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 30033
_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 DQF-COSY' . . . 30033 1
2 '2D 1H-1H NOESY' . . . 30033 1
3 '2D 1H-1H TOCSY' . . . 30033 1
4 '2D 1H-15N HSQC' . . . 30033 1
6 '3D HNCACB' . . . 30033 1
7 '3D HN(CO)CA' . . . 30033 1
8 '3D HNCA' . . . 30033 1
9 '3D HNCO' . . . 30033 1
10 '3D CBCA(CO)NH' . . . 30033 1
11 '3D 1H-15N NOESY' . . . 30033 1
12 '3D 1H-15N TOCSY' . . . 30033 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
2 $software_2 . . 30033 1
3 $software_3 . . 30033 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 VAL HA H 1 3.814 0.020 . . . . . . A 1 VAL HA . 30033 1
2 . 1 . 1 1 1 VAL HB H 1 2.207 0.020 . . . . . . A 1 VAL HB . 30033 1
3 . 1 . 1 1 1 VAL HG11 H 1 0.992 0.020 . . . . . . A 1 VAL HG11 . 30033 1
4 . 1 . 1 1 1 VAL HG12 H 1 0.992 0.020 . . . . . . A 1 VAL HG12 . 30033 1
5 . 1 . 1 1 1 VAL HG13 H 1 0.992 0.020 . . . . . . A 1 VAL HG13 . 30033 1
6 . 1 . 1 1 1 VAL HG21 H 1 1.012 0.020 . . . . . . A 1 VAL HG21 . 30033 1
7 . 1 . 1 1 1 VAL HG22 H 1 1.012 0.020 . . . . . . A 1 VAL HG22 . 30033 1
8 . 1 . 1 1 1 VAL HG23 H 1 1.012 0.020 . . . . . . A 1 VAL HG23 . 30033 1
9 . 1 . 1 1 1 VAL C C 13 172.059 0.300 . . . . . . A 1 VAL C . 30033 1
10 . 1 . 1 1 1 VAL CA C 13 61.127 0.300 . . . . . . A 1 VAL CA . 30033 1
11 . 1 . 1 1 1 VAL CB C 13 32.975 0.300 . . . . . . A 1 VAL CB . 30033 1
12 . 1 . 1 1 1 VAL N N 15 123.086 0.300 . . . . . . A 1 VAL N . 30033 1
13 . 1 . 1 2 2 HIS H H 1 8.913 0.020 . . . . . . A 2 HIS H . 30033 1
14 . 1 . 1 2 2 HIS HA H 1 4.766 0.020 . . . . . . A 2 HIS HA . 30033 1
15 . 1 . 1 2 2 HIS HB2 H 1 3.250 0.020 . . . . . . A 2 HIS HB2 . 30033 1
16 . 1 . 1 2 2 HIS HB3 H 1 3.189 0.020 . . . . . . A 2 HIS HB3 . 30033 1
17 . 1 . 1 2 2 HIS HD2 H 1 7.319 0.020 . . . . . . A 2 HIS HD2 . 30033 1
18 . 1 . 1 2 2 HIS C C 13 173.874 0.300 . . . . . . A 2 HIS C . 30033 1
19 . 1 . 1 2 2 HIS CA C 13 55.230 0.300 . . . . . . A 2 HIS CA . 30033 1
20 . 1 . 1 2 2 HIS CB C 13 28.953 0.300 . . . . . . A 2 HIS CB . 30033 1
21 . 1 . 1 2 2 HIS N N 15 123.184 0.300 . . . . . . A 2 HIS N . 30033 1
22 . 1 . 1 3 3 LYS H H 1 8.597 0.020 . . . . . . A 3 LYS H . 30033 1
23 . 1 . 1 3 3 LYS HA H 1 4.307 0.020 . . . . . . A 3 LYS HA . 30033 1
24 . 1 . 1 3 3 LYS HB2 H 1 1.787 0.020 . . . . . . A 3 LYS HB2 . 30033 1
25 . 1 . 1 3 3 LYS HB3 H 1 1.787 0.020 . . . . . . A 3 LYS HB3 . 30033 1
26 . 1 . 1 3 3 LYS HG2 H 1 1.379 0.020 . . . . . . A 3 LYS HG2 . 30033 1
27 . 1 . 1 3 3 LYS HG3 H 1 1.438 0.020 . . . . . . A 3 LYS HG3 . 30033 1
28 . 1 . 1 3 3 LYS HD2 H 1 1.719 0.020 . . . . . . A 3 LYS HD2 . 30033 1
29 . 1 . 1 3 3 LYS HD3 H 1 1.719 0.020 . . . . . . A 3 LYS HD3 . 30033 1
30 . 1 . 1 3 3 LYS HE2 H 1 2.985 0.020 . . . . . . A 3 LYS HE2 . 30033 1
31 . 1 . 1 3 3 LYS HE3 H 1 2.985 0.020 . . . . . . A 3 LYS HE3 . 30033 1
32 . 1 . 1 3 3 LYS C C 13 176.110 0.300 . . . . . . A 3 LYS C . 30033 1
33 . 1 . 1 3 3 LYS CA C 13 56.385 0.300 . . . . . . A 3 LYS CA . 30033 1
34 . 1 . 1 3 3 LYS CB C 13 33.310 0.300 . . . . . . A 3 LYS CB . 30033 1
35 . 1 . 1 3 3 LYS N N 15 124.726 0.300 . . . . . . A 3 LYS N . 30033 1
36 . 1 . 1 4 4 MET H H 1 8.521 0.020 . . . . . . A 4 MET H . 30033 1
37 . 1 . 1 4 4 MET HA H 1 4.474 0.020 . . . . . . A 4 MET HA . 30033 1
38 . 1 . 1 4 4 MET HB2 H 1 2.595 0.020 . . . . . . A 4 MET HB2 . 30033 1
39 . 1 . 1 4 4 MET HB3 H 1 2.560 0.020 . . . . . . A 4 MET HB3 . 30033 1
40 . 1 . 1 4 4 MET HG2 H 1 2.034 0.020 . . . . . . A 4 MET HG2 . 30033 1
41 . 1 . 1 4 4 MET HG3 H 1 1.991 0.020 . . . . . . A 4 MET HG3 . 30033 1
42 . 1 . 1 4 4 MET C C 13 175.677 0.300 . . . . . . A 4 MET C . 30033 1
43 . 1 . 1 4 4 MET CA C 13 55.230 0.300 . . . . . . A 4 MET CA . 30033 1
44 . 1 . 1 4 4 MET CB C 13 33.310 0.300 . . . . . . A 4 MET CB . 30033 1
45 . 1 . 1 4 4 MET N N 15 122.954 0.300 . . . . . . A 4 MET N . 30033 1
46 . 1 . 1 5 5 ALA H H 1 8.453 0.020 . . . . . . A 5 ALA H . 30033 1
47 . 1 . 1 5 5 ALA HA H 1 4.351 0.020 . . . . . . A 5 ALA HA . 30033 1
48 . 1 . 1 5 5 ALA HB1 H 1 1.413 0.020 . . . . . . A 5 ALA HB1 . 30033 1
49 . 1 . 1 5 5 ALA HB2 H 1 1.413 0.020 . . . . . . A 5 ALA HB2 . 30033 1
50 . 1 . 1 5 5 ALA HB3 H 1 1.413 0.020 . . . . . . A 5 ALA HB3 . 30033 1
51 . 1 . 1 5 5 ALA C C 13 177.560 0.300 . . . . . . A 5 ALA C . 30033 1
52 . 1 . 1 5 5 ALA CA C 13 52.503 0.300 . . . . . . A 5 ALA CA . 30033 1
53 . 1 . 1 5 5 ALA CB C 13 19.569 0.300 . . . . . . A 5 ALA CB . 30033 1
54 . 1 . 1 5 5 ALA N N 15 126.710 0.300 . . . . . . A 5 ALA N . 30033 1
55 . 1 . 1 6 6 LYS H H 1 8.437 0.020 . . . . . . A 6 LYS H . 30033 1
56 . 1 . 1 6 6 LYS HA H 1 4.220 0.020 . . . . . . A 6 LYS HA . 30033 1
57 . 1 . 1 6 6 LYS HB2 H 1 1.794 0.020 . . . . . . A 6 LYS HB2 . 30033 1
58 . 1 . 1 6 6 LYS HB3 H 1 1.733 0.020 . . . . . . A 6 LYS HB3 . 30033 1
59 . 1 . 1 6 6 LYS HG2 H 1 1.464 0.020 . . . . . . A 6 LYS HG2 . 30033 1
60 . 1 . 1 6 6 LYS HG3 H 1 1.394 0.020 . . . . . . A 6 LYS HG3 . 30033 1
61 . 1 . 1 6 6 LYS HD2 H 1 1.681 0.020 . . . . . . A 6 LYS HD2 . 30033 1
