . 30867 1
606 . 1 . 1 65 65 LYS HZ2 H 1 7.008 0.001 . . . . . . A 65 LYS HZ2 . 30867 1
607 . 1 . 1 65 65 LYS HZ3 H 1 7.008 0.001 . . . . . . A 65 LYS HZ3 . 30867 1
608 . 1 . 1 65 65 LYS C C 13 174.489 0.000 . . . . . . A 65 LYS C . 30867 1
609 . 1 . 1 65 65 LYS CA C 13 47.639 19.295 . . . . . . A 65 LYS CA . 30867 1
610 . 1 . 1 65 65 LYS CB C 13 32.807 0.022 . . . . . . A 65 LYS CB . 30867 1
611 . 1 . 1 65 65 LYS CG C 13 24.997 0.000 . . . . . . A 65 LYS CG . 30867 1
612 . 1 . 1 66 66 LEU H H 1 8.649 0.002 . . . . . . A 66 LEU H . 30867 1
613 . 1 . 1 66 66 LEU HA H 1 5.228 0.004 . . . . . . A 66 LEU HA . 30867 1
614 . 1 . 1 66 66 LEU HB2 H 1 1.896 0.003 . . . . . . A 66 LEU HB2 . 30867 1
615 . 1 . 1 66 66 LEU HB3 H 1 1.896 0.003 . . . . . . A 66 LEU HB3 . 30867 1
616 . 1 . 1 66 66 LEU HD11 H 1 0.887 0.003 . . . . . . A 66 LEU HD11 . 30867 1
617 . 1 . 1 66 66 LEU HD12 H 1 0.887 0.003 . . . . . . A 66 LEU HD12 . 30867 1
618 . 1 . 1 66 66 LEU HD13 H 1 0.887 0.003 . . . . . . A 66 LEU HD13 . 30867 1
619 . 1 . 1 66 66 LEU C C 13 175.174 0.000 . . . . . . A 66 LEU C . 30867 1
620 . 1 . 1 66 66 LEU CA C 13 55.298 2.497 . . . . . . A 66 LEU CA . 30867 1
621 . 1 . 1 66 66 LEU CB C 13 46.293 0.022 . . . . . . A 66 LEU CB . 30867 1
622 . 1 . 1 66 66 LEU N N 15 127.502 0.095 . . . . . . A 66 LEU N . 30867 1
623 . 1 . 1 67 67 HIS H H 1 9.184 0.000 . . . . . . A 67 HIS H . 30867 1
624 . 1 . 1 67 67 HIS HA H 1 5.165 0.000 . . . . . . A 67 HIS HA . 30867 1
625 . 1 . 1 67 67 HIS HB2 H 1 3.180 0.000 . . . . . . A 67 HIS HB2 . 30867 1
626 . 1 . 1 67 67 HIS HB3 H 1 3.195 0.000 . . . . . . A 67 HIS HB3 . 30867 1
627 . 1 . 1 67 67 HIS HD2 H 1 7.074 0.001 . . . . . . A 67 HIS HD2 . 30867 1
628 . 1 . 1 67 67 HIS C C 13 173.439 0.000 . . . . . . A 67 HIS C . 30867 1
629 . 1 . 1 67 67 HIS CA C 13 54.461 0.021 . . . . . . A 67 HIS CA . 30867 1
630 . 1 . 1 67 67 HIS CB C 13 31.728 0.044 . . . . . . A 67 HIS CB . 30867 1
631 . 1 . 1 67 67 HIS N N 15 125.531 0.977 . . . . . . A 67 HIS N . 30867 1
632 . 1 . 1 68 68 CYS H H 1 9.125 0.003 . . . . . . A 68 CYS H . 30867 1
633 . 1 . 1 68 68 CYS HA H 1 5.773 0.004 . . . . . . A 68 CYS HA . 30867 1
634 . 1 . 1 68 68 CYS HB2 H 1 3.164 0.002 . . . . . . A 68 CYS HB2 . 30867 1
635 . 1 . 1 68 68 CYS HB3 H 1 3.352 0.000 . . . . . . A 68 CYS HB3 . 30867 1
