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 36085
_Assigned_chem_shift_list.ID 1
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.05
_Assigned_chem_shift_list.Chem_shift_15N_err 0.05
_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 36085 1
2 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36085 1
3 '3D HNCACB' 1 $sample_1 isotropic 36085 1
4 '3D HBHA(CO)NH' 1 $sample_1 isotropic 36085 1
5 '3D HNCO' 1 $sample_1 isotropic 36085 1
6 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36085 1
7 '3D 1H-13C NOESY aromatic' 1 $sample_1 isotropic 36085 1
8 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36085 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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 H H 1 8.4301 0.01 . . . . . . X 1 MET H1 . 36085 1
2 . 1 1 1 1 MET HA H 1 4.4608 0.01 . . . . . . X 1 MET HA . 36085 1
3 . 1 1 1 1 MET HB2 H 1 1.940 0.01 . . . . . . X 1 MET HB2 . 36085 1
4 . 1 1 1 1 MET HB3 H 1 2.003 0.01 . . . . . . X 1 MET HB3 . 36085 1
5 . 1 1 1 1 MET HG2 H 1 2.393 0.01 . . . . . . X 1 MET HG2 . 36085 1
6 . 1 1 1 1 MET HG3 H 1 2.423 0.01 . . . . . . X 1 MET HG3 . 36085 1
7 . 1 1 1 1 MET C C 13 175.0400 0.05 . . . . . . X 1 MET C . 36085 1
8 . 1 1 1 1 MET CA C 13 57.0100 0.05 . . . . . . X 1 MET CA . 36085 1
9 . 1 1 1 1 MET CB C 13 35.6400 0.05 . . . . . . X 1 MET CB . 36085 1
10 . 1 1 1 1 MET CG C 13 32.50 0.05 . . . . . . X 1 MET CG . 36085 1
11 . 1 1 1 1 MET N N 15 122.8440 0.05 . . . . . . X 1 MET N . 36085 1
12 . 1 1 2 2 ASN H H 1 9.0247 0.01 . . . . . . X 2 ASN H . 36085 1
13 . 1 1 2 2 ASN HA H 1 4.9200 0.01 . . . . . . X 2 ASN HA . 36085 1
14 . 1 1 2 2 ASN HB2 H 1 2.8262 0.01 . . . . . . X 2 ASN HB2 . 36085 1
15 . 1 1 2 2 ASN HB3 H 1 3.1506 0.01 . . . . . . X 2 ASN HB3 . 36085 1
16 . 1 1 2 2 ASN HD21 H 1 7.646 0.01 . . . . . . X 2 ASN HD21 . 36085 1
17 . 1 1 2 2 ASN HD22 H 1 6.929 0.01 . . . . . . X 2 ASN HD22 . 36085 1
18 . 1 1 2 2 ASN C C 13 176.6900 0.05 . . . . . . X 2 ASN C . 36085 1
19 . 1 1 2 2 ASN CA C 13 52.2800 0.05 . . . . . . X 2 ASN CA . 36085 1
20 . 1 1 2 2 ASN CB C 13 41.0000 0.05 . . . . . . X 2 ASN CB . 36085 1
21 . 1 1 2 2 ASN N N 15 122.4570 0.05 . . . . . . X 2 ASN N . 36085 1
22 . 1 1 2 2 ASN ND2 N 15 113.73 0.05 . . . . . . X 2 ASN ND2 . 36085 1
23 . 1 1 3 3 ILE H H 1 8.7557 0.01 . . . . . . X 3 ILE H . 36085 1
24 . 1 1 3 3 ILE HA H 1 3.8006 0.01 . . . . . . X 3 ILE HA . 36085 1
25 . 1 1 3 3 ILE HB H 1 1.9360 0.01 . . . . . . X 3 ILE HB . 36085 1
26 . 1 1 3 3 ILE HG12 H 1 1.308 0.01 . . . . . . X 3 ILE HG12 . 36085 1
27 . 1 1 3 3 ILE HG13 H 1 1.342 0.01 . . . . . . X 3 ILE HG13 . 36085 1
28 . 1 1 3 3 ILE HG21 H 1 0.900 0.01 . . . . . . X 3 ILE HG21 . 36085 1
29 . 1 1 3 3 ILE HG22 H 1 0.900 0.01 . . . . . . X 3 ILE HG22 . 36085 1
30 . 1 1 3 3 ILE HG23 H 1 0.900 0.01 . . . . . . X 3 ILE HG23 . 36085 1
31 . 1 1 3 3 ILE HD11 H 1 0.926 0.01 . . . . . . X 3 ILE HD11 . 36085 1
32 . 1 1 3 3 ILE HD12 H 1 0.926 0.01 . . . . . . X 3 ILE HD12 . 36085 1
33 . 1 1 3 3 ILE HD13 H 1 0.926 0.01 . . . . . . X 3 ILE HD13 . 36085 1
34 . 1 1 3 3 ILE C C 13 175.3600 0.05 . . . . . . X 3 ILE C . 36085 1
35 . 1 1 3 3 ILE CA C 13 63.5600 0.05 . . . . . . X 3 ILE CA . 36085 1
36 . 1 1 3 3 ILE CB C 13 38.5600 0.05 . . . . . . X 3 ILE CB . 36085 1
37 . 1 1 3 3 ILE CG1 C 13 30.09 0.05 . . . . . . X 3 ILE CG1 . 36085 1
38 . 1 1 3 3 ILE CG2 C 13 18.28 0.05 . . . . . . X 3 ILE CG2 . 36085 1
39 . 1 1 3 3 ILE CD1 C 13 15.21 0.05 . . . . . . X 3 ILE CD1 . 36085 1
40 . 1 1 3 3 ILE N N 15 120.0390 0.05 . . . . . . X 3 ILE N . 36085 1
41 . 1 1 4 4 ASN H H 1 7.9187 0.01 . . . . . . X 4 ASN H . 36085 1
42 . 1 1 4 4 ASN HA H 1 4.3478 0.01 . . . . . . X 4 ASN HA . 36085 1
43 . 1 1 4 4 ASN HB2 H 1 2.649 0.01 . . . . . . X 4 ASN HB2 . 36085 1
44 . 1 1 4 4 ASN HB3 H 1 2.782 0.01 . . . . . . X 4 ASN HB3 . 36085 1
45 . 1 1 4 4 ASN HD21 H 1 7.5762 0.01 . . . . . . X 4 ASN HD21 . 36085 1
46 . 1 1 4 4 ASN HD22 H 1 6.9239 0.01 . . . . . . X 4 ASN HD22 . 36085 1
47 . 1 1 4 4 ASN C C 13 178.5600 0.05 . . . . . . X 4 ASN C . 36085 1
48 . 1 1 4 4 ASN CA C 13 57.2800 0.05 . . . . . . X 4 ASN CA . 36085 1
49 . 1 1 4 4 ASN CB C 13 38.5700 0.05 . . . . . . X 4 ASN CB . 36085 1
50 . 1 1 4 4 ASN N N 15 120.0230 0.05 . . . . . . X 4 ASN N . 36085 1
51 . 1 1 4 4 ASN ND2 N 15 113.152 0.05 . . . . . . X 4 ASN ND2 . 36085 1
52 . 1 1 5 5 ASP H H 1 7.9483 0.01 . . . . . . X 5 ASP H . 36085 1
53 . 1 1 5 5 ASP HA H 1 4.3010 0.01 . . . . . . X 5 ASP HA . 36085 1
54 . 1 1 5 5 ASP HB2 H 1 2.710 0.01 . . . . . . X 5 ASP HB2 . 36085 1
55 . 1 1 5 5 ASP HB3 H 1 2.876 0.01 . . . . . . X 5 ASP HB3 . 36085 1
56 . 1 1 5 5 ASP C C 13 177.2400 0.05 . . . . . . X 5 ASP C . 36085 1
57 . 1 1 5 5 ASP CA C 13 57.8200 0.05 . . . . . . X 5 ASP CA . 36085 1
58 . 1 1 5 5 ASP CB C 13 41.9700 0.05 . . . . . . X 5 ASP CB . 36085 1
59 . 1 1 5 5 ASP N N 15 121.9300 0.05 . . . . . . X 5 ASP N . 36085 1
60 . 1 1 6 6 LEU H H 1 7.8808 0.01 . . . . . . X 6 LEU H . 36085 1
61 . 1 1 6 6 LEU HA H 1 3.724 0.01 . . . . . . X 6 LEU HA . 36085 1
62 . 1 1 6 6 LEU HB2 H 1 1.1672 0.01 . . . . . . X 6 LEU HB2 . 36085 1
63 . 1 1 6 6 LEU HB3 H 1 1.8220 0.01 . . . . . . X 6 LEU HB3 . 36085 1
64 . 1 1 6 6 LEU HG H 1 0.948 0.01 . . . . . . X 6 LEU HG . 36085 1
65 . 1 1 6 6 LEU HD11 H 1 0.322 0.01 . . . . . . X 6 LEU HD11 . 36085 1
66 . 1 1 6 6 LEU HD12 H 1 0.322 0.01 . . . . . . X 6 LEU HD12 . 36085 1
67 . 1 1 6 6 LEU HD13 H 1 0.322 0.01 . . . . . . X 6 LEU HD13 . 36085 1
68 . 1 1 6 6 LEU HD21 H 1 -0.289 0.01 . . . . . . X 6 LEU HD21 . 36085 1
69 . 1 1 6 6 LEU HD22 H 1 -0.289 0.01 . . . . . . X 6 LEU HD22 . 36085 1
70 . 1 1 6 6 LEU HD23 H 1 -0.289 0.01 . . . . . . X 6 LEU HD23 . 36085 1
71 . 1 1 6 6 LEU C C 13 177.8600 0.05 . . . . . . X 6 LEU C . 36085 1
72 . 1 1 6 6 LEU CA C 13 58.9900 0.05 . . . . . . X 6 LEU CA . 36085 1
73 . 1 1 6 6 LEU CB C 13 42.0400 0.05 . . . . . . X 6 LEU CB . 36085 1
74 . 1 1 6 6 LEU CG C 13 27.39 0.05 . . . . . . X 6 LEU CG . 36085 1
75 . 1 1 6 6 LEU CD1 C 13 26.78 0.05 . . . . . . X 6 LEU CD1 . 36085 1
76 . 1 1 6 6 LEU CD2 C 13 22.16 0.05 . . . . . . X 6 LEU CD2 . 36085 1
77 . 1 1 6 6 LEU N N 15 120.3440 0.05 . . . . . . X 6 LEU N . 36085 1
78 . 1 1 7 7 ILE H H 1 8.1025 0.01 . . . . . . X 7 ILE H . 36085 1
79 . 1 1 7 7 ILE HA H 1 3.303 0.01 . . . . . . X 7 ILE HA . 36085 1
80 . 1 1 7 7 ILE HB H 1 1.779 0.01 . . . . . . X 7 ILE HB . 36085 1
81 . 1 1 7 7 ILE HG12 H 1 0.852 0.01 . . . . . . X 7 ILE HG12 . 36085 1
82 . 1 1 7 7 ILE HG13 H 1 1.734 0.01 . . . . . . X 7 ILE HG13 . 36085 1
83 . 1 1 7 7 ILE HG21 H 1 0.847 0.01 . . . . . . X 7 ILE HG21 . 36085 1
84 . 1 1 7 7 ILE HG22 H 1 0.847 0.01 . . . . . . X 7 ILE HG22 . 36085 1
85 . 1 1 7 7 ILE HG23 H 1 0.847 0.01 . . . . . . X 7 ILE HG23 . 36085 1
86 . 1 1 7 7 ILE HD11 H 1 0.752 0.01 . . . . . . X 7 ILE HD11 . 36085 1
87 . 1 1 7 7 ILE HD12 H 1 0.752 0.01 . . . . . . X 7 ILE HD12 . 36085 1
88 . 1 1 7 7 ILE HD13 H 1 0.752 0.01 . . . . . . X 7 ILE HD13 . 36085 1
89 . 1 1 7 7 ILE C C 13 177.0800 0.05 . . . . . . X 7 ILE C . 36085 1
90 . 1 1 7 7 ILE CA C 13 67.0800 0.05 . . . . . . X 7 ILE CA . 36085 1
91 . 1 1 7 7 ILE CB C 13 38.8800 0.05 . . . . . . X 7 ILE CB . 36085 1
92 . 1 1 7 7 ILE CG1 C 13 30.92 0.05 . . . . . . X 7 ILE CG1 . 36085 1
93 . 1 1 7 7 ILE CG2 C 13 18.03 0.05 . . . . . . X 7 ILE CG2 . 36085 1
94 . 1 1 7 7 ILE CD1 C 13 14.92 0.05 . . . . . . X 7 ILE CD1 . 36085 1
95 . 1 1 7 7 ILE N N 15 117.2230 0.05 . . . . . . X 7 ILE N . 36085 1
96 . 1 1 8 8 ARG H H 1 7.5205 0.01 . . . . . . X 8 ARG H . 36085 1
97 . 1 1 8 8 ARG HA H 1 3.851 0.01 . . . . . . X 8 ARG HA . 36085 1
98 . 1 1 8 8 ARG HB2 H 1 1.848 0.01 . . . . . . X 8 ARG HB2 . 36085 1
99 . 1 1 8 8 ARG HB3 H 1 2.039 0.01 . . . . . . X 8 ARG HB3 . 36085 1
100 . 1 1 8 8 ARG HG2 H 1 1.377 0.01 . . . . . . X 8 ARG HG2 . 36085 1
101 . 1 1 8 8 ARG HG3 H 1 1.670 0.01 . . . . . . X 8 ARG HG3 . 36085 1
102 . 1 1 8 8 ARG HD2 H 1 3.200 0.01 . . . . . . X 8 ARG HD2 . 36085 1
103 . 1 1 8 8 ARG HD3 H 1 3.255 0.01 . . . . . . X 8 ARG HD3 . 36085 1
104 . 1 1 8 8 ARG C C 13 178.9000 0.05 . . . . . . X 8 ARG C . 36085 1
105 . 1 1 8 8 ARG CA C 13 60.4600 0.05 . . . . . . X 8 ARG CA . 36085 1
106 . 1 1 8 8 ARG CB C 13 30.4800 0.05 . . . . . . X 8 ARG CB . 36085 1
107 . 1 1 8 8 ARG CG C 13 28.12 0.05 . . . . . . X 8 ARG CG . 36085 1
108 . 1 1 8 8 ARG CD C 13 43.84 0.05 . . . . . . X 8 ARG CD . 36085 1
109 . 1 1 8 8 ARG N N 15 118.9340 0.05 . . . . . . X 8 ARG N . 36085 1
110 . 1 1 9 9 GLU H H 1 8.1259 0.01 . . . . . . X 9 GLU H . 36085 1
111 . 1 1 9 9 GLU HA H 1 4.010 0.01 . . . . . . X 9 GLU HA . 36085 1
112 . 1 1 9 9 GLU HB2 H 1 1.920 0.01 . . . . . . X 9 GLU HB2 . 36085 1
113 . 1 1 9 9 GLU HB3 H 1 1.918 0.01 . . . . . . X 9 GLU HB3 . 36085 1
114 . 1 1 9 9 GLU HG2 H 1 2.126 0.01 . . . . . . X 9 GLU HG2 . 36085 1
115 . 1 1 9 9 GLU HG3 H 1 2.579 0.01 . . . . . . X 9 GLU HG3 . 36085 1
116 . 1 1 9 9 GLU C C 13 179.7300 0.05 . . . . . . X 9 GLU C . 36085 1
117 . 1 1 9 9 GLU CA C 13 59.4500 0.05 . . . . . . X 9 GLU CA . 36085 1
118 . 1 1 9 9 GLU CB C 13 30.1400 0.05 . . . . . . X 9 GLU CB . 36085 1
119 . 1 1 9 9 GLU CG C 13 35.74 0.05 . . . . . . X 9 GLU CG . 36085 1
120 . 1 1 9 9 GLU N N 15 117.0910 0.05 . . . . . . X 9 GLU N . 36085 1
121 . 1 1 10 10 ILE H H 1 8.2994 0.01 . . . . . . X 10 ILE H . 36085 1
122 . 1 1 10 10 ILE HA H 1 3.369 0.01 . . . . . . X 10 ILE HA . 36085 1
123 . 1 1 10 10 ILE HB H 1 1.677 0.01 . . . . . . X 10 ILE HB . 36085 1
124 . 1 1 10 10 ILE HG12 H 1 0.525 0.01 . . . . . . X 10 ILE HG12 . 36085 1
125 . 1 1 10 10 ILE HG13 H 1 1.668 0.01 . . . . . . X 10 ILE HG13 . 36085 1
126 . 1 1 10 10 ILE HG21 H 1 0.708 0.01 . . . . . . X 10 ILE HG21 . 36085 1
127 . 1 1 10 10 ILE HG22 H 1 0.708 0.01 . . . . . . X 10 ILE HG22 . 36085 1
128 . 1 1 10 10 ILE HG23 H 1 0.708 0.01 . . . . . . X 10 ILE HG23 . 36085 1
