Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 26001
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 26001 1
3 '3D HNCO' 1 $sample_1 isotropic 26001 1
4 '3D HNCA' 1 $sample_1 isotropic 26001 1
5 '3D HNCACB' 1 $sample_1 isotropic 26001 1
8 '3D HCCH-TOCSY' 1 $sample_1 isotropic 26001 1
12 '3D 1H-15N NOESY' 1 $sample_1 isotropic 26001 1
13 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 26001 1
17 HBCBCGCDHD 1 $sample_1 isotropic 26001 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 2 2 PHE H H 1 8.7 0.02 . 1 . . . . A 2 PHE H . 26001 1
2 . 1 . 1 2 2 PHE HA H 1 4.852 0.02 . 1 . . . . A 2 PHE HA . 26001 1
3 . 1 . 1 2 2 PHE HB2 H 1 3.132 0.02 . 2 . . . . A 2 PHE HB2 . 26001 1
4 . 1 . 1 2 2 PHE HB3 H 1 2.252 0.02 . 2 . . . . A 2 PHE HB3 . 26001 1
5 . 1 . 1 2 2 PHE HD1 H 1 7.227 0.02 . 1 . . . . A 2 PHE HD1 . 26001 1
6 . 1 . 1 2 2 PHE HD2 H 1 7.227 0.02 . 1 . . . . A 2 PHE HD2 . 26001 1
7 . 1 . 1 2 2 PHE HE1 H 1 7.165 0.02 . 1 . . . . A 2 PHE HE1 . 26001 1
8 . 1 . 1 2 2 PHE HE2 H 1 7.165 0.02 . 1 . . . . A 2 PHE HE2 . 26001 1
9 . 1 . 1 2 2 PHE C C 13 174.926 0.3 . 1 . . . . A 2 PHE C . 26001 1
10 . 1 . 1 2 2 PHE CA C 13 57.092 0.3 . 1 . . . . A 2 PHE CA . 26001 1
11 . 1 . 1 2 2 PHE CB C 13 42.335 0.3 . 1 . . . . A 2 PHE CB . 26001 1
12 . 1 . 1 2 2 PHE N N 15 120.327 0.3 . 1 . . . . A 2 PHE N . 26001 1
13 . 1 . 1 3 3 GLY H H 1 8.913 0.02 . 1 . . . . A 3 GLY H . 26001 1
14 . 1 . 1 3 3 GLY HA2 H 1 4.85 0.02 . 2 . . . . A 3 GLY HA2 . 26001 1
15 . 1 . 1 3 3 GLY HA3 H 1 3.892 0.02 . 2 . . . . A 3 GLY HA3 . 26001 1
16 . 1 . 1 3 3 GLY C C 13 173.443 0.3 . 1 . . . . A 3 GLY C . 26001 1
17 . 1 . 1 3 3 GLY CA C 13 44.114 0.3 . 1 . . . . A 3 GLY CA . 26001 1
18 . 1 . 1 3 3 GLY N N 15 110.104 0.3 . 1 . . . . A 3 GLY N . 26001 1
19 . 1 . 1 4 4 GLY H H 1 8.32 0.02 . 1 . . . . A 4 GLY H . 26001 1
20 . 1 . 1 4 4 GLY HA2 H 1 4.407 0.02 . 2 . . . . A 4 GLY HA2 . 26001 1
21 . 1 . 1 4 4 GLY HA3 H 1 4.266 0.02 . 2 . . . . A 4 GLY HA3 . 26001 1
22 . 1 . 1 4 4 GLY C C 13 173.779 0.3 . 1 . . . . A 4 GLY C . 26001 1
23 . 1 . 1 4 4 GLY CA C 13 45.746 0.3 . 1 . . . . A 4 GLY CA . 26001 1
24 . 1 . 1 4 4 GLY N N 15 109.968 0.3 . 1 . . . . A 4 GLY N . 26001 1
25 . 1 . 1 5 5 GLU H H 1 7.94 0.02 . 1 . . . . A 5 GLU H . 26001 1
26 . 1 . 1 5 5 GLU HA H 1 5.056 0.02 . 1 . . . . A 5 GLU HA . 26001 1
27 . 1 . 1 5 5 GLU HB2 H 1 1.761 0.02 . 2 . . . . A 5 GLU HB2 . 26001 1
28 . 1 . 1 5 5 GLU HB3 H 1 1.671 0.02 . 2 . . . . A 5 GLU HB3 . 26001 1
29 . 1 . 1 5 5 GLU HG2 H 1 2.201 0.02 . 2 . . . . A 5 GLU HG2 . 26001 1
30 . 1 . 1 5 5 GLU HG3 H 1 2.113 0.02 . 2 . . . . A 5 GLU HG3 . 26001 1
31 . 1 . 1 5 5 GLU C C 13 176.718 0.3 . 1 . . . . A 5 GLU C . 26001 1
32 . 1 . 1 5 5 GLU CA C 13 54.154 0.3 . 1 . . . . A 5 GLU CA . 26001 1
33 . 1 . 1 5 5 GLU CB C 13 33.486 0.3 . 1 . . . . A 5 GLU CB . 26001 1
34 . 1 . 1 5 5 GLU CG C 13 36.01 0.3 . 1 . . . . A 5 GLU CG . 26001 1
35 . 1 . 1 5 5 GLU N N 15 119.495 0.3 . 1 . . . . A 5 GLU N . 26001 1
36 . 1 . 1 6 6 CYS H H 1 9.551 0.02 . 1 . . . . A 6 CYS H . 26001 1
37 . 1 . 1 6 6 CYS HA H 1 6.28 0.02 . 1 . . . . A 6 CYS HA . 26001 1
38 . 1 . 1 6 6 CYS HB2 H 1 3.573 0.02 . 2 . . . . A 6 CYS HB2 . 26001 1
39 . 1 . 1 6 6 CYS HB3 H 1 2.866 0.02 . 2 . . . . A 6 CYS HB3 . 26001 1
40 . 1 . 1 6 6 CYS C C 13 172.128 0.3 . 1 . . . . A 6 CYS C . 26001 1
41 . 1 . 1 6 6 CYS CA C 13 53.015 0.3 . 1 . . . . A 6 CYS CA . 26001 1
42 . 1 . 1 6 6 CYS CB C 13 42.825 0.3 . 1 . . . . A 6 CYS CB . 26001 1
43 . 1 . 1 6 6 CYS N N 15 122.696 0.3 . 1 . . . . A 6 CYS N . 26001 1
44 . 1 . 1 7 7 SER H H 1 8.587 0.02 . 1 . . . . A 7 SER H . 26001 1
45 . 1 . 1 7 7 SER HA H 1 5.07 0.02 . 1 . . . . A 7 SER HA . 26001 1
46 . 1 . 1 7 7 SER HB2 H 1 4.003 0.02 . 2 . . . . A 7 SER HB2 . 26001 1
47 . 1 . 1 7 7 SER HB3 H 1 3.813 0.02 . 2 . . . . A 7 SER HB3 . 26001 1
48 . 1 . 1 7 7 SER C C 13 175.695 0.3 . 1 . . . . A 7 SER C . 26001 1
49 . 1 . 1 7 7 SER CA C 13 54.402 0.3 . 1 . . . . A 7 SER CA . 26001 1
50 . 1 . 1 7 7 SER CB C 13 64.365 0.3 . 1 . . . . A 7 SER CB . 26001 1
51 . 1 . 1 7 7 SER N N 15 115.277 0.3 . 1 . . . . A 7 SER N . 26001 1
52 . 1 . 1 8 8 LEU H H 1 9.017 0.02 . 1 . . . . A 8 LEU H . 26001 1
53 . 1 . 1 8 8 LEU HA H 1 3.645 0.02 . 1 . . . . A 8 LEU HA . 26001 1
54 . 1 . 1 8 8 LEU HB2 H 1 1.661 0.02 . 2 . . . . A 8 LEU HB2 . 26001 1
55 . 1 . 1 8 8 LEU HB3 H 1 1.056 0.02 . 2 . . . . A 8 LEU HB3 . 26001 1
56 . 1 . 1 8 8 LEU HG H 1 1.377 0.02 . 1 . . . . A 8 LEU HG . 26001 1
57 . 1 . 1 8 8 LEU HD11 H 1 0.8 0.02 . 2 . . . . A 8 LEU HD11 . 26001 1
58 . 1 . 1 8 8 LEU HD12 H 1 0.8 0.02 . 2 . . . . A 8 LEU HD12 . 26001 1
59 . 1 . 1 8 8 LEU HD13 H 1 0.8 0.02 . 2 . . . . A 8 LEU HD13 . 26001 1
60 . 1 . 1 8 8 LEU HD21 H 1 0.641 0.02 . 2 . . . . A 8 LEU HD21 . 26001 1
61 . 1 . 1 8 8 LEU HD22 H 1 0.641 0.02 . 2 . . . . A 8 LEU HD22 . 26001 1
62 . 1 . 1 8 8 LEU HD23 H 1 0.641 0.02 . 2 . . . . A 8 LEU HD23 . 26001 1
63 . 1 . 1 8 8 LEU CA C 13 57.751 0.3 . 1 . . . . A 8 LEU CA . 26001 1
64 . 1 . 1 8 8 LEU CB C 13 43.105 0.3 . 1 . . . . A 8 LEU CB . 26001 1
65 . 1 . 1 8 8 LEU CG C 13 25.886 0.3 . 1 . . . . A 8 LEU CG . 26001 1
66 . 1 . 1 8 8 LEU CD1 C 13 23.736 0.3 . 1 . . . . A 8 LEU CD1 . 26001 1
67 . 1 . 1 8 8 LEU CD2 C 13 23.736 0.3 . 1 . . . . A 8 LEU CD2 . 26001 1
68 . 1 . 1 8 8 LEU N N 15 133.387 0.3 . 1 . . . . A 8 LEU N . 26001 1
69 . 1 . 1 9 9 LYS H H 1 8.41 0.02 . 1 . . . . A 9 LYS H . 26001 1
70 . 1 . 1 9 9 LYS HA H 1 3.762 0.02 . 1 . . . . A 9 LYS HA . 26001 1
71 . 1 . 1 9 9 LYS HB2 H 1 1.496 0.02 . 2 . . . . A 9 LYS HB2 . 26001 1