62 . 1 . 1 6 6 LYS HD3 H 1 1.681 0.020 . . . . . . A 6 LYS HD3 . 30033 1
63 . 1 . 1 6 6 LYS HE2 H 1 2.993 0.020 . . . . . . A 6 LYS HE2 . 30033 1
64 . 1 . 1 6 6 LYS HE3 H 1 2.993 0.020 . . . . . . A 6 LYS HE3 . 30033 1
65 . 1 . 1 6 6 LYS HZ1 H 1 7.543 0.020 . . . . . . A 6 LYS HZ1 . 30033 1
66 . 1 . 1 6 6 LYS HZ2 H 1 7.543 0.020 . . . . . . A 6 LYS HZ2 . 30033 1
67 . 1 . 1 6 6 LYS HZ3 H 1 7.543 0.020 . . . . . . A 6 LYS HZ3 . 30033 1
68 . 1 . 1 6 6 LYS C C 13 176.367 0.300 . . . . . . A 6 LYS C . 30033 1
69 . 1 . 1 6 6 LYS CA C 13 56.818 0.300 . . . . . . A 6 LYS CA . 30033 1
70 . 1 . 1 6 6 LYS CB C 13 32.807 0.300 . . . . . . A 6 LYS CB . 30033 1
71 . 1 . 1 6 6 LYS N N 15 121.367 0.300 . . . . . . A 6 LYS N . 30033 1
72 . 1 . 1 7 7 ASN H H 1 8.409 0.020 . . . . . . A 7 ASN H . 30033 1
73 . 1 . 1 7 7 ASN HA H 1 4.631 0.020 . . . . . . A 7 ASN HA . 30033 1
74 . 1 . 1 7 7 ASN HB2 H 1 2.917 0.020 . . . . . . A 7 ASN HB2 . 30033 1
75 . 1 . 1 7 7 ASN HB3 H 1 2.917 0.020 . . . . . . A 7 ASN HB3 . 30033 1
76 . 1 . 1 7 7 ASN HD21 H 1 7.538 0.020 . . . . . . A 7 ASN HD21 . 30033 1
77 . 1 . 1 7 7 ASN HD22 H 1 6.913 0.020 . . . . . . A 7 ASN HD22 . 30033 1
78 . 1 . 1 7 7 ASN C C 13 174.595 0.300 . . . . . . A 7 ASN C . 30033 1
79 . 1 . 1 7 7 ASN CA C 13 53.505 0.300 . . . . . . A 7 ASN CA . 30033 1
80 . 1 . 1 7 7 ASN CB C 13 38.337 0.300 . . . . . . A 7 ASN CB . 30033 1
81 . 1 . 1 7 7 ASN N N 15 119.016 0.300 . . . . . . A 7 ASN N . 30033 1
82 . 1 . 1 7 7 ASN ND2 N 15 112.263 0.300 . . . . . . A 7 ASN ND2 . 30033 1
83 . 1 . 1 8 8 GLN H H 1 8.194 0.020 . . . . . . A 8 GLN H . 30033 1
84 . 1 . 1 8 8 GLN HA H 1 4.365 0.020 . . . . . . A 8 GLN HA . 30033 1
85 . 1 . 1 8 8 GLN HB2 H 1 2.061 0.020 . . . . . . A 8 GLN HB2 . 30033 1
86 . 1 . 1 8 8 GLN HB3 H 1 1.992 0.020 . . . . . . A 8 GLN HB3 . 30033 1
87 . 1 . 1 8 8 GLN HG2 H 1 2.218 0.020 . . . . . . A 8 GLN HG2 . 30033 1
88 . 1 . 1 8 8 GLN HG3 H 1 2.567 0.020 . . . . . . A 8 GLN HG3 . 30033 1
89 . 1 . 1 8 8 GLN HE21 H 1 7.546 0.020 . . . . . . A 8 GLN HE21 . 30033 1
90 . 1 . 1 8 8 GLN HE22 H 1 6.862 0.020 . . . . . . A 8 GLN HE22 . 30033 1
91 . 1 . 1 8 8 GLN C C 13 175.990 0.300 . . . . . . A 8 GLN C . 30033 1
92 . 1 . 1 8 8 GLN CA C 13 56.889 0.300 . . . . . . A 8 GLN CA . 30033 1
93 . 1 . 1 8 8 GLN CB C 13 29.288 0.300 . . . . . . A 8 GLN CB . 30033 1
94 . 1 . 1 8 8 GLN N N 15 121.234 0.300 . . . . . . A 8 GLN N . 30033 1
95 . 1 . 1 8 8 GLN NE2 N 15 110.968 0.300 . . . . . . A 8 GLN NE2 . 30033 1
96 . 1 . 1 9 9 PHE H H 1 8.322 0.020 . . . . . . A 9 PHE H . 30033 1
97 . 1 . 1 9 9 PHE HA H 1 4.128 0.020 . . . . . . A 9 PHE HA . 30033 1
98 . 1 . 1 9 9 PHE HB2 H 1 3.034 0.020 . . . . . . A 9 PHE HB2 . 30033 1
99 . 1 . 1 9 9 PHE HB3 H 1 2.707 0.020 . . . . . . A 9 PHE HB3 . 30033 1
100 . 1 . 1 9 9 PHE HD1 H 1 6.917 0.020 . . . . . . A 9 PHE HD1 . 30033 1
101 . 1 . 1 9 9 PHE HD2 H 1 6.907 0.020 . . . . . . A 9 PHE HD2 . 30033 1
102 . 1 . 1 9 9 PHE HE1 H 1 7.008 0.020 . . . . . . A 9 PHE HE1 . 30033 1
103 . 1 . 1 9 9 PHE HE2 H 1 6.997 0.020 . . . . . . A 9 PHE HE2 . 30033 1
104 . 1 . 1 9 9 PHE HZ H 1 6.812 0.020 . . . . . . A 9 PHE HZ . 30033 1
105 . 1 . 1 9 9 PHE C C 13 174.884 0.300 . . . . . . A 9 PHE C . 30033 1
106 . 1 . 1 9 9 PHE CA C 13 59.200 0.300 . . . . . . A 9 PHE CA . 30033 1
107 . 1 . 1 9 9 PHE CB C 13 37.419 0.300 . . . . . . A 9 PHE CB . 30033 1
108 . 1 . 1 9 9 PHE N N 15 116.314 0.300 . . . . . . A 9 PHE N . 30033 1
109 . 1 . 1 10 10 GLY H H 1 8.062 0.020 . . . . . . A 10 GLY H . 30033 1
110 . 1 . 1 10 10 GLY HA2 H 1 4.051 0.020 . . . . . . A 10 GLY HA2 . 30033 1
111 . 1 . 1 10 10 GLY HA3 H 1 3.672 0.020 . . . . . . A 10 GLY HA3 . 30033 1
112 . 1 . 1 10 10 GLY C C 13 174.306 0.300 . . . . . . A 10 GLY C . 30033 1
113 . 1 . 1 10 10 GLY CA C 13 46.278 0.300 . . . . . . A 10 GLY CA . 30033 1
114 . 1 . 1 10 10 GLY N N 15 103.366 0.300 . . . . . . A 10 GLY N . 30033 1
115 . 1 . 1 11 11 CYS H H 1 7.925 0.020 . . . . . . A 11 CYS H . 30033 1
116 . 1 . 1 11 11 CYS HA H 1 5.129 0.020 . . . . . . A 11 CYS HA . 30033 1
117 . 1 . 1 11 11 CYS HB2 H 1 2.719 0.020 . . . . . . A 11 CYS HB2 . 30033 1
118 . 1 . 1 11 11 CYS HB3 H 1 2.870 0.020 . . . . . . A 11 CYS HB3 . 30033 1
119 . 1 . 1 11 11 CYS C C 13 175.111 0.300 . . . . . . A 11 CYS C . 30033 1
120 . 1 . 1 11 11 CYS CA C 13 55.446 0.300 . . . . . . A 11 CYS CA . 30033 1
121 . 1 . 1 11 11 CYS CB C 13 35.991 0.300 . . . . . . A 11 CYS CB . 30033 1
122 . 1 . 1 11 11 CYS N N 15 119.211 0.300 . . . . . . A 11 CYS N . 30033 1
123 . 1 . 1 12 12 PHE H H 1 8.990 0.020 . . . . . . A 12 PHE H . 30033 1
124 . 1 . 1 12 12 PHE HA H 1 4.299 0.020 . . . . . . A 12 PHE HA . 30033 1
125 . 1 . 1 12 12 PHE HB2 H 1 3.075 0.020 . . . . . . A 12 PHE HB2 . 30033 1
126 . 1 . 1 12 12 PHE HB3 H 1 2.873 0.020 . . . . . . A 12 PHE HB3 . 30033 1
127 . 1 . 1 12 12 PHE HD1 H 1 7.259 0.020 . . . . . . A 12 PHE HD1 . 30033 1
128 . 1 . 1 12 12 PHE HD2 H 1 7.248 0.020 . . . . . . A 12 PHE HD2 . 30033 1
129 . 1 . 1 12 12 PHE HE1 H 1 7.374 0.020 . . . . . . A 12 PHE HE1 . 30033 1