129 . 1 1 10 10 ILE HD11 H 1 0.487 0.01 . . . . . . X 10 ILE HD11 . 36085 1
130 . 1 1 10 10 ILE HD12 H 1 0.487 0.01 . . . . . . X 10 ILE HD12 . 36085 1
131 . 1 1 10 10 ILE HD13 H 1 0.487 0.01 . . . . . . X 10 ILE HD13 . 36085 1
132 . 1 1 10 10 ILE C C 13 179.0800 0.05 . . . . . . X 10 ILE C . 36085 1
133 . 1 1 10 10 ILE CA C 13 67.3900 0.05 . . . . . . X 10 ILE CA . 36085 1
134 . 1 1 10 10 ILE CB C 13 39.7300 0.05 . . . . . . X 10 ILE CB . 36085 1
135 . 1 1 10 10 ILE CG1 C 13 29.77 0.05 . . . . . . X 10 ILE CG1 . 36085 1
136 . 1 1 10 10 ILE CG2 C 13 19.488 0.05 . . . . . . X 10 ILE CG2 . 36085 1
137 . 1 1 10 10 ILE CD1 C 13 15.66 0.05 . . . . . . X 10 ILE CD1 . 36085 1
138 . 1 1 10 10 ILE N N 15 121.3180 0.05 . . . . . . X 10 ILE N . 36085 1
139 . 1 1 11 11 LYS H H 1 8.4201 0.01 . . . . . . X 11 LYS H . 36085 1
140 . 1 1 11 11 LYS HA H 1 4.4187 0.01 . . . . . . X 11 LYS HA . 36085 1
141 . 1 1 11 11 LYS HB2 H 1 1.8620 0.01 . . . . . . X 11 LYS HB2 . 36085 1
142 . 1 1 11 11 LYS HB3 H 1 1.8620 0.01 . . . . . . X 11 LYS HB3 . 36085 1
143 . 1 1 11 11 LYS HG2 H 1 1.571 0.01 . . . . . . X 11 LYS HG2 . 36085 1
144 . 1 1 11 11 LYS HG3 H 1 1.571 0.01 . . . . . . X 11 LYS HG3 . 36085 1
145 . 1 1 11 11 LYS HD2 H 1 1.487 0.01 . . . . . . X 11 LYS HD2 . 36085 1
146 . 1 1 11 11 LYS HD3 H 1 1.715 0.01 . . . . . . X 11 LYS HD3 . 36085 1
147 . 1 1 11 11 LYS HE2 H 1 2.917 0.01 . . . . . . X 11 LYS HE2 . 36085 1
148 . 1 1 11 11 LYS HE3 H 1 2.917 0.01 . . . . . . X 11 LYS HE3 . 36085 1
149 . 1 1 11 11 LYS C C 13 181.6100 0.05 . . . . . . X 11 LYS C . 36085 1
150 . 1 1 11 11 LYS CA C 13 60.5800 0.05 . . . . . . X 11 LYS CA . 36085 1
151 . 1 1 11 11 LYS CB C 13 32.7100 0.05 . . . . . . X 11 LYS CB . 36085 1
152 . 1 1 11 11 LYS CG C 13 29.72 0.05 . . . . . . X 11 LYS CG . 36085 1
153 . 1 1 11 11 LYS CD C 13 26.579 0.05 . . . . . . X 11 LYS CD . 36085 1
154 . 1 1 11 11 LYS CE C 13 42.68 0.05 . . . . . . X 11 LYS CE . 36085 1
155 . 1 1 11 11 LYS N N 15 119.5760 0.05 . . . . . . X 11 LYS N . 36085 1
156 . 1 1 12 12 ASN H H 1 8.3432 0.01 . . . . . . X 12 ASN H . 36085 1
157 . 1 1 12 12 ASN HA H 1 4.587 0.01 . . . . . . X 12 ASN HA . 36085 1
158 . 1 1 12 12 ASN HB2 H 1 2.907 0.01 . . . . . . X 12 ASN HB2 . 36085 1
159 . 1 1 12 12 ASN HB3 H 1 2.907 0.01 . . . . . . X 12 ASN HB3 . 36085 1
160 . 1 1 12 12 ASN HD21 H 1 7.4696 0.01 . . . . . . X 12 ASN HD21 . 36085 1
161 . 1 1 12 12 ASN HD22 H 1 6.7784 0.01 . . . . . . X 12 ASN HD22 . 36085 1
162 . 1 1 12 12 ASN C C 13 176.6400 0.05 . . . . . . X 12 ASN C . 36085 1
163 . 1 1 12 12 ASN CA C 13 55.5900 0.05 . . . . . . X 12 ASN CA . 36085 1
164 . 1 1 12 12 ASN CB C 13 38.8300 0.05 . . . . . . X 12 ASN CB . 36085 1
165 . 1 1 12 12 ASN N N 15 119.0650 0.05 . . . . . . X 12 ASN N . 36085 1
166 . 1 1 12 12 ASN ND2 N 15 110.824 0.05 . . . . . . X 12 ASN ND2 . 36085 1
167 . 1 1 13 13 LYS H H 1 7.4674 0.01 . . . . . . X 13 LYS H . 36085 1
168 . 1 1 13 13 LYS HA H 1 4.4326 0.01 . . . . . . X 13 LYS HA . 36085 1
169 . 1 1 13 13 LYS HB2 H 1 2.027 0.01 . . . . . . X 13 LYS HB2 . 36085 1
170 . 1 1 13 13 LYS HB3 H 1 2.279 0.01 . . . . . . X 13 LYS HB3 . 36085 1
171 . 1 1 13 13 LYS HG2 H 1 1.548 0.01 . . . . . . X 13 LYS HG2 . 36085 1
172 . 1 1 13 13 LYS HG3 H 1 1.548 0.01 . . . . . . X 13 LYS HG3 . 36085 1
173 . 1 1 13 13 LYS HD2 H 1 1.670 0.01 . . . . . . X 13 LYS HD2 . 36085 1
174 . 1 1 13 13 LYS HD3 H 1 1.670 0.01 . . . . . . X 13 LYS HD3 . 36085 1
175 . 1 1 13 13 LYS C C 13 174.1200 0.05 . . . . . . X 13 LYS C . 36085 1
176 . 1 1 13 13 LYS CA C 13 55.5800 0.05 . . . . . . X 13 LYS CA . 36085 1
177 . 1 1 13 13 LYS CB C 13 32.0000 0.05 . . . . . . X 13 LYS CB . 36085 1
178 . 1 1 13 13 LYS CG C 13 25.49 0.05 . . . . . . X 13 LYS CG . 36085 1
179 . 1 1 13 13 LYS CD C 13 28.68 0.05 . . . . . . X 13 LYS CD . 36085 1
180 . 1 1 13 13 LYS N N 15 118.9180 0.05 . . . . . . X 13 LYS N . 36085 1
181 . 1 1 14 14 ASP H H 1 8.1471 0.01 . . . . . . X 14 ASP H . 36085 1
182 . 1 1 14 14 ASP HA H 1 4.228 0.01 . . . . . . X 14 ASP HA . 36085 1
183 . 1 1 14 14 ASP HB2 H 1 2.5615 0.01 . . . . . . X 14 ASP HB2 . 36085 1
184 . 1 1 14 14 ASP HB3 H 1 2.8463 0.01 . . . . . . X 14 ASP HB3 . 36085 1
185 . 1 1 14 14 ASP C C 13 174.8500 0.05 . . . . . . X 14 ASP C . 36085 1
186 . 1 1 14 14 ASP CA C 13 56.7400 0.05 . . . . . . X 14 ASP CA . 36085 1
187 . 1 1 14 14 ASP CB C 13 39.1800 0.05 . . . . . . X 14 ASP CB . 36085 1
188 . 1 1 14 14 ASP N N 15 113.2540 0.05 . . . . . . X 14 ASP N . 36085 1
189 . 1 1 15 15 TYR H H 1 6.9985 0.01 . . . . . . X 15 TYR H . 36085 1
190 . 1 1 15 15 TYR HA H 1 4.657 0.01 . . . . . . X 15 TYR HA . 36085 1
191 . 1 1 15 15 TYR HB2 H 1 2.496 0.01 . . . . . . X 15 TYR HB2 . 36085 1
192 . 1 1 15 15 TYR HB3 H 1 2.782 0.01 . . . . . . X 15 TYR HB3 . 36085 1
193 . 1 1 15 15 TYR HD1 H 1 7.2024 0.01 . . . . . . X 15 TYR HD1 . 36085 1
194 . 1 1 15 15 TYR HE1 H 1 6.8553 0.01 . . . . . . X 15 TYR HE1 . 36085 1
195 . 1 1 15 15 TYR C C 13 176.3100 0.05 . . . . . . X 15 TYR C . 36085 1
196 . 1 1 15 15 TYR CA C 13 58.8400 0.05 . . . . . . X 15 TYR CA . 36085 1
197 . 1 1 15 15 TYR CB C 13 40.4900 0.05 . . . . . . X 15 TYR CB . 36085 1
198 . 1 1 15 15 TYR CD1 C 13 133.923 0.05 . . . . . . X 15 TYR CD1 . 36085 1
199 . 1 1 15 15 TYR CE1 C 13 118.120 0.05 . . . . . . X 15 TYR CE1 . 36085 1
200 . 1 1 15 15 TYR N N 15 116.0050 0.05 . . . . . . X 15 TYR N . 36085 1
201 . 1 1 16 16 THR H H 1 8.7347 0.01 . . . . . . X 16 THR H . 36085 1
202 . 1 1 16 16 THR HA H 1 4.391 0.01 . . . . . . X 16 THR HA . 36085 1
203 . 1 1 16 16 THR HB H 1 4.085 0.01 . . . . . . X 16 THR HB . 36085 1
204 . 1 1 16 16 THR HG21 H 1 1.183 0.01 . . . . . . X 16 THR HG21 . 36085 1
205 . 1 1 16 16 THR HG22 H 1 1.183 0.01 . . . . . . X 16 THR HG22 . 36085 1
206 . 1 1 16 16 THR HG23 H 1 1.183 0.01 . . . . . . X 16 THR HG23 . 36085 1
207 . 1 1 16 16 THR C C 13 173.1100 0.05 . . . . . . X 16 THR C . 36085 1
208 . 1 1 16 16 THR CA C 13 63.6200 0.05 . . . . . . X 16 THR CA . 36085 1
209 . 1 1 16 16 THR CB C 13 70.6400 0.05 . . . . . . X 16 THR CB . 36085 1
210 . 1 1 16 16 THR CG2 C 13 22.24 0.05 . . . . . . X 16 THR CG2 . 36085 1
211 . 1 1 16 16 THR N N 15 117.8510 0.05 . . . . . . X 16 THR N . 36085 1
212 . 1 1 17 17 VAL H H 1 8.3175 0.01 . . . . . . X 17 VAL H . 36085 1
213 . 1 1 17 17 VAL HA H 1 5.3305 0.01 . . . . . . X 17 VAL HA . 36085 1
214 . 1 1 17 17 VAL HB H 1 1.8985 0.01 . . . . . . X 17 VAL HB . 36085 1
215 . 1 1 17 17 VAL HG11 H 1 0.873 0.01 . . . . . . X 17 VAL HG11 . 36085 1
216 . 1 1 17 17 VAL HG12 H 1 0.873 0.01 . . . . . . X 17 VAL HG12 . 36085 1
217 . 1 1 17 17 VAL HG13 H 1 0.873 0.01 . . . . . . X 17 VAL HG13 . 36085 1
218 . 1 1 17 17 VAL HG21 H 1 0.814 0.01 . . . . . . X 17 VAL HG21 . 36085 1
219 . 1 1 17 17 VAL HG22 H 1 0.814 0.01 . . . . . . X 17 VAL HG22 . 36085 1
220 . 1 1 17 17 VAL HG23 H 1 0.814 0.01 . . . . . . X 17 VAL HG23 . 36085 1
221 . 1 1 17 17 VAL C C 13 174.0500 0.05 . . . . . . X 17 VAL C . 36085 1
222 . 1 1 17 17 VAL CA C 13 59.4600 0.05 . . . . . . X 17 VAL CA . 36085 1
223 . 1 1 17 17 VAL CB C 13 35.7100 0.05 . . . . . . X 17 VAL CB . 36085 1
224 . 1 1 17 17 VAL CG1 C 13 22.34 0.05 . . . . . . X 17 VAL CG1 . 36085 1
225 . 1 1 17 17 VAL N N 15 120.8670 0.05 . . . . . . X 17 VAL N . 36085 1
226 . 1 1 18 18 LYS H H 1 8.9531 0.01 . . . . . . X 18 LYS H . 36085 1
227 . 1 1 18 18 LYS HA H 1 4.6064 0.01 . . . . . . X 18 LYS HA . 36085 1
228 . 1 1 18 18 LYS HB2 H 1 1.638 0.01 . . . . . . X 18 LYS HB2 . 36085 1
229 . 1 1 18 18 LYS HB3 H 1 1.763 0.01 . . . . . . X 18 LYS HB3 . 36085 1
230 . 1 1 18 18 LYS HG2 H 1 1.266 0.01 . . . . . . X 18 LYS HG2 . 36085 1
231 . 1 1 18 18 LYS HG3 H 1 1.312 0.01 . . . . . . X 18 LYS HG3 . 36085 1
232 . 1 1 18 18 LYS HD2 H 1 1.591 0.01 . . . . . . X 18 LYS HD2 . 36085 1
233 . 1 1 18 18 LYS HD3 H 1 1.591 0.01 . . . . . . X 18 LYS HD3 . 36085 1
234 . 1 1 18 18 LYS HE2 H 1 2.814 0.01 . . . . . . X 18 LYS HE2 . 36085 1
235 . 1 1 18 18 LYS HE3 H 1 2.814 0.01 . . . . . . X 18 LYS HE3 . 36085 1
236 . 1 1 18 18 LYS C C 13 173.9000 0.05 . . . . . . X 18 LYS C . 36085 1
237 . 1 1 18 18 LYS CA C 13 55.7600 0.05 . . . . . . X 18 LYS CA . 36085 1
238 . 1 1 18 18 LYS CB C 13 36.5500 0.05 . . . . . . X 18 LYS CB . 36085 1
239 . 1 1 18 18 LYS CG C 13 25.23 0.05 . . . . . . X 18 LYS CG . 36085 1
240 . 1 1 18 18 LYS CD C 13 29.959 0.05 . . . . . . X 18 LYS CD . 36085 1
241 . 1 1 18 18 LYS CE C 13 42.749 0.05 . . . . . . X 18 LYS CE . 36085 1
242 . 1 1 18 18 LYS N N 15 124.7270 0.05 . . . . . . X 18 LYS N . 36085 1
243 . 1 1 19 19 LEU H H 1 8.5894 0.01 . . . . . . X 19 LEU H . 36085 1
244 . 1 1 19 19 LEU HA H 1 5.2500 0.01 . . . . . . X 19 LEU HA . 36085 1
245 . 1 1 19 19 LEU HB2 H 1 1.487 0.01 . . . . . . X 19 LEU HB2 . 36085 1
246 . 1 1 19 19 LEU HB3 H 1 1.617 0.01 . . . . . . X 19 LEU HB3 . 36085 1
247 . 1 1 19 19 LEU HG H 1 1.5018 0.01 . . . . . . X 19 LEU HG . 36085 1
248 . 1 1 19 19 LEU HD11 H 1 0.837 0.01 . . . . . . X 19 LEU HD11 . 36085 1
249 . 1 1 19 19 LEU HD12 H 1 0.837 0.01 . . . . . . X 19 LEU HD12 . 36085 1
250 . 1 1 19 19 LEU HD13 H 1 0.837 0.01 . . . . . . X 19 LEU HD13 . 36085 1
251 . 1 1 19 19 LEU C C 13 176.7700 0.05 . . . . . . X 19 LEU C . 36085 1
252 . 1 1 19 19 LEU CA C 13 54.2200 0.05 . . . . . . X 19 LEU CA . 36085 1
253 . 1 1 19 19 LEU CB C 13 45.0800 0.05 . . . . . . X 19 LEU CB . 36085 1
254 . 1 1 19 19 LEU CG C 13 27.70 0.05 . . . . . . X 19 LEU CG . 36085 1
255 . 1 1 19 19 LEU CD1 C 13 25.30 0.05 . . . . . . X 19 LEU CD1 . 36085 1
256 . 1 1 19 19 LEU N N 15 124.4070 0.05 . . . . . . X 19 LEU N . 36085 1
257 . 1 1 20 20 SER HA H 1 4.776 0.01 . . . . . . X 20 SER HA . 36085 1
258 . 1 1 20 20 SER HB2 H 1 3.714 0.01 . . . . . . X 20 SER HB2 . 36085 1
259 . 1 1 20 20 SER HB3 H 1 3.750 0.01 . . . . . . X 20 SER HB3 . 36085 1