72 . 1 . 1 9 9 LYS HB3 H 1 1.087 0.02 . 2 . . . . A 9 LYS HB3 . 26001 1
73 . 1 . 1 9 9 LYS HG2 H 1 0.943 0.02 . 2 . . . . A 9 LYS HG2 . 26001 1
74 . 1 . 1 9 9 LYS HG3 H 1 0.714 0.02 . 2 . . . . A 9 LYS HG3 . 26001 1
75 . 1 . 1 9 9 LYS HD2 H 1 1.406 0.02 . 1 . . . . A 9 LYS HD2 . 26001 1
76 . 1 . 1 9 9 LYS HD3 H 1 1.406 0.02 . 1 . . . . A 9 LYS HD3 . 26001 1
77 . 1 . 1 9 9 LYS HE2 H 1 2.756 0.02 . 1 . . . . A 9 LYS HE2 . 26001 1
78 . 1 . 1 9 9 LYS HE3 H 1 2.756 0.02 . 1 . . . . A 9 LYS HE3 . 26001 1
79 . 1 . 1 9 9 LYS C C 13 177.886 0.3 . 1 . . . . A 9 LYS C . 26001 1
80 . 1 . 1 9 9 LYS CA C 13 58.84 0.3 . 1 . . . . A 9 LYS CA . 26001 1
81 . 1 . 1 9 9 LYS CB C 13 32.614 0.3 . 1 . . . . A 9 LYS CB . 26001 1
82 . 1 . 1 9 9 LYS CG C 13 24.259 0.3 . 1 . . . . A 9 LYS CG . 26001 1
83 . 1 . 1 9 9 LYS CD C 13 29.024 0.3 . 1 . . . . A 9 LYS CD . 26001 1
84 . 1 . 1 9 9 LYS CE C 13 41.867 0.3 . 1 . . . . A 9 LYS CE . 26001 1
85 . 1 . 1 9 9 LYS N N 15 117.81 0.3 . 1 . . . . A 9 LYS N . 26001 1
86 . 1 . 1 10 10 HIS H H 1 7.551 0.02 . 1 . . . . A 10 HIS H . 26001 1
87 . 1 . 1 10 10 HIS HA H 1 4.618 0.02 . 1 . . . . A 10 HIS HA . 26001 1
88 . 1 . 1 10 10 HIS HB2 H 1 3.178 0.02 . 2 . . . . A 10 HIS HB2 . 26001 1
89 . 1 . 1 10 10 HIS HB3 H 1 2.756 0.02 . 2 . . . . A 10 HIS HB3 . 26001 1
90 . 1 . 1 10 10 HIS HD2 H 1 6.976 0.02 . 1 . . . . A 10 HIS HD2 . 26001 1
91 . 1 . 1 10 10 HIS C C 13 174.926 0.3 . 1 . . . . A 10 HIS C . 26001 1
92 . 1 . 1 10 10 HIS CA C 13 55.483 0.3 . 1 . . . . A 10 HIS CA . 26001 1
93 . 1 . 1 10 10 HIS CB C 13 31.076 0.3 . 1 . . . . A 10 HIS CB . 26001 1
94 . 1 . 1 10 10 HIS N N 15 112.191 0.3 . 1 . . . . A 10 HIS N . 26001 1
95 . 1 . 1 11 11 ASN H H 1 8.485 0.02 . 1 . . . . A 11 ASN H . 26001 1
96 . 1 . 1 11 11 ASN HA H 1 4.641 0.02 . 1 . . . . A 11 ASN HA . 26001 1
97 . 1 . 1 11 11 ASN HB2 H 1 3.287 0.02 . 2 . . . . A 11 ASN HB2 . 26001 1
98 . 1 . 1 11 11 ASN HB3 H 1 2.385 0.02 . 2 . . . . A 11 ASN HB3 . 26001 1
99 . 1 . 1 11 11 ASN HD21 H 1 7.094 0.02 . 1 . . . . A 11 ASN HD21 . 26001 1
100 . 1 . 1 11 11 ASN HD22 H 1 6.547 0.02 . 1 . . . . A 11 ASN HD22 . 26001 1
101 . 1 . 1 11 11 ASN C C 13 174.574 0.3 . 1 . . . . A 11 ASN C . 26001 1
102 . 1 . 1 11 11 ASN CA C 13 53.945 0.3 . 1 . . . . A 11 ASN CA . 26001 1
103 . 1 . 1 11 11 ASN CB C 13 37.16 0.3 . 1 . . . . A 11 ASN CB . 26001 1
104 . 1 . 1 11 11 ASN N N 15 119.867 0.3 . 1 . . . . A 11 ASN N . 26001 1
105 . 1 . 1 11 11 ASN ND2 N 15 109.356 0.3 . 1 . . . . A 11 ASN ND2 . 26001 1
106 . 1 . 1 12 12 THR H H 1 7.078 0.02 . 1 . . . . A 12 THR H . 26001 1
107 . 1 . 1 12 12 THR HA H 1 4.901 0.02 . 1 . . . . A 12 THR HA . 26001 1
108 . 1 . 1 12 12 THR HB H 1 3.96 0.02 . 1 . . . . A 12 THR HB . 26001 1
109 . 1 . 1 12 12 THR HG21 H 1 0.932 0.02 . 1 . . . . A 12 THR HG21 . 26001 1
110 . 1 . 1 12 12 THR HG22 H 1 0.932 0.02 . 1 . . . . A 12 THR HG22 . 26001 1
111 . 1 . 1 12 12 THR HG23 H 1 0.932 0.02 . 1 . . . . A 12 THR HG23 . 26001 1
112 . 1 . 1 12 12 THR CA C 13 58.351 0.3 . 1 . . . . A 12 THR CA . 26001 1
113 . 1 . 1 12 12 THR CB C 13 72.268 0.3 . 1 . . . . A 12 THR CB . 26001 1
114 . 1 . 1 12 12 THR CG2 C 13 21.121 0.3 . 1 . . . . A 12 THR CG2 . 26001 1
115 . 1 . 1 12 12 THR N N 15 104.205 0.3 . 1 . . . . A 12 THR N . 26001 1
116 . 1 . 1 13 13 CYS H H 1 9.563 0.02 . 1 . . . . A 13 CYS H . 26001 1
117 . 1 . 1 13 13 CYS HA H 1 4.731 0.02 . 1 . . . . A 13 CYS HA . 26001 1
118 . 1 . 1 13 13 CYS HB2 H 1 2.781 0.02 . 2 . . . . A 13 CYS HB2 . 26001 1
119 . 1 . 1 13 13 CYS HB3 H 1 2.622 0.02 . 2 . . . . A 13 CYS HB3 . 26001 1
120 . 1 . 1 13 13 CYS C C 13 173.275 0.3 . 1 . . . . A 13 CYS C . 26001 1
121 . 1 . 1 13 13 CYS CA C 13 53.595 0.3 . 1 . . . . A 13 CYS CA . 26001 1
122 . 1 . 1 13 13 CYS CB C 13 43.035 0.3 . 1 . . . . A 13 CYS CB . 26001 1
123 . 1 . 1 13 13 CYS N N 15 120.463 0.3 . 1 . . . . A 13 CYS N . 26001 1
124 . 1 . 1 14 14 THR H H 1 8.239 0.02 . 1 . . . . A 14 THR H . 26001 1
125 . 1 . 1 14 14 THR HA H 1 5.366 0.02 . 1 . . . . A 14 THR HA . 26001 1
126 . 1 . 1 14 14 THR HB H 1 3.948 0.02 . 1 . . . . A 14 THR HB . 26001 1
127 . 1 . 1 14 14 THR HG21 H 1 0.909 0.02 . 1 . . . . A 14 THR HG21 . 26001 1
128 . 1 . 1 14 14 THR HG22 H 1 0.909 0.02 . 1 . . . . A 14 THR HG22 . 26001 1
129 . 1 . 1 14 14 THR HG23 H 1 0.909 0.02 . 1 . . . . A 14 THR HG23 . 26001 1
130 . 1 . 1 14 14 THR C C 13 173.751 0.3 . 1 . . . . A 14 THR C . 26001 1
131 . 1 . 1 14 14 THR CA C 13 61.568 0.3 . 1 . . . . A 14 THR CA . 26001 1
132 . 1 . 1 14 14 THR CB C 13 69.324 0.3 . 1 . . . . A 14 THR CB . 26001 1
133 . 1 . 1 14 14 THR CG2 C 13 20.656 0.3 . 1 . . . . A 14 THR CG2 . 26001 1
134 . 1 . 1 14 14 THR N N 15 126.042 0.3 . 1 . . . . A 14 THR N . 26001 1
135 . 1 . 1 15 15 TYR H H 1 8.945 0.02 . 1 . . . . A 15 TYR H . 26001 1
136 . 1 . 1 15 15 TYR HA H 1 5.147 0.02 . 1 . . . . A 15 TYR HA . 26001 1
137 . 1 . 1 15 15 TYR HB2 H 1 2.834 0.02 . 2 . . . . A 15 TYR HB2 . 26001 1
138 . 1 . 1 15 15 TYR HB3 H 1 2.302 0.02 . 2 . . . . A 15 TYR HB3 . 26001 1
139 . 1 . 1 15 15 TYR HD1 H 1 6.409 0.02 . 1 . . . . A 15 TYR HD1 . 26001 1
140 . 1 . 1 15 15 TYR HD2 H 1 6.409 0.02 . 1 . . . . A 15 TYR HD2 . 26001 1
141 . 1 . 1 15 15 TYR HE1 H 1 5.741 0.02 . 1 . . . . A 15 TYR HE1 . 26001 1
142 . 1 . 1 15 15 TYR HE2 H 1 5.741 0.02 . 1 . . . . A 15 TYR HE2 . 26001 1
143 . 1 . 1 15 15 TYR C C 13 172.086 0.3 . 1 . . . . A 15 TYR C . 26001 1
144 . 1 . 1 15 15 TYR CA C 13 54.535 0.3 . 1 . . . . A 15 TYR CA . 26001 1
145 . 1 . 1 15 15 TYR CB C 13 41.806 0.3 . 1 . . . . A 15 TYR CB . 26001 1