130 . 1 . 1 12 12 PHE HE2 H 1 7.364 0.020 . . . . . . A 12 PHE HE2 . 30033 1
131 . 1 . 1 12 12 PHE C C 13 175.749 0.300 . . . . . . A 12 PHE C . 30033 1
132 . 1 . 1 12 12 PHE CA C 13 59.778 0.300 . . . . . . A 12 PHE CA . 30033 1
133 . 1 . 1 12 12 PHE CB C 13 41.856 0.300 . . . . . . A 12 PHE CB . 30033 1
134 . 1 . 1 12 12 PHE N N 15 121.725 0.300 . . . . . . A 12 PHE N . 30033 1
135 . 1 . 1 13 13 ALA H H 1 7.968 0.020 . . . . . . A 13 ALA H . 30033 1
136 . 1 . 1 13 13 ALA HA H 1 3.738 0.020 . . . . . . A 13 ALA HA . 30033 1
137 . 1 . 1 13 13 ALA HB1 H 1 1.097 0.020 . . . . . . A 13 ALA HB1 . 30033 1
138 . 1 . 1 13 13 ALA HB2 H 1 1.097 0.020 . . . . . . A 13 ALA HB2 . 30033 1
139 . 1 . 1 13 13 ALA HB3 H 1 1.097 0.020 . . . . . . A 13 ALA HB3 . 30033 1
140 . 1 . 1 13 13 ALA C C 13 176.038 0.300 . . . . . . A 13 ALA C . 30033 1
141 . 1 . 1 13 13 ALA CA C 13 53.505 0.300 . . . . . . A 13 ALA CA . 30033 1
142 . 1 . 1 13 13 ALA CB C 13 16.720 0.300 . . . . . . A 13 ALA CB . 30033 1
143 . 1 . 1 13 13 ALA N N 15 131.722 0.300 . . . . . . A 13 ALA N . 30033 1
144 . 1 . 1 14 14 ASN H H 1 8.031 0.020 . . . . . . A 14 ASN H . 30033 1
145 . 1 . 1 14 14 ASN HA H 1 3.925 0.020 . . . . . . A 14 ASN HA . 30033 1
146 . 1 . 1 14 14 ASN HB2 H 1 3.207 0.020 . . . . . . A 14 ASN HB2 . 30033 1
147 . 1 . 1 14 14 ASN HB3 H 1 3.508 0.020 . . . . . . A 14 ASN HB3 . 30033 1
148 . 1 . 1 14 14 ASN HD21 H 1 7.609 0.020 . . . . . . A 14 ASN HD21 . 30033 1
149 . 1 . 1 14 14 ASN HD22 H 1 6.967 0.020 . . . . . . A 14 ASN HD22 . 30033 1
150 . 1 . 1 14 14 ASN C C 13 174.018 0.300 . . . . . . A 14 ASN C . 30033 1
151 . 1 . 1 14 14 ASN CA C 13 55.761 0.300 . . . . . . A 14 ASN CA . 30033 1
152 . 1 . 1 14 14 ASN CB C 13 38.002 0.300 . . . . . . A 14 ASN CB . 30033 1
153 . 1 . 1 14 14 ASN N N 15 104.151 0.300 . . . . . . A 14 ASN N . 30033 1
154 . 1 . 1 14 14 ASN ND2 N 15 115.140 0.300 . . . . . . A 14 ASN ND2 . 30033 1
155 . 1 . 1 15 15 VAL H H 1 8.404 0.020 . . . . . . A 15 VAL H . 30033 1
156 . 1 . 1 15 15 VAL HA H 1 4.189 0.020 . . . . . . A 15 VAL HA . 30033 1
157 . 1 . 1 15 15 VAL HB H 1 2.344 0.020 . . . . . . A 15 VAL HB . 30033 1
158 . 1 . 1 15 15 VAL HG11 H 1 0.922 0.020 . . . . . . A 15 VAL HG11 . 30033 1
159 . 1 . 1 15 15 VAL HG12 H 1 0.922 0.020 . . . . . . A 15 VAL HG12 . 30033 1
160 . 1 . 1 15 15 VAL HG13 H 1 0.922 0.020 . . . . . . A 15 VAL HG13 . 30033 1
161 . 1 . 1 15 15 VAL HG21 H 1 1.013 0.020 . . . . . . A 15 VAL HG21 . 30033 1
162 . 1 . 1 15 15 VAL HG22 H 1 1.013 0.020 . . . . . . A 15 VAL HG22 . 30033 1
163 . 1 . 1 15 15 VAL HG23 H 1 1.013 0.020 . . . . . . A 15 VAL HG23 . 30033 1
164 . 1 . 1 15 15 VAL C C 13 174.667 0.300 . . . . . . A 15 VAL C . 30033 1
165 . 1 . 1 15 15 VAL CA C 13 62.089 0.300 . . . . . . A 15 VAL CA . 30033 1
166 . 1 . 1 15 15 VAL CB C 13 33.310 0.300 . . . . . . A 15 VAL CB . 30033 1
167 . 1 . 1 15 15 VAL N N 15 123.160 0.300 . . . . . . A 15 VAL N . 30033 1
168 . 1 . 1 16 16 ASP H H 1 8.948 0.020 . . . . . . A 16 ASP H . 30033 1
169 . 1 . 1 16 16 ASP HA H 1 4.961 0.020 . . . . . . A 16 ASP HA . 30033 1
170 . 1 . 1 16 16 ASP HB2 H 1 3.096 0.020 . . . . . . A 16 ASP HB2 . 30033 1
171 . 1 . 1 16 16 ASP HB3 H 1 2.580 0.020 . . . . . . A 16 ASP HB3 . 30033 1
172 . 1 . 1 16 16 ASP C C 13 177.673 0.300 . . . . . . A 16 ASP C . 30033 1
173 . 1 . 1 16 16 ASP CA C 13 52.236 0.300 . . . . . . A 16 ASP CA . 30033 1
174 . 1 . 1 16 16 ASP CB C 13 39.007 0.300 . . . . . . A 16 ASP CB . 30033 1
175 . 1 . 1 16 16 ASP N N 15 128.572 0.300 . . . . . . A 16 ASP N . 30033 1
176 . 1 . 1 17 17 VAL H H 1 7.851 0.020 . . . . . . A 17 VAL H . 30033 1
177 . 1 . 1 17 17 VAL HA H 1 3.540 0.020 . . . . . . A 17 VAL HA . 30033 1
178 . 1 . 1 17 17 VAL HB H 1 2.227 0.020 . . . . . . A 17 VAL HB . 30033 1
179 . 1 . 1 17 17 VAL HG11 H 1 1.025 0.020 . . . . . . A 17 VAL HG11 . 30033 1
180 . 1 . 1 17 17 VAL HG12 H 1 1.025 0.020 . . . . . . A 17 VAL HG12 . 30033 1
181 . 1 . 1 17 17 VAL HG13 H 1 1.025 0.020 . . . . . . A 17 VAL HG13 . 30033 1
182 . 1 . 1 17 17 VAL HG21 H 1 1.309 0.020 . . . . . . A 17 VAL HG21 . 30033 1
183 . 1 . 1 17 17 VAL HG22 H 1 1.309 0.020 . . . . . . A 17 VAL HG22 . 30033 1
184 . 1 . 1 17 17 VAL HG23 H 1 1.309 0.020 . . . . . . A 17 VAL HG23 . 30033 1
185 . 1 . 1 17 17 VAL C C 13 177.356 0.300 . . . . . . A 17 VAL C . 30033 1
186 . 1 . 1 17 17 VAL CA C 13 67.441 0.300 . . . . . . A 17 VAL CA . 30033 1
187 . 1 . 1 17 17 VAL CB C 13 32.400 0.300 . . . . . . A 17 VAL CB . 30033 1
188 . 1 . 1 17 17 VAL N N 15 124.366 0.300 . . . . . . A 17 VAL N . 30033 1
189 . 1 . 1 18 18 LYS H H 1 8.930 0.020 . . . . . . A 18 LYS H . 30033 1
190 . 1 . 1 18 18 LYS HA H 1 4.627 0.020 . . . . . . A 18 LYS HA . 30033 1
191 . 1 . 1 18 18 LYS HB2 H 1 2.092 0.020 . . . . . . A 18 LYS HB2 . 30033 1
192 . 1 . 1 18 18 LYS HB3 H 1 2.092 0.020 . . . . . . A 18 LYS HB3 . 30033 1
193 . 1 . 1 18 18 LYS HG2 H 1 1.523 0.020 . . . . . . A 18 LYS HG2 . 30033 1
194 . 1 . 1 18 18 LYS HG3 H 1 1.441 0.020 . . . . . . A 18 LYS HG3 . 30033 1