260 . 1 1 20 20 SER C C 13 173.6200 0.05 . . . . . . X 20 SER C . 36085 1
261 . 1 1 20 20 SER CA C 13 57.9200 0.05 . . . . . . X 20 SER CA . 36085 1
262 . 1 1 20 20 SER CB C 13 66.0200 0.05 . . . . . . X 20 SER CB . 36085 1
263 . 1 1 21 21 GLY H H 1 8.4453 0.01 . . . . . . X 21 GLY H . 36085 1
264 . 1 1 21 21 GLY HA2 H 1 4.191 0.01 . . . . . . X 21 GLY HA2 . 36085 1
265 . 1 1 21 21 GLY HA3 H 1 4.265 0.01 . . . . . . X 21 GLY HA3 . 36085 1
266 . 1 1 21 21 GLY C C 13 174.3700 0.05 . . . . . . X 21 GLY C . 36085 1
267 . 1 1 21 21 GLY CA C 13 46.445 0.05 . . . . . . X 21 GLY CA . 36085 1
268 . 1 1 21 21 GLY N N 15 111.1710 0.05 . . . . . . X 21 GLY N . 36085 1
269 . 1 1 22 22 THR H H 1 8.1025 0.01 . . . . . . X 22 THR H . 36085 1
270 . 1 1 22 22 THR HA H 1 4.245 0.01 . . . . . . X 22 THR HA . 36085 1
271 . 1 1 22 22 THR HB H 1 4.325 0.01 . . . . . . X 22 THR HB . 36085 1
272 . 1 1 22 22 THR HG21 H 1 1.138 0.01 . . . . . . X 22 THR HG21 . 36085 1
273 . 1 1 22 22 THR HG22 H 1 1.138 0.01 . . . . . . X 22 THR HG22 . 36085 1
274 . 1 1 22 22 THR HG23 H 1 1.138 0.01 . . . . . . X 22 THR HG23 . 36085 1
275 . 1 1 22 22 THR C C 13 175.0900 0.05 . . . . . . X 22 THR C . 36085 1
276 . 1 1 22 22 THR CA C 13 63.184 0.05 . . . . . . X 22 THR CA . 36085 1
277 . 1 1 22 22 THR CB C 13 70.2100 0.05 . . . . . . X 22 THR CB . 36085 1
278 . 1 1 22 22 THR CG2 C 13 22.54 0.05 . . . . . . X 22 THR CG2 . 36085 1
279 . 1 1 22 22 THR N N 15 110.8040 0.05 . . . . . . X 22 THR N . 36085 1
280 . 1 1 23 23 ASP H H 1 8.2440 0.01 . . . . . . X 23 ASP H . 36085 1
281 . 1 1 23 23 ASP HA H 1 4.554 0.01 . . . . . . X 23 ASP HA . 36085 1
282 . 1 1 23 23 ASP HB2 H 1 2.760 0.01 . . . . . . X 23 ASP HB2 . 36085 1
283 . 1 1 23 23 ASP HB3 H 1 2.763 0.01 . . . . . . X 23 ASP HB3 . 36085 1
284 . 1 1 23 23 ASP C C 13 176.7000 0.05 . . . . . . X 23 ASP C . 36085 1
285 . 1 1 23 23 ASP CA C 13 54.9500 0.05 . . . . . . X 23 ASP CA . 36085 1
286 . 1 1 23 23 ASP CB C 13 41.9900 0.05 . . . . . . X 23 ASP CB . 36085 1
287 . 1 1 23 23 ASP N N 15 119.8130 0.05 . . . . . . X 23 ASP N . 36085 1
288 . 1 1 24 24 SER HA H 1 4.3270 0.01 . . . . . . X 24 SER HA . 36085 1
289 . 1 1 24 24 SER HB2 H 1 3.9010 0.01 . . . . . . X 24 SER HB2 . 36085 1
290 . 1 1 24 24 SER HB3 H 1 3.9010 0.01 . . . . . . X 24 SER HB3 . 36085 1
291 . 1 1 24 24 SER C C 13 174.4500 0.05 . . . . . . X 24 SER C . 36085 1
292 . 1 1 24 24 SER CA C 13 60.6400 0.05 . . . . . . X 24 SER CA . 36085 1
293 . 1 1 24 24 SER CB C 13 64.1600 0.05 . . . . . . X 24 SER CB . 36085 1
294 . 1 1 25 25 ASN H H 1 8.2323 0.01 . . . . . . X 25 ASN H . 36085 1
295 . 1 1 25 25 ASN HA H 1 4.7487 0.01 . . . . . . X 25 ASN HA . 36085 1
296 . 1 1 25 25 ASN HB2 H 1 2.7395 0.01 . . . . . . X 25 ASN HB2 . 36085 1
297 . 1 1 25 25 ASN HB3 H 1 2.8880 0.01 . . . . . . X 25 ASN HB3 . 36085 1
298 . 1 1 25 25 ASN HD21 H 1 7.606 0.01 . . . . . . X 25 ASN HD21 . 36085 1
299 . 1 1 25 25 ASN HD22 H 1 6.857 0.01 . . . . . . X 25 ASN HD22 . 36085 1
300 . 1 1 25 25 ASN C C 13 174.7700 0.05 . . . . . . X 25 ASN C . 36085 1
301 . 1 1 25 25 ASN CA C 13 54.3300 0.05 . . . . . . X 25 ASN CA . 36085 1
302 . 1 1 25 25 ASN CB C 13 39.7100 0.05 . . . . . . X 25 ASN CB . 36085 1
303 . 1 1 25 25 ASN N N 15 118.2590 0.05 . . . . . . X 25 ASN N . 36085 1
304 . 1 1 25 25 ASN ND2 N 15 112.81 0.05 . . . . . . X 25 ASN ND2 . 36085 1
305 . 1 1 26 26 SER H H 1 7.7782 0.01 . . . . . . X 26 SER H . 36085 1
306 . 1 1 26 26 SER HA H 1 4.556 0.01 . . . . . . X 26 SER HA . 36085 1
307 . 1 1 26 26 SER HB2 H 1 3.6810 0.01 . . . . . . X 26 SER HB2 . 36085 1
308 . 1 1 26 26 SER HB3 H 1 3.7662 0.01 . . . . . . X 26 SER HB3 . 36085 1
309 . 1 1 26 26 SER C C 13 173.3400 0.05 . . . . . . X 26 SER C . 36085 1
310 . 1 1 26 26 SER CA C 13 58.6200 0.05 . . . . . . X 26 SER CA . 36085 1
311 . 1 1 26 26 SER CB C 13 65.0000 0.05 . . . . . . X 26 SER CB . 36085 1
312 . 1 1 26 26 SER N N 15 115.6040 0.05 . . . . . . X 26 SER N . 36085 1
313 . 1 1 27 27 ILE H H 1 8.1958 0.01 . . . . . . X 27 ILE H . 36085 1
314 . 1 1 27 27 ILE HA H 1 4.215 0.01 . . . . . . X 27 ILE HA . 36085 1
315 . 1 1 27 27 ILE HB H 1 1.773 0.01 . . . . . . X 27 ILE HB . 36085 1
316 . 1 1 27 27 ILE HG12 H 1 1.113 0.01 . . . . . . X 27 ILE HG12 . 36085 1
317 . 1 1 27 27 ILE HG13 H 1 1.482 0.01 . . . . . . X 27 ILE HG13 . 36085 1
318 . 1 1 27 27 ILE HG21 H 1 0.866 0.01 . . . . . . X 27 ILE HG21 . 36085 1
319 . 1 1 27 27 ILE HG22 H 1 0.866 0.01 . . . . . . X 27 ILE HG22 . 36085 1
320 . 1 1 27 27 ILE HG23 H 1 0.866 0.01 . . . . . . X 27 ILE HG23 . 36085 1
321 . 1 1 27 27 ILE HD11 H 1 0.796 0.01 . . . . . . X 27 ILE HD11 . 36085 1
322 . 1 1 27 27 ILE HD12 H 1 0.796 0.01 . . . . . . X 27 ILE HD12 . 36085 1
323 . 1 1 27 27 ILE HD13 H 1 0.796 0.01 . . . . . . X 27 ILE HD13 . 36085 1
324 . 1 1 27 27 ILE C C 13 176.0100 0.05 . . . . . . X 27 ILE C . 36085 1
325 . 1 1 27 27 ILE CA C 13 61.6900 0.05 . . . . . . X 27 ILE CA . 36085 1
326 . 1 1 27 27 ILE CB C 13 39.4200 0.05 . . . . . . X 27 ILE CB . 36085 1
327 . 1 1 27 27 ILE CG1 C 13 28.03 0.05 . . . . . . X 27 ILE CG1 . 36085 1
328 . 1 1 27 27 ILE CG2 C 13 18.48 0.05 . . . . . . X 27 ILE CG2 . 36085 1
329 . 1 1 27 27 ILE CD1 C 13 13.605 0.05 . . . . . . X 27 ILE CD1 . 36085 1
330 . 1 1 27 27 ILE N N 15 122.9630 0.05 . . . . . . X 27 ILE N . 36085 1
331 . 1 1 29 29 GLN HA H 1 5.166 0.01 . . . . . . X 29 GLN HA . 36085 1
332 . 1 1 29 29 GLN HB2 H 1 1.730 0.01 . . . . . . X 29 GLN HB2 . 36085 1
333 . 1 1 29 29 GLN HB3 H 1 1.846 0.01 . . . . . . X 29 GLN HB3 . 36085 1
334 . 1 1 29 29 GLN HG2 H 1 2.040 0.01 . . . . . . X 29 GLN HG2 . 36085 1
335 . 1 1 29 29 GLN HG3 H 1 2.167 0.01 . . . . . . X 29 GLN HG3 . 36085 1
336 . 1 1 29 29 GLN HE21 H 1 7.0830 0.01 . . . . . . X 29 GLN HE21 . 36085 1
337 . 1 1 29 29 GLN HE22 H 1 6.7164 0.01 . . . . . . X 29 GLN HE22 . 36085 1
338 . 1 1 29 29 GLN C C 13 172.6200 0.05 . . . . . . X 29 GLN C . 36085 1
339 . 1 1 29 29 GLN CA C 13 55.7300 0.05 . . . . . . X 29 GLN CA . 36085 1
340 . 1 1 29 29 GLN CB C 13 34.3600 0.05 . . . . . . X 29 GLN CB . 36085 1
341 . 1 1 29 29 GLN CG C 13 35.26 0.05 . . . . . . X 29 GLN CG . 36085 1
342 . 1 1 29 29 GLN NE2 N 15 111.050 0.05 . . . . . . X 29 GLN NE2 . 36085 1
343 . 1 1 30 30 LEU H H 1 9.2077 0.01 . . . . . . X 30 LEU H . 36085 1
344 . 1 1 30 30 LEU HA H 1 4.928 0.01 . . . . . . X 30 LEU HA . 36085 1
345 . 1 1 30 30 LEU HB2 H 1 1.2704 0.01 . . . . . . X 30 LEU HB2 . 36085 1
346 . 1 1 30 30 LEU HB3 H 1 1.8856 0.01 . . . . . . X 30 LEU HB3 . 36085 1
347 . 1 1 30 30 LEU HG H 1 1.432 0.01 . . . . . . X 30 LEU HG . 36085 1
348 . 1 1 30 30 LEU HD11 H 1 0.738 0.01 . . . . . . X 30 LEU HD11 . 36085 1
349 . 1 1 30 30 LEU HD12 H 1 0.738 0.01 . . . . . . X 30 LEU HD12 . 36085 1
350 . 1 1 30 30 LEU HD13 H 1 0.738 0.01 . . . . . . X 30 LEU HD13 . 36085 1
351 . 1 1 30 30 LEU HD21 H 1 0.707 0.01 . . . . . . X 30 LEU HD21 . 36085 1
352 . 1 1 30 30 LEU HD22 H 1 0.707 0.01 . . . . . . X 30 LEU HD22 . 36085 1
353 . 1 1 30 30 LEU HD23 H 1 0.707 0.01 . . . . . . X 30 LEU HD23 . 36085 1
354 . 1 1 30 30 LEU C C 13 174.0500 0.05 . . . . . . X 30 LEU C . 36085 1
355 . 1 1 30 30 LEU CA C 13 54.5100 0.05 . . . . . . X 30 LEU CA . 36085 1
356 . 1 1 30 30 LEU CB C 13 46.9600 0.05 . . . . . . X 30 LEU CB . 36085 1
357 . 1 1 30 30 LEU CG C 13 28.214 0.05 . . . . . . X 30 LEU CG . 36085 1
358 . 1 1 30 30 LEU CD1 C 13 25.75 0.05 . . . . . . X 30 LEU CD1 . 36085 1
359 . 1 1 30 30 LEU CD2 C 13 27.03 0.05 . . . . . . X 30 LEU CD2 . 36085 1
360 . 1 1 30 30 LEU N N 15 125.8810 0.05 . . . . . . X 30 LEU N . 36085 1
361 . 1 1 31 31 ILE H H 1 9.0008 0.01 . . . . . . X 31 ILE H . 36085 1
362 . 1 1 31 31 ILE HA H 1 4.7872 0.01 . . . . . . X 31 ILE HA . 36085 1
363 . 1 1 31 31 ILE HB H 1 1.7240 0.01 . . . . . . X 31 ILE HB . 36085 1
364 . 1 1 31 31 ILE HG12 H 1 0.970 0.01 . . . . . . X 31 ILE HG12 . 36085 1
365 . 1 1 31 31 ILE HG13 H 1 1.425 0.01 . . . . . . X 31 ILE HG13 . 36085 1
366 . 1 1 31 31 ILE HG21 H 1 0.660 0.01 . . . . . . X 31 ILE HG21 . 36085 1
367 . 1 1 31 31 ILE HG22 H 1 0.660 0.01 . . . . . . X 31 ILE HG22 . 36085 1
368 . 1 1 31 31 ILE HG23 H 1 0.660 0.01 . . . . . . X 31 ILE HG23 . 36085 1
369 . 1 1 31 31 ILE HD11 H 1 0.740 0.01 . . . . . . X 31 ILE HD11 . 36085 1
370 . 1 1 31 31 ILE HD12 H 1 0.740 0.01 . . . . . . X 31 ILE HD12 . 36085 1
371 . 1 1 31 31 ILE HD13 H 1 0.740 0.01 . . . . . . X 31 ILE HD13 . 36085 1
372 . 1 1 31 31 ILE C C 13 175.4800 0.05 . . . . . . X 31 ILE C . 36085 1
373 . 1 1 31 31 ILE CA C 13 61.6800 0.05 . . . . . . X 31 ILE CA . 36085 1
374 . 1 1 31 31 ILE CB C 13 40.7000 0.05 . . . . . . X 31 ILE CB . 36085 1
375 . 1 1 31 31 ILE CG1 C 13 28.70 0.05 . . . . . . X 31 ILE CG1 . 36085 1
376 . 1 1 31 31 ILE CG2 C 13 18.72 0.05 . . . . . . X 31 ILE CG2 . 36085 1
377 . 1 1 31 31 ILE CD1 C 13 14.96 0.05 . . . . . . X 31 ILE CD1 . 36085 1
378 . 1 1 31 31 ILE N N 15 126.3640 0.05 . . . . . . X 31 ILE N . 36085 1
379 . 1 1 32 32 ILE H H 1 9.3862 0.01 . . . . . . X 32 ILE H . 36085 1
380 . 1 1 32 32 ILE HA H 1 4.523 0.01 . . . . . . X 32 ILE HA . 36085 1
381 . 1 1 32 32 ILE HB H 1 1.881 0.01 . . . . . . X 32 ILE HB . 36085 1
382 . 1 1 32 32 ILE HG12 H 1 0.826 0.01 . . . . . . X 32 ILE HG12 . 36085 1
383 . 1 1 32 32 ILE HG13 H 1 1.807 0.01 . . . . . . X 32 ILE HG13 . 36085 1
384 . 1 1 32 32 ILE HG21 H 1 0.790 0.01 . . . . . . X 32 ILE HG21 . 36085 1
385 . 1 1 32 32 ILE HG22 H 1 0.790 0.01 . . . . . . X 32 ILE HG22 . 36085 1
386 . 1 1 32 32 ILE HG23 H 1 0.790 0.01 . . . . . . X 32 ILE HG23 . 36085 1
387 . 1 1 32 32 ILE HD11 H 1 1.061 0.01 . . . . . . X 32 ILE HD11 . 36085 1
388 . 1 1 32 32 ILE HD12 H 1 1.061 0.01 . . . . . . X 32 ILE HD12 . 36085 1
389 . 1 1 32 32 ILE HD13 H 1 1.061 0.01 . . . . . . X 32 ILE HD13 . 36085 1
390 . 1 1 32 32 ILE C C 13 175.4800 0.05 . . . . . . X 32 ILE C . 36085 1