146 . 1 . 1 15 15 TYR N N 15 125.458 0.3 . 1 . . . . A 15 TYR N . 26001 1
147 . 1 . 1 16 16 LEU H H 1 8.392 0.02 . 1 . . . . A 16 LEU H . 26001 1
148 . 1 . 1 16 16 LEU HA H 1 4.761 0.02 . 1 . . . . A 16 LEU HA . 26001 1
149 . 1 . 1 16 16 LEU HB2 H 1 1.577 0.02 . 1 . . . . A 16 LEU HB2 . 26001 1
150 . 1 . 1 16 16 LEU HB3 H 1 1.577 0.02 . 1 . . . . A 16 LEU HB3 . 26001 1
151 . 1 . 1 16 16 LEU HG H 1 1.449 0.02 . 1 . . . . A 16 LEU HG . 26001 1
152 . 1 . 1 16 16 LEU HD11 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD11 . 26001 1
153 . 1 . 1 16 16 LEU HD12 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD12 . 26001 1
154 . 1 . 1 16 16 LEU HD13 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD13 . 26001 1
155 . 1 . 1 16 16 LEU HD21 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD21 . 26001 1
156 . 1 . 1 16 16 LEU HD22 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD22 . 26001 1
157 . 1 . 1 16 16 LEU HD23 H 1 0.678 0.02 . 1 . . . . A 16 LEU HD23 . 26001 1
158 . 1 . 1 16 16 LEU C C 13 177.01 0.3 . 1 . . . . A 16 LEU C . 26001 1
159 . 1 . 1 16 16 LEU CA C 13 53.827 0.3 . 1 . . . . A 16 LEU CA . 26001 1
160 . 1 . 1 16 16 LEU CB C 13 43.944 0.3 . 1 . . . . A 16 LEU CB . 26001 1
161 . 1 . 1 16 16 LEU CG C 13 27.242 0.3 . 1 . . . . A 16 LEU CG . 26001 1
162 . 1 . 1 16 16 LEU CD2 C 13 24.298 0.3 . 1 . . . . A 16 LEU CD2 . 26001 1
163 . 1 . 1 16 16 LEU N N 15 122.491 0.3 . 1 . . . . A 16 LEU N . 26001 1
164 . 1 . 1 17 17 LYS H H 1 8.566 0.02 . 1 . . . . A 17 LYS H . 26001 1
165 . 1 . 1 17 17 LYS HA H 1 4.403 0.02 . 1 . . . . A 17 LYS HA . 26001 1
166 . 1 . 1 17 17 LYS C C 13 177.143 0.3 . 1 . . . . A 17 LYS C . 26001 1
167 . 1 . 1 17 17 LYS CB C 13 34.843 0.3 . 1 . . . . A 17 LYS CB . 26001 1
168 . 1 . 1 17 17 LYS CD C 13 32.731 0.3 . 1 . . . . A 17 LYS CD . 26001 1
169 . 1 . 1 17 17 LYS CE C 13 41.662 0.3 . 1 . . . . A 17 LYS CE . 26001 1
170 . 1 . 1 17 17 LYS N N 15 123.953 0.3 . 1 . . . . A 17 LYS N . 26001 1
171 . 1 . 1 18 18 GLY HA2 H 1 3.897 0.02 . 2 . . . . A 18 GLY HA2 . 26001 1
172 . 1 . 1 18 18 GLY HA3 H 1 3.859 0.02 . 2 . . . . A 18 GLY HA3 . 26001 1
173 . 1 . 1 18 18 GLY CA C 13 47.104 0.3 . 1 . . . . A 18 GLY CA . 26001 1
174 . 1 . 1 19 19 GLY H H 1 8.626 0.02 . 1 . . . . A 19 GLY H . 26001 1
175 . 1 . 1 19 19 GLY HA2 H 1 4.076 0.02 . 2 . . . . A 19 GLY HA2 . 26001 1
176 . 1 . 1 19 19 GLY HA3 H 1 3.552 0.02 . 2 . . . . A 19 GLY HA3 . 26001 1
177 . 1 . 1 19 19 GLY C C 13 173.037 0.3 . 1 . . . . A 19 GLY C . 26001 1
178 . 1 . 1 19 19 GLY CA C 13 45.063 0.3 . 1 . . . . A 19 GLY CA . 26001 1
179 . 1 . 1 19 19 GLY N N 15 104.970 0.3 . 1 . . . . A 19 GLY N . 26001 1
180 . 1 . 1 20 20 LYS H H 1 7.518 0.02 . 1 . . . . A 20 LYS H . 26001 1
181 . 1 . 1 20 20 LYS HA H 1 4.503 0.02 . 1 . . . . A 20 LYS HA . 26001 1
182 . 1 . 1 20 20 LYS HB2 H 1 1.602 0.02 . 1 . . . . A 20 LYS HB2 . 26001 1
183 . 1 . 1 20 20 LYS HB3 H 1 1.602 0.02 . 1 . . . . A 20 LYS HB3 . 26001 1
184 . 1 . 1 20 20 LYS HG2 H 1 1.221 0.02 . 1 . . . . A 20 LYS HG2 . 26001 1
185 . 1 . 1 20 20 LYS HG3 H 1 1.221 0.02 . 1 . . . . A 20 LYS HG3 . 26001 1
186 . 1 . 1 20 20 LYS HD2 H 1 1.538 0.02 . 1 . . . . A 20 LYS HD2 . 26001 1
187 . 1 . 1 20 20 LYS HD3 H 1 1.538 0.02 . 1 . . . . A 20 LYS HD3 . 26001 1
188 . 1 . 1 20 20 LYS HE2 H 1 2.842 0.02 . 1 . . . . A 20 LYS HE2 . 26001 1
189 . 1 . 1 20 20 LYS HE3 H 1 2.842 0.02 . 1 . . . . A 20 LYS HE3 . 26001 1
190 . 1 . 1 20 20 LYS C C 13 174.844 0.3 . 1 . . . . A 20 LYS C . 26001 1
191 . 1 . 1 20 20 LYS CA C 13 53.735 0.3 . 1 . . . . A 20 LYS CA . 26001 1
192 . 1 . 1 20 20 LYS CB C 13 35.482 0.3 . 1 . . . . A 20 LYS CB . 26001 1
193 . 1 . 1 20 20 LYS CG C 13 24.303 0.3 . 1 . . . . A 20 LYS CG . 26001 1
194 . 1 . 1 20 20 LYS CD C 13 28.844 0.3 . 1 . . . . A 20 LYS CD . 26001 1
195 . 1 . 1 20 20 LYS CE C 13 39.079 0.3 . 1 . . . . A 20 LYS CE . 26001 1
196 . 1 . 1 20 20 LYS N N 15 119.34 0.3 . 1 . . . . A 20 LYS N . 26001 1
197 . 1 . 1 21 21 ASN H H 1 8.506 0.02 . 1 . . . . A 21 ASN H . 26001 1
198 . 1 . 1 21 21 ASN HA H 1 4.798 0.02 . 1 . . . . A 21 ASN HA . 26001 1
199 . 1 . 1 21 21 ASN HB2 H 1 2.393 0.02 . 2 . . . . A 21 ASN HB2 . 26001 1
200 . 1 . 1 21 21 ASN HB3 H 1 2.049 0.02 . 2 . . . . A 21 ASN HB3 . 26001 1
201 . 1 . 1 21 21 ASN HD21 H 1 7.068 0.02 . 1 . . . . A 21 ASN HD21 . 26001 1
202 . 1 . 1 21 21 ASN HD22 H 1 6.543 0.02 . 1 . . . . A 21 ASN HD22 . 26001 1
203 . 1 . 1 21 21 ASN C C 13 174.975 0.3 . 1 . . . . A 21 ASN C . 26001 1
204 . 1 . 1 21 21 ASN CA C 13 53.148 0.3 . 1 . . . . A 21 ASN CA . 26001 1
205 . 1 . 1 21 21 ASN CB C 13 39.188 0.3 . 1 . . . . A 21 ASN CB . 26001 1
206 . 1 . 1 21 21 ASN N N 15 121.641 0.3 . 1 . . . . A 21 ASN N . 26001 1
207 . 1 . 1 21 21 ASN ND2 N 15 110.287 0.3 . 1 . . . . A 21 ASN ND2 . 26001 1
208 . 1 . 1 22 22 HIS H H 1 8.824 0.02 . 1 . . . . A 22 HIS H . 26001 1
209 . 1 . 1 22 22 HIS HA H 1 4.218 0.02 . 1 . . . . A 22 HIS HA . 26001 1
210 . 1 . 1 22 22 HIS HB2 H 1 2.301 0.02 . 2 . . . . A 22 HIS HB2 . 26001 1
211 . 1 . 1 22 22 HIS HB3 H 1 1.245 0.02 . 2 . . . . A 22 HIS HB3 . 26001 1
212 . 1 . 1 22 22 HIS HD2 H 1 6.749 0.02 . 1 . . . . A 22 HIS HD2 . 26001 1
213 . 1 . 1 22 22 HIS C C 13 172.072 0.3 . 1 . . . . A 22 HIS C . 26001 1
214 . 1 . 1 22 22 HIS CA C 13 54.495 0.3 . 1 . . . . A 22 HIS CA . 26001 1
215 . 1 . 1 22 22 HIS CB C 13 31.285 0.3 . 1 . . . . A 22 HIS CB . 26001 1
216 . 1 . 1 22 22 HIS N N 15 123.154 0.3 . 1 . . . . A 22 HIS N . 26001 1
217 . 1 . 1 23 23 VAL H H 1 8.158 0.02 . 1 . . . . A 23 VAL H . 26001 1
218 . 1 . 1 23 23 VAL HA H 1 4.815 0.02 . 1 . . . . A 23 VAL HA . 26001 1