636 . 1 . 1 68 68 CYS C C 13 172.161 0.000 . . . . . . A 68 CYS C . 30867 1
637 . 1 . 1 68 68 CYS CA C 13 53.607 0.018 . . . . . . A 68 CYS CA . 30867 1
638 . 1 . 1 68 68 CYS CB C 13 43.018 0.038 . . . . . . A 68 CYS CB . 30867 1
639 . 1 . 1 68 68 CYS N N 15 124.991 0.080 . . . . . . A 68 CYS N . 30867 1
640 . 1 . 1 69 69 CYS H H 1 9.195 0.002 . . . . . . A 69 CYS H . 30867 1
641 . 1 . 1 69 69 CYS HA H 1 5.057 0.007 . . . . . . A 69 CYS HA . 30867 1
642 . 1 . 1 69 69 CYS HB2 H 1 3.020 0.004 . . . . . . A 69 CYS HB2 . 30867 1
643 . 1 . 1 69 69 CYS HB3 H 1 3.571 0.002 . . . . . . A 69 CYS HB3 . 30867 1
644 . 1 . 1 69 69 CYS C C 13 173.900 0.000 . . . . . . A 69 CYS C . 30867 1
645 . 1 . 1 69 69 CYS CA C 13 54.310 0.094 . . . . . . A 69 CYS CA . 30867 1
646 . 1 . 1 69 69 CYS CB C 13 45.658 0.050 . . . . . . A 69 CYS CB . 30867 1
647 . 1 . 1 69 69 CYS N N 15 118.144 0.067 . . . . . . A 69 CYS N . 30867 1
648 . 1 . 1 70 70 ARG H H 1 8.825 0.000 . . . . . . A 70 ARG H . 30867 1
649 . 1 . 1 70 70 ARG HA H 1 4.894 0.003 . . . . . . A 70 ARG HA . 30867 1
650 . 1 . 1 70 70 ARG HB2 H 1 2.356 0.000 . . . . . . A 70 ARG HB2 . 30867 1
651 . 1 . 1 70 70 ARG HB3 H 1 1.735 0.003 . . . . . . A 70 ARG HB3 . 30867 1
652 . 1 . 1 70 70 ARG HG2 H 1 1.601 0.000 . . . . . . A 70 ARG HG2 . 30867 1
653 . 1 . 1 70 70 ARG HG3 H 1 1.601 0.000 . . . . . . A 70 ARG HG3 . 30867 1
654 . 1 . 1 70 70 ARG HD2 H 1 3.248 0.000 . . . . . . A 70 ARG HD2 . 30867 1
655 . 1 . 1 70 70 ARG HD3 H 1 3.248 0.000 . . . . . . A 70 ARG HD3 . 30867 1
656 . 1 . 1 70 70 ARG HE H 1 7.204 0.000 . . . . . . A 70 ARG HE . 30867 1
657 . 1 . 1 70 70 ARG C C 13 175.395 0.000 . . . . . . A 70 ARG C . 30867 1
658 . 1 . 1 70 70 ARG CA C 13 56.698 0.013 . . . . . . A 70 ARG CA . 30867 1
659 . 1 . 1 70 70 ARG CB C 13 31.205 0.162 . . . . . . A 70 ARG CB . 30867 1
660 . 1 . 1 70 70 ARG CG C 13 27.317 0.000 . . . . . . A 70 ARG CG . 30867 1
661 . 1 . 1 70 70 ARG CD C 13 43.442 0.000 . . . . . . A 70 ARG CD . 30867 1
662 . 1 . 1 71 71 THR H H 1 7.393 0.003 . . . . . . A 71 THR H . 30867 1
663 . 1 . 1 71 71 THR HA H 1 4.715 0.000 . . . . . . A 71 THR HA . 30867 1
664 . 1 . 1 71 71 THR HB H 1 4.267 0.004 . . . . . . A 71 THR HB . 30867 1
665 . 1 . 1 71 71 THR HG21 H 1 1.205 0.003 . . . . . . A 71 THR HG21 . 30867 1