195 . 1 . 1 18 18 LYS HD2 H 1 1.759 0.020 . . . . . . A 18 LYS HD2 . 30033 1
196 . 1 . 1 18 18 LYS HD3 H 1 1.759 0.020 . . . . . . A 18 LYS HD3 . 30033 1
197 . 1 . 1 18 18 LYS HE2 H 1 3.023 0.020 . . . . . . A 18 LYS HE2 . 30033 1
198 . 1 . 1 18 18 LYS HE3 H 1 3.023 0.020 . . . . . . A 18 LYS HE3 . 30033 1
199 . 1 . 1 18 18 LYS HZ1 H 1 7.142 0.020 . . . . . . A 18 LYS HZ1 . 30033 1
200 . 1 . 1 18 18 LYS HZ2 H 1 7.142 0.020 . . . . . . A 18 LYS HZ2 . 30033 1
201 . 1 . 1 18 18 LYS HZ3 H 1 7.142 0.020 . . . . . . A 18 LYS HZ3 . 30033 1
202 . 1 . 1 18 18 LYS C C 13 176.896 0.300 . . . . . . A 18 LYS C . 30033 1
203 . 1 . 1 18 18 LYS CA C 13 54.802 0.300 . . . . . . A 18 LYS CA . 30033 1
204 . 1 . 1 18 18 LYS CB C 13 33.185 0.300 . . . . . . A 18 LYS CB . 30033 1
205 . 1 . 1 18 18 LYS N N 15 115.731 0.300 . . . . . . A 18 LYS N . 30033 1
206 . 1 . 1 19 19 GLY H H 1 7.372 0.020 . . . . . . A 19 GLY H . 30033 1
207 . 1 . 1 19 19 GLY HA2 H 1 4.142 0.020 . . . . . . A 19 GLY HA2 . 30033 1
208 . 1 . 1 19 19 GLY HA3 H 1 3.730 0.020 . . . . . . A 19 GLY HA3 . 30033 1
209 . 1 . 1 19 19 GLY C C 13 175.206 0.300 . . . . . . A 19 GLY C . 30033 1
210 . 1 . 1 19 19 GLY CA C 13 46.086 0.300 . . . . . . A 19 GLY CA . 30033 1
211 . 1 . 1 19 19 GLY N N 15 107.761 0.300 . . . . . . A 19 GLY N . 30033 1
212 . 1 . 1 20 20 ASP H H 1 8.187 0.020 . . . . . . A 20 ASP H . 30033 1
213 . 1 . 1 20 20 ASP HA H 1 4.602 0.020 . . . . . . A 20 ASP HA . 30033 1
214 . 1 . 1 20 20 ASP HB2 H 1 3.783 0.020 . . . . . . A 20 ASP HB2 . 30033 1
215 . 1 . 1 20 20 ASP HB3 H 1 3.783 0.020 . . . . . . A 20 ASP HB3 . 30033 1
216 . 1 . 1 20 20 ASP C C 13 177.875 0.300 . . . . . . A 20 ASP C . 30033 1
217 . 1 . 1 20 20 ASP CA C 13 56.330 0.300 . . . . . . A 20 ASP CA . 30033 1
218 . 1 . 1 20 20 ASP CB C 13 38.692 0.300 . . . . . . A 20 ASP CB . 30033 1
219 . 1 . 1 20 20 ASP N N 15 119.252 0.300 . . . . . . A 20 ASP N . 30033 1
220 . 1 . 1 21 21 CYS H H 1 10.470 0.020 . . . . . . A 21 CYS H . 30033 1
221 . 1 . 1 21 21 CYS HA H 1 4.610 0.020 . . . . . . A 21 CYS HA . 30033 1
222 . 1 . 1 21 21 CYS HB2 H 1 2.586 0.020 . . . . . . A 21 CYS HB2 . 30033 1
223 . 1 . 1 21 21 CYS HB3 H 1 3.169 0.020 . . . . . . A 21 CYS HB3 . 30033 1
224 . 1 . 1 21 21 CYS C C 13 176.493 0.300 . . . . . . A 21 CYS C . 30033 1
225 . 1 . 1 21 21 CYS CA C 13 58.142 0.300 . . . . . . A 21 CYS CA . 30033 1
226 . 1 . 1 21 21 CYS CB C 13 35.317 0.300 . . . . . . A 21 CYS CB . 30033 1
227 . 1 . 1 21 21 CYS N N 15 127.565 0.300 . . . . . . A 21 CYS N . 30033 1
228 . 1 . 1 22 22 LYS H H 1 9.488 0.020 . . . . . . A 22 LYS H . 30033 1
229 . 1 . 1 22 22 LYS HA H 1 3.752 0.020 . . . . . . A 22 LYS HA . 30033 1
230 . 1 . 1 22 22 LYS HB2 H 1 1.996 0.020 . . . . . . A 22 LYS HB2 . 30033 1
231 . 1 . 1 22 22 LYS HB3 H 1 1.826 0.020 . . . . . . A 22 LYS HB3 . 30033 1
232 . 1 . 1 22 22 LYS HG2 H 1 1.390 0.020 . . . . . . A 22 LYS HG2 . 30033 1
233 . 1 . 1 22 22 LYS HG3 H 1 1.390 0.020 . . . . . . A 22 LYS HG3 . 30033 1
234 . 1 . 1 22 22 LYS HD2 H 1 1.634 0.020 . . . . . . A 22 LYS HD2 . 30033 1
235 . 1 . 1 22 22 LYS HD3 H 1 1.634 0.020 . . . . . . A 22 LYS HD3 . 30033 1
236 . 1 . 1 22 22 LYS HE2 H 1 3.099 0.020 . . . . . . A 22 LYS HE2 . 30033 1
237 . 1 . 1 22 22 LYS HE3 H 1 3.099 0.020 . . . . . . A 22 LYS HE3 . 30033 1
238 . 1 . 1 22 22 LYS HZ1 H 1 7.670 0.020 . . . . . . A 22 LYS HZ1 . 30033 1
239 . 1 . 1 22 22 LYS HZ2 H 1 7.670 0.020 . . . . . . A 22 LYS HZ2 . 30033 1
240 . 1 . 1 22 22 LYS HZ3 H 1 7.670 0.020 . . . . . . A 22 LYS HZ3 . 30033 1
241 . 1 . 1 22 22 LYS C C 13 180.136 0.300 . . . . . . A 22 LYS C . 30033 1
242 . 1 . 1 22 22 LYS CA C 13 60.803 0.300 . . . . . . A 22 LYS CA . 30033 1
243 . 1 . 1 22 22 LYS CB C 13 31.799 0.300 . . . . . . A 22 LYS CB . 30033 1
244 . 1 . 1 22 22 LYS N N 15 123.352 0.300 . . . . . . A 22 LYS N . 30033 1
245 . 1 . 1 23 23 ARG H H 1 7.916 0.020 . . . . . . A 23 ARG H . 30033 1
246 . 1 . 1 23 23 ARG HA H 1 3.970 0.020 . . . . . . A 23 ARG HA . 30033 1
247 . 1 . 1 23 23 ARG HB2 H 1 1.889 0.020 . . . . . . A 23 ARG HB2 . 30033 1
248 . 1 . 1 23 23 ARG HB3 H 1 1.963 0.020 . . . . . . A 23 ARG HB3 . 30033 1
249 . 1 . 1 23 23 ARG HG2 H 1 0.942 0.020 . . . . . . A 23 ARG HG2 . 30033 1
250 . 1 . 1 23 23 ARG HG3 H 1 0.942 0.020 . . . . . . A 23 ARG HG3 . 30033 1
251 . 1 . 1 23 23 ARG HD2 H 1 3.333 0.020 . . . . . . A 23 ARG HD2 . 30033 1
252 . 1 . 1 23 23 ARG HD3 H 1 3.270 0.020 . . . . . . A 23 ARG HD3 . 30033 1
253 . 1 . 1 23 23 ARG HE H 1 7.337 0.020 . . . . . . A 23 ARG HE . 30033 1
254 . 1 . 1 23 23 ARG C C 13 178.493 0.300 . . . . . . A 23 ARG C . 30033 1
255 . 1 . 1 23 23 ARG CA C 13 60.577 0.300 . . . . . . A 23 ARG CA . 30033 1
256 . 1 . 1 23 23 ARG CB C 13 30.874 0.300 . . . . . . A 23 ARG CB . 30033 1
257 . 1 . 1 23 23 ARG N N 15 118.015 0.300 . . . . . . A 23 ARG N . 30033 1
258 . 1 . 1 24 24 HIS H H 1 8.142 0.020 . . . . . . A 24 HIS H . 30033 1
259 . 1 . 1 24 24 HIS HA H 1 4.269 0.020 . . . . . . A 24 HIS HA . 30033 1