219 . 1 . 1 23 23 VAL HB H 1 1.662 0.02 . 1 . . . . A 23 VAL HB . 26001 1
220 . 1 . 1 23 23 VAL HG11 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG11 . 26001 1
221 . 1 . 1 23 23 VAL HG12 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG12 . 26001 1
222 . 1 . 1 23 23 VAL HG13 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG13 . 26001 1
223 . 1 . 1 23 23 VAL HG21 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG21 . 26001 1
224 . 1 . 1 23 23 VAL HG22 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG22 . 26001 1
225 . 1 . 1 23 23 VAL HG23 H 1 0.698 0.02 . 1 . . . . A 23 VAL HG23 . 26001 1
226 . 1 . 1 23 23 VAL C C 13 175.785 0.3 . 1 . . . . A 23 VAL C . 26001 1
227 . 1 . 1 23 23 VAL CA C 13 61.218 0.3 . 1 . . . . A 23 VAL CA . 26001 1
228 . 1 . 1 23 23 VAL CB C 13 34.223 0.3 . 1 . . . . A 23 VAL CB . 26001 1
229 . 1 . 1 23 23 VAL CG1 C 13 20.845 0.3 . 1 . . . . A 23 VAL CG1 . 26001 1
230 . 1 . 1 23 23 VAL CG2 C 13 20.845 0.3 . 1 . . . . A 23 VAL CG2 . 26001 1
231 . 1 . 1 23 23 VAL N N 15 119.618 0.3 . 1 . . . . A 23 VAL N . 26001 1
232 . 1 . 1 24 24 VAL H H 1 8.575 0.02 . 1 . . . . A 24 VAL H . 26001 1
233 . 1 . 1 24 24 VAL HA H 1 4.516 0.02 . 1 . . . . A 24 VAL HA . 26001 1
234 . 1 . 1 24 24 VAL HB H 1 1.802 0.02 . 1 . . . . A 24 VAL HB . 26001 1
235 . 1 . 1 24 24 VAL HG11 H 1 0.465 0.02 . 2 . . . . A 24 VAL HG11 . 26001 1
236 . 1 . 1 24 24 VAL HG12 H 1 0.465 0.02 . 2 . . . . A 24 VAL HG12 . 26001 1
237 . 1 . 1 24 24 VAL HG13 H 1 0.465 0.02 . 2 . . . . A 24 VAL HG13 . 26001 1
238 . 1 . 1 24 24 VAL HG21 H 1 0.563 0.02 . 2 . . . . A 24 VAL HG21 . 26001 1
239 . 1 . 1 24 24 VAL HG22 H 1 0.563 0.02 . 2 . . . . A 24 VAL HG22 . 26001 1
240 . 1 . 1 24 24 VAL HG23 H 1 0.563 0.02 . 2 . . . . A 24 VAL HG23 . 26001 1
241 . 1 . 1 24 24 VAL C C 13 173.807 0.3 . 1 . . . . A 24 VAL C . 26001 1
242 . 1 . 1 24 24 VAL CA C 13 58.84 0.3 . 1 . . . . A 24 VAL CA . 26001 1
243 . 1 . 1 24 24 VAL CB C 13 35.482 0.3 . 1 . . . . A 24 VAL CB . 26001 1
244 . 1 . 1 24 24 VAL CG1 C 13 20.903 0.3 . 1 . . . . A 24 VAL CG1 . 26001 1
245 . 1 . 1 24 24 VAL CG2 C 13 19.731 0.3 . 1 . . . . A 24 VAL CG2 . 26001 1
246 . 1 . 1 24 24 VAL N N 15 122.935 0.3 . 1 . . . . A 24 VAL N . 26001 1
247 . 1 . 1 25 25 ASN H H 1 8.709 0.02 . 1 . . . . A 25 ASN H . 26001 1
248 . 1 . 1 25 25 ASN HA H 1 4.507 0.02 . 1 . . . . A 25 ASN HA . 26001 1
249 . 1 . 1 25 25 ASN HB2 H 1 2.806 0.02 . 2 . . . . A 25 ASN HB2 . 26001 1
250 . 1 . 1 25 25 ASN HB3 H 1 2.657 0.02 . 2 . . . . A 25 ASN HB3 . 26001 1
251 . 1 . 1 25 25 ASN HD21 H 1 6.99 0.02 . 1 . . . . A 25 ASN HD21 . 26001 1
252 . 1 . 1 25 25 ASN HD22 H 1 7.634 0.02 . 1 . . . . A 25 ASN HD22 . 26001 1
253 . 1 . 1 25 25 ASN C C 13 175.989 0.3 . 1 . . . . A 25 ASN C . 26001 1
254 . 1 . 1 25 25 ASN CA C 13 54.43 0.3 . 1 . . . . A 25 ASN CA . 26001 1
255 . 1 . 1 25 25 ASN CB C 13 39.079 0.3 . 1 . . . . A 25 ASN CB . 26001 1
256 . 1 . 1 25 25 ASN N N 15 124.245 0.3 . 1 . . . . A 25 ASN N . 26001 1
257 . 1 . 1 25 25 ASN ND2 N 15 113.081 0.3 . 1 . . . . A 25 ASN ND2 . 26001 1
258 . 1 . 1 26 26 CYS H H 1 8.646 0.02 . 1 . . . . A 26 CYS H . 26001 1
259 . 1 . 1 26 26 CYS HA H 1 4.167 0.02 . 1 . . . . A 26 CYS HA . 26001 1
260 . 1 . 1 26 26 CYS HB2 H 1 3.287 0.02 . 2 . . . . A 26 CYS HB2 . 26001 1
261 . 1 . 1 26 26 CYS HB3 H 1 3.054 0.02 . 2 . . . . A 26 CYS HB3 . 26001 1
262 . 1 . 1 26 26 CYS C C 13 174.408 0.3 . 1 . . . . A 26 CYS C . 26001 1
263 . 1 . 1 26 26 CYS CA C 13 58.84 0.3 . 1 . . . . A 26 CYS CA . 26001 1
264 . 1 . 1 26 26 CYS CB C 13 42.965 0.3 . 1 . . . . A 26 CYS CB . 26001 1
265 . 1 . 1 26 26 CYS N N 15 120.871 0.3 . 1 . . . . A 26 CYS N . 26001 1
266 . 1 . 1 27 27 GLY H H 1 7.829 0.02 . 1 . . . . A 27 GLY H . 26001 1
267 . 1 . 1 27 27 GLY HA2 H 1 4.184 0.02 . 2 . . . . A 27 GLY HA2 . 26001 1
268 . 1 . 1 27 27 GLY HA3 H 1 3.684 0.02 . 2 . . . . A 27 GLY HA3 . 26001 1
269 . 1 . 1 27 27 GLY C C 13 172.953 0.3 . 1 . . . . A 27 GLY C . 26001 1
270 . 1 . 1 27 27 GLY CA C 13 44.062 0.3 . 1 . . . . A 27 GLY CA . 26001 1
271 . 1 . 1 27 27 GLY N N 15 104.670 0.3 . 1 . . . . A 27 GLY N . 26001 1
272 . 1 . 1 28 28 SER H H 1 8.015 0.02 . 1 . . . . A 28 SER H . 26001 1
273 . 1 . 1 28 28 SER HA H 1 4.216 0.02 . 1 . . . . A 28 SER HA . 26001 1
274 . 1 . 1 28 28 SER HB2 H 1 3.857 0.02 . 2 . . . . A 28 SER HB2 . 26001 1
275 . 1 . 1 28 28 SER HB3 H 1 3.78 0.02 . 2 . . . . A 28 SER HB3 . 26001 1
276 . 1 . 1 28 28 SER C C 13 175.29 0.3 . 1 . . . . A 28 SER C . 26001 1
277 . 1 . 1 28 28 SER CA C 13 58.77 0.3 . 1 . . . . A 28 SER CA . 26001 1
278 . 1 . 1 28 28 SER CB C 13 64.225 0.3 . 1 . . . . A 28 SER CB . 26001 1
279 . 1 . 1 28 28 SER N N 15 112.612 0.3 . 1 . . . . A 28 SER N . 26001 1
280 . 1 . 1 29 29 ALA H H 1 7.881 0.02 . 1 . . . . A 29 ALA H . 26001 1
281 . 1 . 1 29 29 ALA HA H 1 4.178 0.02 . 1 . . . . A 29 ALA HA . 26001 1
282 . 1 . 1 29 29 ALA HB1 H 1 1.42 0.02 . 1 . . . . A 29 ALA HB1 . 26001 1
283 . 1 . 1 29 29 ALA HB2 H 1 1.42 0.02 . 1 . . . . A 29 ALA HB2 . 26001 1
284 . 1 . 1 29 29 ALA HB3 H 1 1.42 0.02 . 1 . . . . A 29 ALA HB3 . 26001 1
285 . 1 . 1 29 29 ALA C C 13 179.015 0.3 . 1 . . . . A 29 ALA C . 26001 1
286 . 1 . 1 29 29 ALA CA C 13 52.686 0.3 . 1 . . . . A 29 ALA CA . 26001 1
287 . 1 . 1 29 29 ALA CB C 13 19.357 0.3 . 1 . . . . A 29 ALA CB . 26001 1
288 . 1 . 1 29 29 ALA N N 15 124.22 0.3 . 1 . . . . A 29 ALA N . 26001 1
289 . 1 . 1 30 30 ALA H H 1 8.921 0.02 . 1 . . . . A 30 ALA H . 26001 1
290 . 1 . 1 30 30 ALA HA H 1 3.816 0.02 . 1 . . . . A 30 ALA HA . 26001 1