391 . 1 1 32 32 ILE CA C 13 61.4300 0.05 . . . . . . X 32 ILE CA . 36085 1
392 . 1 1 32 32 ILE CB C 13 41.8800 0.05 . . . . . . X 32 ILE CB . 36085 1
393 . 1 1 32 32 ILE CG1 C 13 28.47 0.05 . . . . . . X 32 ILE CG1 . 36085 1
394 . 1 1 32 32 ILE CG2 C 13 19.45 0.05 . . . . . . X 32 ILE CG2 . 36085 1
395 . 1 1 32 32 ILE CD1 C 13 15.50 0.05 . . . . . . X 32 ILE CD1 . 36085 1
396 . 1 1 32 32 ILE N N 15 128.1330 0.05 . . . . . . X 32 ILE N . 36085 1
397 . 1 1 33 33 ARG H H 1 8.7146 0.01 . . . . . . X 33 ARG H . 36085 1
398 . 1 1 33 33 ARG HA H 1 4.4370 0.01 . . . . . . X 33 ARG HA . 36085 1
399 . 1 1 33 33 ARG HB2 H 1 1.7696 0.01 . . . . . . X 33 ARG HB2 . 36085 1
400 . 1 1 33 33 ARG HB3 H 1 1.958 0.01 . . . . . . X 33 ARG HB3 . 36085 1
401 . 1 1 33 33 ARG HG2 H 1 1.541 0.01 . . . . . . X 33 ARG HG2 . 36085 1
402 . 1 1 33 33 ARG HG3 H 1 1.567 0.01 . . . . . . X 33 ARG HG3 . 36085 1
403 . 1 1 33 33 ARG HD2 H 1 3.111 0.01 . . . . . . X 33 ARG HD2 . 36085 1
404 . 1 1 33 33 ARG HD3 H 1 3.131 0.01 . . . . . . X 33 ARG HD3 . 36085 1
405 . 1 1 33 33 ARG C C 13 175.3900 0.05 . . . . . . X 33 ARG C . 36085 1
406 . 1 1 33 33 ARG CA C 13 57.4400 0.05 . . . . . . X 33 ARG CA . 36085 1
407 . 1 1 33 33 ARG CB C 13 30.3200 0.05 . . . . . . X 33 ARG CB . 36085 1
408 . 1 1 33 33 ARG CG C 13 28.60 0.05 . . . . . . X 33 ARG CG . 36085 1
409 . 1 1 33 33 ARG CD C 13 44.35 0.05 . . . . . . X 33 ARG CD . 36085 1
410 . 1 1 33 33 ARG N N 15 128.3860 0.05 . . . . . . X 33 ARG N . 36085 1
411 . 1 1 34 34 VAL H H 1 8.4956 0.01 . . . . . . X 34 VAL H . 36085 1
412 . 1 1 34 34 VAL HA H 1 3.324 0.01 . . . . . . X 34 VAL HA . 36085 1
413 . 1 1 34 34 VAL HB H 1 1.412 0.01 . . . . . . X 34 VAL HB . 36085 1
414 . 1 1 34 34 VAL HG11 H 1 0.543 0.01 . . . . . . X 34 VAL HG11 . 36085 1
415 . 1 1 34 34 VAL HG12 H 1 0.543 0.01 . . . . . . X 34 VAL HG12 . 36085 1
416 . 1 1 34 34 VAL HG13 H 1 0.543 0.01 . . . . . . X 34 VAL HG13 . 36085 1
417 . 1 1 34 34 VAL HG21 H 1 -0.0188 0.01 . . . . . . X 34 VAL HG21 . 36085 1
418 . 1 1 34 34 VAL HG22 H 1 -0.0188 0.01 . . . . . . X 34 VAL HG22 . 36085 1
419 . 1 1 34 34 VAL HG23 H 1 -0.0188 0.01 . . . . . . X 34 VAL HG23 . 36085 1
420 . 1 1 34 34 VAL C C 13 175.7700 0.05 . . . . . . X 34 VAL C . 36085 1
421 . 1 1 34 34 VAL CA C 13 65.5300 0.05 . . . . . . X 34 VAL CA . 36085 1
422 . 1 1 34 34 VAL CB C 13 33.0500 0.05 . . . . . . X 34 VAL CB . 36085 1
423 . 1 1 34 34 VAL CG1 C 13 21.41 0.05 . . . . . . X 34 VAL CG1 . 36085 1
424 . 1 1 34 34 VAL N N 15 129.5580 0.05 . . . . . . X 34 VAL N . 36085 1
425 . 1 1 35 35 ASN H H 1 7.4781 0.01 . . . . . . X 35 ASN H . 36085 1
426 . 1 1 35 35 ASN HA H 1 4.7068 0.01 . . . . . . X 35 ASN HA . 36085 1
427 . 1 1 35 35 ASN HB2 H 1 3.0210 0.01 . . . . . . X 35 ASN HB2 . 36085 1
428 . 1 1 35 35 ASN HB3 H 1 3.2254 0.01 . . . . . . X 35 ASN HB3 . 36085 1
429 . 1 1 35 35 ASN HD21 H 1 7.7840 0.01 . . . . . . X 35 ASN HD21 . 36085 1
430 . 1 1 35 35 ASN HD22 H 1 7.1422 0.01 . . . . . . X 35 ASN HD22 . 36085 1
431 . 1 1 35 35 ASN C C 13 175.2100 0.05 . . . . . . X 35 ASN C . 36085 1
432 . 1 1 35 35 ASN CA C 13 52.4900 0.05 . . . . . . X 35 ASN CA . 36085 1
433 . 1 1 35 35 ASN CB C 13 40.5800 0.05 . . . . . . X 35 ASN CB . 36085 1
434 . 1 1 35 35 ASN N N 15 111.9960 0.05 . . . . . . X 35 ASN N . 36085 1
435 . 1 1 35 35 ASN ND2 N 15 114.674 0.05 . . . . . . X 35 ASN ND2 . 36085 1
436 . 1 1 36 36 ASN H H 1 8.6390 0.01 . . . . . . X 36 ASN H . 36085 1
437 . 1 1 36 36 ASN HA H 1 4.7620 0.01 . . . . . . X 36 ASN HA . 36085 1
438 . 1 1 36 36 ASN HB2 H 1 2.7524 0.01 . . . . . . X 36 ASN HB2 . 36085 1
439 . 1 1 36 36 ASN HB3 H 1 2.9226 0.01 . . . . . . X 36 ASN HB3 . 36085 1
440 . 1 1 36 36 ASN HD21 H 1 7.6062 0.01 . . . . . . X 36 ASN HD21 . 36085 1
441 . 1 1 36 36 ASN HD22 H 1 6.9329 0.01 . . . . . . X 36 ASN HD22 . 36085 1
442 . 1 1 36 36 ASN C C 13 175.4600 0.05 . . . . . . X 36 ASN C . 36085 1
443 . 1 1 36 36 ASN CA C 13 54.8300 0.05 . . . . . . X 36 ASN CA . 36085 1
444 . 1 1 36 36 ASN CB C 13 39.1300 0.05 . . . . . . X 36 ASN CB . 36085 1
445 . 1 1 36 36 ASN N N 15 116.1480 0.05 . . . . . . X 36 ASN N . 36085 1
446 . 1 1 36 36 ASN ND2 N 15 113.380 0.05 . . . . . . X 36 ASN ND2 . 36085 1
447 . 1 1 37 37 ASP H H 1 8.1708 0.01 . . . . . . X 37 ASP H . 36085 1
448 . 1 1 37 37 ASP HA H 1 4.7074 0.01 . . . . . . X 37 ASP HA . 36085 1
449 . 1 1 37 37 ASP HB2 H 1 2.3965 0.01 . . . . . . X 37 ASP HB2 . 36085 1
450 . 1 1 37 37 ASP HB3 H 1 2.7538 0.01 . . . . . . X 37 ASP HB3 . 36085 1
451 . 1 1 37 37 ASP C C 13 176.5400 0.05 . . . . . . X 37 ASP C . 36085 1
452 . 1 1 37 37 ASP CA C 13 55.2300 0.05 . . . . . . X 37 ASP CA . 36085 1
453 . 1 1 37 37 ASP CB C 13 42.1200 0.05 . . . . . . X 37 ASP CB . 36085 1
454 . 1 1 37 37 ASP N N 15 119.1380 0.05 . . . . . . X 37 ASP N . 36085 1
455 . 1 1 38 38 GLY H H 1 7.9492 0.01 . . . . . . X 38 GLY H . 36085 1
456 . 1 1 38 38 GLY HA2 H 1 3.586 0.01 . . . . . . X 38 GLY HA2 . 36085 1
457 . 1 1 38 38 GLY HA3 H 1 4.196 0.01 . . . . . . X 38 GLY HA3 . 36085 1
458 . 1 1 38 38 GLY C C 13 174.1200 0.05 . . . . . . X 38 GLY C . 36085 1
459 . 1 1 38 38 GLY CA C 13 46.0500 0.05 . . . . . . X 38 GLY CA . 36085 1
460 . 1 1 38 38 GLY N N 15 106.6790 0.05 . . . . . . X 38 GLY N . 36085 1
461 . 1 1 39 39 ASN H H 1 7.7247 0.01 . . . . . . X 39 ASN H . 36085 1
462 . 1 1 39 39 ASN HA H 1 4.5921 0.01 . . . . . . X 39 ASN HA . 36085 1
463 . 1 1 39 39 ASN HB2 H 1 2.589 0.01 . . . . . . X 39 ASN HB2 . 36085 1
464 . 1 1 39 39 ASN HB3 H 1 2.651 0.01 . . . . . . X 39 ASN HB3 . 36085 1
465 . 1 1 39 39 ASN HD21 H 1 7.4603 0.01 . . . . . . X 39 ASN HD21 . 36085 1
466 . 1 1 39 39 ASN HD22 H 1 7.3541 0.01 . . . . . . X 39 ASN HD22 . 36085 1
467 . 1 1 39 39 ASN C C 13 174.4700 0.05 . . . . . . X 39 ASN C . 36085 1
468 . 1 1 39 39 ASN CA C 13 54.4600 0.05 . . . . . . X 39 ASN CA . 36085 1
469 . 1 1 39 39 ASN CB C 13 39.0200 0.05 . . . . . . X 39 ASN CB . 36085 1
470 . 1 1 39 39 ASN N N 15 119.9270 0.05 . . . . . . X 39 ASN N . 36085 1
471 . 1 1 39 39 ASN ND2 N 15 111.301 0.05 . . . . . . X 39 ASN ND2 . 36085 1
472 . 1 1 40 40 GLU H H 1 8.2101 0.01 . . . . . . X 40 GLU H . 36085 1
473 . 1 1 40 40 GLU HA H 1 4.9859 0.01 . . . . . . X 40 GLU HA . 36085 1
474 . 1 1 40 40 GLU HB2 H 1 1.610 0.01 . . . . . . X 40 GLU HB2 . 36085 1
475 . 1 1 40 40 GLU HB3 H 1 1.718 0.01 . . . . . . X 40 GLU HB3 . 36085 1
476 . 1 1 40 40 GLU HG2 H 1 1.870 0.01 . . . . . . X 40 GLU HG2 . 36085 1
477 . 1 1 40 40 GLU HG3 H 1 2.181 0.01 . . . . . . X 40 GLU HG3 . 36085 1
478 . 1 1 40 40 GLU C C 13 174.1800 0.05 . . . . . . X 40 GLU C . 36085 1
479 . 1 1 40 40 GLU CA C 13 55.4500 0.05 . . . . . . X 40 GLU CA . 36085 1
480 . 1 1 40 40 GLU CB C 13 33.9000 0.05 . . . . . . X 40 GLU CB . 36085 1
481 . 1 1 40 40 GLU CG C 13 37.11 0.05 . . . . . . X 40 GLU CG . 36085 1
482 . 1 1 40 40 GLU N N 15 123.6210 0.05 . . . . . . X 40 GLU N . 36085 1
483 . 1 1 41 41 TYR H H 1 9.3733 0.01 . . . . . . X 41 TYR H . 36085 1
484 . 1 1 41 41 TYR HA H 1 4.4849 0.01 . . . . . . X 41 TYR HA . 36085 1
485 . 1 1 41 41 TYR HB2 H 1 2.5176 0.01 . . . . . . X 41 TYR HB2 . 36085 1
486 . 1 1 41 41 TYR HB3 H 1 3.0544 0.01 . . . . . . X 41 TYR HB3 . 36085 1
487 . 1 1 41 41 TYR HD1 H 1 7.0966 0.01 . . . . . . X 41 TYR HD1 . 36085 1
488 . 1 1 41 41 TYR HE1 H 1 6.7407 0.01 . . . . . . X 41 TYR HE1 . 36085 1
489 . 1 1 41 41 TYR C C 13 174.2900 0.05 . . . . . . X 41 TYR C . 36085 1
490 . 1 1 41 41 TYR CA C 13 58.6500 0.05 . . . . . . X 41 TYR CA . 36085 1
491 . 1 1 41 41 TYR CB C 13 42.1500 0.05 . . . . . . X 41 TYR CB . 36085 1
492 . 1 1 41 41 TYR CD1 C 13 132.491 0.05 . . . . . . X 41 TYR CD1 . 36085 1
493 . 1 1 41 41 TYR CE1 C 13 118.293 0.05 . . . . . . X 41 TYR CE1 . 36085 1
494 . 1 1 41 41 TYR N N 15 126.8180 0.05 . . . . . . X 41 TYR N . 36085 1
495 . 1 1 42 42 VAL H H 1 8.2066 0.01 . . . . . . X 42 VAL H . 36085 1
496 . 1 1 42 42 VAL HA H 1 4.7609 0.01 . . . . . . X 42 VAL HA . 36085 1
497 . 1 1 42 42 VAL HB H 1 1.787 0.01 . . . . . . X 42 VAL HB . 36085 1
498 . 1 1 42 42 VAL HG11 H 1 0.806 0.01 . . . . . . X 42 VAL HG11 . 36085 1
499 . 1 1 42 42 VAL HG12 H 1 0.806 0.01 . . . . . . X 42 VAL HG12 . 36085 1
500 . 1 1 42 42 VAL HG13 H 1 0.806 0.01 . . . . . . X 42 VAL HG13 . 36085 1
501 . 1 1 42 42 VAL HG21 H 1 0.691 0.01 . . . . . . X 42 VAL HG21 . 36085 1
502 . 1 1 42 42 VAL HG22 H 1 0.691 0.01 . . . . . . X 42 VAL HG22 . 36085 1
503 . 1 1 42 42 VAL HG23 H 1 0.691 0.01 . . . . . . X 42 VAL HG23 . 36085 1
504 . 1 1 42 42 VAL C C 13 175.5000 0.05 . . . . . . X 42 VAL C . 36085 1
505 . 1 1 42 42 VAL CA C 13 62.5300 0.05 . . . . . . X 42 VAL CA . 36085 1
506 . 1 1 42 42 VAL CB C 13 34.3200 0.05 . . . . . . X 42 VAL CB . 36085 1
507 . 1 1 42 42 VAL CG1 C 13 21.72 0.05 . . . . . . X 42 VAL CG1 . 36085 1
508 . 1 1 42 42 VAL N N 15 128.2960 0.05 . . . . . . X 42 VAL N . 36085 1
509 . 1 1 43 43 ILE H H 1 9.2885 0.01 . . . . . . X 43 ILE H . 36085 1
510 . 1 1 43 43 ILE HA H 1 4.3526 0.01 . . . . . . X 43 ILE HA . 36085 1
511 . 1 1 43 43 ILE HB H 1 1.9076 0.01 . . . . . . X 43 ILE HB . 36085 1
512 . 1 1 43 43 ILE HG12 H 1 1.282 0.01 . . . . . . X 43 ILE HG12 . 36085 1
513 . 1 1 43 43 ILE HG13 H 1 1.900 0.01 . . . . . . X 43 ILE HG13 . 36085 1
514 . 1 1 43 43 ILE HG21 H 1 1.0787 0.01 . . . . . . X 43 ILE HG21 . 36085 1
515 . 1 1 43 43 ILE HG22 H 1 1.0787 0.01 . . . . . . X 43 ILE HG22 . 36085 1
516 . 1 1 43 43 ILE HG23 H 1 1.0787 0.01 . . . . . . X 43 ILE HG23 . 36085 1
517 . 1 1 43 43 ILE HD11 H 1 1.156 0.01 . . . . . . X 43 ILE HD11 . 36085 1
518 . 1 1 43 43 ILE HD12 H 1 1.156 0.01 . . . . . . X 43 ILE HD12 . 36085 1
519 . 1 1 43 43 ILE HD13 H 1 1.156 0.01 . . . . . . X 43 ILE HD13 . 36085 1
520 . 1 1 43 43 ILE C C 13 174.6100 0.05 . . . . . . X 43 ILE C . 36085 1
521 . 1 1 43 43 ILE CA C 13 61.6500 0.05 . . . . . . X 43 ILE CA . 36085 1