260 . 1 . 1 24 24 HIS HB2 H 1 3.018 0.020 . . . . . . A 24 HIS HB2 . 30033 1
261 . 1 . 1 24 24 HIS HB3 H 1 3.018 0.020 . . . . . . A 24 HIS HB3 . 30033 1
262 . 1 . 1 24 24 HIS HD2 H 1 6.518 0.020 . . . . . . A 24 HIS HD2 . 30033 1
263 . 1 . 1 24 24 HIS C C 13 176.958 0.300 . . . . . . A 24 HIS C . 30033 1
264 . 1 . 1 24 24 HIS CA C 13 58.570 0.300 . . . . . . A 24 HIS CA . 30033 1
265 . 1 . 1 24 24 HIS CB C 13 27.741 0.300 . . . . . . A 24 HIS CB . 30033 1
266 . 1 . 1 24 24 HIS N N 15 119.673 0.300 . . . . . . A 24 HIS N . 30033 1
267 . 1 . 1 25 25 CYS H H 1 8.237 0.020 . . . . . . A 25 CYS H . 30033 1
268 . 1 . 1 25 25 CYS HA H 1 4.042 0.020 . . . . . . A 25 CYS HA . 30033 1
269 . 1 . 1 25 25 CYS HB2 H 1 2.153 0.020 . . . . . . A 25 CYS HB2 . 30033 1
270 . 1 . 1 25 25 CYS HB3 H 1 2.357 0.020 . . . . . . A 25 CYS HB3 . 30033 1
271 . 1 . 1 25 25 CYS C C 13 177.831 0.300 . . . . . . A 25 CYS C . 30033 1
272 . 1 . 1 25 25 CYS CA C 13 56.001 0.300 . . . . . . A 25 CYS CA . 30033 1
273 . 1 . 1 25 25 CYS CB C 13 35.978 0.300 . . . . . . A 25 CYS CB . 30033 1
274 . 1 . 1 25 25 CYS N N 15 115.849 0.300 . . . . . . A 25 CYS N . 30033 1
275 . 1 . 1 26 26 LYS H H 1 8.474 0.020 . . . . . . A 26 LYS H . 30033 1
276 . 1 . 1 26 26 LYS HA H 1 4.130 0.020 . . . . . . A 26 LYS HA . 30033 1
277 . 1 . 1 26 26 LYS HB2 H 1 2.020 0.020 . . . . . . A 26 LYS HB2 . 30033 1
278 . 1 . 1 26 26 LYS HB3 H 1 1.986 0.020 . . . . . . A 26 LYS HB3 . 30033 1
279 . 1 . 1 26 26 LYS HG2 H 1 1.468 0.020 . . . . . . A 26 LYS HG2 . 30033 1
280 . 1 . 1 26 26 LYS HG3 H 1 1.401 0.020 . . . . . . A 26 LYS HG3 . 30033 1
281 . 1 . 1 26 26 LYS HD2 H 1 1.718 0.020 . . . . . . A 26 LYS HD2 . 30033 1
282 . 1 . 1 26 26 LYS HD3 H 1 1.637 0.020 . . . . . . A 26 LYS HD3 . 30033 1
283 . 1 . 1 26 26 LYS HE2 H 1 2.989 0.020 . . . . . . A 26 LYS HE2 . 30033 1
284 . 1 . 1 26 26 LYS HE3 H 1 2.989 0.020 . . . . . . A 26 LYS HE3 . 30033 1
285 . 1 . 1 26 26 LYS C C 13 179.633 0.300 . . . . . . A 26 LYS C . 30033 1
286 . 1 . 1 26 26 LYS CA C 13 59.705 0.300 . . . . . . A 26 LYS CA . 30033 1
287 . 1 . 1 26 26 LYS CB C 13 31.969 0.300 . . . . . . A 26 LYS CB . 30033 1
288 . 1 . 1 26 26 LYS N N 15 125.012 0.300 . . . . . . A 26 LYS N . 30033 1
289 . 1 . 1 27 27 ALA H H 1 7.257 0.020 . . . . . . A 27 ALA H . 30033 1
290 . 1 . 1 27 27 ALA HA H 1 4.264 0.020 . . . . . . A 27 ALA HA . 30033 1
291 . 1 . 1 27 27 ALA HB1 H 1 1.515 0.020 . . . . . . A 27 ALA HB1 . 30033 1
292 . 1 . 1 27 27 ALA HB2 H 1 1.515 0.020 . . . . . . A 27 ALA HB2 . 30033 1
293 . 1 . 1 27 27 ALA HB3 H 1 1.515 0.020 . . . . . . A 27 ALA HB3 . 30033 1
294 . 1 . 1 27 27 ALA C C 13 178.063 0.300 . . . . . . A 27 ALA C . 30033 1
295 . 1 . 1 27 27 ALA CA C 13 54.580 0.300 . . . . . . A 27 ALA CA . 30033 1
296 . 1 . 1 27 27 ALA CB C 13 17.893 0.300 . . . . . . A 27 ALA CB . 30033 1
297 . 1 . 1 27 27 ALA N N 15 122.198 0.300 . . . . . . A 27 ALA N . 30033 1
298 . 1 . 1 28 28 GLU H H 1 7.309 0.020 . . . . . . A 28 GLU H . 30033 1
299 . 1 . 1 28 28 GLU HA H 1 4.575 0.020 . . . . . . A 28 GLU HA . 30033 1
300 . 1 . 1 28 28 GLU HB2 H 1 1.952 0.020 . . . . . . A 28 GLU HB2 . 30033 1
301 . 1 . 1 28 28 GLU HB3 H 1 2.221 0.020 . . . . . . A 28 GLU HB3 . 30033 1
302 . 1 . 1 28 28 GLU HG2 H 1 2.239 0.020 . . . . . . A 28 GLU HG2 . 30033 1
303 . 1 . 1 28 28 GLU HG3 H 1 2.345 0.020 . . . . . . A 28 GLU HG3 . 30033 1
304 . 1 . 1 28 28 GLU C C 13 174.734 0.300 . . . . . . A 28 GLU C . 30033 1
305 . 1 . 1 28 28 GLU CA C 13 54.075 0.300 . . . . . . A 28 GLU CA . 30033 1
306 . 1 . 1 28 28 GLU CB C 13 28.283 0.300 . . . . . . A 28 GLU CB . 30033 1
307 . 1 . 1 28 28 GLU N N 15 114.358 0.300 . . . . . . A 28 GLU N . 30033 1
308 . 1 . 1 29 29 ASP H H 1 8.272 0.020 . . . . . . A 29 ASP H . 30033 1
309 . 1 . 1 29 29 ASP HA H 1 4.362 0.020 . . . . . . A 29 ASP HA . 30033 1
310 . 1 . 1 29 29 ASP HB2 H 1 2.890 0.020 . . . . . . A 29 ASP HB2 . 30033 1
311 . 1 . 1 29 29 ASP HB3 H 1 3.323 0.020 . . . . . . A 29 ASP HB3 . 30033 1
312 . 1 . 1 29 29 ASP C C 13 174.451 0.300 . . . . . . A 29 ASP C . 30033 1
313 . 1 . 1 29 29 ASP CA C 13 54.436 0.300 . . . . . . A 29 ASP CA . 30033 1
314 . 1 . 1 29 29 ASP CB C 13 36.494 0.300 . . . . . . A 29 ASP CB . 30033 1
315 . 1 . 1 29 29 ASP N N 15 115.911 0.300 . . . . . . A 29 ASP N . 30033 1
316 . 1 . 1 30 30 LYS H H 1 7.866 0.020 . . . . . . A 30 LYS H . 30033 1
317 . 1 . 1 30 30 LYS HA H 1 4.823 0.020 . . . . . . A 30 LYS HA . 30033 1
318 . 1 . 1 30 30 LYS HB2 H 1 1.757 0.020 . . . . . . A 30 LYS HB2 . 30033 1
319 . 1 . 1 30 30 LYS HB3 H 1 1.757 0.020 . . . . . . A 30 LYS HB3 . 30033 1
320 . 1 . 1 30 30 LYS HG2 H 1 1.455 0.020 . . . . . . A 30 LYS HG2 . 30033 1
321 . 1 . 1 30 30 LYS HG3 H 1 1.455 0.020 . . . . . . A 30 LYS HG3 . 30033 1
322 . 1 . 1 30 30 LYS HD2 H 1 1.132 0.020 . . . . . . A 30 LYS HD2 . 30033 1
323 . 1 . 1 30 30 LYS HD3 H 1 1.132 0.020 . . . . . . A 30 LYS HD3 . 30033 1
324 . 1 . 1 30 30 LYS HE2 H 1 2.965 0.020 . . . . . . A 30 LYS HE2 . 30033 1
325 . 1 . 1 30 30 LYS HE3 H 1 2.965 0.020 . . . . . . A 30 LYS HE3 . 30033 1