291 . 1 . 1 30 30 ALA HB1 H 1 1.392 0.02 . 1 . . . . A 30 ALA HB1 . 26001 1
292 . 1 . 1 30 30 ALA HB2 H 1 1.392 0.02 . 1 . . . . A 30 ALA HB2 . 26001 1
293 . 1 . 1 30 30 ALA HB3 H 1 1.392 0.02 . 1 . . . . A 30 ALA HB3 . 26001 1
294 . 1 . 1 30 30 ALA C C 13 178.455 0.3 . 1 . . . . A 30 ALA C . 26001 1
295 . 1 . 1 30 30 ALA CA C 13 55.553 0.3 . 1 . . . . A 30 ALA CA . 26001 1
296 . 1 . 1 30 30 ALA CB C 13 18.313 0.3 . 1 . . . . A 30 ALA CB . 26001 1
297 . 1 . 1 30 30 ALA N N 15 124.866 0.3 . 1 . . . . A 30 ALA N . 26001 1
298 . 1 . 1 31 31 ASN H H 1 8.081 0.02 . 1 . . . . A 31 ASN H . 26001 1
299 . 1 . 1 31 31 ASN HA H 1 4.633 0.02 . 1 . . . . A 31 ASN HA . 26001 1
300 . 1 . 1 31 31 ASN HB2 H 1 3.022 0.02 . 2 . . . . A 31 ASN HB2 . 26001 1
301 . 1 . 1 31 31 ASN HB3 H 1 2.675 0.02 . 2 . . . . A 31 ASN HB3 . 26001 1
302 . 1 . 1 31 31 ASN HD21 H 1 7.558 0.02 . 1 . . . . A 31 ASN HD21 . 26001 1
303 . 1 . 1 31 31 ASN HD22 H 1 6.644 0.02 . 1 . . . . A 31 ASN HD22 . 26001 1
304 . 1 . 1 31 31 ASN C C 13 173.82 0.3 . 1 . . . . A 31 ASN C . 26001 1
305 . 1 . 1 31 31 ASN CA C 13 52.759 0.3 . 1 . . . . A 31 ASN CA . 26001 1
306 . 1 . 1 31 31 ASN CB C 13 36.88 0.3 . 1 . . . . A 31 ASN CB . 26001 1
307 . 1 . 1 31 31 ASN N N 15 110.366 0.3 . 1 . . . . A 31 ASN N . 26001 1
308 . 1 . 1 31 31 ASN ND2 N 15 110.998 0.3 . 1 . . . . A 31 ASN ND2 . 26001 1
309 . 1 . 1 32 32 LYS H H 1 7.381 0.02 . 1 . . . . A 32 LYS H . 26001 1
310 . 1 . 1 32 32 LYS HA H 1 4.577 0.02 . 1 . . . . A 32 LYS HA . 26001 1
311 . 1 . 1 32 32 LYS HB2 H 1 1.553 0.02 . 2 . . . . A 32 LYS HB2 . 26001 1
312 . 1 . 1 32 32 LYS HB3 H 1 2.057 0.02 . 2 . . . . A 32 LYS HB3 . 26001 1
313 . 1 . 1 32 32 LYS HG2 H 1 1.207 0.02 . 1 . . . . A 32 LYS HG2 . 26001 1
314 . 1 . 1 32 32 LYS HG3 H 1 1.207 0.02 . 1 . . . . A 32 LYS HG3 . 26001 1
315 . 1 . 1 32 32 LYS HD2 H 1 1.686 0.02 . 1 . . . . A 32 LYS HD2 . 26001 1
316 . 1 . 1 32 32 LYS HD3 H 1 1.686 0.02 . 1 . . . . A 32 LYS HD3 . 26001 1
317 . 1 . 1 32 32 LYS C C 13 176.493 0.3 . 1 . . . . A 32 LYS C . 26001 1
318 . 1 . 1 32 32 LYS CA C 13 54.784 0.3 . 1 . . . . A 32 LYS CA . 26001 1
319 . 1 . 1 32 32 LYS CB C 13 34.852 0.3 . 1 . . . . A 32 LYS CB . 26001 1
320 . 1 . 1 32 32 LYS CG C 13 23.678 0.3 . 1 . . . . A 32 LYS CG . 26001 1
321 . 1 . 1 32 32 LYS CD C 13 28.966 0.3 . 1 . . . . A 32 LYS CD . 26001 1
322 . 1 . 1 32 32 LYS CE C 13 41.867 0.3 . 1 . . . . A 32 LYS CE . 26001 1
323 . 1 . 1 32 32 LYS N N 15 116.291 0.3 . 1 . . . . A 32 LYS N . 26001 1
324 . 1 . 1 33 33 LYS H H 1 7.215 0.02 . 1 . . . . A 33 LYS H . 26001 1
325 . 1 . 1 33 33 LYS HA H 1 4.392 0.02 . 1 . . . . A 33 LYS HA . 26001 1
326 . 1 . 1 33 33 LYS HB2 H 1 1.759 0.02 . 2 . . . . A 33 LYS HB2 . 26001 1
327 . 1 . 1 33 33 LYS HB3 H 1 1.647 0.02 . 2 . . . . A 33 LYS HB3 . 26001 1
328 . 1 . 1 33 33 LYS HG2 H 1 1.289 0.02 . 1 . . . . A 33 LYS HG2 . 26001 1
329 . 1 . 1 33 33 LYS HG3 H 1 1.289 0.02 . 1 . . . . A 33 LYS HG3 . 26001 1
330 . 1 . 1 33 33 LYS HD2 H 1 2.067 0.02 . 2 . . . . A 33 LYS HD2 . 26001 1
331 . 1 . 1 33 33 LYS HD3 H 1 1.837 0.02 . 2 . . . . A 33 LYS HD3 . 26001 1
332 . 1 . 1 33 33 LYS HE2 H 1 3.729 0.02 . 1 . . . . A 33 LYS HE2 . 26001 1
333 . 1 . 1 33 33 LYS HE3 H 1 3.729 0.02 . 1 . . . . A 33 LYS HE3 . 26001 1
334 . 1 . 1 33 33 LYS C C 13 174.926 0.3 . 1 . . . . A 33 LYS C . 26001 1
335 . 1 . 1 33 33 LYS CA C 13 56.043 0.3 . 1 . . . . A 33 LYS CA . 26001 1
336 . 1 . 1 33 33 LYS CB C 13 32.824 0.3 . 1 . . . . A 33 LYS CB . 26001 1
337 . 1 . 1 33 33 LYS CG C 13 24.608 0.3 . 1 . . . . A 33 LYS CG . 26001 1
338 . 1 . 1 33 33 LYS CD C 13 29.441 0.3 . 1 . . . . A 33 LYS CD . 26001 1
339 . 1 . 1 33 33 LYS N N 15 116.091 0.3 . 1 . . . . A 33 LYS N . 26001 1
340 . 1 . 1 34 34 CYS H H 1 8.896 0.02 . 1 . . . . A 34 CYS H . 26001 1
341 . 1 . 1 34 34 CYS HA H 1 4.26 0.02 . 1 . . . . A 34 CYS HA . 26001 1
342 . 1 . 1 34 34 CYS HB2 H 1 3.41 0.02 . 2 . . . . A 34 CYS HB2 . 26001 1
343 . 1 . 1 34 34 CYS HB3 H 1 3.02 0.02 . 2 . . . . A 34 CYS HB3 . 26001 1
344 . 1 . 1 34 34 CYS C C 13 174.507 0.3 . 1 . . . . A 34 CYS C . 26001 1
345 . 1 . 1 34 34 CYS CA C 13 56.178 0.3 . 1 . . . . A 34 CYS CA . 26001 1
346 . 1 . 1 34 34 CYS CB C 13 38.187 0.3 . 1 . . . . A 34 CYS CB . 26001 1
347 . 1 . 1 34 34 CYS N N 15 118.766 0.3 . 1 . . . . A 34 CYS N . 26001 1
348 . 1 . 1 35 35 LYS H H 1 9.487 0.02 . 1 . . . . A 35 LYS H . 26001 1
349 . 1 . 1 35 35 LYS HA H 1 4.267 0.02 . 1 . . . . A 35 LYS HA . 26001 1
350 . 1 . 1 35 35 LYS HB2 H 1 1.607 0.02 . 2 . . . . A 35 LYS HB2 . 26001 1
351 . 1 . 1 35 35 LYS HB3 H 1 1.488 0.02 . 2 . . . . A 35 LYS HB3 . 26001 1
352 . 1 . 1 35 35 LYS HG2 H 1 1.32 0.02 . 2 . . . . A 35 LYS HG2 . 26001 1
353 . 1 . 1 35 35 LYS HG3 H 1 1.218 0.02 . 2 . . . . A 35 LYS HG3 . 26001 1
354 . 1 . 1 35 35 LYS HD2 H 1 2.062 0.02 . 2 . . . . A 35 LYS HD2 . 26001 1
355 . 1 . 1 35 35 LYS HD3 H 1 1.844 0.02 . 2 . . . . A 35 LYS HD3 . 26001 1
356 . 1 . 1 35 35 LYS C C 13 175.855 0.3 . 1 . . . . A 35 LYS C . 26001 1
357 . 1 . 1 35 35 LYS CA C 13 56.209 0.3 . 1 . . . . A 35 LYS CA . 26001 1
358 . 1 . 1 35 35 LYS CB C 13 34.223 0.3 . 1 . . . . A 35 LYS CB . 26001 1
359 . 1 . 1 35 35 LYS CG C 13 25.073 0.3 . 1 . . . . A 35 LYS CG . 26001 1
360 . 1 . 1 35 35 LYS CD C 13 29.198 0.3 . 1 . . . . A 35 LYS CD . 26001 1
361 . 1 . 1 35 35 LYS CE C 13 38.089 0.3 . 1 . . . . A 35 LYS CE . 26001 1
362 . 1 . 1 35 35 LYS N N 15 129.516 0.3 . 1 . . . . A 35 LYS N . 26001 1
363 . 1 . 1 36 36 SER H H 1 7.388 0.02 . 1 . . . . A 36 SER H . 26001 1
364 . 1 . 1 36 36 SER HA H 1 4.477 0.02 . 1 . . . . A 36 SER HA . 26001 1
