Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6805
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_Assigned_chem_shift_list.Chem_shift_1H_err 0.005
_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 $sample_1 isotropic 6805 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.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 VAL HA H 1 3.77 0.005 . 1 . . . . 1 VAL HA . 6805 1
2 . 1 1 1 1 VAL HB H 1 2.18 0.005 . 1 . . . . 1 VAL HB . 6805 1
3 . 1 1 1 1 VAL HG11 H 1 1.01 0.005 . 1 . . . . 1 VAL HG1 . 6805 1
4 . 1 1 1 1 VAL HG12 H 1 1.01 0.005 . 1 . . . . 1 VAL HG1 . 6805 1
5 . 1 1 1 1 VAL HG13 H 1 1.01 0.005 . 1 . . . . 1 VAL HG1 . 6805 1
6 . 1 1 1 1 VAL HG21 H 1 1.01 0.005 . 1 . . . . 1 VAL HG2 . 6805 1
7 . 1 1 1 1 VAL HG22 H 1 1.01 0.005 . 1 . . . . 1 VAL HG2 . 6805 1
8 . 1 1 1 1 VAL HG23 H 1 1.01 0.005 . 1 . . . . 1 VAL HG2 . 6805 1
9 . 1 1 1 1 VAL CA C 13 61.3 0.05 . 1 . . . . 1 VAL CA . 6805 1
10 . 1 1 1 1 VAL CB C 13 32.9 0.05 . 1 . . . . 1 VAL CB . 6805 1
11 . 1 1 1 1 VAL CG1 C 13 20.5 0.05 . 1 . . . . 1 VAL CG1 . 6805 1
12 . 1 1 1 1 VAL CG2 C 13 19.8 0.05 . 1 . . . . 1 VAL CG2 . 6805 1
13 . 1 1 2 2 ASP HA H 1 4.70 0.005 . 1 . . . . 2 ASP HA . 6805 1
14 . 1 1 2 2 ASP HB2 H 1 2.71 0.005 . 2 . . . . 2 ASP HB2 . 6805 1
15 . 1 1 2 2 ASP HB3 H 1 2.64 0.005 . 2 . . . . 2 ASP HB3 . 6805 1
16 . 1 1 2 2 ASP C C 13 175.7 0.05 . 1 . . . . 2 ASP C . 6805 1
17 . 1 1 2 2 ASP CA C 13 54.2 0.05 . 1 . . . . 2 ASP CA . 6805 1
18 . 1 1 2 2 ASP CB C 13 41.5 0.05 . 1 . . . . 2 ASP CB . 6805 1
19 . 1 1 3 3 ASN H H 1 8.56 0.005 . 1 . . . . 3 ASN H . 6805 1
20 . 1 1 3 3 ASN HA H 1 4.69 0.005 . 1 . . . . 3 ASN HA . 6805 1
21 . 1 1 3 3 ASN HB2 H 1 2.80 0.005 . 1 . . . . 3 ASN HB2 . 6805 1
22 . 1 1 3 3 ASN HB3 H 1 2.80 0.005 . 1 . . . . 3 ASN HB3 . 6805 1
23 . 1 1 3 3 ASN HD21 H 1 6.89 0.005 . 2 . . . . 3 ASN HD21 . 6805 1
24 . 1 1 3 3 ASN HD22 H 1 7.62 0.005 . 2 . . . . 3 ASN HD22 . 6805 1
25 . 1 1 3 3 ASN C C 13 175.8 0.05 . 1 . . . . 3 ASN C . 6805 1
26 . 1 1 3 3 ASN CA C 13 53.3 0.05 . 1 . . . . 3 ASN CA . 6805 1
27 . 1 1 3 3 ASN CB C 13 39.0 0.05 . 1 . . . . 3 ASN CB . 6805 1
28 . 1 1 3 3 ASN N N 15 121.7 0.05 . 1 . . . . 3 ASN N . 6805 1
29 . 1 1 3 3 ASN ND2 N 15 113.2 0.05 . 1 . . . . 3 ASN ND2 . 6805 1
30 . 1 1 4 4 LYS H H 1 8.38 0.005 . 1 . . . . 4 LYS H . 6805 1
31 . 1 1 4 4 LYS HA H 1 4.11 0.005 . 1 . . . . 4 LYS HA . 6805 1
32 . 1 1 4 4 LYS HB2 H 1 1.70 0.005 . 1 . . . . 4 LYS HB2 . 6805 1
33 . 1 1 4 4 LYS HB3 H 1 1.62 0.005 . 1 . . . . 4 LYS HB3 . 6805 1
34 . 1 1 4 4 LYS HG2 H 1 1.17 0.005 . 1 . . . . 4 LYS HG2 . 6805 1
35 . 1 1 4 4 LYS HG3 H 1 1.17 0.005 . 1 . . . . 4 LYS HG3 . 6805 1
36 . 1 1 4 4 LYS HD2 H 1 1.56 0.005 . 1 . . . . 4 LYS HD2 . 6805 1
37 . 1 1 4 4 LYS HD3 H 1 1.56 0.005 . 1 . . . . 4 LYS HD3 . 6805 1
38 . 1 1 4 4 LYS HE2 H 1 2.89 0.005 . 1 . . . . 4 LYS HE2 . 6805 1
39 . 1 1 4 4 LYS HE3 H 1 2.89 0.005 . 1 . . . . 4 LYS HE3 . 6805 1
40 . 1 1 4 4 LYS C C 13 177.1 0.05 . 1 . . . . 4 LYS C . 6805 1
41 . 1 1 4 4 LYS CA C 13 57.8 0.05 . 1 . . . . 4 LYS CA . 6805 1
42 . 1 1 4 4 LYS CB C 13 32.6 0.05 . 1 . . . . 4 LYS CB . 6805 1
43 . 1 1 4 4 LYS CG C 13 24.6 0.05 . 1 . . . . 4 LYS CG . 6805 1
44 . 1 1 4 4 LYS CD C 13 29.1 0.05 . 1 . . . . 4 LYS CD . 6805 1
45 . 1 1 4 4 LYS CE C 13 42.0 0.05 . 1 . . . . 4 LYS CE . 6805 1
46 . 1 1 4 4 LYS N N 15 122.3 0.05 . 1 . . . . 4 LYS N . 6805 1
47 . 1 1 5 5 PHE H H 1 8.34 0.005 . 1 . . . . 5 PHE H . 6805 1
48 . 1 1 5 5 PHE HA H 1 4.56 0.005 . 1 . . . . 5 PHE HA . 6805 1
49 . 1 1 5 5 PHE HB2 H 1 2.95 0.005 . 1 . . . . 5 PHE HB2 . 6805 1
50 . 1 1 5 5 PHE HB3 H 1 3.14 0.005 . 1 . . . . 5 PHE HB3 . 6805 1
51 . 1 1 5 5 PHE HD1 H 1 7.21 0.005 . 1 . . . . 5 PHE HD1 . 6805 1
52 . 1 1 5 5 PHE HD2 H 1 7.21 0.005 . 1 . . . . 5 PHE HD2 . 6805 1
53 . 1 1 5 5 PHE HE1 H 1 7.36 0.005 . 1 . . . . 5 PHE HE1 . 6805 1
54 . 1 1 5 5 PHE HE2 H 1 7.36 0.005 . 1 . . . . 5 PHE HE2 . 6805 1
55 . 1 1 5 5 PHE HZ H 1 7.31 0.005 . 1 . . . . 5 PHE HZ . 6805 1
56 . 1 1 5 5 PHE C C 13 175.8 0.05 . 1 . . . . 5 PHE C . 6805 1
57 . 1 1 5 5 PHE CA C 13 58.6 0.05 . 1 . . . . 5 PHE CA . 6805 1
58 . 1 1 5 5 PHE CB C 13 38.5 0.05 . 1 . . . . 5 PHE CB . 6805 1
59 . 1 1 5 5 PHE N N 15 119.2 0.05 . 1 . . . . 5 PHE N . 6805 1
60 . 1 1 6 6 ASN H H 1 7.82 0.005 . 1 . . . . 6 ASN H . 6805 1
61 . 1 1 6 6 ASN HA H 1 4.53 0.005 . 1 . . . . 6 ASN HA . 6805 1
62 . 1 1 6 6 ASN HB2 H 1 2.91 0.005 . 2 . . . . 6 ASN HB2 . 6805 1
63 . 1 1 6 6 ASN HB3 H 1 2.84 0.005 . 2 . . . . 6 ASN HB3 . 6805 1
64 . 1 1 6 6 ASN HD21 H 1 6.96 0.005 . 2 . . . . 6 ASN HD21 . 6805 1
65 . 1 1 6 6 ASN HD22 H 1 7.69 0.005 . 2 . . . . 6 ASN HD22 . 6805 1
66 . 1 1 6 6 ASN C C 13 176.5 0.05 . 1 . . . . 6 ASN C . 6805 1
67 . 1 1 6 6 ASN CA C 13 54.9 0.05 . 1 . . . . 6 ASN CA . 6805 1
68 . 1 1 6 6 ASN CB C 13 38.7 0.05 . 1 . . . . 6 ASN CB . 6805 1
69 . 1 1 6 6 ASN N N 15 120.3 0.05 . 1 . . . . 6 ASN N . 6805 1
70 . 1 1 6 6 ASN ND2 N 15 113.1 0.05 . 1 . . . . 6 ASN ND2 . 6805 1
71 . 1 1 7 7 LYS H H 1 8.40 0.005 . 1 . . . . 7 LYS H . 6805 1
72 . 1 1 7 7 LYS HA H 1 3.98 0.005 . 1 . . . . 7 LYS HA . 6805 1
73 . 1 1 7 7 LYS HB2 H 1 1.88 0.005 . 2 . . . . 7 LYS HB2 . 6805 1
74 . 1 1 7 7 LYS HB3 H 1 1.83 0.005 . 2 . . . . 7 LYS HB3 . 6805 1
75 . 1 1 7 7 LYS HG2 H 1 1.49 0.005 . 2 . . . . 7 LYS HG2 . 6805 1
76 . 1 1 7 7 LYS HG3 H 1 1.40 0.005 . 2 . . . . 7 LYS HG3 . 6805 1
77 . 1 1 7 7 LYS HD2 H 1 1.70 0.005 . 1 . . . . 7 LYS HD2 . 6805 1
78 . 1 1 7 7 LYS HD3 H 1 1.70 0.005 . 1 . . . . 7 LYS HD3 . 6805 1
79 . 1 1 7 7 LYS HE2 H 1 2.96 0.005 . 1 . . . . 7 LYS HE2 . 6805 1
80 . 1 1 7 7 LYS HE3 H 1 2.96 0.005 . 1 . . . . 7 LYS HE3 . 6805 1
81 . 1 1 7 7 LYS C C 13 178.1 0.05 . 1 . . . . 7 LYS C . 6805 1
82 . 1 1 7 7 LYS CA C 13 59.6 0.05 . 1 . . . . 7 LYS CA . 6805 1
83 . 1 1 7 7 LYS CB C 13 32.2 0.05 . 1 . . . . 7 LYS CB . 6805 1
84 . 1 1 7 7 LYS CG C 13 24.9 0.05 . 1 . . . . 7 LYS CG . 6805 1
85 . 1 1 7 7 LYS CD C 13 29.3 0.05 . 1 . . . . 7 LYS CD . 6805 1
86 . 1 1 7 7 LYS CE C 13 42.0 0.05 . 1 . . . . 7 LYS CE . 6805 1
87 . 1 1 7 7 LYS N N 15 121.6 0.05 . 1 . . . . 7 LYS N . 6805 1
88 . 1 1 8 8 GLU H H 1 8.48 0.005 . 1 . . . . 8 GLU H . 6805 1
89 . 1 1 8 8 GLU HA H 1 3.98 0.005 . 1 . . . . 8 GLU HA . 6805 1
90 . 1 1 8 8 GLU HB2 H 1 2.07 0.005 . 1 . . . . 8 GLU HB2 . 6805 1
91 . 1 1 8 8 GLU HB3 H 1 2.19 0.005 . 1 . . . . 8 GLU HB3 . 6805 1
92 . 1 1 8 8 GLU HG2 H 1 2.42 0.005 . 2 . . . . 8 GLU HG2 . 6805 1
93 . 1 1 8 8 GLU HG3 H 1 2.38 0.005 . 2 . . . . 8 GLU HG3 . 6805 1