522 . 1 1 43 43 ILE CB C 13 40.9000 0.05 . . . . . . X 43 ILE CB . 36085 1
523 . 1 1 43 43 ILE CG1 C 13 27.91 0.05 . . . . . . X 43 ILE CG1 . 36085 1
524 . 1 1 43 43 ILE CG2 C 13 21.28 0.05 . . . . . . X 43 ILE CG2 . 36085 1
525 . 1 1 43 43 ILE CD1 C 13 15.11 0.05 . . . . . . X 43 ILE CD1 . 36085 1
526 . 1 1 43 43 ILE N N 15 127.4490 0.05 . . . . . . X 43 ILE N . 36085 1
527 . 1 1 44 44 SER H H 1 8.8061 0.01 . . . . . . X 44 SER H . 36085 1
528 . 1 1 44 44 SER HA H 1 5.1691 0.01 . . . . . . X 44 SER HA . 36085 1
529 . 1 1 44 44 SER HB2 H 1 3.668 0.01 . . . . . . X 44 SER HB2 . 36085 1
530 . 1 1 44 44 SER HB3 H 1 3.793 0.01 . . . . . . X 44 SER HB3 . 36085 1
531 . 1 1 44 44 SER C C 13 173.7800 0.05 . . . . . . X 44 SER C . 36085 1
532 . 1 1 44 44 SER CA C 13 57.6400 0.05 . . . . . . X 44 SER CA . 36085 1
533 . 1 1 44 44 SER CB C 13 65.6100 0.05 . . . . . . X 44 SER CB . 36085 1
534 . 1 1 44 44 SER N N 15 122.4450 0.05 . . . . . . X 44 SER N . 36085 1
535 . 1 1 45 45 GLU H H 1 8.2890 0.01 . . . . . . X 45 GLU H . 36085 1
536 . 1 1 45 45 GLU HA H 1 4.1059 0.01 . . . . . . X 45 GLU HA . 36085 1
537 . 1 1 45 45 GLU HB2 H 1 2.074 0.01 . . . . . . X 45 GLU HB2 . 36085 1
538 . 1 1 45 45 GLU HB3 H 1 2.118 0.01 . . . . . . X 45 GLU HB3 . 36085 1
539 . 1 1 45 45 GLU HG2 H 1 2.274 0.01 . . . . . . X 45 GLU HG2 . 36085 1
540 . 1 1 45 45 GLU HG3 H 1 2.387 0.01 . . . . . . X 45 GLU HG3 . 36085 1
541 . 1 1 45 45 GLU C C 13 175.6200 0.05 . . . . . . X 45 GLU C . 36085 1
542 . 1 1 45 45 GLU CA C 13 58.1200 0.05 . . . . . . X 45 GLU CA . 36085 1
543 . 1 1 45 45 GLU CB C 13 31.5100 0.05 . . . . . . X 45 GLU CB . 36085 1
544 . 1 1 45 45 GLU CG C 13 36.82 0.05 . . . . . . X 45 GLU CG . 36085 1
545 . 1 1 45 45 GLU N N 15 123.8970 0.05 . . . . . . X 45 GLU N . 36085 1
546 . 1 1 46 46 SER H H 1 8.3620 0.01 . . . . . . X 46 SER H . 36085 1
547 . 1 1 46 46 SER HA H 1 4.887 0.01 . . . . . . X 46 SER HA . 36085 1
548 . 1 1 46 46 SER HB2 H 1 3.957 0.01 . . . . . . X 46 SER HB2 . 36085 1
549 . 1 1 46 46 SER HB3 H 1 4.107 0.01 . . . . . . X 46 SER HB3 . 36085 1
550 . 1 1 46 46 SER C C 13 173.9300 0.05 . . . . . . X 46 SER C . 36085 1
551 . 1 1 46 46 SER CA C 13 58.1100 0.05 . . . . . . X 46 SER CA . 36085 1
552 . 1 1 46 46 SER CB C 13 66.9300 0.05 . . . . . . X 46 SER CB . 36085 1
553 . 1 1 46 46 SER N N 15 119.1600 0.05 . . . . . . X 46 SER N . 36085 1
554 . 1 1 47 47 GLU HA H 1 4.001 0.01 . . . . . . X 47 GLU HA . 36085 1
555 . 1 1 47 47 GLU HB2 H 1 1.971 0.01 . . . . . . X 47 GLU HB2 . 36085 1
556 . 1 1 47 47 GLU HB3 H 1 1.971 0.01 . . . . . . X 47 GLU HB3 . 36085 1
557 . 1 1 47 47 GLU C C 13 176.8500 0.05 . . . . . . X 47 GLU C . 36085 1
558 . 1 1 47 47 GLU CA C 13 59.9400 0.05 . . . . . . X 47 GLU CA . 36085 1
559 . 1 1 47 47 GLU CB C 13 30.2100 0.05 . . . . . . X 47 GLU CB . 36085 1
560 . 1 1 48 48 ASN H H 1 8.2945 0.01 . . . . . . X 48 ASN H . 36085 1
561 . 1 1 48 48 ASN HA H 1 4.7699 0.01 . . . . . . X 48 ASN HA . 36085 1
562 . 1 1 48 48 ASN HB2 H 1 2.8006 0.01 . . . . . . X 48 ASN HB2 . 36085 1
563 . 1 1 48 48 ASN HB3 H 1 2.8006 0.01 . . . . . . X 48 ASN HB3 . 36085 1
564 . 1 1 48 48 ASN HD21 H 1 7.600 0.01 . . . . . . X 48 ASN HD21 . 36085 1
565 . 1 1 48 48 ASN HD22 H 1 6.921 0.01 . . . . . . X 48 ASN HD22 . 36085 1
566 . 1 1 48 48 ASN C C 13 174.5000 0.05 . . . . . . X 48 ASN C . 36085 1
567 . 1 1 48 48 ASN CA C 13 54.0700 0.05 . . . . . . X 48 ASN CA . 36085 1
568 . 1 1 48 48 ASN CB C 13 40.3800 0.05 . . . . . . X 48 ASN CB . 36085 1
569 . 1 1 48 48 ASN N N 15 113.2790 0.05 . . . . . . X 48 ASN N . 36085 1
570 . 1 1 48 48 ASN ND2 N 15 112.85 0.05 . . . . . . X 48 ASN ND2 . 36085 1
571 . 1 1 49 49 GLU H H 1 7.3743 0.01 . . . . . . X 49 GLU H . 36085 1
572 . 1 1 49 49 GLU HA H 1 4.584 0.01 . . . . . . X 49 GLU HA . 36085 1
573 . 1 1 49 49 GLU HB2 H 1 1.789 0.01 . . . . . . X 49 GLU HB2 . 36085 1
574 . 1 1 49 49 GLU HB3 H 1 1.847 0.01 . . . . . . X 49 GLU HB3 . 36085 1
575 . 1 1 49 49 GLU HG2 H 1 2.1183 0.01 . . . . . . X 49 GLU HG2 . 36085 1
576 . 1 1 49 49 GLU HG3 H 1 2.1183 0.01 . . . . . . X 49 GLU HG3 . 36085 1
577 . 1 1 49 49 GLU C C 13 173.8700 0.05 . . . . . . X 49 GLU C . 36085 1
578 . 1 1 49 49 GLU CA C 13 57.0400 0.05 . . . . . . X 49 GLU CA . 36085 1
579 . 1 1 49 49 GLU CB C 13 34.0900 0.05 . . . . . . X 49 GLU CB . 36085 1
580 . 1 1 49 49 GLU CG C 13 37.57 0.05 . . . . . . X 49 GLU CG . 36085 1
581 . 1 1 49 49 GLU N N 15 120.2100 0.05 . . . . . . X 49 GLU N . 36085 1
582 . 1 1 50 50 SER H H 1 8.8880 0.01 . . . . . . X 50 SER H . 36085 1
583 . 1 1 50 50 SER HA H 1 4.665 0.01 . . . . . . X 50 SER HA . 36085 1
584 . 1 1 50 50 SER HB2 H 1 3.999 0.01 . . . . . . X 50 SER HB2 . 36085 1
585 . 1 1 50 50 SER HB3 H 1 3.999 0.01 . . . . . . X 50 SER HB3 . 36085 1
586 . 1 1 50 50 SER C C 13 174.7300 0.05 . . . . . . X 50 SER C . 36085 1
587 . 1 1 50 50 SER CA C 13 57.7900 0.05 . . . . . . X 50 SER CA . 36085 1
588 . 1 1 50 50 SER CB C 13 66.7500 0.05 . . . . . . X 50 SER CB . 36085 1
589 . 1 1 50 50 SER N N 15 121.2330 0.05 . . . . . . X 50 SER N . 36085 1
590 . 1 1 51 51 ILE H H 1 8.9361 0.01 . . . . . . X 51 ILE H . 36085 1
591 . 1 1 51 51 ILE HA H 1 3.4958 0.01 . . . . . . X 51 ILE HA . 36085 1
592 . 1 1 51 51 ILE HB H 1 1.7430 0.01 . . . . . . X 51 ILE HB . 36085 1
593 . 1 1 51 51 ILE HG12 H 1 0.863 0.01 . . . . . . X 51 ILE HG12 . 36085 1
594 . 1 1 51 51 ILE HG13 H 1 1.659 0.01 . . . . . . X 51 ILE HG13 . 36085 1
595 . 1 1 51 51 ILE HG21 H 1 0.743 0.01 . . . . . . X 51 ILE HG21 . 36085 1
596 . 1 1 51 51 ILE HG22 H 1 0.743 0.01 . . . . . . X 51 ILE HG22 . 36085 1
597 . 1 1 51 51 ILE HG23 H 1 0.743 0.01 . . . . . . X 51 ILE HG23 . 36085 1
598 . 1 1 51 51 ILE HD11 H 1 0.747 0.01 . . . . . . X 51 ILE HD11 . 36085 1
599 . 1 1 51 51 ILE HD12 H 1 0.747 0.01 . . . . . . X 51 ILE HD12 . 36085 1
600 . 1 1 51 51 ILE HD13 H 1 0.747 0.01 . . . . . . X 51 ILE HD13 . 36085 1
601 . 1 1 51 51 ILE C C 13 177.5800 0.05 . . . . . . X 51 ILE C . 36085 1
602 . 1 1 51 51 ILE CA C 13 66.4300 0.05 . . . . . . X 51 ILE CA . 36085 1
603 . 1 1 51 51 ILE CB C 13 38.4300 0.05 . . . . . . X 51 ILE CB . 36085 1
604 . 1 1 51 51 ILE CG1 C 13 30.89 0.05 . . . . . . X 51 ILE CG1 . 36085 1
605 . 1 1 51 51 ILE CG2 C 13 18.72 0.05 . . . . . . X 51 ILE CG2 . 36085 1
606 . 1 1 51 51 ILE CD1 C 13 14.39 0.05 . . . . . . X 51 ILE CD1 . 36085 1
607 . 1 1 51 51 ILE N N 15 120.2680 0.05 . . . . . . X 51 ILE N . 36085 1
608 . 1 1 52 52 VAL H H 1 7.9199 0.01 . . . . . . X 52 VAL H . 36085 1
609 . 1 1 52 52 VAL HA H 1 3.429 0.01 . . . . . . X 52 VAL HA . 36085 1
610 . 1 1 52 52 VAL HB H 1 1.892 0.01 . . . . . . X 52 VAL HB . 36085 1
611 . 1 1 52 52 VAL HG11 H 1 0.900 0.01 . . . . . . X 52 VAL HG11 . 36085 1
612 . 1 1 52 52 VAL HG12 H 1 0.900 0.01 . . . . . . X 52 VAL HG12 . 36085 1
613 . 1 1 52 52 VAL HG13 H 1 0.900 0.01 . . . . . . X 52 VAL HG13 . 36085 1
614 . 1 1 52 52 VAL HG21 H 1 0.844 0.01 . . . . . . X 52 VAL HG21 . 36085 1
615 . 1 1 52 52 VAL HG22 H 1 0.844 0.01 . . . . . . X 52 VAL HG22 . 36085 1
616 . 1 1 52 52 VAL HG23 H 1 0.844 0.01 . . . . . . X 52 VAL HG23 . 36085 1
617 . 1 1 52 52 VAL C C 13 177.4700 0.05 . . . . . . X 52 VAL C . 36085 1
618 . 1 1 52 52 VAL CA C 13 68.0100 0.05 . . . . . . X 52 VAL CA . 36085 1
619 . 1 1 52 52 VAL CB C 13 32.6300 0.05 . . . . . . X 52 VAL CB . 36085 1
620 . 1 1 52 52 VAL CG1 C 13 22.51 0.05 . . . . . . X 52 VAL CG1 . 36085 1
621 . 1 1 52 52 VAL N N 15 117.1440 0.05 . . . . . . X 52 VAL N . 36085 1
622 . 1 1 53 53 GLU H H 1 7.6729 0.01 . . . . . . X 53 GLU H . 36085 1
623 . 1 1 53 53 GLU HA H 1 3.8883 0.01 . . . . . . X 53 GLU HA . 36085 1
624 . 1 1 53 53 GLU HB2 H 1 2.1440 0.01 . . . . . . X 53 GLU HB2 . 36085 1
625 . 1 1 53 53 GLU HB3 H 1 2.2665 0.01 . . . . . . X 53 GLU HB3 . 36085 1
626 . 1 1 53 53 GLU HG2 H 1 2.309 0.01 . . . . . . X 53 GLU HG2 . 36085 1
627 . 1 1 53 53 GLU C C 13 180.1700 0.05 . . . . . . X 53 GLU C . 36085 1
628 . 1 1 53 53 GLU CA C 13 60.6500 0.05 . . . . . . X 53 GLU CA . 36085 1
629 . 1 1 53 53 GLU CB C 13 30.3200 0.05 . . . . . . X 53 GLU CB . 36085 1
630 . 1 1 53 53 GLU CG C 13 38.122 0.05 . . . . . . X 53 GLU CG . 36085 1
631 . 1 1 53 53 GLU N N 15 118.4230 0.05 . . . . . . X 53 GLU N . 36085 1
632 . 1 1 54 54 LYS H H 1 8.5618 0.01 . . . . . . X 54 LYS H . 36085 1
633 . 1 1 54 54 LYS HA H 1 3.953 0.01 . . . . . . X 54 LYS HA . 36085 1
634 . 1 1 54 54 LYS HB2 H 1 1.743 0.01 . . . . . . X 54 LYS HB2 . 36085 1
635 . 1 1 54 54 LYS HB3 H 1 1.880 0.01 . . . . . . X 54 LYS HB3 . 36085 1
636 . 1 1 54 54 LYS HG2 H 1 1.319 0.01 . . . . . . X 54 LYS HG2 . 36085 1
637 . 1 1 54 54 LYS HG3 H 1 1.610 0.01 . . . . . . X 54 LYS HG3 . 36085 1
638 . 1 1 54 54 LYS HD2 H 1 1.652 0.01 . . . . . . X 54 LYS HD2 . 36085 1
639 . 1 1 54 54 LYS HD3 H 1 1.652 0.01 . . . . . . X 54 LYS HD3 . 36085 1
640 . 1 1 54 54 LYS HE2 H 1 2.950 0.01 . . . . . . X 54 LYS HE2 . 36085 1
641 . 1 1 54 54 LYS HE3 H 1 3.046 0.01 . . . . . . X 54 LYS HE3 . 36085 1
642 . 1 1 54 54 LYS C C 13 179.2900 0.05 . . . . . . X 54 LYS C . 36085 1
643 . 1 1 54 54 LYS CA C 13 60.5800 0.05 . . . . . . X 54 LYS CA . 36085 1
644 . 1 1 54 54 LYS CB C 13 34.0500 0.05 . . . . . . X 54 LYS CB . 36085 1
645 . 1 1 54 54 LYS CG C 13 26.86 0.05 . . . . . . X 54 LYS CG . 36085 1
646 . 1 1 54 54 LYS CD C 13 30.285 0.05 . . . . . . X 54 LYS CD . 36085 1
647 . 1 1 54 54 LYS CE C 13 43.290 0.05 . . . . . . X 54 LYS CE . 36085 1
648 . 1 1 54 54 LYS N N 15 120.0400 0.05 . . . . . . X 54 LYS N . 36085 1
649 . 1 1 55 55 PHE H H 1 8.8743 0.01 . . . . . . X 55 PHE H . 36085 1
650 . 1 1 55 55 PHE HA H 1 3.853 0.01 . . . . . . X 55 PHE HA . 36085 1
651 . 1 1 55 55 PHE HB2 H 1 2.896 0.01 . . . . . . X 55 PHE HB2 . 36085 1
652 . 1 1 55 55 PHE HB3 H 1 3.549 0.01 . . . . . . X 55 PHE HB3 . 36085 1
653 . 1 1 55 55 PHE HD1 H 1 6.8898 0.01 . . . . . . X 55 PHE HD1 . 36085 1