666 . 1 . 1 71 71 THR HG22 H 1 1.205 0.003 . . . . . . A 71 THR HG22 . 30867 1
667 . 1 . 1 71 71 THR HG23 H 1 1.205 0.003 . . . . . . A 71 THR HG23 . 30867 1
668 . 1 . 1 71 71 THR C C 13 174.931 0.000 . . . . . . A 71 THR C . 30867 1
669 . 1 . 1 71 71 THR CA C 13 60.299 0.035 . . . . . . A 71 THR CA . 30867 1
670 . 1 . 1 71 71 THR CB C 13 72.112 0.005 . . . . . . A 71 THR CB . 30867 1
671 . 1 . 1 71 71 THR CG2 C 13 22.321 0.000 . . . . . . A 71 THR CG2 . 30867 1
672 . 1 . 1 71 71 THR N N 15 111.101 0.059 . . . . . . A 71 THR N . 30867 1
673 . 1 . 1 72 72 ASP H H 1 8.572 0.003 . . . . . . A 72 ASP H . 30867 1
674 . 1 . 1 72 72 ASP HA H 1 4.702 0.001 . . . . . . A 72 ASP HA . 30867 1
675 . 1 . 1 72 72 ASP HB2 H 1 2.462 0.002 . . . . . . A 72 ASP HB2 . 30867 1
676 . 1 . 1 72 72 ASP HB3 H 1 2.721 0.004 . . . . . . A 72 ASP HB3 . 30867 1
677 . 1 . 1 72 72 ASP C C 13 177.592 0.000 . . . . . . A 72 ASP C . 30867 1
678 . 1 . 1 72 72 ASP CA C 13 55.658 0.020 . . . . . . A 72 ASP CA . 30867 1
679 . 1 . 1 72 72 ASP CB C 13 41.340 0.024 . . . . . . A 72 ASP CB . 30867 1
680 . 1 . 1 72 72 ASP N N 15 119.469 0.106 . . . . . . A 72 ASP N . 30867 1
681 . 1 . 1 73 73 LYS H H 1 9.595 0.000 . . . . . . A 73 LYS H . 30867 1
682 . 1 . 1 73 73 LYS HA H 1 3.143 0.004 . . . . . . A 73 LYS HA . 30867 1
683 . 1 . 1 73 73 LYS HB2 H 1 1.760 0.001 . . . . . . A 73 LYS HB2 . 30867 1
684 . 1 . 1 73 73 LYS HB3 H 1 2.050 0.005 . . . . . . A 73 LYS HB3 . 30867 1
685 . 1 . 1 73 73 LYS HG2 H 1 0.319 0.001 . . . . . . A 73 LYS HG2 . 30867 1
686 . 1 . 1 73 73 LYS HG3 H 1 0.319 0.001 . . . . . . A 73 LYS HG3 . 30867 1
687 . 1 . 1 73 73 LYS HD2 H 1 1.530 0.004 . . . . . . A 73 LYS HD2 . 30867 1
688 . 1 . 1 73 73 LYS HD3 H 1 0.956 0.002 . . . . . . A 73 LYS HD3 . 30867 1
689 . 1 . 1 73 73 LYS HE2 H 1 2.719 0.000 . . . . . . A 73 LYS HE2 . 30867 1
690 . 1 . 1 73 73 LYS HE3 H 1 2.719 0.000 . . . . . . A 73 LYS HE3 . 30867 1
691 . 1 . 1 73 73 LYS HZ1 H 1 6.843 0.003 . . . . . . A 73 LYS HZ1 . 30867 1
692 . 1 . 1 73 73 LYS HZ2 H 1 6.843 0.003 . . . . . . A 73 LYS HZ2 . 30867 1
693 . 1 . 1 73 73 LYS HZ3 H 1 6.843 0.003 . . . . . . A 73 LYS HZ3 . 30867 1
694 . 1 . 1 73 73 LYS C C 13 175.613 0.000 . . . . . . A 73 LYS C . 30867 1
695 . 1 . 1 73 73 LYS CA C 13 58.577 0.028 . . . . . . A 73 LYS CA . 30867 1