94 . 1 1 8 8 GLU C C 13 179.1 0.05 . 1 . . . . 8 GLU C . 6805 1
95 . 1 1 8 8 GLU CA C 13 59.9 0.05 . 1 . . . . 8 GLU CA . 6805 1
96 . 1 1 8 8 GLU CB C 13 29.0 0.05 . 1 . . . . 8 GLU CB . 6805 1
97 . 1 1 8 8 GLU CG C 13 37.0 0.05 . 1 . . . . 8 GLU CG . 6805 1
98 . 1 1 8 8 GLU N N 15 119.6 0.05 . 1 . . . . 8 GLU N . 6805 1
99 . 1 1 9 9 ARG H H 1 8.22 0.005 . 1 . . . . 9 ARG H . 6805 1
100 . 1 1 9 9 ARG HA H 1 4.16 0.005 . 1 . . . . 9 ARG HA . 6805 1
101 . 1 1 9 9 ARG HB2 H 1 2.06 0.005 . 2 . . . . 9 ARG HB2 . 6805 1
102 . 1 1 9 9 ARG HB3 H 1 1.84 0.005 . 2 . . . . 9 ARG HB3 . 6805 1
103 . 1 1 9 9 ARG HG2 H 1 1.69 0.005 . 2 . . . . 9 ARG HG2 . 6805 1
104 . 1 1 9 9 ARG HG3 H 1 1.62 0.005 . 2 . . . . 9 ARG HG3 . 6805 1
105 . 1 1 9 9 ARG HD2 H 1 3.12 0.005 . 2 . . . . 9 ARG HD2 . 6805 1
106 . 1 1 9 9 ARG HD3 H 1 3.08 0.005 . 2 . . . . 9 ARG HD3 . 6805 1
107 . 1 1 9 9 ARG HE H 1 7.40 0.005 . 1 . . . . 9 ARG HE . 6805 1
108 . 1 1 9 9 ARG C C 13 177.3 0.05 . 1 . . . . 9 ARG C . 6805 1
109 . 1 1 9 9 ARG CA C 13 59.4 0.05 . 1 . . . . 9 ARG CA . 6805 1
110 . 1 1 9 9 ARG CB C 13 30.2 0.05 . 1 . . . . 9 ARG CB . 6805 1
111 . 1 1 9 9 ARG CG C 13 27.2 0.05 . 1 . . . . 9 ARG CG . 6805 1
112 . 1 1 9 9 ARG CD C 13 44.0 0.05 . 1 . . . . 9 ARG CD . 6805 1
113 . 1 1 9 9 ARG N N 15 121.4 0.05 . 1 . . . . 9 ARG N . 6805 1
114 . 1 1 9 9 ARG NE N 15 83.9 0.05 . 1 . . . . 9 ARG NE . 6805 1
115 . 1 1 10 10 VAL H H 1 7.79 0.005 . 1 . . . . 10 VAL H . 6805 1
116 . 1 1 10 10 VAL HA H 1 3.63 0.005 . 1 . . . . 10 VAL HA . 6805 1
117 . 1 1 10 10 VAL HB H 1 2.21 0.005 . 1 . . . . 10 VAL HB . 6805 1
118 . 1 1 10 10 VAL HG11 H 1 0.96 0.005 . 1 . . . . 10 VAL HG1 . 6805 1
119 . 1 1 10 10 VAL HG12 H 1 0.96 0.005 . 1 . . . . 10 VAL HG1 . 6805 1
120 . 1 1 10 10 VAL HG13 H 1 0.96 0.005 . 1 . . . . 10 VAL HG1 . 6805 1
121 . 1 1 10 10 VAL HG21 H 1 1.07 0.005 . 1 . . . . 10 VAL HG2 . 6805 1
122 . 1 1 10 10 VAL HG22 H 1 1.07 0.005 . 1 . . . . 10 VAL HG2 . 6805 1
123 . 1 1 10 10 VAL HG23 H 1 1.07 0.005 . 1 . . . . 10 VAL HG2 . 6805 1
124 . 1 1 10 10 VAL C C 13 178.9 0.05 . 1 . . . . 10 VAL C . 6805 1
125 . 1 1 10 10 VAL CA C 13 66.4 0.05 . 1 . . . . 10 VAL CA . 6805 1
126 . 1 1 10 10 VAL CB C 13 31.8 0.05 . 1 . . . . 10 VAL CB . 6805 1
127 . 1 1 10 10 VAL CG1 C 13 21.6 0.05 . 1 . . . . 10 VAL CG1 . 6805 1
128 . 1 1 10 10 VAL CG2 C 13 23.0 0.05 . 1 . . . . 10 VAL CG2 . 6805 1
129 . 1 1 10 10 VAL N N 15 119.5 0.05 . 1 . . . . 10 VAL N . 6805 1
130 . 1 1 11 11 ILE H H 1 7.95 0.005 . 1 . . . . 11 ILE H . 6805 1
131 . 1 1 11 11 ILE HA H 1 3.74 0.005 . 1 . . . . 11 ILE HA . 6805 1
132 . 1 1 11 11 ILE HB H 1 1.88 0.005 . 1 . . . . 11 ILE HB . 6805 1
133 . 1 1 11 11 ILE HG12 H 1 1.68 0.005 . 2 . . . . 11 ILE HG12 . 6805 1
134 . 1 1 11 11 ILE HG13 H 1 1.18 0.005 . 2 . . . . 11 ILE HG13 . 6805 1
135 . 1 1 11 11 ILE HG21 H 1 0.89 0.005 . 1 . . . . 11 ILE HG2 . 6805 1
136 . 1 1 11 11 ILE HG22 H 1 0.89 0.005 . 1 . . . . 11 ILE HG2 . 6805 1
137 . 1 1 11 11 ILE HG23 H 1 0.89 0.005 . 1 . . . . 11 ILE HG2 . 6805 1
138 . 1 1 11 11 ILE HD11 H 1 0.82 0.005 . 1 . . . . 11 ILE HD1 . 6805 1
139 . 1 1 11 11 ILE HD12 H 1 0.82 0.005 . 1 . . . . 11 ILE HD1 . 6805 1
140 . 1 1 11 11 ILE HD13 H 1 0.82 0.005 . 1 . . . . 11 ILE HD1 . 6805 1
141 . 1 1 11 11 ILE C C 13 178.6 0.05 . 1 . . . . 11 ILE C . 6805 1
142 . 1 1 11 11 ILE CA C 13 64.3 0.05 . 1 . . . . 11 ILE CA . 6805 1
143 . 1 1 11 11 ILE CB C 13 38.0 0.05 . 1 . . . . 11 ILE CB . 6805 1
144 . 1 1 11 11 ILE CG1 C 13 29.0 0.05 . 1 . . . . 11 ILE CG1 . 6805 1
145 . 1 1 11 11 ILE CG2 C 13 17.2 0.05 . 1 . . . . 11 ILE CG2 . 6805 1
146 . 1 1 11 11 ILE CD1 C 13 13.0 0.05 . 1 . . . . 11 ILE CD1 . 6805 1
147 . 1 1 11 11 ILE N N 15 122.1 0.05 . 1 . . . . 11 ILE N . 6805 1
148 . 1 1 12 12 ALA H H 1 8.08 0.005 . 1 . . . . 12 ALA H . 6805 1
149 . 1 1 12 12 ALA HA H 1 4.04 0.005 . 1 . . . . 12 ALA HA . 6805 1
150 . 1 1 12 12 ALA HB1 H 1 1.47 0.005 . 1 . . . . 12 ALA HB . 6805 1
151 . 1 1 12 12 ALA HB2 H 1 1.47 0.005 . 1 . . . . 12 ALA HB . 6805 1
152 . 1 1 12 12 ALA HB3 H 1 1.47 0.005 . 1 . . . . 12 ALA HB . 6805 1
153 . 1 1 12 12 ALA C C 13 179.2 0.05 . 1 . . . . 12 ALA C . 6805 1
154 . 1 1 12 12 ALA CA C 13 55.5 0.05 . 1 . . . . 12 ALA CA . 6805 1
155 . 1 1 12 12 ALA CB C 13 18.4 0.05 . 1 . . . . 12 ALA CB . 6805 1
156 . 1 1 12 12 ALA N N 15 122.9 0.05 . 1 . . . . 12 ALA N . 6805 1
157 . 1 1 13 13 ILE H H 1 8.34 0.005 . 1 . . . . 13 ILE H . 6805 1
158 . 1 1 13 13 ILE HA H 1 3.39 0.005 . 1 . . . . 13 ILE HA . 6805 1
159 . 1 1 13 13 ILE HB H 1 1.88 0.005 . 1 . . . . 13 ILE HB . 6805 1
160 . 1 1 13 13 ILE HG12 H 1 1.95 0.005 . 2 . . . . 13 ILE HG12 . 6805 1
161 . 1 1 13 13 ILE HG13 H 1 0.89 0.005 . 2 . . . . 13 ILE HG13 . 6805 1
162 . 1 1 13 13 ILE HG21 H 1 0.84 0.005 . 1 . . . . 13 ILE HG2 . 6805 1
163 . 1 1 13 13 ILE HG22 H 1 0.84 0.005 . 1 . . . . 13 ILE HG2 . 6805 1
164 . 1 1 13 13 ILE HG23 H 1 0.84 0.005 . 1 . . . . 13 ILE HG2 . 6805 1
165 . 1 1 13 13 ILE HD11 H 1 0.81 0.005 . 1 . . . . 13 ILE HD1 . 6805 1
166 . 1 1 13 13 ILE HD12 H 1 0.81 0.005 . 1 . . . . 13 ILE HD1 . 6805 1
167 . 1 1 13 13 ILE HD13 H 1 0.81 0.005 . 1 . . . . 13 ILE HD1 . 6805 1
168 . 1 1 13 13 ILE C C 13 177.7 0.05 . 1 . . . . 13 ILE C . 6805 1
169 . 1 1 13 13 ILE CA C 13 66.0 0.05 . 1 . . . . 13 ILE CA . 6805 1
170 . 1 1 13 13 ILE CB C 13 37.8 0.05 . 1 . . . . 13 ILE CB . 6805 1
171 . 1 1 13 13 ILE CG1 C 13 30.3 0.05 . 1 . . . . 13 ILE CG1 . 6805 1
172 . 1 1 13 13 ILE CG2 C 13 17.4 0.05 . 1 . . . . 13 ILE CG2 . 6805 1
173 . 1 1 13 13 ILE CD1 C 13 13.9 0.05 . 1 . . . . 13 ILE CD1 . 6805 1
174 . 1 1 13 13 ILE N N 15 117.7 0.05 . 1 . . . . 13 ILE N . 6805 1
175 . 1 1 14 14 GLY H H 1 7.81 0.005 . 1 . . . . 14 GLY H . 6805 1
176 . 1 1 14 14 GLY HA2 H 1 3.88 0.005 . 2 . . . . 14 GLY HA2 . 6805 1
177 . 1 1 14 14 GLY HA3 H 1 3.62 0.005 . 2 . . . . 14 GLY HA3 . 6805 1
178 . 1 1 14 14 GLY C C 13 176.1 0.05 . 1 . . . . 14 GLY C . 6805 1
179 . 1 1 14 14 GLY CA C 13 47.3 0.05 . 1 . . . . 14 GLY CA . 6805 1
180 . 1 1 14 14 GLY N N 15 105.9 0.05 . 1 . . . . 14 GLY N . 6805 1
181 . 1 1 15 15 GLU H H 1 7.85 0.005 . 1 . . . . 15 GLU H . 6805 1
182 . 1 1 15 15 GLU HA H 1 3.99 0.005 . 1 . . . . 15 GLU HA . 6805 1
183 . 1 1 15 15 GLU HB2 H 1 2.08 0.005 . 2 . . . . 15 GLU HB2 . 6805 1
184 . 1 1 15 15 GLU HB3 H 1 1.96 0.005 . 2 . . . . 15 GLU HB3 . 6805 1
185 . 1 1 15 15 GLU HG2 H 1 2.29 0.005 . 2 . . . . 15 GLU HG2 . 6805 1
186 . 1 1 15 15 GLU HG3 H 1 2.22 0.005 . 2 . . . . 15 GLU HG3 . 6805 1