365 . 1 . 1 36 36 SER HB2 H 1 3.662 0.02 . 1 . . . . A 36 SER HB2 . 26001 1
366 . 1 . 1 36 36 SER HB3 H 1 3.662 0.02 . 1 . . . . A 36 SER HB3 . 26001 1
367 . 1 . 1 36 36 SER C C 13 172.59 0.3 . 1 . . . . A 36 SER C . 26001 1
368 . 1 . 1 36 36 SER CA C 13 56.409 0.3 . 1 . . . . A 36 SER CA . 26001 1
369 . 1 . 1 36 36 SER CB C 13 64.225 0.3 . 1 . . . . A 36 SER CB . 26001 1
370 . 1 . 1 36 36 SER N N 15 114.822 0.3 . 1 . . . . A 36 SER N . 26001 1
371 . 1 . 1 37 37 ASP H H 1 9.085 0.02 . 1 . . . . A 37 ASP H . 26001 1
372 . 1 . 1 37 37 ASP HA H 1 4.346 0.02 . 1 . . . . A 37 ASP HA . 26001 1
373 . 1 . 1 37 37 ASP HB2 H 1 2.549 0.02 . 1 . . . . A 37 ASP HB2 . 26001 1
374 . 1 . 1 37 37 ASP HB3 H 1 2.549 0.02 . 1 . . . . A 37 ASP HB3 . 26001 1
375 . 1 . 1 37 37 ASP C C 13 177.15 0.3 . 1 . . . . A 37 ASP C . 26001 1
376 . 1 . 1 37 37 ASP CA C 13 57.358 0.3 . 1 . . . . A 37 ASP CA . 26001 1
377 . 1 . 1 37 37 ASP CB C 13 41.146 0.3 . 1 . . . . A 37 ASP CB . 26001 1
378 . 1 . 1 37 37 ASP N N 15 124.914 0.3 . 1 . . . . A 37 ASP N . 26001 1
379 . 1 . 1 38 38 ARG H H 1 8.895 0.02 . 1 . . . . A 38 ARG H . 26001 1
380 . 1 . 1 38 38 ARG HA H 1 3.939 0.02 . 1 . . . . A 38 ARG HA . 26001 1
381 . 1 . 1 38 38 ARG HB2 H 1 2.07 0.02 . 1 . . . . A 38 ARG HB2 . 26001 1
382 . 1 . 1 38 38 ARG HB3 H 1 2.07 0.02 . 1 . . . . A 38 ARG HB3 . 26001 1
383 . 1 . 1 38 38 ARG HG2 H 1 1.559 0.02 . 2 . . . . A 38 ARG HG2 . 26001 1
384 . 1 . 1 38 38 ARG HG3 H 1 1.453 0.02 . 2 . . . . A 38 ARG HG3 . 26001 1
385 . 1 . 1 38 38 ARG HD2 H 1 3.179 0.02 . 2 . . . . A 38 ARG HD2 . 26001 1
386 . 1 . 1 38 38 ARG HD3 H 1 3.105 0.02 . 2 . . . . A 38 ARG HD3 . 26001 1
387 . 1 . 1 38 38 ARG C C 13 176.255 0.3 . 1 . . . . A 38 ARG C . 26001 1
388 . 1 . 1 38 38 ARG CA C 13 58.264 0.3 . 1 . . . . A 38 ARG CA . 26001 1
389 . 1 . 1 38 38 ARG CB C 13 26.518 0.3 . 1 . . . . A 38 ARG CB . 26001 1
390 . 1 . 1 38 38 ARG CG C 13 27.397 0.3 . 1 . . . . A 38 ARG CG . 26001 1
391 . 1 . 1 38 38 ARG CD C 13 43.261 0.3 . 1 . . . . A 38 ARG CD . 26001 1
392 . 1 . 1 38 38 ARG N N 15 118.605 0.3 . 1 . . . . A 38 ARG N . 26001 1
393 . 1 . 1 39 39 HIS H H 1 8.042 0.02 . 1 . . . . A 39 HIS H . 26001 1
394 . 1 . 1 39 39 HIS HA H 1 4.046 0.02 . 1 . . . . A 39 HIS HA . 26001 1
395 . 1 . 1 39 39 HIS HB2 H 1 3.595 0.02 . 2 . . . . A 39 HIS HB2 . 26001 1
396 . 1 . 1 39 39 HIS HB3 H 1 3.432 0.02 . 2 . . . . A 39 HIS HB3 . 26001 1
397 . 1 . 1 39 39 HIS HD2 H 1 7.114 0.02 . 1 . . . . A 39 HIS HD2 . 26001 1
398 . 1 . 1 39 39 HIS C C 13 175.129 0.3 . 1 . . . . A 39 HIS C . 26001 1
399 . 1 . 1 39 39 HIS CA C 13 57.936 0.3 . 1 . . . . A 39 HIS CA . 26001 1
400 . 1 . 1 39 39 HIS CB C 13 28.908 0.3 . 1 . . . . A 39 HIS CB . 26001 1
401 . 1 . 1 39 39 HIS N N 15 119.136 0.3 . 1 . . . . A 39 HIS N . 26001 1
402 . 1 . 1 40 40 HIS H H 1 8.643 0.02 . 1 . . . . A 40 HIS H . 26001 1
403 . 1 . 1 40 40 HIS HA H 1 4.868 0.02 . 1 . . . . A 40 HIS HA . 26001 1
404 . 1 . 1 40 40 HIS HB2 H 1 3.071 0.02 . 2 . . . . A 40 HIS HB2 . 26001 1
405 . 1 . 1 40 40 HIS HB3 H 1 2.848 0.02 . 2 . . . . A 40 HIS HB3 . 26001 1
406 . 1 . 1 40 40 HIS HD2 H 1 7.281 0.02 . 1 . . . . A 40 HIS HD2 . 26001 1
407 . 1 . 1 40 40 HIS C C 13 174.212 0.3 . 1 . . . . A 40 HIS C . 26001 1
408 . 1 . 1 40 40 HIS CA C 13 57.09 0.3 . 1 . . . . A 40 HIS CA . 26001 1
409 . 1 . 1 40 40 HIS CB C 13 28.572 0.3 . 1 . . . . A 40 HIS CB . 26001 1
410 . 1 . 1 40 40 HIS N N 15 124.543 0.3 . 1 . . . . A 40 HIS N . 26001 1
411 . 1 . 1 41 41 CYS H H 1 7.966 0.02 . 1 . . . . A 41 CYS H . 26001 1
412 . 1 . 1 41 41 CYS HA H 1 5.344 0.02 . 1 . . . . A 41 CYS HA . 26001 1
413 . 1 . 1 41 41 CYS HB2 H 1 3.271 0.02 . 2 . . . . A 41 CYS HB2 . 26001 1
414 . 1 . 1 41 41 CYS HB3 H 1 2.904 0.02 . 2 . . . . A 41 CYS HB3 . 26001 1
415 . 1 . 1 41 41 CYS CA C 13 53.209 0.3 . 1 . . . . A 41 CYS CA . 26001 1
416 . 1 . 1 41 41 CYS N N 15 119.779 0.3 . 1 . . . . A 41 CYS N . 26001 1
417 . 1 . 1 42 42 GLU H H 1 8.341 0.02 . 1 . . . . A 42 GLU H . 26001 1
418 . 1 . 1 42 42 GLU HA H 1 5.254 0.02 . 1 . . . . A 42 GLU HA . 26001 1
419 . 1 . 1 42 42 GLU HB2 H 1 1.763 0.02 . 1 . . . . A 42 GLU HB2 . 26001 1
420 . 1 . 1 42 42 GLU HB3 H 1 1.763 0.02 . 1 . . . . A 42 GLU HB3 . 26001 1
421 . 1 . 1 42 42 GLU HG2 H 1 2.079 0.02 . 1 . . . . A 42 GLU HG2 . 26001 1
422 . 1 . 1 42 42 GLU HG3 H 1 2.079 0.02 . 1 . . . . A 42 GLU HG3 . 26001 1
423 . 1 . 1 42 42 GLU C C 13 173.961 0.3 . 1 . . . . A 42 GLU C . 26001 1
424 . 1 . 1 42 42 GLU CA C 13 54.108 0.3 . 1 . . . . A 42 GLU CA . 26001 1
425 . 1 . 1 42 42 GLU CB C 13 34.852 0.3 . 1 . . . . A 42 GLU CB . 26001 1
426 . 1 . 1 42 42 GLU CG C 13 36.579 0.3 . 1 . . . . A 42 GLU CG . 26001 1
427 . 1 . 1 42 42 GLU N N 15 116.823 0.3 . 1 . . . . A 42 GLU N . 26001 1
428 . 1 . 1 43 43 TYR H H 1 8.869 0.02 . 1 . . . . A 43 TYR H . 26001 1
429 . 1 . 1 43 43 TYR HA H 1 5.101 0.02 . 1 . . . . A 43 TYR HA . 26001 1
430 . 1 . 1 43 43 TYR HB2 H 1 2.19 0.02 . 2 . . . . A 43 TYR HB2 . 26001 1
431 . 1 . 1 43 43 TYR HB3 H 1 1.981 0.02 . 2 . . . . A 43 TYR HB3 . 26001 1
432 . 1 . 1 43 43 TYR HD1 H 1 6.51 0.02 . 3 . . . . A 43 TYR HD1 . 26001 1
433 . 1 . 1 43 43 TYR HD2 H 1 6.523 0.02 . 3 . . . . A 43 TYR HD2 . 26001 1
434 . 1 . 1 43 43 TYR C C 13 173.093 0.3 . 1 . . . . A 43 TYR C . 26001 1
435 . 1 . 1 43 43 TYR CA C 13 55.094 0.3 . 1 . . . . A 43 TYR CA . 26001 1
436 . 1 . 1 43 43 TYR CB C 13 41.477 0.3 . 1 . . . . A 43 TYR CB . 26001 1
437 . 1 . 1 43 43 TYR N N 15 122.033 0.3 . 1 . . . . A 43 TYR N . 26001 1