326 . 1 . 1 30 30 LYS HZ1 H 1 7.568 0.020 . . . . . . A 30 LYS HZ1 . 30033 1
327 . 1 . 1 30 30 LYS HZ2 H 1 7.568 0.020 . . . . . . A 30 LYS HZ2 . 30033 1
328 . 1 . 1 30 30 LYS HZ3 H 1 7.568 0.020 . . . . . . A 30 LYS HZ3 . 30033 1
329 . 1 . 1 30 30 LYS C C 13 175.533 0.300 . . . . . . A 30 LYS C . 30033 1
330 . 1 . 1 30 30 LYS CA C 13 55.260 0.300 . . . . . . A 30 LYS CA . 30033 1
331 . 1 . 1 30 30 LYS CB C 13 38.840 0.300 . . . . . . A 30 LYS CB . 30033 1
332 . 1 . 1 30 30 LYS N N 15 116.975 0.300 . . . . . . A 30 LYS N . 30033 1
333 . 1 . 1 31 31 GLU H H 1 8.669 0.020 . . . . . . A 31 GLU H . 30033 1
334 . 1 . 1 31 31 GLU HA H 1 4.290 0.020 . . . . . . A 31 GLU HA . 30033 1
335 . 1 . 1 31 31 GLU HB2 H 1 1.908 0.020 . . . . . . A 31 GLU HB2 . 30033 1
336 . 1 . 1 31 31 GLU HB3 H 1 2.048 0.020 . . . . . . A 31 GLU HB3 . 30033 1
337 . 1 . 1 31 31 GLU HG2 H 1 2.347 0.020 . . . . . . A 31 GLU HG2 . 30033 1
338 . 1 . 1 31 31 GLU HG3 H 1 2.441 0.020 . . . . . . A 31 GLU HG3 . 30033 1
339 . 1 . 1 31 31 GLU C C 13 176.327 0.300 . . . . . . A 31 GLU C . 30033 1
340 . 1 . 1 31 31 GLU CA C 13 55.591 0.300 . . . . . . A 31 GLU CA . 30033 1
341 . 1 . 1 31 31 GLU CB C 13 29.456 0.300 . . . . . . A 31 GLU CB . 30033 1
342 . 1 . 1 31 31 GLU N N 15 120.020 0.300 . . . . . . A 31 GLU N . 30033 1
343 . 1 . 1 32 32 GLY H H 1 8.343 0.020 . . . . . . A 32 GLY H . 30033 1
344 . 1 . 1 32 32 GLY HA2 H 1 5.187 0.020 . . . . . . A 32 GLY HA2 . 30033 1
345 . 1 . 1 32 32 GLY HA3 H 1 3.048 0.020 . . . . . . A 32 GLY HA3 . 30033 1
346 . 1 . 1 32 32 GLY C C 13 171.930 0.300 . . . . . . A 32 GLY C . 30033 1
347 . 1 . 1 32 32 GLY CA C 13 47.217 0.300 . . . . . . A 32 GLY CA . 30033 1
348 . 1 . 1 32 32 GLY N N 15 111.595 0.300 . . . . . . A 32 GLY N . 30033 1
349 . 1 . 1 33 33 ILE H H 1 8.651 0.020 . . . . . . A 33 ILE H . 30033 1
350 . 1 . 1 33 33 ILE HA H 1 4.308 0.020 . . . . . . A 33 ILE HA . 30033 1
351 . 1 . 1 33 33 ILE HB H 1 1.798 0.020 . . . . . . A 33 ILE HB . 30033 1
352 . 1 . 1 33 33 ILE HG12 H 1 1.384 0.020 . . . . . . A 33 ILE HG12 . 30033 1
353 . 1 . 1 33 33 ILE HG13 H 1 1.110 0.020 . . . . . . A 33 ILE HG13 . 30033 1
354 . 1 . 1 33 33 ILE HG21 H 1 0.834 0.020 . . . . . . A 33 ILE HG21 . 30033 1
355 . 1 . 1 33 33 ILE HG22 H 1 0.834 0.020 . . . . . . A 33 ILE HG22 . 30033 1
356 . 1 . 1 33 33 ILE HG23 H 1 0.834 0.020 . . . . . . A 33 ILE HG23 . 30033 1
357 . 1 . 1 33 33 ILE HD11 H 1 0.709 0.020 . . . . . . A 33 ILE HD11 . 30033 1
358 . 1 . 1 33 33 ILE HD12 H 1 0.709 0.020 . . . . . . A 33 ILE HD12 . 30033 1
359 . 1 . 1 33 33 ILE HD13 H 1 0.709 0.020 . . . . . . A 33 ILE HD13 . 30033 1
360 . 1 . 1 33 33 ILE C C 13 174.566 0.300 . . . . . . A 33 ILE C . 30033 1
361 . 1 . 1 33 33 ILE CA C 13 59.771 0.300 . . . . . . A 33 ILE CA . 30033 1
362 . 1 . 1 33 33 ILE CB C 13 41.688 0.300 . . . . . . A 33 ILE CB . 30033 1
363 . 1 . 1 33 33 ILE N N 15 126.450 0.300 . . . . . . A 33 ILE N . 30033 1
364 . 1 . 1 34 34 CYS H H 1 8.971 0.020 . . . . . . A 34 CYS H . 30033 1
365 . 1 . 1 34 34 CYS HA H 1 5.312 0.020 . . . . . . A 34 CYS HA . 30033 1
366 . 1 . 1 34 34 CYS HB2 H 1 2.439 0.020 . . . . . . A 34 CYS HB2 . 30033 1
367 . 1 . 1 34 34 CYS HB3 H 1 2.439 0.020 . . . . . . A 34 CYS HB3 . 30033 1
368 . 1 . 1 34 34 CYS C C 13 174.518 0.300 . . . . . . A 34 CYS C . 30033 1
369 . 1 . 1 34 34 CYS CA C 13 53.881 0.300 . . . . . . A 34 CYS CA . 30033 1
370 . 1 . 1 34 34 CYS CB C 13 35.991 0.300 . . . . . . A 34 CYS CB . 30033 1
371 . 1 . 1 34 34 CYS N N 15 124.364 0.300 . . . . . . A 34 CYS N . 30033 1
372 . 1 . 1 35 35 HIS H H 1 9.509 0.020 . . . . . . A 35 HIS H . 30033 1
373 . 1 . 1 35 35 HIS HA H 1 4.892 0.020 . . . . . . A 35 HIS HA . 30033 1
374 . 1 . 1 35 35 HIS HB2 H 1 3.029 0.020 . . . . . . A 35 HIS HB2 . 30033 1
375 . 1 . 1 35 35 HIS HB3 H 1 3.187 0.020 . . . . . . A 35 HIS HB3 . 30033 1
376 . 1 . 1 35 35 HIS HD1 H 1 8.659 0.020 . . . . . . A 35 HIS HD1 . 30033 1
377 . 1 . 1 35 35 HIS HD2 H 1 7.141 0.020 . . . . . . A 35 HIS HD2 . 30033 1
378 . 1 . 1 35 35 HIS C C 13 175.048 0.300 . . . . . . A 35 HIS C . 30033 1
379 . 1 . 1 35 35 HIS CA C 13 54.075 0.300 . . . . . . A 35 HIS CA . 30033 1
380 . 1 . 1 35 35 HIS CB C 13 28.785 0.300 . . . . . . A 35 HIS CB . 30033 1
381 . 1 . 1 35 35 HIS N N 15 123.699 0.300 . . . . . . A 35 HIS N . 30033 1
382 . 1 . 1 36 36 GLY H H 1 9.629 0.020 . . . . . . A 36 GLY H . 30033 1
383 . 1 . 1 36 36 GLY HA2 H 1 3.415 0.020 . . . . . . A 36 GLY HA2 . 30033 1
384 . 1 . 1 36 36 GLY HA3 H 1 4.145 0.020 . . . . . . A 36 GLY HA3 . 30033 1
385 . 1 . 1 36 36 GLY C C 13 174.420 0.300 . . . . . . A 36 GLY C . 30033 1
386 . 1 . 1 36 36 GLY CA C 13 47.794 0.300 . . . . . . A 36 GLY CA . 30033 1
387 . 1 . 1 36 36 GLY N N 15 117.739 0.300 . . . . . . A 36 GLY N . 30033 1
388 . 1 . 1 37 37 THR H H 1 8.354 0.020 . . . . . . A 37 THR H . 30033 1
389 . 1 . 1 37 37 THR HA H 1 4.324 0.020 . . . . . . A 37 THR HA . 30033 1
390 . 1 . 1 37 37 THR HB H 1 4.265 0.020 . . . . . . A 37 THR HB . 30033 1