187 . 1 1 15 15 GLU C C 13 179.9 0.05 . 1 . . . . 15 GLU C . 6805 1
188 . 1 1 15 15 GLU CA C 13 59.1 0.05 . 1 . . . . 15 GLU CA . 6805 1
189 . 1 1 15 15 GLU CB C 13 30.0 0.05 . 1 . . . . 15 GLU CB . 6805 1
190 . 1 1 15 15 GLU CG C 13 36.2 0.05 . 1 . . . . 15 GLU CG . 6805 1
191 . 1 1 15 15 GLU N N 15 120.0 0.05 . 1 . . . . 15 GLU N . 6805 1
192 . 1 1 16 16 ILE H H 1 8.25 0.005 . 1 . . . . 16 ILE H . 6805 1
193 . 1 1 16 16 ILE HA H 1 3.48 0.005 . 1 . . . . 16 ILE HA . 6805 1
194 . 1 1 16 16 ILE HB H 1 1.87 0.005 . 1 . . . . 16 ILE HB . 6805 1
195 . 1 1 16 16 ILE HG12 H 1 1.73 0.005 . 2 . . . . 16 ILE HG12 . 6805 1
196 . 1 1 16 16 ILE HG13 H 1 0.63 0.005 . 2 . . . . 16 ILE HG13 . 6805 1
197 . 1 1 16 16 ILE HG21 H 1 0.80 0.005 . 1 . . . . 16 ILE HG2 . 6805 1
198 . 1 1 16 16 ILE HG22 H 1 0.80 0.005 . 1 . . . . 16 ILE HG2 . 6805 1
199 . 1 1 16 16 ILE HG23 H 1 0.80 0.005 . 1 . . . . 16 ILE HG2 . 6805 1
200 . 1 1 16 16 ILE HD11 H 1 0.44 0.005 . 1 . . . . 16 ILE HD1 . 6805 1
201 . 1 1 16 16 ILE HD12 H 1 0.44 0.005 . 1 . . . . 16 ILE HD1 . 6805 1
202 . 1 1 16 16 ILE HD13 H 1 0.44 0.005 . 1 . . . . 16 ILE HD1 . 6805 1
203 . 1 1 16 16 ILE C C 13 177.8 0.05 . 1 . . . . 16 ILE C . 6805 1
204 . 1 1 16 16 ILE CA C 13 64.9 0.05 . 1 . . . . 16 ILE CA . 6805 1
205 . 1 1 16 16 ILE CB C 13 37.7 0.05 . 1 . . . . 16 ILE CB . 6805 1
206 . 1 1 16 16 ILE CG1 C 13 30.0 0.05 . 1 . . . . 16 ILE CG1 . 6805 1
207 . 1 1 16 16 ILE CG2 C 13 17.3 0.05 . 1 . . . . 16 ILE CG2 . 6805 1
208 . 1 1 16 16 ILE CD1 C 13 12.8 0.05 . 1 . . . . 16 ILE CD1 . 6805 1
209 . 1 1 16 16 ILE N N 15 121.2 0.05 . 1 . . . . 16 ILE N . 6805 1
210 . 1 1 17 17 MET H H 1 7.89 0.005 . 1 . . . . 17 MET H . 6805 1
211 . 1 1 17 17 MET HA H 1 4.10 0.005 . 1 . . . . 17 MET HA . 6805 1
212 . 1 1 17 17 MET HB2 H 1 2.03 0.005 . 2 . . . . 17 MET HB2 . 6805 1
213 . 1 1 17 17 MET HB3 H 1 2.01 0.005 . 2 . . . . 17 MET HB3 . 6805 1
214 . 1 1 17 17 MET HG2 H 1 2.62 0.005 . 2 . . . . 17 MET HG2 . 6805 1
215 . 1 1 17 17 MET HG3 H 1 2.52 0.005 . 2 . . . . 17 MET HG3 . 6805 1
216 . 1 1 17 17 MET HE1 H 1 1.96 0.005 . 1 . . . . 17 MET HE . 6805 1
217 . 1 1 17 17 MET HE2 H 1 1.96 0.005 . 1 . . . . 17 MET HE . 6805 1
218 . 1 1 17 17 MET HE3 H 1 1.96 0.005 . 1 . . . . 17 MET HE . 6805 1
219 . 1 1 17 17 MET C C 13 176.7 0.05 . 1 . . . . 17 MET C . 6805 1
220 . 1 1 17 17 MET CA C 13 57.4 0.05 . 1 . . . . 17 MET CA . 6805 1
221 . 1 1 17 17 MET CB C 13 32.1 0.05 . 1 . . . . 17 MET CB . 6805 1
222 . 1 1 17 17 MET CG C 13 32.6 0.05 . 1 . . . . 17 MET CG . 6805 1
223 . 1 1 17 17 MET CE C 13 17.0 0.05 . 1 . . . . 17 MET CE . 6805 1
224 . 1 1 17 17 MET N N 15 114.9 0.05 . 1 . . . . 17 MET N . 6805 1
225 . 1 1 18 18 ARG H H 1 7.19 0.005 . 1 . . . . 18 ARG H . 6805 1
226 . 1 1 18 18 ARG HA H 1 4.38 0.005 . 1 . . . . 18 ARG HA . 6805 1
227 . 1 1 18 18 ARG HB2 H 1 1.96 0.005 . 1 . . . . 18 ARG HB2 . 6805 1
228 . 1 1 18 18 ARG HB3 H 1 1.82 0.005 . 1 . . . . 18 ARG HB3 . 6805 1
229 . 1 1 18 18 ARG HG2 H 1 1.73 0.005 . 2 . . . . 18 ARG HG2 . 6805 1
230 . 1 1 18 18 ARG HG3 H 1 1.69 0.005 . 2 . . . . 18 ARG HG3 . 6805 1
231 . 1 1 18 18 ARG HD2 H 1 3.16 0.005 . 1 . . . . 18 ARG HD2 . 6805 1
232 . 1 1 18 18 ARG HD3 H 1 3.16 0.005 . 1 . . . . 18 ARG HD3 . 6805 1
233 . 1 1 18 18 ARG HE H 1 7.23 0.005 . 1 . . . . 18 ARG HE . 6805 1
234 . 1 1 18 18 ARG C C 13 176.2 0.05 . 1 . . . . 18 ARG C . 6805 1
235 . 1 1 18 18 ARG CA C 13 56.0 0.05 . 1 . . . . 18 ARG CA . 6805 1
236 . 1 1 18 18 ARG CB C 13 31.1 0.05 . 1 . . . . 18 ARG CB . 6805 1
237 . 1 1 18 18 ARG CG C 13 27.6 0.05 . 1 . . . . 18 ARG CG . 6805 1
238 . 1 1 18 18 ARG CD C 13 43.6 0.05 . 1 . . . . 18 ARG CD . 6805 1
239 . 1 1 18 18 ARG N N 15 116.4 0.05 . 1 . . . . 18 ARG N . 6805 1
240 . 1 1 18 18 ARG NE N 15 85.2 0.05 . 1 . . . . 18 ARG NE . 6805 1
241 . 1 1 19 19 LEU H H 1 7.19 0.005 . 1 . . . . 19 LEU H . 6805 1
242 . 1 1 19 19 LEU HA H 1 4.49 0.005 . 1 . . . . 19 LEU HA . 6805 1
243 . 1 1 19 19 LEU HB2 H 1 1.94 0.005 . 1 . . . . 19 LEU HB2 . 6805 1
244 . 1 1 19 19 LEU HB3 H 1 1.20 0.005 . 1 . . . . 19 LEU HB3 . 6805 1
245 . 1 1 19 19 LEU HG H 1 2.06 0.005 . 1 . . . . 19 LEU HG . 6805 1
246 . 1 1 19 19 LEU HD11 H 1 0.70 0.005 . 1 . . . . 19 LEU HD1 . 6805 1
247 . 1 1 19 19 LEU HD12 H 1 0.70 0.005 . 1 . . . . 19 LEU HD1 . 6805 1
248 . 1 1 19 19 LEU HD13 H 1 0.70 0.005 . 1 . . . . 19 LEU HD1 . 6805 1
249 . 1 1 19 19 LEU HD21 H 1 0.81 0.005 . 1 . . . . 19 LEU HD2 . 6805 1
250 . 1 1 19 19 LEU HD22 H 1 0.81 0.005 . 1 . . . . 19 LEU HD2 . 6805 1
251 . 1 1 19 19 LEU HD23 H 1 0.81 0.005 . 1 . . . . 19 LEU HD2 . 6805 1
252 . 1 1 19 19 LEU C C 13 176.6 0.05 . 1 . . . . 19 LEU C . 6805 1
253 . 1 1 19 19 LEU CA C 13 52.6 0.05 . 1 . . . . 19 LEU CA . 6805 1
254 . 1 1 19 19 LEU CB C 13 39.7 0.05 . 1 . . . . 19 LEU CB . 6805 1
255 . 1 1 19 19 LEU CG C 13 25.3 0.05 . 1 . . . . 19 LEU CG . 6805 1
256 . 1 1 19 19 LEU CD1 C 13 27.2 0.05 . 1 . . . . 19 LEU CD1 . 6805 1
257 . 1 1 19 19 LEU CD2 C 13 23.3 0.05 . 1 . . . . 19 LEU CD2 . 6805 1
258 . 1 1 19 19 LEU N N 15 124.8 0.05 . 1 . . . . 19 LEU N . 6805 1
259 . 1 1 20 20 PRO HA H 1 4.38 0.005 . 1 . . . . 20 PRO HA . 6805 1
260 . 1 1 20 20 PRO HB2 H 1 2.27 0.005 . 2 . . . . 20 PRO HB2 . 6805 1
261 . 1 1 20 20 PRO HB3 H 1 1.96 0.005 . 2 . . . . 20 PRO HB3 . 6805 1
262 . 1 1 20 20 PRO HG2 H 1 2.11 0.005 . 2 . . . . 20 PRO HG2 . 6805 1
263 . 1 1 20 20 PRO HG3 H 1 1.96 0.005 . 2 . . . . 20 PRO HG3 . 6805 1
264 . 1 1 20 20 PRO HD2 H 1 4.06 0.005 . 2 . . . . 20 PRO HD2 . 6805 1
265 . 1 1 20 20 PRO HD3 H 1 3.80 0.005 . 2 . . . . 20 PRO HD3 . 6805 1
266 . 1 1 20 20 PRO C C 13 178.0 0.05 . 1 . . . . 20 PRO C . 6805 1
267 . 1 1 20 20 PRO CA C 13 64.6 0.05 . 1 . . . . 20 PRO CA . 6805 1
268 . 1 1 20 20 PRO CB C 13 32.8 0.05 . 1 . . . . 20 PRO CB . 6805 1
269 . 1 1 20 20 PRO CG C 13 27.2 0.05 . 1 . . . . 20 PRO CG . 6805 1
270 . 1 1 20 20 PRO CD C 13 51.3 0.05 . 1 . . . . 20 PRO CD . 6805 1
271 . 1 1 21 21 ASN H H 1 8.81 0.005 . 1 . . . . 21 ASN H . 6805 1
272 . 1 1 21 21 ASN HA H 1 4.96 0.005 . 1 . . . . 21 ASN HA . 6805 1
273 . 1 1 21 21 ASN HB2 H 1 2.88 0.005 . 2 . . . . 21 ASN HB2 . 6805 1
274 . 1 1 21 21 ASN HB3 H 1 2.84 0.005 . 2 . . . . 21 ASN HB3 . 6805 1
275 . 1 1 21 21 ASN HD21 H 1 6.98 0.005 . 2 . . . . 21 ASN HD21 . 6805 1
276 . 1 1 21 21 ASN HD22 H 1 7.41 0.005 . 2 . . . . 21 ASN HD22 . 6805 1
277 . 1 1 21 21 ASN C C 13 176.4 0.05 . 1 . . . . 21 ASN C . 6805 1
278 . 1 1 21 21 ASN CA C 13 52.6 0.05 . 1 . . . . 21 ASN CA . 6805 1