654 . 1 1 55 55 PHE HE1 H 1 6.8234 0.01 . . . . . . X 55 PHE HE1 . 36085 1
655 . 1 1 55 55 PHE C C 13 176.3800 0.05 . . . . . . X 55 PHE C . 36085 1
656 . 1 1 55 55 PHE CA C 13 62.9800 0.05 . . . . . . X 55 PHE CA . 36085 1
657 . 1 1 55 55 PHE CB C 13 40.3600 0.05 . . . . . . X 55 PHE CB . 36085 1
658 . 1 1 55 55 PHE CD1 C 13 131.488 0.05 . . . . . . X 55 PHE CD1 . 36085 1
659 . 1 1 55 55 PHE CE1 C 13 131.555 0.05 . . . . . . X 55 PHE CE1 . 36085 1
660 . 1 1 55 55 PHE N N 15 122.4750 0.05 . . . . . . X 55 PHE N . 36085 1
661 . 1 1 56 56 ILE H H 1 8.4778 0.01 . . . . . . X 56 ILE H . 36085 1
662 . 1 1 56 56 ILE HA H 1 3.607 0.01 . . . . . . X 56 ILE HA . 36085 1
663 . 1 1 56 56 ILE HB H 1 1.984 0.01 . . . . . . X 56 ILE HB . 36085 1
664 . 1 1 56 56 ILE HG12 H 1 1.254 0.01 . . . . . . X 56 ILE HG12 . 36085 1
665 . 1 1 56 56 ILE HG13 H 1 2.007 0.01 . . . . . . X 56 ILE HG13 . 36085 1
666 . 1 1 56 56 ILE HG21 H 1 0.954 0.01 . . . . . . X 56 ILE HG21 . 36085 1
667 . 1 1 56 56 ILE HG22 H 1 0.954 0.01 . . . . . . X 56 ILE HG22 . 36085 1
668 . 1 1 56 56 ILE HG23 H 1 0.954 0.01 . . . . . . X 56 ILE HG23 . 36085 1
669 . 1 1 56 56 ILE HD11 H 1 0.930 0.01 . . . . . . X 56 ILE HD11 . 36085 1
670 . 1 1 56 56 ILE HD12 H 1 0.930 0.01 . . . . . . X 56 ILE HD12 . 36085 1
671 . 1 1 56 56 ILE HD13 H 1 0.930 0.01 . . . . . . X 56 ILE HD13 . 36085 1
672 . 1 1 56 56 ILE C C 13 177.9700 0.05 . . . . . . X 56 ILE C . 36085 1
673 . 1 1 56 56 ILE CA C 13 65.9740 0.05 . . . . . . X 56 ILE CA . 36085 1
674 . 1 1 56 56 ILE CB C 13 38.5800 0.05 . . . . . . X 56 ILE CB . 36085 1
675 . 1 1 56 56 ILE CG1 C 13 29.99 0.05 . . . . . . X 56 ILE CG1 . 36085 1
676 . 1 1 56 56 ILE CG2 C 13 18.40 0.05 . . . . . . X 56 ILE CG2 . 36085 1
677 . 1 1 56 56 ILE CD1 C 13 14.15 0.05 . . . . . . X 56 ILE CD1 . 36085 1
678 . 1 1 56 56 ILE N N 15 119.0930 0.05 . . . . . . X 56 ILE N . 36085 1
679 . 1 1 57 57 SER H H 1 8.0716 0.01 . . . . . . X 57 SER H . 36085 1
680 . 1 1 57 57 SER HA H 1 3.996 0.01 . . . . . . X 57 SER HA . 36085 1
681 . 1 1 57 57 SER HB2 H 1 3.849 0.01 . . . . . . X 57 SER HB2 . 36085 1
682 . 1 1 57 57 SER HB3 H 1 3.909 0.01 . . . . . . X 57 SER HB3 . 36085 1
683 . 1 1 57 57 SER C C 13 177.9700 0.05 . . . . . . X 57 SER C . 36085 1
684 . 1 1 57 57 SER CA C 13 62.3700 0.05 . . . . . . X 57 SER CA . 36085 1
685 . 1 1 57 57 SER CB C 13 63.7700 0.05 . . . . . . X 57 SER CB . 36085 1
686 . 1 1 57 57 SER N N 15 112.2540 0.05 . . . . . . X 57 SER N . 36085 1
687 . 1 1 58 58 ALA H H 1 7.9071 0.01 . . . . . . X 58 ALA H . 36085 1
688 . 1 1 58 58 ALA HA H 1 3.8828 0.01 . . . . . . X 58 ALA HA . 36085 1
689 . 1 1 58 58 ALA HB1 H 1 0.574 0.01 . . . . . . X 58 ALA HB1 . 36085 1
690 . 1 1 58 58 ALA HB2 H 1 0.574 0.01 . . . . . . X 58 ALA HB2 . 36085 1
691 . 1 1 58 58 ALA HB3 H 1 0.574 0.01 . . . . . . X 58 ALA HB3 . 36085 1
692 . 1 1 58 58 ALA C C 13 180.4800 0.05 . . . . . . X 58 ALA C . 36085 1
693 . 1 1 58 58 ALA CA C 13 54.89 0.05 . . . . . . X 58 ALA CA . 36085 1
694 . 1 1 58 58 ALA CB C 13 18.6100 0.05 . . . . . . X 58 ALA CB . 36085 1
695 . 1 1 58 58 ALA N N 15 121.1260 0.05 . . . . . . X 58 ALA N . 36085 1
696 . 1 1 59 59 PHE H H 1 7.3312 0.01 . . . . . . X 59 PHE H . 36085 1
697 . 1 1 59 59 PHE HA H 1 4.760 0.01 . . . . . . X 59 PHE HA . 36085 1
698 . 1 1 59 59 PHE HB2 H 1 1.6983 0.01 . . . . . . X 59 PHE HB2 . 36085 1
699 . 1 1 59 59 PHE HB3 H 1 2.491 0.01 . . . . . . X 59 PHE HB3 . 36085 1
700 . 1 1 59 59 PHE HD1 H 1 6.2862 0.01 . . . . . . X 59 PHE HD1 . 36085 1
701 . 1 1 59 59 PHE C C 13 178.2900 0.05 . . . . . . X 59 PHE C . 36085 1
702 . 1 1 59 59 PHE CA C 13 59.3200 0.05 . . . . . . X 59 PHE CA . 36085 1
703 . 1 1 59 59 PHE CB C 13 40.7700 0.05 . . . . . . X 59 PHE CB . 36085 1
704 . 1 1 59 59 PHE CD1 C 13 128.8089 0.05 . . . . . . X 59 PHE CD1 . 36085 1
705 . 1 1 59 59 PHE N N 15 111.5140 0.05 . . . . . . X 59 PHE N . 36085 1
706 . 1 1 60 60 LYS H H 1 8.3784 0.01 . . . . . . X 60 LYS H . 36085 1
707 . 1 1 60 60 LYS HA H 1 4.428 0.01 . . . . . . X 60 LYS HA . 36085 1
708 . 1 1 60 60 LYS HB2 H 1 1.993 0.01 . . . . . . X 60 LYS HB2 . 36085 1
709 . 1 1 60 60 LYS HB3 H 1 1.993 0.01 . . . . . . X 60 LYS HB3 . 36085 1
710 . 1 1 60 60 LYS HG2 H 1 1.162 0.01 . . . . . . X 60 LYS HG2 . 36085 1
711 . 1 1 60 60 LYS HG3 H 1 1.518 0.01 . . . . . . X 60 LYS HG3 . 36085 1
712 . 1 1 60 60 LYS HD2 H 1 1.600 0.01 . . . . . . X 60 LYS HD2 . 36085 1
713 . 1 1 60 60 LYS HD3 H 1 1.600 0.01 . . . . . . X 60 LYS HD3 . 36085 1
714 . 1 1 60 60 LYS HE2 H 1 2.923 0.01 . . . . . . X 60 LYS HE2 . 36085 1
715 . 1 1 60 60 LYS HE3 H 1 2.923 0.01 . . . . . . X 60 LYS HE3 . 36085 1
716 . 1 1 60 60 LYS C C 13 177.2300 0.05 . . . . . . X 60 LYS C . 36085 1
717 . 1 1 60 60 LYS CA C 13 60.4100 0.05 . . . . . . X 60 LYS CA . 36085 1
718 . 1 1 60 60 LYS CB C 13 31.6600 0.05 . . . . . . X 60 LYS CB . 36085 1
719 . 1 1 60 60 LYS CG C 13 23.95 0.05 . . . . . . X 60 LYS CG . 36085 1
720 . 1 1 60 60 LYS CD C 13 30.69 0.05 . . . . . . X 60 LYS CD . 36085 1
721 . 1 1 60 60 LYS CE C 13 42.87 0.05 . . . . . . X 60 LYS CE . 36085 1
722 . 1 1 60 60 LYS N N 15 120.3860 0.05 . . . . . . X 60 LYS N . 36085 1
723 . 1 1 61 61 ASN H H 1 8.2860 0.01 . . . . . . X 61 ASN H . 36085 1
724 . 1 1 61 61 ASN HA H 1 4.898 0.01 . . . . . . X 61 ASN HA . 36085 1
725 . 1 1 61 61 ASN HB2 H 1 2.658 0.01 . . . . . . X 61 ASN HB2 . 36085 1
726 . 1 1 61 61 ASN HB3 H 1 2.931 0.01 . . . . . . X 61 ASN HB3 . 36085 1
727 . 1 1 61 61 ASN HD21 H 1 7.6492 0.01 . . . . . . X 61 ASN HD21 . 36085 1
728 . 1 1 61 61 ASN HD22 H 1 6.9383 0.01 . . . . . . X 61 ASN HD22 . 36085 1
729 . 1 1 61 61 ASN C C 13 175.8400 0.05 . . . . . . X 61 ASN C . 36085 1
730 . 1 1 61 61 ASN CA C 13 53.9000 0.05 . . . . . . X 61 ASN CA . 36085 1
731 . 1 1 61 61 ASN CB C 13 39.7400 0.05 . . . . . . X 61 ASN CB . 36085 1
732 . 1 1 61 61 ASN N N 15 116.1550 0.05 . . . . . . X 61 ASN N . 36085 1
733 . 1 1 61 61 ASN ND2 N 15 114.174 0.05 . . . . . . X 61 ASN ND2 . 36085 1
734 . 1 1 62 62 GLY H H 1 7.7196 0.01 . . . . . . X 62 GLY H . 36085 1
735 . 1 1 62 62 GLY HA2 H 1 3.650 0.01 . . . . . . X 62 GLY HA2 . 36085 1
736 . 1 1 62 62 GLY HA3 H 1 4.259 0.01 . . . . . . X 62 GLY HA3 . 36085 1
737 . 1 1 62 62 GLY C C 13 173.6200 0.05 . . . . . . X 62 GLY C . 36085 1
738 . 1 1 62 62 GLY CA C 13 45.9400 0.05 . . . . . . X 62 GLY CA . 36085 1
739 . 1 1 62 62 GLY N N 15 107.5430 0.05 . . . . . . X 62 GLY N . 36085 1
740 . 1 1 63 63 TRP H H 1 8.9605 0.01 . . . . . . X 63 TRP H . 36085 1
741 . 1 1 63 63 TRP HA H 1 4.112 0.01 . . . . . . X 63 TRP HA . 36085 1
742 . 1 1 63 63 TRP HB2 H 1 3.163 0.01 . . . . . . X 63 TRP HB2 . 36085 1
743 . 1 1 63 63 TRP HB3 H 1 3.437 0.01 . . . . . . X 63 TRP HB3 . 36085 1
744 . 1 1 63 63 TRP HD1 H 1 6.5846 0.01 . . . . . . X 63 TRP HD1 . 36085 1
745 . 1 1 63 63 TRP HE1 H 1 10.385 0.01 . . . . . . X 63 TRP HE1 . 36085 1
746 . 1 1 63 63 TRP HE3 H 1 7.6710 0.01 . . . . . . X 63 TRP HE3 . 36085 1
747 . 1 1 63 63 TRP HZ2 H 1 6.8767 0.01 . . . . . . X 63 TRP HZ2 . 36085 1
748 . 1 1 63 63 TRP HZ3 H 1 7.1271 0.01 . . . . . . X 63 TRP HZ3 . 36085 1
749 . 1 1 63 63 TRP HH2 H 1 7.1567 0.01 . . . . . . X 63 TRP HH2 . 36085 1
750 . 1 1 63 63 TRP C C 13 175.4100 0.05 . . . . . . X 63 TRP C . 36085 1
751 . 1 1 63 63 TRP CA C 13 59.2700 0.05 . . . . . . X 63 TRP CA . 36085 1
752 . 1 1 63 63 TRP CB C 13 29.1200 0.05 . . . . . . X 63 TRP CB . 36085 1
753 . 1 1 63 63 TRP CD1 C 13 125.789 0.05 . . . . . . X 63 TRP CD1 . 36085 1
754 . 1 1 63 63 TRP CE3 C 13 121.597 0.05 . . . . . . X 63 TRP CE3 . 36085 1
755 . 1 1 63 63 TRP CZ2 C 13 113.864 0.05 . . . . . . X 63 TRP CZ2 . 36085 1
756 . 1 1 63 63 TRP CZ3 C 13 123.910 0.05 . . . . . . X 63 TRP CZ3 . 36085 1
757 . 1 1 63 63 TRP CH2 C 13 126.116 0.05 . . . . . . X 63 TRP CH2 . 36085 1
758 . 1 1 63 63 TRP N N 15 119.4600 0.05 . . . . . . X 63 TRP N . 36085 1
759 . 1 1 63 63 TRP NE1 N 15 134.234 0.05 . . . . . . X 63 TRP NE1 . 36085 1
760 . 1 1 64 64 ASN H H 1 5.9471 0.01 . . . . . . X 64 ASN H . 36085 1
761 . 1 1 64 64 ASN HA H 1 4.196 0.01 . . . . . . X 64 ASN HA . 36085 1
762 . 1 1 64 64 ASN HB2 H 1 2.616 0.01 . . . . . . X 64 ASN HB2 . 36085 1
763 . 1 1 64 64 ASN HB3 H 1 3.054 0.01 . . . . . . X 64 ASN HB3 . 36085 1
764 . 1 1 64 64 ASN HD21 H 1 7.6900 0.01 . . . . . . X 64 ASN HD21 . 36085 1
765 . 1 1 64 64 ASN HD22 H 1 7.2927 0.01 . . . . . . X 64 ASN HD22 . 36085 1
766 . 1 1 64 64 ASN C C 13 174.4100 0.05 . . . . . . X 64 ASN C . 36085 1
767 . 1 1 64 64 ASN CA C 13 53.2200 0.05 . . . . . . X 64 ASN CA . 36085 1
768 . 1 1 64 64 ASN CB C 13 38.1700 0.05 . . . . . . X 64 ASN CB . 36085 1
769 . 1 1 64 64 ASN N N 15 127.0360 0.05 . . . . . . X 64 ASN N . 36085 1
770 . 1 1 64 64 ASN ND2 N 15 112.894 0.05 . . . . . . X 64 ASN ND2 . 36085 1
771 . 1 1 65 65 GLN HA H 1 0.403 0.01 . . . . . . X 65 GLN HA . 36085 1
772 . 1 1 65 65 GLN HB2 H 1 1.542 0.01 . . . . . . X 65 GLN HB2 . 36085 1
773 . 1 1 65 65 GLN HB3 H 1 1.691 0.01 . . . . . . X 65 GLN HB3 . 36085 1
774 . 1 1 65 65 GLN HG2 H 1 1.444 0.01 . . . . . . X 65 GLN HG2 . 36085 1
775 . 1 1 65 65 GLN HG3 H 1 1.541 0.01 . . . . . . X 65 GLN HG3 . 36085 1
776 . 1 1 65 65 GLN HE21 H 1 7.1774 0.01 . . . . . . X 65 GLN HE21 . 36085 1
777 . 1 1 65 65 GLN HE22 H 1 6.6850 0.01 . . . . . . X 65 GLN HE22 . 36085 1
778 . 1 1 65 65 GLN C C 13 174.6800 0.05 . . . . . . X 65 GLN C . 36085 1
779 . 1 1 65 65 GLN CA C 13 57.4700 0.05 . . . . . . X 65 GLN CA . 36085 1
780 . 1 1 65 65 GLN CB C 13 25.957 0.05 . . . . . . X 65 GLN CB . 36085 1
781 . 1 1 65 65 GLN CG C 13 34.75 0.05 . . . . . . X 65 GLN CG . 36085 1
782 . 1 1 65 65 GLN NE2 N 15 112.177 0.05 . . . . . . X 65 GLN NE2 . 36085 1
783 . 1 1 66 66 GLU H H 1 6.5632 0.01 . . . . . . X 66 GLU H . 36085 1
784 . 1 1 66 66 GLU HA H 1 3.638 0.01 . . . . . . X 66 GLU HA . 36085 1