438 . 1 . 1 44 44 ASP H H 1 8.398 0.02 . 1 . . . . A 44 ASP H . 26001 1
439 . 1 . 1 44 44 ASP HA H 1 4.469 0.02 . 1 . . . . A 44 ASP HA . 26001 1
440 . 1 . 1 44 44 ASP HB2 H 1 2.74 0.02 . 2 . . . . A 44 ASP HB2 . 26001 1
441 . 1 . 1 44 44 ASP HB3 H 1 2.351 0.02 . 2 . . . . A 44 ASP HB3 . 26001 1
442 . 1 . 1 44 44 ASP C C 13 175.108 0.3 . 1 . . . . A 44 ASP C . 26001 1
443 . 1 . 1 44 44 ASP CA C 13 51.497 0.3 . 1 . . . . A 44 ASP CA . 26001 1
444 . 1 . 1 44 44 ASP CB C 13 41.947 0.3 . 1 . . . . A 44 ASP CB . 26001 1
445 . 1 . 1 44 44 ASP N N 15 127.671 0.3 . 1 . . . . A 44 ASP N . 26001 1
446 . 1 . 1 45 45 GLU H H 1 8.761 0.02 . 1 . . . . A 45 GLU H . 26001 1
447 . 1 . 1 45 45 GLU HA H 1 3.488 0.02 . 1 . . . . A 45 GLU HA . 26001 1
448 . 1 . 1 45 45 GLU HB2 H 1 1.832 0.02 . 1 . . . . A 45 GLU HB2 . 26001 1
449 . 1 . 1 45 45 GLU HB3 H 1 1.832 0.02 . 1 . . . . A 45 GLU HB3 . 26001 1
450 . 1 . 1 45 45 GLU HG2 H 1 2.177 0.02 . 1 . . . . A 45 GLU HG2 . 26001 1
451 . 1 . 1 45 45 GLU HG3 H 1 2.177 0.02 . 1 . . . . A 45 GLU HG3 . 26001 1
452 . 1 . 1 45 45 GLU C C 13 177.241 0.3 . 1 . . . . A 45 GLU C . 26001 1
453 . 1 . 1 45 45 GLU CA C 13 57.913 0.3 . 1 . . . . A 45 GLU CA . 26001 1
454 . 1 . 1 45 45 GLU CB C 13 29.486 0.3 . 1 . . . . A 45 GLU CB . 26001 1
455 . 1 . 1 45 45 GLU CG C 13 35.707 0.3 . 1 . . . . A 45 GLU CG . 26001 1
456 . 1 . 1 45 45 GLU N N 15 125.514 0.3 . 1 . . . . A 45 GLU N . 26001 1
457 . 1 . 1 46 46 HIS H H 1 7.966 0.02 . 1 . . . . A 46 HIS H . 26001 1
458 . 1 . 1 46 46 HIS HA H 1 4.234 0.02 . 1 . . . . A 46 HIS HA . 26001 1
459 . 1 . 1 46 46 HIS HB2 H 1 2.906 0.02 . 2 . . . . A 46 HIS HB2 . 26001 1
460 . 1 . 1 46 46 HIS HB3 H 1 2.826 0.02 . 2 . . . . A 46 HIS HB3 . 26001 1
461 . 1 . 1 46 46 HIS HD2 H 1 6.463 0.02 . 1 . . . . A 46 HIS HD2 . 26001 1
462 . 1 . 1 46 46 HIS C C 13 176.224 0.3 . 1 . . . . A 46 HIS C . 26001 1
463 . 1 . 1 46 46 HIS CA C 13 57.879 0.3 . 1 . . . . A 46 HIS CA . 26001 1
464 . 1 . 1 46 46 HIS CB C 13 29.067 0.3 . 1 . . . . A 46 HIS CB . 26001 1
465 . 1 . 1 46 46 HIS N N 15 118.871 0.3 . 1 . . . . A 46 HIS N . 26001 1
466 . 1 . 1 47 47 HIS H H 1 7.413 0.02 . 1 . . . . A 47 HIS H . 26001 1
467 . 1 . 1 47 47 HIS HA H 1 4.471 0.02 . 1 . . . . A 47 HIS HA . 26001 1
468 . 1 . 1 47 47 HIS HB2 H 1 3.238 0.02 . 2 . . . . A 47 HIS HB2 . 26001 1
469 . 1 . 1 47 47 HIS HB3 H 1 2.407 0.02 . 2 . . . . A 47 HIS HB3 . 26001 1
470 . 1 . 1 47 47 HIS HD2 H 1 7.183 0.02 . 1 . . . . A 47 HIS HD2 . 26001 1
471 . 1 . 1 47 47 HIS C C 13 173.023 0.3 . 1 . . . . A 47 HIS C . 26001 1
472 . 1 . 1 47 47 HIS CA C 13 55.693 0.3 . 1 . . . . A 47 HIS CA . 26001 1
473 . 1 . 1 47 47 HIS CB C 13 29.252 0.3 . 1 . . . . A 47 HIS CB . 26001 1
474 . 1 . 1 47 47 HIS N N 15 113.384 0.3 . 1 . . . . A 47 HIS N . 26001 1
475 . 1 . 1 48 48 LYS H H 1 7.616 0.02 . 1 . . . . A 48 LYS H . 26001 1
476 . 1 . 1 48 48 LYS HA H 1 3.716 0.02 . 1 . . . . A 48 LYS HA . 26001 1
477 . 1 . 1 48 48 LYS HB2 H 1 2.031 0.02 . 2 . . . . A 48 LYS HB2 . 26001 1
478 . 1 . 1 48 48 LYS HB3 H 1 1.82 0.02 . 2 . . . . A 48 LYS HB3 . 26001 1
479 . 1 . 1 48 48 LYS HG2 H 1 1.261 0.02 . 1 . . . . A 48 LYS HG2 . 26001 1
480 . 1 . 1 48 48 LYS HG3 H 1 1.261 0.02 . 1 . . . . A 48 LYS HG3 . 26001 1
481 . 1 . 1 48 48 LYS HD2 H 1 1.643 0.02 . 1 . . . . A 48 LYS HD2 . 26001 1
482 . 1 . 1 48 48 LYS HD3 H 1 1.643 0.02 . 1 . . . . A 48 LYS HD3 . 26001 1
483 . 1 . 1 48 48 LYS HE2 H 1 2.956 0.02 . 1 . . . . A 48 LYS HE2 . 26001 1
484 . 1 . 1 48 48 LYS HE3 H 1 2.956 0.02 . 1 . . . . A 48 LYS HE3 . 26001 1
485 . 1 . 1 48 48 LYS C C 13 175.029 0.3 . 1 . . . . A 48 LYS C . 26001 1
486 . 1 . 1 48 48 LYS CA C 13 57.092 0.3 . 1 . . . . A 48 LYS CA . 26001 1
487 . 1 . 1 48 48 LYS CB C 13 29.044 0.3 . 1 . . . . A 48 LYS CB . 26001 1
488 . 1 . 1 48 48 LYS CG C 13 24.782 0.3 . 1 . . . . A 48 LYS CG . 26001 1
489 . 1 . 1 48 48 LYS CD C 13 29.379 0.3 . 1 . . . . A 48 LYS CD . 26001 1
490 . 1 . 1 48 48 LYS CE C 13 42.39 0.3 . 1 . . . . A 48 LYS CE . 26001 1
491 . 1 . 1 48 48 LYS N N 15 118.306 0.3 . 1 . . . . A 48 LYS N . 26001 1
492 . 1 . 1 49 49 ARG H H 1 7.392 0.02 . 1 . . . . A 49 ARG H . 26001 1
493 . 1 . 1 49 49 ARG HA H 1 4.787 0.02 . 1 . . . . A 49 ARG HA . 26001 1
494 . 1 . 1 49 49 ARG HB2 H 1 1.705 0.02 . 1 . . . . A 49 ARG HB2 . 26001 1
495 . 1 . 1 49 49 ARG HB3 H 1 1.705 0.02 . 1 . . . . A 49 ARG HB3 . 26001 1
496 . 1 . 1 49 49 ARG HG2 H 1 1.529 0.02 . 1 . . . . A 49 ARG HG2 . 26001 1
497 . 1 . 1 49 49 ARG HG3 H 1 1.529 0.02 . 1 . . . . A 49 ARG HG3 . 26001 1
498 . 1 . 1 49 49 ARG HD2 H 1 3.176 0.02 . 2 . . . . A 49 ARG HD2 . 26001 1
499 . 1 . 1 49 49 ARG HD3 H 1 3.091 0.02 . 2 . . . . A 49 ARG HD3 . 26001 1
500 . 1 . 1 49 49 ARG C C 13 174.111 0.3 . 1 . . . . A 49 ARG C . 26001 1
501 . 1 . 1 49 49 ARG CA C 13 54.714 0.3 . 1 . . . . A 49 ARG CA . 26001 1
502 . 1 . 1 49 49 ARG CB C 13 34.153 0.3 . 1 . . . . A 49 ARG CB . 26001 1
503 . 1 . 1 49 49 ARG CG C 13 27.223 0.3 . 1 . . . . A 49 ARG CG . 26001 1
504 . 1 . 1 49 49 ARG CD C 13 43.436 0.3 . 1 . . . . A 49 ARG CD . 26001 1
505 . 1 . 1 49 49 ARG N N 15 117.344 0.3 . 1 . . . . A 49 ARG N . 26001 1
506 . 1 . 1 50 50 VAL H H 1 8.784 0.02 . 1 . . . . A 50 VAL H . 26001 1
507 . 1 . 1 50 50 VAL HA H 1 5.04 0.02 . 1 . . . . A 50 VAL HA . 26001 1
508 . 1 . 1 50 50 VAL HB H 1 2.009 0.02 . 1 . . . . A 50 VAL HB . 26001 1
509 . 1 . 1 50 50 VAL HG11 H 1 0.959 0.02 . 2 . . . . A 50 VAL HG11 . 26001 1
510 . 1 . 1 50 50 VAL HG12 H 1 0.959 0.02 . 2 . . . . A 50 VAL HG12 . 26001 1
511 . 1 . 1 50 50 VAL HG13 H 1 0.959 0.02 . 2 . . . . A 50 VAL HG13 . 26001 1