279 . 1 1 21 21 ASN CB C 13 38.8 0.05 . 1 . . . . 21 ASN CB . 6805 1
280 . 1 1 21 21 ASN N N 15 114.0 0.05 . 1 . . . . 21 ASN N . 6805 1
281 . 1 1 21 21 ASN ND2 N 15 115.6 0.05 . 1 . . . . 21 ASN ND2 . 6805 1
282 . 1 1 22 22 LEU H H 1 6.74 0.005 . 1 . . . . 22 LEU H . 6805 1
283 . 1 1 22 22 LEU HA H 1 4.44 0.005 . 1 . . . . 22 LEU HA . 6805 1
284 . 1 1 22 22 LEU HB2 H 1 1.83 0.005 . 1 . . . . 22 LEU HB2 . 6805 1
285 . 1 1 22 22 LEU HB3 H 1 1.49 0.005 . 1 . . . . 22 LEU HB3 . 6805 1
286 . 1 1 22 22 LEU HG H 1 1.69 0.005 . 1 . . . . 22 LEU HG . 6805 1
287 . 1 1 22 22 LEU HD11 H 1 0.98 0.005 . 1 . . . . 22 LEU HD1 . 6805 1
288 . 1 1 22 22 LEU HD12 H 1 0.98 0.005 . 1 . . . . 22 LEU HD1 . 6805 1
289 . 1 1 22 22 LEU HD13 H 1 0.98 0.005 . 1 . . . . 22 LEU HD1 . 6805 1
290 . 1 1 22 22 LEU HD21 H 1 0.85 0.005 . 1 . . . . 22 LEU HD2 . 6805 1
291 . 1 1 22 22 LEU HD22 H 1 0.85 0.005 . 1 . . . . 22 LEU HD2 . 6805 1
292 . 1 1 22 22 LEU HD23 H 1 0.85 0.005 . 1 . . . . 22 LEU HD2 . 6805 1
293 . 1 1 22 22 LEU C C 13 176.9 0.05 . 1 . . . . 22 LEU C . 6805 1
294 . 1 1 22 22 LEU CA C 13 54.3 0.05 . 1 . . . . 22 LEU CA . 6805 1
295 . 1 1 22 22 LEU CB C 13 42.7 0.05 . 1 . . . . 22 LEU CB . 6805 1
296 . 1 1 22 22 LEU CG C 13 27.2 0.05 . 1 . . . . 22 LEU CG . 6805 1
297 . 1 1 22 22 LEU CD1 C 13 27.1 0.05 . 1 . . . . 22 LEU CD1 . 6805 1
298 . 1 1 22 22 LEU CD2 C 13 22.4 0.05 . 1 . . . . 22 LEU CD2 . 6805 1
299 . 1 1 22 22 LEU N N 15 119.1 0.05 . 1 . . . . 22 LEU N . 6805 1
300 . 1 1 23 23 ASN H H 1 8.84 0.005 . 1 . . . . 23 ASN H . 6805 1
301 . 1 1 23 23 ASN HA H 1 4.97 0.005 . 1 . . . . 23 ASN HA . 6805 1
302 . 1 1 23 23 ASN HB2 H 1 3.21 0.005 . 1 . . . . 23 ASN HB2 . 6805 1
303 . 1 1 23 23 ASN HB3 H 1 2.80 0.005 . 1 . . . . 23 ASN HB3 . 6805 1
304 . 1 1 23 23 ASN HD21 H 1 7.00 0.005 . 2 . . . . 23 ASN HD21 . 6805 1
305 . 1 1 23 23 ASN HD22 H 1 7.65 0.005 . 2 . . . . 23 ASN HD22 . 6805 1
306 . 1 1 23 23 ASN C C 13 176.4 0.05 . 1 . . . . 23 ASN C . 6805 1
307 . 1 1 23 23 ASN CA C 13 51.4 0.05 . 1 . . . . 23 ASN CA . 6805 1
308 . 1 1 23 23 ASN CB C 13 39.3 0.05 . 1 . . . . 23 ASN CB . 6805 1
309 . 1 1 23 23 ASN N N 15 121.4 0.05 . 1 . . . . 23 ASN N . 6805 1
310 . 1 1 23 23 ASN ND2 N 15 113.8 0.05 . 1 . . . . 23 ASN ND2 . 6805 1
311 . 1 1 24 24 SER H H 1 8.77 0.005 . 1 . . . . 24 SER H . 6805 1
312 . 1 1 24 24 SER HA H 1 4.08 0.005 . 1 . . . . 24 SER HA . 6805 1
313 . 1 1 24 24 SER HB2 H 1 3.90 0.005 . 1 . . . . 24 SER HB2 . 6805 1
314 . 1 1 24 24 SER HB3 H 1 3.90 0.005 . 1 . . . . 24 SER HB3 . 6805 1
315 . 1 1 24 24 SER C C 13 176.1 0.05 . 1 . . . . 24 SER C . 6805 1
316 . 1 1 24 24 SER CA C 13 62.3 0.05 . 1 . . . . 24 SER CA . 6805 1
317 . 1 1 24 24 SER CB C 13 62.9 0.05 . 1 . . . . 24 SER CB . 6805 1
318 . 1 1 24 24 SER N N 15 115.6 0.05 . 1 . . . . 24 SER N . 6805 1
319 . 1 1 25 25 LEU H H 1 7.92 0.005 . 1 . . . . 25 LEU H . 6805 1
320 . 1 1 25 25 LEU HA H 1 4.05 0.005 . 1 . . . . 25 LEU HA . 6805 1
321 . 1 1 25 25 LEU HB2 H 1 1.53 0.005 . 2 . . . . 25 LEU HB2 . 6805 1
322 . 1 1 25 25 LEU HB3 H 1 1.81 0.005 . 2 . . . . 25 LEU HB3 . 6805 1
323 . 1 1 25 25 LEU HG H 1 1.66 0.005 . 1 . . . . 25 LEU HG . 6805 1
324 . 1 1 25 25 LEU HD11 H 1 0.88 0.005 . 1 . . . . 25 LEU HD1 . 6805 1
325 . 1 1 25 25 LEU HD12 H 1 0.88 0.005 . 1 . . . . 25 LEU HD1 . 6805 1
326 . 1 1 25 25 LEU HD13 H 1 0.88 0.005 . 1 . . . . 25 LEU HD1 . 6805 1
327 . 1 1 25 25 LEU HD21 H 1 0.84 0.005 . 1 . . . . 25 LEU HD2 . 6805 1
328 . 1 1 25 25 LEU HD22 H 1 0.84 0.005 . 1 . . . . 25 LEU HD2 . 6805 1
329 . 1 1 25 25 LEU HD23 H 1 0.84 0.005 . 1 . . . . 25 LEU HD2 . 6805 1
330 . 1 1 25 25 LEU C C 13 180.4 0.05 . 1 . . . . 25 LEU C . 6805 1
331 . 1 1 25 25 LEU CA C 13 58.0 0.05 . 1 . . . . 25 LEU CA . 6805 1
332 . 1 1 25 25 LEU CB C 13 41.3 0.05 . 1 . . . . 25 LEU CB . 6805 1
333 . 1 1 25 25 LEU CG C 13 27.1 0.05 . 1 . . . . 25 LEU CG . 6805 1
334 . 1 1 25 25 LEU CD1 C 13 25.0 0.05 . 1 . . . . 25 LEU CD1 . 6805 1
335 . 1 1 25 25 LEU CD2 C 13 23.5 0.05 . 1 . . . . 25 LEU CD2 . 6805 1
336 . 1 1 25 25 LEU N N 15 122.5 0.05 . 1 . . . . 25 LEU N . 6805 1
337 . 1 1 26 26 GLN H H 1 8.07 0.005 . 1 . . . . 26 GLN H . 6805 1
338 . 1 1 26 26 GLN HA H 1 3.93 0.005 . 1 . . . . 26 GLN HA . 6805 1
339 . 1 1 26 26 GLN HB2 H 1 2.58 0.005 . 1 . . . . 26 GLN HB2 . 6805 1
340 . 1 1 26 26 GLN HB3 H 1 1.69 0.005 . 1 . . . . 26 GLN HB3 . 6805 1
341 . 1 1 26 26 GLN HG2 H 1 2.67 0.005 . 2 . . . . 26 GLN HG2 . 6805 1
342 . 1 1 26 26 GLN HG3 H 1 2.31 0.005 . 2 . . . . 26 GLN HG3 . 6805 1
343 . 1 1 26 26 GLN HE21 H 1 7.66 0.005 . 2 . . . . 26 GLN HE21 . 6805 1
344 . 1 1 26 26 GLN HE22 H 1 8.34 0.005 . 2 . . . . 26 GLN HE22 . 6805 1
345 . 1 1 26 26 GLN C C 13 178.3 0.05 . 1 . . . . 26 GLN C . 6805 1
346 . 1 1 26 26 GLN CA C 13 58.3 0.05 . 1 . . . . 26 GLN CA . 6805 1
347 . 1 1 26 26 GLN CB C 13 28.6 0.05 . 1 . . . . 26 GLN CB . 6805 1
348 . 1 1 26 26 GLN CG C 13 34.4 0.05 . 1 . . . . 26 GLN CG . 6805 1
349 . 1 1 26 26 GLN N N 15 120.7 0.05 . 1 . . . . 26 GLN N . 6805 1
350 . 1 1 26 26 GLN NE2 N 15 114.1 0.05 . 1 . . . . 26 GLN NE2 . 6805 1
351 . 1 1 27 27 VAL H H 1 8.01 0.005 . 1 . . . . 27 VAL H . 6805 1
352 . 1 1 27 27 VAL HA H 1 3.51 0.005 . 1 . . . . 27 VAL HA . 6805 1
353 . 1 1 27 27 VAL HB H 1 2.19 0.005 . 1 . . . . 27 VAL HB . 6805 1
354 . 1 1 27 27 VAL HG11 H 1 0.93 0.005 . 1 . . . . 27 VAL HG1 . 6805 1
355 . 1 1 27 27 VAL HG12 H 1 0.93 0.005 . 1 . . . . 27 VAL HG1 . 6805 1
356 . 1 1 27 27 VAL HG13 H 1 0.93 0.005 . 1 . . . . 27 VAL HG1 . 6805 1
357 . 1 1 27 27 VAL HG21 H 1 1.03 0.005 . 1 . . . . 27 VAL HG2 . 6805 1
358 . 1 1 27 27 VAL HG22 H 1 1.03 0.005 . 1 . . . . 27 VAL HG2 . 6805 1
359 . 1 1 27 27 VAL HG23 H 1 1.03 0.005 . 1 . . . . 27 VAL HG2 . 6805 1
360 . 1 1 27 27 VAL C C 13 177.6 0.05 . 1 . . . . 27 VAL C . 6805 1
361 . 1 1 27 27 VAL CA C 13 68.1 0.05 . 1 . . . . 27 VAL CA . 6805 1
362 . 1 1 27 27 VAL CB C 13 32.0 0.05 . 1 . . . . 27 VAL CB . 6805 1
363 . 1 1 27 27 VAL CG1 C 13 22.1 0.05 . 1 . . . . 27 VAL CG1 . 6805 1
364 . 1 1 27 27 VAL CG2 C 13 23.9 0.05 . 1 . . . . 27 VAL CG2 . 6805 1
365 . 1 1 27 27 VAL N N 15 119.4 0.05 . 1 . . . . 27 VAL N . 6805 1
366 . 1 1 28 28 VAL H H 1 7.84 0.005 . 1 . . . . 28 VAL H . 6805 1
367 . 1 1 28 28 VAL HA H 1 3.46 0.005 . 1 . . . . 28 VAL HA . 6805 1
368 . 1 1 28 28 VAL HB H 1 2.08 0.005 . 1 . . . . 28 VAL HB . 6805 1
369 . 1 1 28 28 VAL HG11 H 1 0.91 0.005 . 1 . . . . 28 VAL HG1 . 6805 1
370 . 1 1 28 28 VAL HG12 H 1 0.91 0.005 . 1 . . . . 28 VAL HG1 . 6805 1