391 . 1 . 1 37 37 THR HG21 H 1 1.330 0.020 . . . . . . A 37 THR HG21 . 30033 1
392 . 1 . 1 37 37 THR HG22 H 1 1.330 0.020 . . . . . . A 37 THR HG22 . 30033 1
393 . 1 . 1 37 37 THR HG23 H 1 1.330 0.020 . . . . . . A 37 THR HG23 . 30033 1
394 . 1 . 1 37 37 THR C C 13 173.712 0.300 . . . . . . A 37 THR C . 30033 1
395 . 1 . 1 37 37 THR CA C 13 60.961 0.300 . . . . . . A 37 THR CA . 30033 1
396 . 1 . 1 37 37 THR CB C 13 69.170 0.300 . . . . . . A 37 THR CB . 30033 1
397 . 1 . 1 37 37 THR N N 15 117.615 0.300 . . . . . . A 37 THR N . 30033 1
398 . 1 . 1 38 38 LYS H H 1 8.052 0.020 . . . . . . A 38 LYS H . 30033 1
399 . 1 . 1 38 38 LYS HA H 1 4.540 0.020 . . . . . . A 38 LYS HA . 30033 1
400 . 1 . 1 38 38 LYS HB2 H 1 2.009 0.020 . . . . . . A 38 LYS HB2 . 30033 1
401 . 1 . 1 38 38 LYS HB3 H 1 2.031 0.020 . . . . . . A 38 LYS HB3 . 30033 1
402 . 1 . 1 38 38 LYS HG2 H 1 1.519 0.020 . . . . . . A 38 LYS HG2 . 30033 1
403 . 1 . 1 38 38 LYS HG3 H 1 1.365 0.020 . . . . . . A 38 LYS HG3 . 30033 1
404 . 1 . 1 38 38 LYS HD2 H 1 1.820 0.020 . . . . . . A 38 LYS HD2 . 30033 1
405 . 1 . 1 38 38 LYS HD3 H 1 1.665 0.020 . . . . . . A 38 LYS HD3 . 30033 1
406 . 1 . 1 38 38 LYS HE2 H 1 3.000 0.020 . . . . . . A 38 LYS HE2 . 30033 1
407 . 1 . 1 38 38 LYS HE3 H 1 3.000 0.020 . . . . . . A 38 LYS HE3 . 30033 1
408 . 1 . 1 38 38 LYS C C 13 174.671 0.300 . . . . . . A 38 LYS C . 30033 1
409 . 1 . 1 38 38 LYS CA C 13 55.260 0.300 . . . . . . A 38 LYS CA . 30033 1
410 . 1 . 1 38 38 LYS CB C 13 33.772 0.300 . . . . . . A 38 LYS CB . 30033 1
411 . 1 . 1 38 38 LYS N N 15 121.635 0.300 . . . . . . A 38 LYS N . 30033 1
412 . 1 . 1 39 39 CYS H H 1 8.805 0.020 . . . . . . A 39 CYS H . 30033 1
413 . 1 . 1 39 39 CYS HA H 1 5.037 0.020 . . . . . . A 39 CYS HA . 30033 1
414 . 1 . 1 39 39 CYS HB2 H 1 3.231 0.020 . . . . . . A 39 CYS HB2 . 30033 1
415 . 1 . 1 39 39 CYS HB3 H 1 2.782 0.020 . . . . . . A 39 CYS HB3 . 30033 1
416 . 1 . 1 39 39 CYS C C 13 173.540 0.300 . . . . . . A 39 CYS C . 30033 1
417 . 1 . 1 39 39 CYS CA C 13 55.322 0.300 . . . . . . A 39 CYS CA . 30033 1
418 . 1 . 1 39 39 CYS CB C 13 38.213 0.300 . . . . . . A 39 CYS CB . 30033 1
419 . 1 . 1 39 39 CYS N N 15 123.390 0.300 . . . . . . A 39 CYS N . 30033 1
420 . 1 . 1 40 40 LYS H H 1 9.160 0.020 . . . . . . A 40 LYS H . 30033 1
421 . 1 . 1 40 40 LYS HA H 1 4.754 0.020 . . . . . . A 40 LYS HA . 30033 1
422 . 1 . 1 40 40 LYS HB2 H 1 1.881 0.020 . . . . . . A 40 LYS HB2 . 30033 1
423 . 1 . 1 40 40 LYS HB3 H 1 1.711 0.020 . . . . . . A 40 LYS HB3 . 30033 1
424 . 1 . 1 40 40 LYS HG2 H 1 1.319 0.020 . . . . . . A 40 LYS HG2 . 30033 1
425 . 1 . 1 40 40 LYS HG3 H 1 1.319 0.020 . . . . . . A 40 LYS HG3 . 30033 1
426 . 1 . 1 40 40 LYS HD2 H 1 1.576 0.020 . . . . . . A 40 LYS HD2 . 30033 1
427 . 1 . 1 40 40 LYS HD3 H 1 1.576 0.020 . . . . . . A 40 LYS HD3 . 30033 1
428 . 1 . 1 40 40 LYS HE2 H 1 2.918 0.020 . . . . . . A 40 LYS HE2 . 30033 1
429 . 1 . 1 40 40 LYS HE3 H 1 2.918 0.020 . . . . . . A 40 LYS HE3 . 30033 1
430 . 1 . 1 40 40 LYS C C 13 175.305 0.300 . . . . . . A 40 LYS C . 30033 1
431 . 1 . 1 40 40 LYS CA C 13 54.445 0.300 . . . . . . A 40 LYS CA . 30033 1
432 . 1 . 1 40 40 LYS CB C 13 34.483 0.300 . . . . . . A 40 LYS CB . 30033 1
433 . 1 . 1 40 40 LYS N N 15 131.804 0.300 . . . . . . A 40 LYS N . 30033 1
434 . 1 . 1 41 41 CYS H H 1 8.984 0.020 . . . . . . A 41 CYS H . 30033 1
435 . 1 . 1 41 41 CYS HA H 1 5.576 0.020 . . . . . . A 41 CYS HA . 30033 1
436 . 1 . 1 41 41 CYS HB2 H 1 2.780 0.020 . . . . . . A 41 CYS HB2 . 30033 1
437 . 1 . 1 41 41 CYS HB3 H 1 2.738 0.020 . . . . . . A 41 CYS HB3 . 30033 1
438 . 1 . 1 41 41 CYS C C 13 175.488 0.300 . . . . . . A 41 CYS C . 30033 1
439 . 1 . 1 41 41 CYS CA C 13 51.909 0.300 . . . . . . A 41 CYS CA . 30033 1
440 . 1 . 1 41 41 CYS CB C 13 35.153 0.300 . . . . . . A 41 CYS CB . 30033 1
441 . 1 . 1 41 41 CYS N N 15 123.280 0.300 . . . . . . A 41 CYS N . 30033 1
442 . 1 . 1 42 42 GLY H H 1 8.942 0.020 . . . . . . A 42 GLY H . 30033 1
443 . 1 . 1 42 42 GLY HA2 H 1 4.333 0.020 . . . . . . A 42 GLY HA2 . 30033 1
444 . 1 . 1 42 42 GLY HA3 H 1 3.858 0.020 . . . . . . A 42 GLY HA3 . 30033 1
445 . 1 . 1 42 42 GLY C C 13 172.661 0.300 . . . . . . A 42 GLY C . 30033 1
446 . 1 . 1 42 42 GLY CA C 13 44.979 0.300 . . . . . . A 42 GLY CA . 30033 1
447 . 1 . 1 42 42 GLY N N 15 114.226 0.300 . . . . . . A 42 GLY N . 30033 1
448 . 1 . 1 43 43 VAL H H 1 8.139 0.020 . . . . . . A 43 VAL H . 30033 1
449 . 1 . 1 43 43 VAL HA H 1 4.376 0.020 . . . . . . A 43 VAL HA . 30033 1
450 . 1 . 1 43 43 VAL HB H 1 2.185 0.020 . . . . . . A 43 VAL HB . 30033 1
451 . 1 . 1 43 43 VAL HG11 H 1 1.039 0.020 . . . . . . A 43 VAL HG11 . 30033 1
452 . 1 . 1 43 43 VAL HG12 H 1 1.039 0.020 . . . . . . A 43 VAL HG12 . 30033 1
453 . 1 . 1 43 43 VAL HG13 H 1 1.039 0.020 . . . . . . A 43 VAL HG13 . 30033 1
454 . 1 . 1 43 43 VAL HG21 H 1 0.947 0.020 . . . . . . A 43 VAL HG21 . 30033 1
455 . 1 . 1 43 43 VAL HG22 H 1 0.947 0.020 . . . . . . A 43 VAL HG22 . 30033 1
456 . 1 . 1 43 43 VAL HG23 H 1 0.947 0.020 . . . . . . A 43 VAL HG23 . 30033 1