696 . 1 . 1 73 73 LYS CB C 13 28.789 0.128 . . . . . . A 73 LYS CB . 30867 1
697 . 1 . 1 73 73 LYS CG C 13 26.315 0.000 . . . . . . A 73 LYS CG . 30867 1
698 . 1 . 1 73 73 LYS N N 15 113.528 0.076 . . . . . . A 73 LYS N . 30867 1
699 . 1 . 1 74 74 CYS H H 1 7.582 0.004 . . . . . . A 74 CYS H . 30867 1
700 . 1 . 1 74 74 CYS HA H 1 4.736 0.000 . . . . . . A 74 CYS HA . 30867 1
701 . 1 . 1 74 74 CYS HB2 H 1 3.843 0.000 . . . . . . A 74 CYS HB2 . 30867 1
702 . 1 . 1 74 74 CYS HB3 H 1 3.472 0.002 . . . . . . A 74 CYS HB3 . 30867 1
703 . 1 . 1 74 74 CYS C C 13 174.819 0.000 . . . . . . A 74 CYS C . 30867 1
704 . 1 . 1 74 74 CYS CA C 13 56.622 0.022 . . . . . . A 74 CYS CA . 30867 1
705 . 1 . 1 74 74 CYS CB C 13 45.220 0.039 . . . . . . A 74 CYS CB . 30867 1
706 . 1 . 1 74 74 CYS N N 15 110.996 0.051 . . . . . . A 74 CYS N . 30867 1
707 . 1 . 1 75 75 ASN H H 1 9.306 0.000 . . . . . . A 75 ASN H . 30867 1
708 . 1 . 1 75 75 ASN HA H 1 4.833 0.004 . . . . . . A 75 ASN HA . 30867 1
709 . 1 . 1 75 75 ASN HB2 H 1 2.229 0.000 . . . . . . A 75 ASN HB2 . 30867 1
710 . 1 . 1 75 75 ASN HB3 H 1 2.917 0.000 . . . . . . A 75 ASN HB3 . 30867 1
711 . 1 . 1 75 75 ASN HD21 H 1 8.715 0.000 . . . . . . A 75 ASN HD21 . 30867 1
712 . 1 . 1 75 75 ASN HD22 H 1 8.021 0.008 . . . . . . A 75 ASN HD22 . 30867 1
713 . 1 . 1 75 75 ASN CA C 13 53.571 0.031 . . . . . . A 75 ASN CA . 30867 1
714 . 1 . 1 75 75 ASN CB C 13 36.870 0.043 . . . . . . A 75 ASN CB . 30867 1
715 . 1 . 1 75 75 ASN N N 15 122.277 0.077 . . . . . . A 75 ASN N . 30867 1
716 . 1 . 1 76 76 ASN H H 1 8.017 0.000 . . . . . . A 76 ASN H . 30867 1
717 . 1 . 1 76 76 ASN HA H 1 3.795 0.001 . . . . . . A 76 ASN HA . 30867 1
718 . 1 . 1 76 76 ASN HB2 H 1 2.364 0.000 . . . . . . A 76 ASN HB2 . 30867 1
719 . 1 . 1 76 76 ASN HB3 H 1 2.464 0.000 . . . . . . A 76 ASN HB3 . 30867 1
720 . 1 . 1 76 76 ASN HD21 H 1 7.307 0.002 . . . . . . A 76 ASN HD21 . 30867 1
721 . 1 . 1 76 76 ASN HD22 H 1 6.474 0.000 . . . . . . A 76 ASN HD22 . 30867 1
722 . 1 . 1 76 76 ASN CA C 13 56.981 0.023 . . . . . . A 76 ASN CA . 30867 1
723 . 1 . 1 76 76 ASN CB C 13 38.488 0.000 . . . . . . A 76 ASN CB . 30867 1
724 . 1 . 1 76 76 ASN N N 15 120.503 0.000 . . . . . . A 76 ASN N . 30867 1
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