371 . 1 1 28 28 VAL HG13 H 1 0.91 0.005 . 1 . . . . 28 VAL HG1 . 6805 1
372 . 1 1 28 28 VAL HG21 H 1 1.06 0.005 . 1 . . . . 28 VAL HG2 . 6805 1
373 . 1 1 28 28 VAL HG22 H 1 1.06 0.005 . 1 . . . . 28 VAL HG2 . 6805 1
374 . 1 1 28 28 VAL HG23 H 1 1.06 0.005 . 1 . . . . 28 VAL HG2 . 6805 1
375 . 1 1 28 28 VAL C C 13 177.1 0.05 . 1 . . . . 28 VAL C . 6805 1
376 . 1 1 28 28 VAL CA C 13 66.9 0.05 . 1 . . . . 28 VAL CA . 6805 1
377 . 1 1 28 28 VAL CB C 13 31.7 0.05 . 1 . . . . 28 VAL CB . 6805 1
378 . 1 1 28 28 VAL CG1 C 13 21.3 0.05 . 1 . . . . 28 VAL CG1 . 6805 1
379 . 1 1 28 28 VAL CG2 C 13 23.5 0.05 . 1 . . . . 28 VAL CG2 . 6805 1
380 . 1 1 28 28 VAL N N 15 118.3 0.05 . 1 . . . . 28 VAL N . 6805 1
381 . 1 1 29 29 ALA H H 1 7.69 0.005 . 1 . . . . 29 ALA H . 6805 1
382 . 1 1 29 29 ALA HA H 1 4.09 0.005 . 1 . . . . 29 ALA HA . 6805 1
383 . 1 1 29 29 ALA HB1 H 1 1.31 0.005 . 1 . . . . 29 ALA HB . 6805 1
384 . 1 1 29 29 ALA HB2 H 1 1.31 0.005 . 1 . . . . 29 ALA HB . 6805 1
385 . 1 1 29 29 ALA HB3 H 1 1.31 0.005 . 1 . . . . 29 ALA HB . 6805 1
386 . 1 1 29 29 ALA C C 13 181.4 0.05 . 1 . . . . 29 ALA C . 6805 1
387 . 1 1 29 29 ALA CA C 13 55.4 0.05 . 1 . . . . 29 ALA CA . 6805 1
388 . 1 1 29 29 ALA CB C 13 17.8 0.05 . 1 . . . . 29 ALA CB . 6805 1
389 . 1 1 29 29 ALA N N 15 122.1 0.05 . 1 . . . . 29 ALA N . 6805 1
390 . 1 1 30 30 PHE H H 1 8.15 0.005 . 1 . . . . 30 PHE H . 6805 1
391 . 1 1 30 30 PHE HA H 1 4.36 0.005 . 1 . . . . 30 PHE HA . 6805 1
392 . 1 1 30 30 PHE HB2 H 1 3.14 0.005 . 1 . . . . 30 PHE HB2 . 6805 1
393 . 1 1 30 30 PHE HB3 H 1 2.96 0.005 . 1 . . . . 30 PHE HB3 . 6805 1
394 . 1 1 30 30 PHE HD1 H 1 7.24 0.005 . 1 . . . . 30 PHE HD1 . 6805 1
395 . 1 1 30 30 PHE HD2 H 1 7.24 0.005 . 1 . . . . 30 PHE HD2 . 6805 1
396 . 1 1 30 30 PHE HE1 H 1 7.26 0.005 . 1 . . . . 30 PHE HE1 . 6805 1
397 . 1 1 30 30 PHE HE2 H 1 7.26 0.005 . 1 . . . . 30 PHE HE2 . 6805 1
398 . 1 1 30 30 PHE HZ H 1 7.09 0.005 . 1 . . . . 30 PHE HZ . 6805 1
399 . 1 1 30 30 PHE C C 13 178.2 0.05 . 1 . . . . 30 PHE C . 6805 1
400 . 1 1 30 30 PHE CA C 13 62.3 0.05 . 1 . . . . 30 PHE CA . 6805 1
401 . 1 1 30 30 PHE CB C 13 39.3 0.05 . 1 . . . . 30 PHE CB . 6805 1
402 . 1 1 30 30 PHE N N 15 117.6 0.05 . 1 . . . . 30 PHE N . 6805 1
403 . 1 1 31 31 ILE H H 1 8.52 0.005 . 1 . . . . 31 ILE H . 6805 1
404 . 1 1 31 31 ILE HA H 1 3.60 0.005 . 1 . . . . 31 ILE HA . 6805 1
405 . 1 1 31 31 ILE HB H 1 1.99 0.005 . 1 . . . . 31 ILE HB . 6805 1
406 . 1 1 31 31 ILE HG12 H 1 1.78 0.005 . 2 . . . . 31 ILE HG12 . 6805 1
407 . 1 1 31 31 ILE HG13 H 1 1.20 0.005 . 2 . . . . 31 ILE HG13 . 6805 1
408 . 1 1 31 31 ILE HG21 H 1 0.85 0.005 . 1 . . . . 31 ILE HG2 . 6805 1
409 . 1 1 31 31 ILE HG22 H 1 0.85 0.005 . 1 . . . . 31 ILE HG2 . 6805 1
410 . 1 1 31 31 ILE HG23 H 1 0.85 0.005 . 1 . . . . 31 ILE HG2 . 6805 1
411 . 1 1 31 31 ILE HD11 H 1 0.79 0.005 . 1 . . . . 31 ILE HD1 . 6805 1
412 . 1 1 31 31 ILE HD12 H 1 0.79 0.005 . 1 . . . . 31 ILE HD1 . 6805 1
413 . 1 1 31 31 ILE HD13 H 1 0.79 0.005 . 1 . . . . 31 ILE HD1 . 6805 1
414 . 1 1 31 31 ILE C C 13 178.3 0.05 . 1 . . . . 31 ILE C . 6805 1
415 . 1 1 31 31 ILE CA C 13 65.6 0.05 . 1 . . . . 31 ILE CA . 6805 1
416 . 1 1 31 31 ILE CB C 13 36.7 0.05 . 1 . . . . 31 ILE CB . 6805 1
417 . 1 1 31 31 ILE CG1 C 13 29.4 0.05 . 1 . . . . 31 ILE CG1 . 6805 1
418 . 1 1 31 31 ILE CG2 C 13 17.5 0.05 . 1 . . . . 31 ILE CG2 . 6805 1
419 . 1 1 31 31 ILE CD1 C 13 13.5 0.05 . 1 . . . . 31 ILE CD1 . 6805 1
420 . 1 1 31 31 ILE N N 15 120.3 0.05 . 1 . . . . 31 ILE N . 6805 1
421 . 1 1 32 32 ASN H H 1 8.83 0.005 . 1 . . . . 32 ASN H . 6805 1
422 . 1 1 32 32 ASN HA H 1 4.38 0.005 . 1 . . . . 32 ASN HA . 6805 1
423 . 1 1 32 32 ASN HB2 H 1 2.90 0.005 . 2 . . . . 32 ASN HB2 . 6805 1
424 . 1 1 32 32 ASN HB3 H 1 2.87 0.005 . 2 . . . . 32 ASN HB3 . 6805 1
425 . 1 1 32 32 ASN HD21 H 1 6.81 0.005 . 2 . . . . 32 ASN HD21 . 6805 1
426 . 1 1 32 32 ASN HD22 H 1 7.55 0.005 . 2 . . . . 32 ASN HD22 . 6805 1
427 . 1 1 32 32 ASN C C 13 178.0 0.05 . 1 . . . . 32 ASN C . 6805 1
428 . 1 1 32 32 ASN CA C 13 56.4 0.05 . 1 . . . . 32 ASN CA . 6805 1
429 . 1 1 32 32 ASN CB C 13 37.9 0.05 . 1 . . . . 32 ASN CB . 6805 1
430 . 1 1 32 32 ASN N N 15 120.1 0.05 . 1 . . . . 32 ASN N . 6805 1
431 . 1 1 32 32 ASN ND2 N 15 112.7 0.05 . 1 . . . . 32 ASN ND2 . 6805 1
432 . 1 1 33 33 SER H H 1 8.05 0.005 . 1 . . . . 33 SER H . 6805 1
433 . 1 1 33 33 SER HA H 1 4.27 0.005 . 1 . . . . 33 SER HA . 6805 1
434 . 1 1 33 33 SER HB2 H 1 4.07 0.005 . 1 . . . . 33 SER HB2 . 6805 1
435 . 1 1 33 33 SER HB3 H 1 3.94 0.005 . 1 . . . . 33 SER HB3 . 6805 1
436 . 1 1 33 33 SER C C 13 176.3 0.05 . 1 . . . . 33 SER C . 6805 1
437 . 1 1 33 33 SER CA C 13 62.4 0.05 . 1 . . . . 33 SER CA . 6805 1
438 . 1 1 33 33 SER CB C 13 63.4 0.05 . 1 . . . . 33 SER CB . 6805 1
439 . 1 1 33 33 SER N N 15 117.2 0.05 . 1 . . . . 33 SER N . 6805 1
440 . 1 1 34 34 LEU H H 1 8.06 0.005 . 1 . . . . 34 LEU H . 6805 1
441 . 1 1 34 34 LEU HA H 1 3.88 0.005 . 1 . . . . 34 LEU HA . 6805 1
442 . 1 1 34 34 LEU HB2 H 1 1.31 0.005 . 2 . . . . 34 LEU HB2 . 6805 1
443 . 1 1 34 34 LEU HB3 H 1 1.91 0.005 . 2 . . . . 34 LEU HB3 . 6805 1
444 . 1 1 34 34 LEU HG H 1 1.83 0.005 . 1 . . . . 34 LEU HG . 6805 1
445 . 1 1 34 34 LEU HD11 H 1 0.80 0.005 . 1 . . . . 34 LEU HD1 . 6805 1
446 . 1 1 34 34 LEU HD12 H 1 0.80 0.005 . 1 . . . . 34 LEU HD1 . 6805 1
447 . 1 1 34 34 LEU HD13 H 1 0.80 0.005 . 1 . . . . 34 LEU HD1 . 6805 1
448 . 1 1 34 34 LEU HD21 H 1 0.85 0.005 . 1 . . . . 34 LEU HD2 . 6805 1
449 . 1 1 34 34 LEU HD22 H 1 0.85 0.005 . 1 . . . . 34 LEU HD2 . 6805 1
450 . 1 1 34 34 LEU HD23 H 1 0.85 0.005 . 1 . . . . 34 LEU HD2 . 6805 1
451 . 1 1 34 34 LEU C C 13 178.0 0.05 . 1 . . . . 34 LEU C . 6805 1
452 . 1 1 34 34 LEU CA C 13 57.3 0.05 . 1 . . . . 34 LEU CA . 6805 1
453 . 1 1 34 34 LEU CB C 13 42.3 0.05 . 1 . . . . 34 LEU CB . 6805 1
454 . 1 1 34 34 LEU CG C 13 27.2 0.05 . 1 . . . . 34 LEU CG . 6805 1
455 . 1 1 34 34 LEU CD1 C 13 26.2 0.05 . 1 . . . . 34 LEU CD1 . 6805 1
456 . 1 1 34 34 LEU CD2 C 13 25.6 0.05 . 1 . . . . 34 LEU CD2 . 6805 1
457 . 1 1 34 34 LEU N N 15 123.5 0.05 . 1 . . . . 34 LEU N . 6805 1
458 . 1 1 35 35 ARG H H 1 8.03 0.005 . 1 . . . . 35 ARG H . 6805 1
459 . 1 1 35 35 ARG HA H 1 3.92 0.005 . 1 . . . . 35 ARG HA . 6805 1
460 . 1 1 35 35 ARG HB2 H 1 2.08 0.005 . 1 . . . . 35 ARG HB2 . 6805 1
461 . 1 1 35 35 ARG HB3 H 1 1.90 0.005 . 1 . . . . 35 ARG HB3 . 6805 1
462 . 1 1 35 35 ARG HG2 H 1 1.86 0.005 . 2 . . . . 35 ARG HG2 . 6805 1