457 . 1 . 1 43 43 VAL C C 13 173.666 0.300 . . . . . . A 43 VAL C . 30033 1
458 . 1 . 1 43 43 VAL CA C 13 60.341 0.300 . . . . . . A 43 VAL CA . 30033 1
459 . 1 . 1 43 43 VAL CB C 13 31.686 0.300 . . . . . . A 43 VAL CB . 30033 1
460 . 1 . 1 43 43 VAL N N 15 121.567 0.300 . . . . . . A 43 VAL N . 30033 1
461 . 1 . 1 44 44 PRO HA H 1 4.680 0.020 . . . . . . A 44 PRO HA . 30033 1
462 . 1 . 1 44 44 PRO HB2 H 1 2.329 0.020 . . . . . . A 44 PRO HB2 . 30033 1
463 . 1 . 1 44 44 PRO HB3 H 1 1.800 0.020 . . . . . . A 44 PRO HB3 . 30033 1
464 . 1 . 1 44 44 PRO HG2 H 1 2.059 0.020 . . . . . . A 44 PRO HG2 . 30033 1
465 . 1 . 1 44 44 PRO HG3 H 1 1.926 0.020 . . . . . . A 44 PRO HG3 . 30033 1
466 . 1 . 1 44 44 PRO HD2 H 1 3.629 0.020 . . . . . . A 44 PRO HD2 . 30033 1
467 . 1 . 1 44 44 PRO HD3 H 1 3.891 0.020 . . . . . . A 44 PRO HD3 . 30033 1
468 . 1 . 1 44 44 PRO C C 13 176.958 0.300 . . . . . . A 44 PRO C . 30033 1
469 . 1 . 1 44 44 PRO CA C 13 63.000 0.300 . . . . . . A 44 PRO CA . 30033 1
470 . 1 . 1 44 44 PRO CB C 13 32.034 0.300 . . . . . . A 44 PRO CB . 30033 1
471 . 1 . 1 45 45 ILE H H 1 7.845 0.020 . . . . . . A 45 ILE H . 30033 1
472 . 1 . 1 45 45 ILE HA H 1 3.981 0.020 . . . . . . A 45 ILE HA . 30033 1
473 . 1 . 1 45 45 ILE HB H 1 1.632 0.020 . . . . . . A 45 ILE HB . 30033 1
474 . 1 . 1 45 45 ILE HG12 H 1 0.969 0.020 . . . . . . A 45 ILE HG12 . 30033 1
475 . 1 . 1 45 45 ILE HG13 H 1 1.316 0.020 . . . . . . A 45 ILE HG13 . 30033 1
476 . 1 . 1 45 45 ILE HG21 H 1 0.788 0.020 . . . . . . A 45 ILE HG21 . 30033 1
477 . 1 . 1 45 45 ILE HG22 H 1 0.788 0.020 . . . . . . A 45 ILE HG22 . 30033 1
478 . 1 . 1 45 45 ILE HG23 H 1 0.788 0.020 . . . . . . A 45 ILE HG23 . 30033 1
479 . 1 . 1 45 45 ILE HD11 H 1 0.733 0.020 . . . . . . A 45 ILE HD11 . 30033 1
480 . 1 . 1 45 45 ILE HD12 H 1 0.733 0.020 . . . . . . A 45 ILE HD12 . 30033 1
481 . 1 . 1 45 45 ILE HD13 H 1 0.733 0.020 . . . . . . A 45 ILE HD13 . 30033 1
482 . 1 . 1 45 45 ILE C C 13 176.272 0.300 . . . . . . A 45 ILE C . 30033 1
483 . 1 . 1 45 45 ILE CA C 13 61.776 0.300 . . . . . . A 45 ILE CA . 30033 1
484 . 1 . 1 45 45 ILE CB C 13 38.505 0.300 . . . . . . A 45 ILE CB . 30033 1
485 . 1 . 1 45 45 ILE N N 15 121.296 0.300 . . . . . . A 45 ILE N . 30033 1
486 . 1 . 1 46 46 SER H H 1 8.163 0.020 . . . . . . A 46 SER H . 30033 1
487 . 1 . 1 46 46 SER HA H 1 4.438 0.020 . . . . . . A 46 SER HA . 30033 1
488 . 1 . 1 46 46 SER HB2 H 1 3.804 0.020 . . . . . . A 46 SER HB2 . 30033 1
489 . 1 . 1 46 46 SER HB3 H 1 3.769 0.020 . . . . . . A 46 SER HB3 . 30033 1
490 . 1 . 1 46 46 SER C C 13 173.792 0.300 . . . . . . A 46 SER C . 30033 1
491 . 1 . 1 46 46 SER CA C 13 58.079 0.300 . . . . . . A 46 SER CA . 30033 1
492 . 1 . 1 46 46 SER CB C 13 63.976 0.300 . . . . . . A 46 SER CB . 30033 1
493 . 1 . 1 46 46 SER N N 15 119.156 0.300 . . . . . . A 46 SER N . 30033 1
494 . 1 . 1 47 47 TYR H H 1 8.221 0.020 . . . . . . A 47 TYR H . 30033 1
495 . 1 . 1 47 47 TYR HA H 1 4.604 0.020 . . . . . . A 47 TYR HA . 30033 1
496 . 1 . 1 47 47 TYR HB2 H 1 2.944 0.020 . . . . . . A 47 TYR HB2 . 30033 1
497 . 1 . 1 47 47 TYR HB3 H 1 3.091 0.020 . . . . . . A 47 TYR HB3 . 30033 1
498 . 1 . 1 47 47 TYR HD1 H 1 7.136 0.020 . . . . . . A 47 TYR HD1 . 30033 1
499 . 1 . 1 47 47 TYR HD2 H 1 7.122 0.020 . . . . . . A 47 TYR HD2 . 30033 1
500 . 1 . 1 47 47 TYR HE1 H 1 6.820 0.020 . . . . . . A 47 TYR HE1 . 30033 1
501 . 1 . 1 47 47 TYR HE2 H 1 6.803 0.020 . . . . . . A 47 TYR HE2 . 30033 1
502 . 1 . 1 47 47 TYR C C 13 175.362 0.300 . . . . . . A 47 TYR C . 30033 1
503 . 1 . 1 47 47 TYR CA C 13 57.901 0.300 . . . . . . A 47 TYR CA . 30033 1
504 . 1 . 1 47 47 TYR CB C 13 38.599 0.300 . . . . . . A 47 TYR CB . 30033 1
505 . 1 . 1 47 47 TYR N N 15 122.585 0.300 . . . . . . A 47 TYR N . 30033 1
506 . 1 . 1 48 48 LEU H H 1 8.100 0.020 . . . . . . A 48 LEU H . 30033 1
507 . 1 . 1 48 48 LEU HA H 1 4.323 0.020 . . . . . . A 48 LEU HA . 30033 1
508 . 1 . 1 48 48 LEU HB2 H 1 1.616 0.020 . . . . . . A 48 LEU HB2 . 30033 1
509 . 1 . 1 48 48 LEU HB3 H 1 1.616 0.020 . . . . . . A 48 LEU HB3 . 30033 1
510 . 1 . 1 48 48 LEU HG H 1 1.533 0.020 . . . . . . A 48 LEU HG . 30033 1
511 . 1 . 1 48 48 LEU HD11 H 1 0.859 0.020 . . . . . . A 48 LEU HD11 . 30033 1
512 . 1 . 1 48 48 LEU HD12 H 1 0.859 0.020 . . . . . . A 48 LEU HD12 . 30033 1
513 . 1 . 1 48 48 LEU HD13 H 1 0.859 0.020 . . . . . . A 48 LEU HD13 . 30033 1
514 . 1 . 1 48 48 LEU HD21 H 1 0.859 0.020 . . . . . . A 48 LEU HD21 . 30033 1
515 . 1 . 1 48 48 LEU HD22 H 1 0.859 0.020 . . . . . . A 48 LEU HD22 . 30033 1
516 . 1 . 1 48 48 LEU HD23 H 1 0.859 0.020 . . . . . . A 48 LEU HD23 . 30033 1
517 . 1 . 1 48 48 LEU C C 13 179.131 0.300 . . . . . . A 48 LEU C . 30033 1
518 . 1 . 1 48 48 LEU CA C 13 54.633 0.300 . . . . . . A 48 LEU CA . 30033 1
519 . 1 . 1 48 48 LEU CB C 13 42.191 0.300 . . . . . . A 48 LEU CB . 30033 1
520 . 1 . 1 48 48 LEU N N 15 124.719 0.300 . . . . . . A 48 LEU N . 30033 1
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