785 . 1 1 66 66 GLU HB2 H 1 1.488 0.01 . . . . . . X 66 GLU HB2 . 36085 1
786 . 1 1 66 66 GLU HB3 H 1 1.570 0.01 . . . . . . X 66 GLU HB3 . 36085 1
787 . 1 1 66 66 GLU HG2 H 1 1.366 0.01 . . . . . . X 66 GLU HG2 . 36085 1
788 . 1 1 66 66 GLU HG3 H 1 1.663 0.01 . . . . . . X 66 GLU HG3 . 36085 1
789 . 1 1 66 66 GLU C C 13 176.5500 0.05 . . . . . . X 66 GLU C . 36085 1
790 . 1 1 66 66 GLU CA C 13 60.7400 0.05 . . . . . . X 66 GLU CA . 36085 1
791 . 1 1 66 66 GLU CB C 13 30.6900 0.05 . . . . . . X 66 GLU CB . 36085 1
792 . 1 1 66 66 GLU CG C 13 36.60 0.05 . . . . . . X 66 GLU CG . 36085 1
793 . 1 1 66 66 GLU N N 15 119.4150 0.05 . . . . . . X 66 GLU N . 36085 1
794 . 1 1 67 67 TYR H H 1 9.0178 0.01 . . . . . . X 67 TYR H . 36085 1
795 . 1 1 67 67 TYR HA H 1 5.056 0.01 . . . . . . X 67 TYR HA . 36085 1
796 . 1 1 67 67 TYR HB2 H 1 2.857 0.01 . . . . . . X 67 TYR HB2 . 36085 1
797 . 1 1 67 67 TYR HB3 H 1 3.321 0.01 . . . . . . X 67 TYR HB3 . 36085 1
798 . 1 1 67 67 TYR HD1 H 1 7.3267 0.01 . . . . . . X 67 TYR HD1 . 36085 1
799 . 1 1 67 67 TYR HE1 H 1 6.850 0.01 . . . . . . X 67 TYR HE1 . 36085 1
800 . 1 1 67 67 TYR C C 13 177.6400 0.05 . . . . . . X 67 TYR C . 36085 1
801 . 1 1 67 67 TYR CA C 13 57.5300 0.05 . . . . . . X 67 TYR CA . 36085 1
802 . 1 1 67 67 TYR CB C 13 39.5500 0.05 . . . . . . X 67 TYR CB . 36085 1
803 . 1 1 67 67 TYR CD1 C 13 133.768 0.05 . . . . . . X 67 TYR CD1 . 36085 1
804 . 1 1 67 67 TYR CE1 C 13 118.251 0.05 . . . . . . X 67 TYR CE1 . 36085 1
805 . 1 1 67 67 TYR N N 15 117.2100 0.05 . . . . . . X 67 TYR N . 36085 1
806 . 1 1 68 68 GLU H H 1 9.5251 0.01 . . . . . . X 68 GLU H . 36085 1
807 . 1 1 68 68 GLU HA H 1 4.156 0.01 . . . . . . X 68 GLU HA . 36085 1
808 . 1 1 68 68 GLU HB2 H 1 2.143 0.01 . . . . . . X 68 GLU HB2 . 36085 1
809 . 1 1 68 68 GLU HB3 H 1 2.143 0.01 . . . . . . X 68 GLU HB3 . 36085 1
810 . 1 1 68 68 GLU HG2 H 1 2.442 0.01 . . . . . . X 68 GLU HG2 . 36085 1
811 . 1 1 68 68 GLU HG3 H 1 2.489 0.01 . . . . . . X 68 GLU HG3 . 36085 1
812 . 1 1 68 68 GLU C C 13 178.0900 0.05 . . . . . . X 68 GLU C . 36085 1
813 . 1 1 68 68 GLU CA C 13 60.9900 0.05 . . . . . . X 68 GLU CA . 36085 1
814 . 1 1 68 68 GLU CB C 13 30.4600 0.05 . . . . . . X 68 GLU CB . 36085 1
815 . 1 1 68 68 GLU CG C 13 37.39 0.05 . . . . . . X 68 GLU CG . 36085 1
816 . 1 1 68 68 GLU N N 15 127.2950 0.05 . . . . . . X 68 GLU N . 36085 1
817 . 1 1 69 69 ASP H H 1 8.9388 0.01 . . . . . . X 69 ASP H . 36085 1
818 . 1 1 69 69 ASP HA H 1 4.5591 0.01 . . . . . . X 69 ASP HA . 36085 1
819 . 1 1 69 69 ASP HB2 H 1 2.732 0.01 . . . . . . X 69 ASP HB2 . 36085 1
820 . 1 1 69 69 ASP HB3 H 1 2.787 0.01 . . . . . . X 69 ASP HB3 . 36085 1
821 . 1 1 69 69 ASP C C 13 176.8100 0.05 . . . . . . X 69 ASP C . 36085 1
822 . 1 1 69 69 ASP CA C 13 55.9500 0.05 . . . . . . X 69 ASP CA . 36085 1
823 . 1 1 69 69 ASP CB C 13 40.3200 0.05 . . . . . . X 69 ASP CB . 36085 1
824 . 1 1 69 69 ASP N N 15 116.6470 0.05 . . . . . . X 69 ASP N . 36085 1
825 . 1 1 70 70 GLU H H 1 7.9500 0.01 . . . . . . X 70 GLU H . 36085 1
826 . 1 1 70 70 GLU HA H 1 4.626 0.01 . . . . . . X 70 GLU HA . 36085 1
827 . 1 1 70 70 GLU HB2 H 1 2.733 0.01 . . . . . . X 70 GLU HB2 . 36085 1
828 . 1 1 70 70 GLU HB3 H 1 2.906 0.01 . . . . . . X 70 GLU HB3 . 36085 1
829 . 1 1 70 70 GLU HG2 H 1 2.184 0.01 . . . . . . X 70 GLU HG2 . 36085 1
830 . 1 1 70 70 GLU HG3 H 1 2.556 0.01 . . . . . . X 70 GLU HG3 . 36085 1
831 . 1 1 70 70 GLU C C 13 175.8300 0.05 . . . . . . X 70 GLU C . 36085 1
832 . 1 1 70 70 GLU CA C 13 56.6100 0.05 . . . . . . X 70 GLU CA . 36085 1
833 . 1 1 70 70 GLU CB C 13 32.0500 0.05 . . . . . . X 70 GLU CB . 36085 1
834 . 1 1 70 70 GLU CG C 13 37.70 0.05 . . . . . . X 70 GLU CG . 36085 1
835 . 1 1 70 70 GLU N N 15 117.4200 0.05 . . . . . . X 70 GLU N . 36085 1
836 . 1 1 71 71 GLU H H 1 6.9830 0.01 . . . . . . X 71 GLU H . 36085 1
837 . 1 1 71 71 GLU HA H 1 2.337 0.01 . . . . . . X 71 GLU HA . 36085 1
838 . 1 1 71 71 GLU HB2 H 1 -0.095 0.01 . . . . . . X 71 GLU HB2 . 36085 1
839 . 1 1 71 71 GLU HB3 H 1 1.353 0.01 . . . . . . X 71 GLU HB3 . 36085 1
840 . 1 1 71 71 GLU HG2 H 1 1.356 0.01 . . . . . . X 71 GLU HG2 . 36085 1
841 . 1 1 71 71 GLU HG3 H 1 1.652 0.01 . . . . . . X 71 GLU HG3 . 36085 1
842 . 1 1 71 71 GLU C C 13 176.8500 0.05 . . . . . . X 71 GLU C . 36085 1
843 . 1 1 71 71 GLU CA C 13 60.95 0.05 . . . . . . X 71 GLU CA . 36085 1
844 . 1 1 71 71 GLU CB C 13 29.6100 0.05 . . . . . . X 71 GLU CB . 36085 1
845 . 1 1 71 71 GLU CG C 13 35.84 0.05 . . . . . . X 71 GLU CG . 36085 1
846 . 1 1 71 71 GLU N N 15 122.9390 0.05 . . . . . . X 71 GLU N . 36085 1
847 . 1 1 72 72 GLU H H 1 8.2413 0.01 . . . . . . X 72 GLU H . 36085 1
848 . 1 1 72 72 GLU HA H 1 3.8815 0.01 . . . . . . X 72 GLU HA . 36085 1
849 . 1 1 72 72 GLU HB2 H 1 2.0230 0.01 . . . . . . X 72 GLU HB2 . 36085 1
850 . 1 1 72 72 GLU HB3 H 1 2.0230 0.01 . . . . . . X 72 GLU HB3 . 36085 1
851 . 1 1 72 72 GLU HG2 H 1 2.2382 0.01 . . . . . . X 72 GLU HG2 . 36085 1
852 . 1 1 72 72 GLU HG3 H 1 2.2382 0.01 . . . . . . X 72 GLU HG3 . 36085 1
853 . 1 1 72 72 GLU C C 13 177.9400 0.05 . . . . . . X 72 GLU C . 36085 1
854 . 1 1 72 72 GLU CA C 13 60.8200 0.05 . . . . . . X 72 GLU CA . 36085 1
855 . 1 1 72 72 GLU CB C 13 29.7100 0.05 . . . . . . X 72 GLU CB . 36085 1
856 . 1 1 72 72 GLU CG C 13 37.50 0.05 . . . . . . X 72 GLU CG . 36085 1
857 . 1 1 72 72 GLU N N 15 117.5230 0.05 . . . . . . X 72 GLU N . 36085 1
858 . 1 1 73 73 PHE H H 1 8.2509 0.01 . . . . . . X 73 PHE H . 36085 1
859 . 1 1 73 73 PHE HA H 1 4.594 0.01 . . . . . . X 73 PHE HA . 36085 1
860 . 1 1 73 73 PHE HB2 H 1 3.033 0.01 . . . . . . X 73 PHE HB2 . 36085 1
861 . 1 1 73 73 PHE HB3 H 1 3.447 0.01 . . . . . . X 73 PHE HB3 . 36085 1
862 . 1 1 73 73 PHE HD1 H 1 6.7652 0.01 . . . . . . X 73 PHE HD1 . 36085 1
863 . 1 1 73 73 PHE HE1 H 1 6.4541 0.01 . . . . . . X 73 PHE HE1 . 36085 1
864 . 1 1 73 73 PHE C C 13 177.2700 0.05 . . . . . . X 73 PHE C . 36085 1
865 . 1 1 73 73 PHE CA C 13 61.0000 0.05 . . . . . . X 73 PHE CA . 36085 1
866 . 1 1 73 73 PHE CB C 13 39.8600 0.05 . . . . . . X 73 PHE CB . 36085 1
867 . 1 1 73 73 PHE CD1 C 13 131.6 0.05 . . . . . . X 73 PHE CD1 . 36085 1
868 . 1 1 73 73 PHE CE1 C 13 130.7 0.05 . . . . . . X 73 PHE CE1 . 36085 1
869 . 1 1 73 73 PHE N N 15 120.1130 0.05 . . . . . . X 73 PHE N . 36085 1
870 . 1 1 74 74 TYR H H 1 8.6138 0.01 . . . . . . X 74 TYR H . 36085 1
871 . 1 1 74 74 TYR HA H 1 3.286 0.01 . . . . . . X 74 TYR HA . 36085 1
872 . 1 1 74 74 TYR HB2 H 1 2.641 0.01 . . . . . . X 74 TYR HB2 . 36085 1
873 . 1 1 74 74 TYR HB3 H 1 3.278 0.01 . . . . . . X 74 TYR HB3 . 36085 1
874 . 1 1 74 74 TYR HD1 H 1 7.8080 0.01 . . . . . . X 74 TYR HD1 . 36085 1
875 . 1 1 74 74 TYR HE1 H 1 7.1580 0.01 . . . . . . X 74 TYR HE1 . 36085 1
876 . 1 1 74 74 TYR C C 13 179.4200 0.05 . . . . . . X 74 TYR C . 36085 1
877 . 1 1 74 74 TYR CA C 13 63.4900 0.05 . . . . . . X 74 TYR CA . 36085 1
878 . 1 1 74 74 TYR CB C 13 39.5100 0.05 . . . . . . X 74 TYR CB . 36085 1
879 . 1 1 74 74 TYR CD1 C 13 134.214 0.05 . . . . . . X 74 TYR CD1 . 36085 1
880 . 1 1 74 74 TYR CE1 C 13 118.483 0.05 . . . . . . X 74 TYR CE1 . 36085 1
881 . 1 1 74 74 TYR N N 15 118.3140 0.05 . . . . . . X 74 TYR N . 36085 1
882 . 1 1 75 75 ASN H H 1 8.5193 0.01 . . . . . . X 75 ASN H . 36085 1
883 . 1 1 75 75 ASN HA H 1 4.5509 0.01 . . . . . . X 75 ASN HA . 36085 1
884 . 1 1 75 75 ASN HB2 H 1 2.864 0.01 . . . . . . X 75 ASN HB2 . 36085 1
885 . 1 1 75 75 ASN HB3 H 1 3.006 0.01 . . . . . . X 75 ASN HB3 . 36085 1
886 . 1 1 75 75 ASN HD21 H 1 7.5727 0.01 . . . . . . X 75 ASN HD21 . 36085 1
887 . 1 1 75 75 ASN HD22 H 1 7.1286 0.01 . . . . . . X 75 ASN HD22 . 36085 1
888 . 1 1 75 75 ASN C C 13 178.5900 0.05 . . . . . . X 75 ASN C . 36085 1
889 . 1 1 75 75 ASN CA C 13 56.9300 0.05 . . . . . . X 75 ASN CA . 36085 1
890 . 1 1 75 75 ASN CB C 13 38.0900 0.05 . . . . . . X 75 ASN CB . 36085 1
891 . 1 1 75 75 ASN N N 15 119.3460 0.05 . . . . . . X 75 ASN N . 36085 1
892 . 1 1 75 75 ASN ND2 N 15 111.535 0.05 . . . . . . X 75 ASN ND2 . 36085 1
893 . 1 1 76 76 ASP H H 1 8.9184 0.01 . . . . . . X 76 ASP H . 36085 1
894 . 1 1 76 76 ASP HA H 1 4.4566 0.01 . . . . . . X 76 ASP HA . 36085 1
895 . 1 1 76 76 ASP HB2 H 1 2.2143 0.01 . . . . . . X 76 ASP HB2 . 36085 1
896 . 1 1 76 76 ASP HB3 H 1 3.0030 0.01 . . . . . . X 76 ASP HB3 . 36085 1
897 . 1 1 76 76 ASP C C 13 179.2700 0.05 . . . . . . X 76 ASP C . 36085 1
898 . 1 1 76 76 ASP CA C 13 58.2000 0.05 . . . . . . X 76 ASP CA . 36085 1
899 . 1 1 76 76 ASP CB C 13 41.0500 0.05 . . . . . . X 76 ASP CB . 36085 1
900 . 1 1 76 76 ASP N N 15 123.1700 0.05 . . . . . . X 76 ASP N . 36085 1
901 . 1 1 77 77 MET H H 1 8.2009 0.01 . . . . . . X 77 MET H . 36085 1
902 . 1 1 77 77 MET HA H 1 4.0591 0.01 . . . . . . X 77 MET HA . 36085 1
903 . 1 1 77 77 MET HB2 H 1 0.171 0.01 . . . . . . X 77 MET HB2 . 36085 1
904 . 1 1 77 77 MET HB3 H 1 0.549 0.01 . . . . . . X 77 MET HB3 . 36085 1
905 . 1 1 77 77 MET HG2 H 1 -0.046 0.01 . . . . . . X 77 MET HG2 . 36085 1
906 . 1 1 77 77 MET HG3 H 1 0.739 0.01 . . . . . . X 77 MET HG3 . 36085 1
907 . 1 1 77 77 MET C C 13 179.7700 0.05 . . . . . . X 77 MET C . 36085 1
908 . 1 1 77 77 MET CA C 13 57.5200 0.05 . . . . . . X 77 MET CA . 36085 1
909 . 1 1 77 77 MET CB C 13 34.0600 0.05 . . . . . . X 77 MET CB . 36085 1
910 . 1 1 77 77 MET CG C 13 32.98 0.05 . . . . . . X 77 MET CG . 36085 1
911 . 1 1 77 77 MET N N 15 120.3260 0.05 . . . . . . X 77 MET N . 36085 1
912 . 1 1 78 78 GLN H H 1 8.5037 0.01 . . . . . . X 78 GLN H . 36085 1
913 . 1 1 78 78 GLN HA H 1 3.856 0.01 . . . . . . X 78 GLN HA . 36085 1
914 . 1 1 78 78 GLN HB2 H 1 2.178 0.01 . . . . . . X 78 GLN HB2 . 36085 1
915 . 1 1 78 78 GLN HB3 H 1 2.478 0.01 . . . . . . X 78 GLN HB3 . 36085 1
916 . 1 1 78 78 GLN HG2 H 1 2.133 0.01 . . . . . . X 78 GLN HG2 . 36085 1