463 . 1 1 35 35 ARG HG3 H 1 1.56 0.005 . 2 . . . . 35 ARG HG3 . 6805 1
464 . 1 1 35 35 ARG HD2 H 1 3.17 0.005 . 1 . . . . 35 ARG HD2 . 6805 1
465 . 1 1 35 35 ARG HD3 H 1 3.17 0.005 . 1 . . . . 35 ARG HD3 . 6805 1
466 . 1 1 35 35 ARG HE H 1 7.26 0.005 . 1 . . . . 35 ARG HE . 6805 1
467 . 1 1 35 35 ARG C C 13 177.9 0.05 . 1 . . . . 35 ARG C . 6805 1
468 . 1 1 35 35 ARG CA C 13 58.9 0.05 . 1 . . . . 35 ARG CA . 6805 1
469 . 1 1 35 35 ARG CB C 13 30.0 0.05 . 1 . . . . 35 ARG CB . 6805 1
470 . 1 1 35 35 ARG CG C 13 27.5 0.05 . 1 . . . . 35 ARG CG . 6805 1
471 . 1 1 35 35 ARG CD C 13 43.8 0.05 . 1 . . . . 35 ARG CD . 6805 1
472 . 1 1 35 35 ARG N N 15 119.0 0.05 . 1 . . . . 35 ARG N . 6805 1
473 . 1 1 35 35 ARG NE N 15 85.2 0.05 . 1 . . . . 35 ARG NE . 6805 1
474 . 1 1 36 36 ASP H H 1 7.60 0.005 . 1 . . . . 36 ASP H . 6805 1
475 . 1 1 36 36 ASP HA H 1 4.47 0.005 . 1 . . . . 36 ASP HA . 6805 1
476 . 1 1 36 36 ASP HB2 H 1 2.69 0.005 . 1 . . . . 36 ASP HB2 . 6805 1
477 . 1 1 36 36 ASP HB3 H 1 2.69 0.005 . 1 . . . . 36 ASP HB3 . 6805 1
478 . 1 1 36 36 ASP C C 13 176.9 0.05 . 1 . . . . 36 ASP C . 6805 1
479 . 1 1 36 36 ASP CA C 13 56.5 0.05 . 1 . . . . 36 ASP CA . 6805 1
480 . 1 1 36 36 ASP CB C 13 41.1 0.05 . 1 . . . . 36 ASP CB . 6805 1
481 . 1 1 36 36 ASP N N 15 118.2 0.05 . 1 . . . . 36 ASP N . 6805 1
482 . 1 1 37 37 ASP H H 1 7.61 0.005 . 1 . . . . 37 ASP H . 6805 1
483 . 1 1 37 37 ASP HA H 1 4.96 0.005 . 1 . . . . 37 ASP HA . 6805 1
484 . 1 1 37 37 ASP HB2 H 1 2.55 0.005 . 2 . . . . 37 ASP HB2 . 6805 1
485 . 1 1 37 37 ASP HB3 H 1 2.90 0.005 . 2 . . . . 37 ASP HB3 . 6805 1
486 . 1 1 37 37 ASP CA C 13 51.6 0.05 . 1 . . . . 37 ASP CA . 6805 1
487 . 1 1 37 37 ASP CB C 13 40.6 0.05 . 1 . . . . 37 ASP CB . 6805 1
488 . 1 1 37 37 ASP N N 15 114.8 0.05 . 1 . . . . 37 ASP N . 6805 1
489 . 1 1 38 38 PRO HA H 1 4.41 0.005 . 1 . . . . 38 PRO HA . 6805 1
490 . 1 1 38 38 PRO HB2 H 1 2.14 0.005 . 2 . . . . 38 PRO HB2 . 6805 1
491 . 1 1 38 38 PRO HB3 H 1 1.96 0.005 . 2 . . . . 38 PRO HB3 . 6805 1
492 . 1 1 38 38 PRO HG2 H 1 2.04 0.005 . 2 . . . . 38 PRO HG2 . 6805 1
493 . 1 1 38 38 PRO HG3 H 1 1.96 0.005 . 2 . . . . 38 PRO HG3 . 6805 1
494 . 1 1 38 38 PRO HD2 H 1 3.90 0.005 . 2 . . . . 38 PRO HD2 . 6805 1
495 . 1 1 38 38 PRO HD3 H 1 3.56 0.005 . 2 . . . . 38 PRO HD3 . 6805 1
496 . 1 1 38 38 PRO C C 13 178.5 0.05 . 1 . . . . 38 PRO C . 6805 1
497 . 1 1 38 38 PRO CA C 13 64.2 0.05 . 1 . . . . 38 PRO CA . 6805 1
498 . 1 1 38 38 PRO CB C 13 31.9 0.05 . 1 . . . . 38 PRO CB . 6805 1
499 . 1 1 38 38 PRO CG C 13 27.1 0.05 . 1 . . . . 38 PRO CG . 6805 1
500 . 1 1 38 38 PRO CD C 13 50.3 0.05 . 1 . . . . 38 PRO CD . 6805 1
501 . 1 1 39 39 SER H H 1 8.19 0.005 . 1 . . . . 39 SER H . 6805 1
502 . 1 1 39 39 SER HA H 1 3.72 0.005 . 1 . . . . 39 SER HA . 6805 1
503 . 1 1 39 39 SER HB2 H 1 3.74 0.005 . 1 . . . . 39 SER HB2 . 6805 1
504 . 1 1 39 39 SER HB3 H 1 3.74 0.005 . 1 . . . . 39 SER HB3 . 6805 1
505 . 1 1 39 39 SER C C 13 175.9 0.05 . 1 . . . . 39 SER C . 6805 1
506 . 1 1 39 39 SER CA C 13 61.0 0.05 . 1 . . . . 39 SER CA . 6805 1
507 . 1 1 39 39 SER CB C 13 62.6 0.05 . 1 . . . . 39 SER CB . 6805 1
508 . 1 1 39 39 SER N N 15 117.0 0.05 . 1 . . . . 39 SER N . 6805 1
509 . 1 1 40 40 GLN H H 1 7.48 0.005 . 1 . . . . 40 GLN H . 6805 1
510 . 1 1 40 40 GLN HA H 1 4.55 0.005 . 1 . . . . 40 GLN HA . 6805 1
511 . 1 1 40 40 GLN HB2 H 1 1.91 0.005 . 1 . . . . 40 GLN HB2 . 6805 1
512 . 1 1 40 40 GLN HB3 H 1 2.57 0.005 . 1 . . . . 40 GLN HB3 . 6805 1
513 . 1 1 40 40 GLN HG2 H 1 2.39 0.005 . 2 . . . . 40 GLN HG2 . 6805 1
514 . 1 1 40 40 GLN HG3 H 1 2.23 0.005 . 2 . . . . 40 GLN HG3 . 6805 1
515 . 1 1 40 40 GLN HE21 H 1 6.82 0.005 . 2 . . . . 40 GLN HE21 . 6805 1
516 . 1 1 40 40 GLN HE22 H 1 7.46 0.005 . 2 . . . . 40 GLN HE22 . 6805 1
517 . 1 1 40 40 GLN C C 13 175.9 0.05 . 1 . . . . 40 GLN C . 6805 1
518 . 1 1 40 40 GLN CA C 13 55.3 0.05 . 1 . . . . 40 GLN CA . 6805 1
519 . 1 1 40 40 GLN CB C 13 28.3 0.05 . 1 . . . . 40 GLN CB . 6805 1
520 . 1 1 40 40 GLN CG C 13 33.5 0.05 . 1 . . . . 40 GLN CG . 6805 1
521 . 1 1 40 40 GLN N N 15 120.7 0.05 . 1 . . . . 40 GLN N . 6805 1
522 . 1 1 40 40 GLN NE2 N 15 114.4 0.05 . 1 . . . . 40 GLN NE2 . 6805 1
523 . 1 1 41 41 SER H H 1 7.52 0.005 . 1 . . . . 41 SER H . 6805 1
524 . 1 1 41 41 SER HA H 1 3.87 0.005 . 1 . . . . 41 SER HA . 6805 1
525 . 1 1 41 41 SER HB2 H 1 3.90 0.005 . 2 . . . . 41 SER HB2 . 6805 1
526 . 1 1 41 41 SER HB3 H 1 3.73 0.005 . 2 . . . . 41 SER HB3 . 6805 1
527 . 1 1 41 41 SER C C 13 174.4 0.05 . 1 . . . . 41 SER C . 6805 1
528 . 1 1 41 41 SER CA C 13 63.8 0.05 . 1 . . . . 41 SER CA . 6805 1
529 . 1 1 41 41 SER CB C 13 63.2 0.05 . 1 . . . . 41 SER CB . 6805 1
530 . 1 1 41 41 SER N N 15 116.4 0.05 . 1 . . . . 41 SER N . 6805 1
531 . 1 1 42 42 ALA H H 1 8.53 0.005 . 1 . . . . 42 ALA H . 6805 1
532 . 1 1 42 42 ALA HA H 1 4.08 0.005 . 1 . . . . 42 ALA HA . 6805 1
533 . 1 1 42 42 ALA HB1 H 1 1.41 0.005 . 1 . . . . 42 ALA HB . 6805 1
534 . 1 1 42 42 ALA HB2 H 1 1.41 0.005 . 1 . . . . 42 ALA HB . 6805 1
535 . 1 1 42 42 ALA HB3 H 1 1.41 0.005 . 1 . . . . 42 ALA HB . 6805 1
536 . 1 1 42 42 ALA C C 13 181.0 0.05 . 1 . . . . 42 ALA C . 6805 1
537 . 1 1 42 42 ALA CA C 13 55.6 0.05 . 1 . . . . 42 ALA CA . 6805 1
538 . 1 1 42 42 ALA CB C 13 17.6 0.05 . 1 . . . . 42 ALA CB . 6805 1
539 . 1 1 42 42 ALA N N 15 123.4 0.05 . 1 . . . . 42 ALA N . 6805 1
540 . 1 1 43 43 ASN H H 1 8.05 0.005 . 1 . . . . 43 ASN H . 6805 1
541 . 1 1 43 43 ASN HA H 1 4.48 0.005 . 1 . . . . 43 ASN HA . 6805 1
542 . 1 1 43 43 ASN HB2 H 1 2.85 0.005 . 1 . . . . 43 ASN HB2 . 6805 1
543 . 1 1 43 43 ASN HB3 H 1 2.85 0.005 . 1 . . . . 43 ASN HB3 . 6805 1
544 . 1 1 43 43 ASN HD21 H 1 6.96 0.005 . 2 . . . . 43 ASN HD21 . 6805 1
545 . 1 1 43 43 ASN HD22 H 1 7.72 0.005 . 2 . . . . 43 ASN HD22 . 6805 1
546 . 1 1 43 43 ASN C C 13 178.0 0.05 . 1 . . . . 43 ASN C . 6805 1
547 . 1 1 43 43 ASN CA C 13 56.0 0.05 . 1 . . . . 43 ASN CA . 6805 1
548 . 1 1 43 43 ASN CB C 13 38.1 0.05 . 1 . . . . 43 ASN CB . 6805 1
549 . 1 1 43 43 ASN N N 15 119.1 0.05 . 1 . . . . 43 ASN N . 6805 1
550 . 1 1 43 43 ASN ND2 N 15 113.4 0.05 . 1 . . . . 43 ASN ND2 . 6805 1
551 . 1 1 44 44 LEU H H 1 8.66 0.005 . 1 . . . . 44 LEU H . 6805 1
552 . 1 1 44 44 LEU HA H 1 4.19 0.005 . 1 . . . . 44 LEU HA . 6805 1
553 . 1 1 44 44 LEU HB2 H 1 1.81 0.005 . 1 . . . . 44 LEU HB2 . 6805 1
554 . 1 1 44 44 LEU HB3 H 1 1.33 0.005 . 1 . . . . 44 LEU HB3 . 6805 1
555 . 1 1 44 44 LEU HG H 1 1.86 0.005 . 1 . . . . 44 LEU HG . 6805 1