512 . 1 . 1 50 50 VAL HG21 H 1 1.025 0.02 . 2 . . . . A 50 VAL HG21 . 26001 1
513 . 1 . 1 50 50 VAL HG22 H 1 1.025 0.02 . 2 . . . . A 50 VAL HG22 . 26001 1
514 . 1 . 1 50 50 VAL HG23 H 1 1.025 0.02 . 2 . . . . A 50 VAL HG23 . 26001 1
515 . 1 . 1 50 50 VAL C C 13 173.721 0.3 . 1 . . . . A 50 VAL C . 26001 1
516 . 1 . 1 50 50 VAL CA C 13 59.771 0.3 . 1 . . . . A 50 VAL CA . 26001 1
517 . 1 . 1 50 50 VAL CB C 13 35.057 0.3 . 1 . . . . A 50 VAL CB . 26001 1
518 . 1 . 1 50 50 VAL CG1 C 13 21.876 0.3 . 1 . . . . A 50 VAL CG1 . 26001 1
519 . 1 . 1 50 50 VAL CG2 C 13 21.876 0.3 . 1 . . . . A 50 VAL CG2 . 26001 1
520 . 1 . 1 50 50 VAL N N 15 125.737 0.3 . 1 . . . . A 50 VAL N . 26001 1
521 . 1 . 1 51 51 ASP H H 1 8.472 0.02 . 1 . . . . A 51 ASP H . 26001 1
522 . 1 . 1 51 51 ASP HA H 1 4.877 0.02 . 1 . . . . A 51 ASP HA . 26001 1
523 . 1 . 1 51 51 ASP HB2 H 1 2.824 0.02 . 2 . . . . A 51 ASP HB2 . 26001 1
524 . 1 . 1 51 51 ASP HB3 H 1 2.433 0.02 . 2 . . . . A 51 ASP HB3 . 26001 1
525 . 1 . 1 51 51 ASP CA C 13 53.385 0.3 . 1 . . . . A 51 ASP CA . 26001 1
526 . 1 . 1 51 51 ASP CB C 13 43.384 0.3 . 1 . . . . A 51 ASP CB . 26001 1
527 . 1 . 1 51 51 ASP N N 15 125.083 0.3 . 1 . . . . A 51 ASP N . 26001 1
528 . 1 . 1 52 52 CYS H H 1 9.246 0.02 . 1 . . . . A 52 CYS H . 26001 1
529 . 1 . 1 52 52 CYS HA H 1 4.707 0.02 . 1 . . . . A 52 CYS HA . 26001 1
530 . 1 . 1 52 52 CYS HB2 H 1 3.898 0.02 . 2 . . . . A 52 CYS HB2 . 26001 1
531 . 1 . 1 52 52 CYS HB3 H 1 3.554 0.02 . 2 . . . . A 52 CYS HB3 . 26001 1
532 . 1 . 1 52 52 CYS CA C 13 53.708 0.3 . 1 . . . . A 52 CYS CA . 26001 1
533 . 1 . 1 52 52 CYS CB C 13 40.627 0.3 . 1 . . . . A 52 CYS CB . 26001 1
534 . 1 . 1 52 52 CYS N N 15 122.922 0.3 . 1 . . . . A 52 CYS N . 26001 1
535 . 1 . 1 53 53 GLN H H 1 8.884 0.02 . 1 . . . . A 53 GLN H . 26001 1
536 . 1 . 1 53 53 GLN HA H 1 3.947 0.02 . 1 . . . . A 53 GLN HA . 26001 1
537 . 1 . 1 53 53 GLN HB2 H 1 1.6 0.02 . 1 . . . . A 53 GLN HB2 . 26001 1
538 . 1 . 1 53 53 GLN HB3 H 1 1.6 0.02 . 1 . . . . A 53 GLN HB3 . 26001 1
539 . 1 . 1 53 53 GLN HG2 H 1 2.141 0.02 . 2 . . . . A 53 GLN HG2 . 26001 1
540 . 1 . 1 53 53 GLN HG3 H 1 2.074 0.02 . 2 . . . . A 53 GLN HG3 . 26001 1
541 . 1 . 1 53 53 GLN HE21 H 1 8.869 0.02 . 1 . . . . A 53 GLN HE21 . 26001 1
542 . 1 . 1 53 53 GLN HE22 H 1 7.094 0.02 . 1 . . . . A 53 GLN HE22 . 26001 1
543 . 1 . 1 53 53 GLN C C 13 175.436 0.3 . 1 . . . . A 53 GLN C . 26001 1
544 . 1 . 1 53 53 GLN CA C 13 55.343 0.3 . 1 . . . . A 53 GLN CA . 26001 1
545 . 1 . 1 53 53 GLN CB C 13 29.607 0.3 . 1 . . . . A 53 GLN CB . 26001 1
546 . 1 . 1 53 53 GLN CG C 13 33.789 0.3 . 1 . . . . A 53 GLN CG . 26001 1
547 . 1 . 1 53 53 GLN N N 15 117.958 0.3 . 1 . . . . A 53 GLN N . 26001 1
548 . 1 . 1 53 53 GLN NE2 N 15 114.8 0.3 . 1 . . . . A 53 GLN NE2 . 26001 1
549 . 1 . 1 54 54 THR H H 1 7.271 0.02 . 1 . . . . A 54 THR H . 26001 1
550 . 1 . 1 54 54 THR HA H 1 4.374 0.02 . 1 . . . . A 54 THR HA . 26001 1
551 . 1 . 1 54 54 THR HB H 1 4.044 0.02 . 1 . . . . A 54 THR HB . 26001 1
552 . 1 . 1 54 54 THR HG1 H 1 4.974 0.02 . 1 . . . . A 54 THR HG1 . 26001 1
553 . 1 . 1 54 54 THR HG21 H 1 1.131 0.02 . 1 . . . . A 54 THR HG21 . 26001 1
554 . 1 . 1 54 54 THR HG22 H 1 1.131 0.02 . 1 . . . . A 54 THR HG22 . 26001 1
555 . 1 . 1 54 54 THR HG23 H 1 1.131 0.02 . 1 . . . . A 54 THR HG23 . 26001 1
556 . 1 . 1 54 54 THR C C 13 173.387 0.3 . 1 . . . . A 54 THR C . 26001 1
557 . 1 . 1 54 54 THR CA C 13 60.659 0.3 . 1 . . . . A 54 THR CA . 26001 1
558 . 1 . 1 54 54 THR CB C 13 68.841 0.3 . 1 . . . . A 54 THR CB . 26001 1
559 . 1 . 1 54 54 THR CG2 C 13 21.618 0.3 . 1 . . . . A 54 THR CG2 . 26001 1
560 . 1 . 1 54 54 THR N N 15 115.566 0.3 . 1 . . . . A 54 THR N . 26001 1
561 . 1 . 1 55 55 PRO HA H 1 4.47 0.02 . 1 . . . . A 55 PRO HA . 26001 1
562 . 1 . 1 55 55 PRO HB2 H 1 1.925 0.02 . 2 . . . . A 55 PRO HB2 . 26001 1
563 . 1 . 1 55 55 PRO HB3 H 1 2.229 0.02 . 2 . . . . A 55 PRO HB3 . 26001 1
564 . 1 . 1 55 55 PRO HD2 H 1 3.672 0.02 . 2 . . . . A 55 PRO HD2 . 26001 1
565 . 1 . 1 55 55 PRO HD3 H 1 3.849 0.02 . 2 . . . . A 55 PRO HD3 . 26001 1
566 . 1 . 1 55 55 PRO CA C 13 63.568 0.3 . 1 . . . . A 55 PRO CA . 26001 1
567 . 1 . 1 55 55 PRO CB C 13 31.705 0.3 . 1 . . . . A 55 PRO CB . 26001 1
568 . 1 . 1 55 55 PRO CD C 13 51.014 0.3 . 1 . . . . A 55 PRO CD . 26001 1
569 . 1 . 1 56 56 VAL H H 1 7.579 0.02 . 1 . . . . A 56 VAL H . 26001 1
570 . 1 . 1 56 56 VAL HA H 1 3.734 0.02 . 1 . . . . A 56 VAL HA . 26001 1
571 . 1 . 1 56 56 VAL HB H 1 1.805 0.02 . 1 . . . . A 56 VAL HB . 26001 1
572 . 1 . 1 56 56 VAL HG11 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG11 . 26001 1
573 . 1 . 1 56 56 VAL HG12 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG12 . 26001 1
574 . 1 . 1 56 56 VAL HG13 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG13 . 26001 1
575 . 1 . 1 56 56 VAL HG21 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG21 . 26001 1
576 . 1 . 1 56 56 VAL HG22 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG22 . 26001 1
577 . 1 . 1 56 56 VAL HG23 H 1 0.684 0.02 . 1 . . . . A 56 VAL HG23 . 26001 1
578 . 1 . 1 56 56 VAL C C 13 180.745 0.3 . 1 . . . . A 56 VAL C . 26001 1
579 . 1 . 1 56 56 VAL CA C 13 63.56 0.3 . 1 . . . . A 56 VAL CA . 26001 1
580 . 1 . 1 56 56 VAL CB C 13 32.964 0.3 . 1 . . . . A 56 VAL CB . 26001 1
581 . 1 . 1 56 56 VAL CG1 C 13 21.36 0.3 . 1 . . . . A 56 VAL CG1 . 26001 1
582 . 1 . 1 56 56 VAL CG2 C 13 20.225 0.3 . 1 . . . . A 56 VAL CG2 . 26001 1
583 . 1 . 1 56 56 VAL N N 15 122.992 0.3 . 1 . . . . A 56 VAL N . 26001 1
stop_
save_