917 . 1 1 78 78 GLN HG3 H 1 2.458 0.01 . . . . . . X 78 GLN HG3 . 36085 1
918 . 1 1 78 78 GLN HE21 H 1 7.0348 0.01 . . . . . . X 78 GLN HE21 . 36085 1
919 . 1 1 78 78 GLN HE22 H 1 6.8566 0.01 . . . . . . X 78 GLN HE22 . 36085 1
920 . 1 1 78 78 GLN C C 13 180.2700 0.05 . . . . . . X 78 GLN C . 36085 1
921 . 1 1 78 78 GLN CA C 13 60.0300 0.05 . . . . . . X 78 GLN CA . 36085 1
922 . 1 1 78 78 GLN CB C 13 28.5800 0.05 . . . . . . X 78 GLN CB . 36085 1
923 . 1 1 78 78 GLN CG C 13 33.85 0.05 . . . . . . X 78 GLN CG . 36085 1
924 . 1 1 78 78 GLN N N 15 121.1290 0.05 . . . . . . X 78 GLN N . 36085 1
925 . 1 1 78 78 GLN NE2 N 15 110.505 0.05 . . . . . . X 78 GLN NE2 . 36085 1
926 . 1 1 79 79 THR H H 1 7.9364 0.01 . . . . . . X 79 THR H . 36085 1
927 . 1 1 79 79 THR HA H 1 3.900 0.01 . . . . . . X 79 THR HA . 36085 1
928 . 1 1 79 79 THR HB H 1 4.359 0.01 . . . . . . X 79 THR HB . 36085 1
929 . 1 1 79 79 THR HG21 H 1 1.364 0.01 . . . . . . X 79 THR HG21 . 36085 1
930 . 1 1 79 79 THR HG22 H 1 1.364 0.01 . . . . . . X 79 THR HG22 . 36085 1
931 . 1 1 79 79 THR HG23 H 1 1.364 0.01 . . . . . . X 79 THR HG23 . 36085 1
932 . 1 1 79 79 THR C C 13 176.6100 0.05 . . . . . . X 79 THR C . 36085 1
933 . 1 1 79 79 THR CA C 13 67.3100 0.05 . . . . . . X 79 THR CA . 36085 1
934 . 1 1 79 79 THR CB C 13 69.4100 0.05 . . . . . . X 79 THR CB . 36085 1
935 . 1 1 79 79 THR CG2 C 13 22.71 0.05 . . . . . . X 79 THR CG2 . 36085 1
936 . 1 1 79 79 THR N N 15 114.1150 0.05 . . . . . . X 79 THR N . 36085 1
937 . 1 1 80 80 ILE H H 1 7.3166 0.01 . . . . . . X 80 ILE H . 36085 1
938 . 1 1 80 80 ILE HA H 1 3.6175 0.01 . . . . . . X 80 ILE HA . 36085 1
939 . 1 1 80 80 ILE HB H 1 2.2724 0.01 . . . . . . X 80 ILE HB . 36085 1
940 . 1 1 80 80 ILE HG12 H 1 0.916 0.01 . . . . . . X 80 ILE HG12 . 36085 1
941 . 1 1 80 80 ILE HG13 H 1 1.892 0.01 . . . . . . X 80 ILE HG13 . 36085 1
942 . 1 1 80 80 ILE HG21 H 1 0.638 0.01 . . . . . . X 80 ILE HG21 . 36085 1
943 . 1 1 80 80 ILE HG22 H 1 0.638 0.01 . . . . . . X 80 ILE HG22 . 36085 1
944 . 1 1 80 80 ILE HG23 H 1 0.638 0.01 . . . . . . X 80 ILE HG23 . 36085 1
945 . 1 1 80 80 ILE HD11 H 1 0.763 0.01 . . . . . . X 80 ILE HD11 . 36085 1
946 . 1 1 80 80 ILE HD12 H 1 0.763 0.01 . . . . . . X 80 ILE HD12 . 36085 1
947 . 1 1 80 80 ILE HD13 H 1 0.763 0.01 . . . . . . X 80 ILE HD13 . 36085 1
948 . 1 1 80 80 ILE C C 13 178.0800 0.05 . . . . . . X 80 ILE C . 36085 1
949 . 1 1 80 80 ILE CA C 13 66.4360 0.05 . . . . . . X 80 ILE CA . 36085 1
950 . 1 1 80 80 ILE CB C 13 38.4160 0.05 . . . . . . X 80 ILE CB . 36085 1
951 . 1 1 80 80 ILE CG1 C 13 29.77 0.05 . . . . . . X 80 ILE CG1 . 36085 1
952 . 1 1 80 80 ILE CG2 C 13 17.87 0.05 . . . . . . X 80 ILE CG2 . 36085 1
953 . 1 1 80 80 ILE CD1 C 13 14.52 0.05 . . . . . . X 80 ILE CD1 . 36085 1
954 . 1 1 80 80 ILE N N 15 122.5560 0.05 . . . . . . X 80 ILE N . 36085 1
955 . 1 1 81 81 THR H H 1 7.7824 0.01 . . . . . . X 81 THR H . 36085 1
956 . 1 1 81 81 THR HA H 1 3.9780 0.01 . . . . . . X 81 THR HA . 36085 1
957 . 1 1 81 81 THR HB H 1 4.299 0.01 . . . . . . X 81 THR HB . 36085 1
958 . 1 1 81 81 THR HG21 H 1 1.366 0.01 . . . . . . X 81 THR HG21 . 36085 1
959 . 1 1 81 81 THR HG22 H 1 1.366 0.01 . . . . . . X 81 THR HG22 . 36085 1
960 . 1 1 81 81 THR HG23 H 1 1.366 0.01 . . . . . . X 81 THR HG23 . 36085 1
961 . 1 1 81 81 THR C C 13 176.0500 0.05 . . . . . . X 81 THR C . 36085 1
962 . 1 1 81 81 THR CA C 13 66.5800 0.05 . . . . . . X 81 THR CA . 36085 1
963 . 1 1 81 81 THR CB C 13 69.5400 0.05 . . . . . . X 81 THR CB . 36085 1
964 . 1 1 81 81 THR CG2 C 13 24.68 0.05 . . . . . . X 81 THR CG2 . 36085 1
965 . 1 1 81 81 THR N N 15 110.6110 0.05 . . . . . . X 81 THR N . 36085 1
966 . 1 1 82 82 LEU H H 1 7.4483 0.01 . . . . . . X 82 LEU H . 36085 1
967 . 1 1 82 82 LEU HA H 1 4.2518 0.01 . . . . . . X 82 LEU HA . 36085 1
968 . 1 1 82 82 LEU HB2 H 1 1.5872 0.01 . . . . . . X 82 LEU HB2 . 36085 1
969 . 1 1 82 82 LEU HB3 H 1 1.7885 0.01 . . . . . . X 82 LEU HB3 . 36085 1
970 . 1 1 82 82 LEU HG H 1 0.875 0.01 . . . . . . X 82 LEU HG . 36085 1
971 . 1 1 82 82 LEU HD11 H 1 0.883 0.01 . . . . . . X 82 LEU HD11 . 36085 1
972 . 1 1 82 82 LEU HD12 H 1 0.883 0.01 . . . . . . X 82 LEU HD12 . 36085 1
973 . 1 1 82 82 LEU HD13 H 1 0.883 0.01 . . . . . . X 82 LEU HD13 . 36085 1
974 . 1 1 82 82 LEU HD21 H 1 0.867 0.01 . . . . . . X 82 LEU HD21 . 36085 1
975 . 1 1 82 82 LEU HD22 H 1 0.867 0.01 . . . . . . X 82 LEU HD22 . 36085 1
976 . 1 1 82 82 LEU HD23 H 1 0.867 0.01 . . . . . . X 82 LEU HD23 . 36085 1
977 . 1 1 82 82 LEU C C 13 178.6800 0.05 . . . . . . X 82 LEU C . 36085 1
978 . 1 1 82 82 LEU CA C 13 57.2300 0.05 . . . . . . X 82 LEU CA . 36085 1
979 . 1 1 82 82 LEU CB C 13 42.5200 0.05 . . . . . . X 82 LEU CB . 36085 1
980 . 1 1 82 82 LEU CG C 13 26.28 0.05 . . . . . . X 82 LEU CG . 36085 1
981 . 1 1 82 82 LEU CD1 C 13 23.09 0.05 . . . . . . X 82 LEU CD1 . 36085 1
982 . 1 1 82 82 LEU N N 15 120.9150 0.05 . . . . . . X 82 LEU N . 36085 1
983 . 1 1 83 83 LYS H H 1 7.6384 0.01 . . . . . . X 83 LYS H . 36085 1
984 . 1 1 83 83 LYS HA H 1 4.1958 0.01 . . . . . . X 83 LYS HA . 36085 1
985 . 1 1 83 83 LYS HB2 H 1 1.8894 0.01 . . . . . . X 83 LYS HB2 . 36085 1
986 . 1 1 83 83 LYS HB3 H 1 1.8894 0.01 . . . . . . X 83 LYS HB3 . 36085 1
987 . 1 1 83 83 LYS HG2 H 1 1.427 0.01 . . . . . . X 83 LYS HG2 . 36085 1
988 . 1 1 83 83 LYS HG3 H 1 1.542 0.01 . . . . . . X 83 LYS HG3 . 36085 1
989 . 1 1 83 83 LYS HD2 H 1 1.578 0.01 . . . . . . X 83 LYS HD2 . 36085 1
990 . 1 1 83 83 LYS HD3 H 1 1.578 0.01 . . . . . . X 83 LYS HD3 . 36085 1
991 . 1 1 83 83 LYS HE2 H 1 2.921 0.01 . . . . . . X 83 LYS HE2 . 36085 1
992 . 1 1 83 83 LYS HE3 H 1 2.921 0.01 . . . . . . X 83 LYS HE3 . 36085 1
993 . 1 1 83 83 LYS C C 13 177.6100 0.05 . . . . . . X 83 LYS C . 36085 1
994 . 1 1 83 83 LYS CA C 13 58.2400 0.05 . . . . . . X 83 LYS CA . 36085 1
995 . 1 1 83 83 LYS CB C 13 32.7400 0.05 . . . . . . X 83 LYS CB . 36085 1
996 . 1 1 83 83 LYS CG C 13 25.84 0.05 . . . . . . X 83 LYS CG . 36085 1
997 . 1 1 83 83 LYS CD C 13 29.43 0.05 . . . . . . X 83 LYS CD . 36085 1
998 . 1 1 83 83 LYS CE C 13 42.94 0.05 . . . . . . X 83 LYS CE . 36085 1
999 . 1 1 83 83 LYS N N 15 119.0690 0.05 . . . . . . X 83 LYS N . 36085 1
1000 . 1 1 84 84 SER H H 1 7.8603 0.01 . . . . . . X 84 SER H . 36085 1
1001 . 1 1 84 84 SER HA H 1 4.3339 0.01 . . . . . . X 84 SER HA . 36085 1
1002 . 1 1 84 84 SER HB2 H 1 3.8999 0.01 . . . . . . X 84 SER HB2 . 36085 1
1003 . 1 1 84 84 SER HB3 H 1 3.8999 0.01 . . . . . . X 84 SER HB3 . 36085 1
1004 . 1 1 84 84 SER C C 13 174.7000 0.05 . . . . . . X 84 SER C . 36085 1
1005 . 1 1 84 84 SER CA C 13 60.5600 0.05 . . . . . . X 84 SER CA . 36085 1
1006 . 1 1 84 84 SER CB C 13 64.7200 0.05 . . . . . . X 84 SER CB . 36085 1
1007 . 1 1 84 84 SER N N 15 115.2070 0.05 . . . . . . X 84 SER N . 36085 1
1008 . 1 1 85 85 GLU H H 1 8.1138 0.01 . . . . . . X 85 GLU H . 36085 1
1009 . 1 1 85 85 GLU HA H 1 4.3111 0.01 . . . . . . X 85 GLU HA . 36085 1
1010 . 1 1 85 85 GLU HB2 H 1 1.932 0.01 . . . . . . X 85 GLU HB2 . 36085 1
1011 . 1 1 85 85 GLU HB3 H 1 2.102 0.01 . . . . . . X 85 GLU HB3 . 36085 1
1012 . 1 1 85 85 GLU HG2 H 1 2.220 0.01 . . . . . . X 85 GLU HG2 . 36085 1
1013 . 1 1 85 85 GLU HG3 H 1 2.277 0.01 . . . . . . X 85 GLU HG3 . 36085 1
1014 . 1 1 85 85 GLU C C 13 176.3700 0.05 . . . . . . X 85 GLU C . 36085 1
1015 . 1 1 85 85 GLU CA C 13 57.5100 0.05 . . . . . . X 85 GLU CA . 36085 1
1016 . 1 1 85 85 GLU CB C 13 30.7200 0.05 . . . . . . X 85 GLU CB . 36085 1
1017 . 1 1 85 85 GLU CG C 13 37.05 0.05 . . . . . . X 85 GLU CG . 36085 1
1018 . 1 1 85 85 GLU N N 15 120.6110 0.05 . . . . . . X 85 GLU N . 36085 1
1019 . 1 1 86 86 LEU H H 1 7.9023 0.01 . . . . . . X 86 LEU H . 36085 1
1020 . 1 1 86 86 LEU HA H 1 4.3437 0.01 . . . . . . X 86 LEU HA . 36085 1
1021 . 1 1 86 86 LEU HB2 H 1 1.595 0.01 . . . . . . X 86 LEU HB2 . 36085 1
1022 . 1 1 86 86 LEU HB3 H 1 1.621 0.01 . . . . . . X 86 LEU HB3 . 36085 1
1023 . 1 1 86 86 LEU HG H 1 1.599 0.01 . . . . . . X 86 LEU HG . 36085 1
1024 . 1 1 86 86 LEU HD11 H 1 0.880 0.01 . . . . . . X 86 LEU HD11 . 36085 1
1025 . 1 1 86 86 LEU HD12 H 1 0.880 0.01 . . . . . . X 86 LEU HD12 . 36085 1
1026 . 1 1 86 86 LEU HD13 H 1 0.880 0.01 . . . . . . X 86 LEU HD13 . 36085 1
1027 . 1 1 86 86 LEU HD21 H 1 0.819 0.01 . . . . . . X 86 LEU HD21 . 36085 1
1028 . 1 1 86 86 LEU HD22 H 1 0.819 0.01 . . . . . . X 86 LEU HD22 . 36085 1
1029 . 1 1 86 86 LEU HD23 H 1 0.819 0.01 . . . . . . X 86 LEU HD23 . 36085 1
1030 . 1 1 86 86 LEU C C 13 176.2700 0.05 . . . . . . X 86 LEU C . 36085 1
1031 . 1 1 86 86 LEU CA C 13 55.8100 0.05 . . . . . . X 86 LEU CA . 36085 1
1032 . 1 1 86 86 LEU CB C 13 43.0600 0.05 . . . . . . X 86 LEU CB . 36085 1
1033 . 1 1 86 86 LEU CG C 13 27.235 0.05 . . . . . . X 86 LEU CG . 36085 1
1034 . 1 1 86 86 LEU CD1 C 13 24.315 0.05 . . . . . . X 86 LEU CD1 . 36085 1
1035 . 1 1 86 86 LEU N N 15 121.6370 0.05 . . . . . . X 86 LEU N . 36085 1
1036 . 1 1 87 87 ASN H H 1 7.8617 0.01 . . . . . . X 87 ASN H . 36085 1
1037 . 1 1 87 87 ASN HA H 1 4.4281 0.01 . . . . . . X 87 ASN HA . 36085 1
1038 . 1 1 87 87 ASN HB2 H 1 2.604 0.01 . . . . . . X 87 ASN HB2 . 36085 1
1039 . 1 1 87 87 ASN HB3 H 1 2.604 0.01 . . . . . . X 87 ASN HB3 . 36085 1
1040 . 1 1 87 87 ASN HD21 H 1 7.4499 0.01 . . . . . . X 87 ASN HD21 . 36085 1
1041 . 1 1 87 87 ASN HD22 H 1 6.8208 0.01 . . . . . . X 87 ASN HD22 . 36085 1
1042 . 1 1 87 87 ASN C C 13 179.4300 0.05 . . . . . . X 87 ASN C . 36085 1
1043 . 1 1 87 87 ASN CA C 13 55.6400 0.05 . . . . . . X 87 ASN CA . 36085 1
1044 . 1 1 87 87 ASN CB C 13 41.4500 0.05 . . . . . . X 87 ASN CB . 36085 1
1045 . 1 1 87 87 ASN N N 15 124.2510 0.05 . . . . . . X 87 ASN N . 36085 1
1046 . 1 1 87 87 ASN ND2 N 15 113.008 0.05 . . . . . . X 87 ASN ND2 . 36085 1
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