556 . 1 1 44 44 LEU HD11 H 1 0.85 0.005 . 1 . . . . 44 LEU HD1 . 6805 1
557 . 1 1 44 44 LEU HD12 H 1 0.85 0.005 . 1 . . . . 44 LEU HD1 . 6805 1
558 . 1 1 44 44 LEU HD13 H 1 0.85 0.005 . 1 . . . . 44 LEU HD1 . 6805 1
559 . 1 1 44 44 LEU HD21 H 1 1.03 0.005 . 1 . . . . 44 LEU HD2 . 6805 1
560 . 1 1 44 44 LEU HD22 H 1 1.03 0.005 . 1 . . . . 44 LEU HD2 . 6805 1
561 . 1 1 44 44 LEU HD23 H 1 1.03 0.005 . 1 . . . . 44 LEU HD2 . 6805 1
562 . 1 1 44 44 LEU C C 13 178.7 0.05 . 1 . . . . 44 LEU C . 6805 1
563 . 1 1 44 44 LEU CA C 13 57.9 0.05 . 1 . . . . 44 LEU CA . 6805 1
564 . 1 1 44 44 LEU CB C 13 41.7 0.05 . 1 . . . . 44 LEU CB . 6805 1
565 . 1 1 44 44 LEU CG C 13 27.4 0.05 . 1 . . . . 44 LEU CG . 6805 1
566 . 1 1 44 44 LEU CD1 C 13 26.0 0.05 . 1 . . . . 44 LEU CD1 . 6805 1
567 . 1 1 44 44 LEU CD2 C 13 23.4 0.05 . 1 . . . . 44 LEU CD2 . 6805 1
568 . 1 1 44 44 LEU N N 15 122.3 0.05 . 1 . . . . 44 LEU N . 6805 1
569 . 1 1 45 45 LEU H H 1 8.33 0.005 . 1 . . . . 45 LEU H . 6805 1
570 . 1 1 45 45 LEU HA H 1 3.82 0.005 . 1 . . . . 45 LEU HA . 6805 1
571 . 1 1 45 45 LEU HB2 H 1 1.81 0.005 . 2 . . . . 45 LEU HB2 . 6805 1
572 . 1 1 45 45 LEU HB3 H 1 1.51 0.005 . 2 . . . . 45 LEU HB3 . 6805 1
573 . 1 1 45 45 LEU HG H 1 1.55 0.005 . 1 . . . . 45 LEU HG . 6805 1
574 . 1 1 45 45 LEU HD11 H 1 0.86 0.005 . 1 . . . . 45 LEU HD1 . 6805 1
575 . 1 1 45 45 LEU HD12 H 1 0.86 0.005 . 1 . . . . 45 LEU HD1 . 6805 1
576 . 1 1 45 45 LEU HD13 H 1 0.86 0.005 . 1 . . . . 45 LEU HD1 . 6805 1
577 . 1 1 45 45 LEU HD21 H 1 0.86 0.005 . 1 . . . . 45 LEU HD2 . 6805 1
578 . 1 1 45 45 LEU HD22 H 1 0.86 0.005 . 1 . . . . 45 LEU HD2 . 6805 1
579 . 1 1 45 45 LEU HD23 H 1 0.86 0.005 . 1 . . . . 45 LEU HD2 . 6805 1
580 . 1 1 45 45 LEU C C 13 178.2 0.05 . 1 . . . . 45 LEU C . 6805 1
581 . 1 1 45 45 LEU CA C 13 58.0 0.05 . 1 . . . . 45 LEU CA . 6805 1
582 . 1 1 45 45 LEU CB C 13 41.5 0.05 . 1 . . . . 45 LEU CB . 6805 1
583 . 1 1 45 45 LEU CG C 13 27.2 0.05 . 1 . . . . 45 LEU CG . 6805 1
584 . 1 1 45 45 LEU CD1 C 13 23.9 0.05 . 1 . . . . 45 LEU CD1 . 6805 1
585 . 1 1 45 45 LEU CD2 C 13 25.1 0.05 . 1 . . . . 45 LEU CD2 . 6805 1
586 . 1 1 45 45 LEU N N 15 120.4 0.05 . 1 . . . . 45 LEU N . 6805 1
587 . 1 1 46 46 ALA H H 1 7.56 0.005 . 1 . . . . 46 ALA H . 6805 1
588 . 1 1 46 46 ALA HA H 1 4.03 0.005 . 1 . . . . 46 ALA HA . 6805 1
589 . 1 1 46 46 ALA HB1 H 1 1.53 0.005 . 1 . . . . 46 ALA HB . 6805 1
590 . 1 1 46 46 ALA HB2 H 1 1.53 0.005 . 1 . . . . 46 ALA HB . 6805 1
591 . 1 1 46 46 ALA HB3 H 1 1.53 0.005 . 1 . . . . 46 ALA HB . 6805 1
592 . 1 1 46 46 ALA C C 13 181.2 0.05 . 1 . . . . 46 ALA C . 6805 1
593 . 1 1 46 46 ALA CA C 13 55.4 0.05 . 1 . . . . 46 ALA CA . 6805 1
594 . 1 1 46 46 ALA CB C 13 17.7 0.05 . 1 . . . . 46 ALA CB . 6805 1
595 . 1 1 46 46 ALA N N 15 120.7 0.05 . 1 . . . . 46 ALA N . 6805 1
596 . 1 1 47 47 GLU H H 1 8.04 0.005 . 1 . . . . 47 GLU H . 6805 1
597 . 1 1 47 47 GLU HA H 1 4.03 0.005 . 1 . . . . 47 GLU HA . 6805 1
598 . 1 1 47 47 GLU HB2 H 1 2.27 0.005 . 1 . . . . 47 GLU HB2 . 6805 1
599 . 1 1 47 47 GLU HB3 H 1 2.27 0.005 . 1 . . . . 47 GLU HB3 . 6805 1
600 . 1 1 47 47 GLU HG2 H 1 2.46 0.005 . 2 . . . . 47 GLU HG2 . 6805 1
601 . 1 1 47 47 GLU HG3 H 1 2.44 0.005 . 2 . . . . 47 GLU HG3 . 6805 1
602 . 1 1 47 47 GLU C C 13 179.0 0.05 . 1 . . . . 47 GLU C . 6805 1
603 . 1 1 47 47 GLU CA C 13 59.3 0.05 . 1 . . . . 47 GLU CA . 6805 1
604 . 1 1 47 47 GLU CB C 13 29.5 0.05 . 1 . . . . 47 GLU CB . 6805 1
605 . 1 1 47 47 GLU CG C 13 35.8 0.05 . 1 . . . . 47 GLU CG . 6805 1
606 . 1 1 47 47 GLU N N 15 120.6 0.05 . 1 . . . . 47 GLU N . 6805 1
607 . 1 1 48 48 ALA H H 1 8.51 0.005 . 1 . . . . 48 ALA H . 6805 1
608 . 1 1 48 48 ALA HA H 1 3.66 0.005 . 1 . . . . 48 ALA HA . 6805 1
609 . 1 1 48 48 ALA HB1 H 1 0.59 0.005 . 1 . . . . 48 ALA HB . 6805 1
610 . 1 1 48 48 ALA HB2 H 1 0.59 0.005 . 1 . . . . 48 ALA HB . 6805 1
611 . 1 1 48 48 ALA HB3 H 1 0.59 0.005 . 1 . . . . 48 ALA HB . 6805 1
612 . 1 1 48 48 ALA C C 13 179.5 0.05 . 1 . . . . 48 ALA C . 6805 1
613 . 1 1 48 48 ALA CA C 13 55.4 0.05 . 1 . . . . 48 ALA CA . 6805 1
614 . 1 1 48 48 ALA CB C 13 17.5 0.05 . 1 . . . . 48 ALA CB . 6805 1
615 . 1 1 48 48 ALA N N 15 124.5 0.05 . 1 . . . . 48 ALA N . 6805 1
616 . 1 1 49 49 LYS H H 1 8.31 0.005 . 1 . . . . 49 LYS H . 6805 1
617 . 1 1 49 49 LYS HA H 1 3.78 0.005 . 1 . . . . 49 LYS HA . 6805 1
618 . 1 1 49 49 LYS HB2 H 1 1.81 0.005 . 1 . . . . 49 LYS HB2 . 6805 1
619 . 1 1 49 49 LYS HB3 H 1 1.95 0.005 . 1 . . . . 49 LYS HB3 . 6805 1
620 . 1 1 49 49 LYS HG2 H 1 1.59 0.005 . 2 . . . . 49 LYS HG2 . 6805 1
621 . 1 1 49 49 LYS HG3 H 1 1.34 0.005 . 2 . . . . 49 LYS HG3 . 6805 1
622 . 1 1 49 49 LYS HD2 H 1 1.66 0.005 . 2 . . . . 49 LYS HD2 . 6805 1
623 . 1 1 49 49 LYS HD3 H 1 1.60 0.005 . 2 . . . . 49 LYS HD3 . 6805 1
624 . 1 1 49 49 LYS HE2 H 1 2.95 0.005 . 2 . . . . 49 LYS HE2 . 6805 1
625 . 1 1 49 49 LYS HE3 H 1 2.81 0.005 . 2 . . . . 49 LYS HE3 . 6805 1
626 . 1 1 49 49 LYS C C 13 178.8 0.05 . 1 . . . . 49 LYS C . 6805 1
627 . 1 1 49 49 LYS CA C 13 60.3 0.05 . 1 . . . . 49 LYS CA . 6805 1
628 . 1 1 49 49 LYS CB C 13 32.3 0.05 . 1 . . . . 49 LYS CB . 6805 1
629 . 1 1 49 49 LYS CG C 13 26.6 0.05 . 1 . . . . 49 LYS CG . 6805 1
630 . 1 1 49 49 LYS CD C 13 29.4 0.05 . 1 . . . . 49 LYS CD . 6805 1
631 . 1 1 49 49 LYS CE C 13 41.9 0.05 . 1 . . . . 49 LYS CE . 6805 1
632 . 1 1 49 49 LYS N N 15 118.9 0.05 . 1 . . . . 49 LYS N . 6805 1
633 . 1 1 50 50 LYS H H 1 7.69 0.005 . 1 . . . . 50 LYS H . 6805 1
634 . 1 1 50 50 LYS HA H 1 4.12 0.005 . 1 . . . . 50 LYS HA . 6805 1
635 . 1 1 50 50 LYS HB2 H 1 1.95 0.005 . 1 . . . . 50 LYS HB2 . 6805 1
636 . 1 1 50 50 LYS HB3 H 1 1.95 0.005 . 1 . . . . 50 LYS HB3 . 6805 1
637 . 1 1 50 50 LYS HG2 H 1 1.62 0.005 . 2 . . . . 50 LYS HG2 . 6805 1
638 . 1 1 50 50 LYS HG3 H 1 1.42 0.005 . 2 . . . . 50 LYS HG3 . 6805 1
639 . 1 1 50 50 LYS HD2 H 1 1.71 0.005 . 1 . . . . 50 LYS HD2 . 6805 1
640 . 1 1 50 50 LYS HD3 H 1 1.71 0.005 . 1 . . . . 50 LYS HD3 . 6805 1
641 . 1 1 50 50 LYS HE2 H 1 2.93 0.005 . 1 . . . . 50 LYS HE2 . 6805 1
642 . 1 1 50 50 LYS HE3 H 1 2.93 0.005 . 1 . . . . 50 LYS HE3 . 6805 1
643 . 1 1 50 50 LYS C C 13 179.9 0.05 . 1 . . . . 50 LYS C . 6805 1
644 . 1 1 50 50 LYS CA C 13 59.6 0.05 . 1 . . . . 50 LYS CA . 6805 1
645 . 1 1 50 50 LYS CB C 13 32.5 0.05 . 1 . . . . 50 LYS CB . 6805 1
646 . 1 1 50 50 LYS CG C 13 25.1 0.05 . 1 . . . . 50 LYS CG . 6805 1
647 . 1 1 50 50 LYS CD C 13 29.6 0.05 . 1 . . . . 50 LYS CD . 6805 1
648 . 1 1 50 50 LYS CE C 13 42.0 0.05 . 1 . . . . 50 LYS CE . 6805 1
649 . 1 1 50 50 LYS N N 15 121.0 0.05 . 1 . . . . 50 LYS N . 6805 1
650 . 1 1 51 51 LEU H H 1 8.14 0.005 . 1 . . . . 51 LEU H . 6805 1
651 . 1 1 51 51 LEU HA H 1 4.14 0.005 . 1 . . . . 51 LEU HA . 6805 1
652 . 1 1 51 51 LEU HB2 H 1 1.73 0.005 . 1 . . . . 51 LEU HB2 . 6805 1
653 . 1 1 51 51 LEU HB3 H 1 1.73 0.005 . 1 . . . . 51 LEU HB3 . 6805 1
654 . 1 1 51 51 LEU HG H 1 1.58 0.005 . 1 . . . . 51 LEU HG . 6805 1
655 . 1 1 51 51 LEU HD11 H 1 0.97 0.005 . 1 . . . . 51 LEU HD1 . 6805 1
656 . 1 1 51 51 LEU HD12 H 1 0.97 0.005 . 1 . . . . 51 LEU HD1 . 6805 1
657 . 1 1 51 51 LEU HD13 H 1 0.97 0.005 . 1 . . . . 51 LEU HD1 . 6805 1
658 . 1 1 51 51 LEU HD21 H 1 0.97 0.005 . 1 . . . . 51 LEU HD2 . 6805 1
659 . 1 1 51 51 LEU HD22 H 1 0.97 0.005 . 1 . . . . 51 LEU HD2 . 6805 1
660 . 1 1 51 51 LEU HD23 H 1 0.97 0.005 . 1 . . . . 51 LEU HD2 . 6805 1
661 . 1 1 51 51 LEU C C 13 178.2 0.05 . 1 . . . . 51 LEU C . 6805 1
662 . 1 1 51 51 LEU CA C 13 57.7 0.05 . 1 . . . . 51 LEU CA . 6805 1
663 . 1 1 51 51 LEU CB C 13 42.1 0.05 . 1 . . . . 51 LEU CB . 6805 1
664 . 1 1 51 51 LEU CG C 13 26.8 0.05 . 1 . . . . 51 LEU CG . 6805 1
665 . 1 1 51 51 LEU CD1 C 13 24.0 0.05 . 1 . . . . 51 LEU CD1 . 6805 1
666 . 1 1 51 51 LEU CD2 C 13 24.6 0.05 . 1 . . . . 51 LEU CD2 . 6805 1
667 . 1 1 51 51 LEU N N 15 123.2 0.05 . 1 . . . . 51 LEU N . 6805 1
668 . 1 1 52 52 ASN H H 1 8.57 0.005 . 1 . . . . 52 ASN H . 6805 1
669 . 1 1 52 52 ASN HA H 1 3.93 0.005 . 1 . . . . 52 ASN HA . 6805 1
670 . 1 1 52 52 ASN HB2 H 1 3.09 0.005 . 2 . . . . 52 ASN HB2 . 6805 1
671 . 1 1 52 52 ASN HB3 H 1 2.40 0.005 . 2 . . . . 52 ASN HB3 . 6805 1
672 . 1 1 52 52 ASN HD21 H 1 6.84 0.005 . 2 . . . . 52 ASN HD21 . 6805 1
673 . 1 1 52 52 ASN HD22 H 1 7.94 0.005 . 2 . . . . 52 ASN HD22 . 6805 1
674 . 1 1 52 52 ASN C C 13 177.6 0.05 . 1 . . . . 52 ASN C . 6805 1
675 . 1 1 52 52 ASN CA C 13 58.1 0.05 . 1 . . . . 52 ASN CA . 6805 1
676 . 1 1 52 52 ASN CB C 13 41.6 0.05 . 1 . . . . 52 ASN CB . 6805 1
677 . 1 1 52 52 ASN N N 15 117.6 0.05 . 1 . . . . 52 ASN N . 6805 1
678 . 1 1 52 52 ASN ND2 N 15 116.8 0.05 . 1 . . . . 52 ASN ND2 . 6805 1
679 . 1 1 53 53 ASP H H 1 8.06 0.005 . 1 . . . . 53 ASP H . 6805 1
680 . 1 1 53 53 ASP HA H 1 4.47 0.005 . 1 . . . . 53 ASP HA . 6805 1
681 . 1 1 53 53 ASP HB2 H 1 2.77 0.005 . 2 . . . . 53 ASP HB2 . 6805 1
682 . 1 1 53 53 ASP HB3 H 1 2.72 0.005 . 2 . . . . 53 ASP HB3 . 6805 1
683 . 1 1 53 53 ASP C C 13 178.9 0.05 . 1 . . . . 53 ASP C . 6805 1
684 . 1 1 53 53 ASP CA C 13 57.0 0.05 . 1 . . . . 53 ASP CA . 6805 1
685 . 1 1 53 53 ASP CB C 13 40.0 0.05 . 1 . . . . 53 ASP CB . 6805 1
686 . 1 1 53 53 ASP N N 15 119.5 0.05 . 1 . . . . 53 ASP N . 6805 1
687 . 1 1 54 54 ALA H H 1 8.05 0.005 . 1 . . . . 54 ALA H . 6805 1
688 . 1 1 54 54 ALA HA H 1 4.23 0.005 . 1 . . . . 54 ALA HA . 6805 1
689 . 1 1 54 54 ALA HB1 H 1 1.58 0.005 . 1 . . . . 54 ALA HB . 6805 1
690 . 1 1 54 54 ALA HB2 H 1 1.58 0.005 . 1 . . . . 54 ALA HB . 6805 1
691 . 1 1 54 54 ALA HB3 H 1 1.58 0.005 . 1 . . . . 54 ALA HB . 6805 1
692 . 1 1 54 54 ALA C C 13 179.4 0.05 . 1 . . . . 54 ALA C . 6805 1
693 . 1 1 54 54 ALA CA C 13 54.3 0.05 . 1 . . . . 54 ALA CA . 6805 1
694 . 1 1 54 54 ALA CB C 13 18.5 0.05 . 1 . . . . 54 ALA CB . 6805 1
695 . 1 1 54 54 ALA N N 15 123.6 0.05 . 1 . . . . 54 ALA N . 6805 1
696 . 1 1 55 55 GLN H H 1 7.55 0.005 . 1 . . . . 55 GLN H . 6805 1
697 . 1 1 55 55 GLN HA H 1 4.37 0.005 . 1 . . . . 55 GLN HA . 6805 1
698 . 1 1 55 55 GLN HB2 H 1 1.74 0.005 . 1 . . . . 55 GLN HB2 . 6805 1
699 . 1 1 55 55 GLN HB3 H 1 2.49 0.005 . 1 . . . . 55 GLN HB3 . 6805 1
700 . 1 1 55 55 GLN HG2 H 1 2.63 0.005 . 2 . . . . 55 GLN HG2 . 6805 1
701 . 1 1 55 55 GLN HG3 H 1 2.32 0.005 . 2 . . . . 55 GLN HG3 . 6805 1
702 . 1 1 55 55 GLN HE21 H 1 7.22 0.005 . 2 . . . . 55 GLN HE21 . 6805 1
703 . 1 1 55 55 GLN HE22 H 1 8.68 0.005 . 2 . . . . 55 GLN HE22 . 6805 1
704 . 1 1 55 55 GLN C C 13 174.1 0.05 . 1 . . . . 55 GLN C . 6805 1
705 . 1 1 55 55 GLN CA C 13 55.0 0.05 . 1 . . . . 55 GLN CA . 6805 1
706 . 1 1 55 55 GLN CB C 13 28.2 0.05 . 1 . . . . 55 GLN CB . 6805 1
707 . 1 1 55 55 GLN CG C 13 35.7 0.05 . 1 . . . . 55 GLN CG . 6805 1
708 . 1 1 55 55 GLN N N 15 115.7 0.05 . 1 . . . . 55 GLN N . 6805 1
709 . 1 1 55 55 GLN NE2 N 15 111.7 0.05 . 1 . . . . 55 GLN NE2 . 6805 1
710 . 1 1 56 56 ALA H H 1 7.09 0.005 . 1 . . . . 56 ALA H . 6805 1
711 . 1 1 56 56 ALA HA H 1 4.34 0.005 . 1 . . . . 56 ALA HA . 6805 1
712 . 1 1 56 56 ALA HB1 H 1 1.43 0.005 . 1 . . . . 56 ALA HB . 6805 1
713 . 1 1 56 56 ALA HB2 H 1 1.43 0.005 . 1 . . . . 56 ALA HB . 6805 1
714 . 1 1 56 56 ALA HB3 H 1 1.43 0.005 . 1 . . . . 56 ALA HB . 6805 1
715 . 1 1 56 56 ALA C C 13 175.5 0.05 . 1 . . . . 56 ALA C . 6805 1
716 . 1 1 56 56 ALA CA C 13 51.0 0.05 . 1 . . . . 56 ALA CA . 6805 1
717 . 1 1 56 56 ALA CB C 13 17.9 0.05 . 1 . . . . 56 ALA CB . 6805 1
718 . 1 1 56 56 ALA N N 15 125.2 0.05 . 1 . . . . 56 ALA N . 6805 1
719 . 1 1 57 57 PRO HA H 1 4.42 0.005 . 1 . . . . 57 PRO HA . 6805 1
720 . 1 1 57 57 PRO HB2 H 1 2.30 0.005 . 2 . . . . 57 PRO HB2 . 6805 1
721 . 1 1 57 57 PRO HB3 H 1 1.96 0.005 . 2 . . . . 57 PRO HB3 . 6805 1
722 . 1 1 57 57 PRO HG2 H 1 2.10 0.005 . 2 . . . . 57 PRO HG2 . 6805 1
723 . 1 1 57 57 PRO HG3 H 1 2.06 0.005 . 2 . . . . 57 PRO HG3 . 6805 1
724 . 1 1 57 57 PRO HD2 H 1 3.79 0.005 . 2 . . . . 57 PRO HD2 . 6805 1
725 . 1 1 57 57 PRO HD3 H 1 3.62 0.005 . 2 . . . . 57 PRO HD3 . 6805 1
726 . 1 1 57 57 PRO C C 13 176.1 0.05 . 1 . . . . 57 PRO C . 6805 1
727 . 1 1 57 57 PRO CA C 13 63.3 0.05 . 1 . . . . 57 PRO CA . 6805 1
728 . 1 1 57 57 PRO CB C 13 32.0 0.05 . 1 . . . . 57 PRO CB . 6805 1
729 . 1 1 57 57 PRO CG C 13 27.5 0.05 . 1 . . . . 57 PRO CG . 6805 1
730 . 1 1 57 57 PRO CD C 13 50.6 0.05 . 1 . . . . 57 PRO CD . 6805 1
731 . 1 1 58 58 LYS H H 1 8.04 0.005 . 1 . . . . 58 LYS H . 6805 1
732 . 1 1 58 58 LYS HA H 1 4.17 0.005 . 1 . . . . 58 LYS HA . 6805 1
733 . 1 1 58 58 LYS HB2 H 1 1.70 0.005 . 1 . . . . 58 LYS HB2 . 6805 1
734 . 1 1 58 58 LYS HB3 H 1 1.85 0.005 . 1 . . . . 58 LYS HB3 . 6805 1
735 . 1 1 58 58 LYS HG2 H 1 1.43 0.005 . 1 . . . . 58 LYS HG2 . 6805 1
736 . 1 1 58 58 LYS HG3 H 1 1.43 0.005 . 1 . . . . 58 LYS HG3 . 6805 1
737 . 1 1 58 58 LYS HD2 H 1 1.68 0.005 . 1 . . . . 58 LYS HD2 . 6805 1
738 . 1 1 58 58 LYS HD3 H 1 1.68 0.005 . 1 . . . . 58 LYS HD3 . 6805 1
739 . 1 1 58 58 LYS HE2 H 1 3.02 0.005 . 1 . . . . 58 LYS HE2 . 6805 1
740 . 1 1 58 58 LYS HE3 H 1 3.02 0.005 . 1 . . . . 58 LYS HE3 . 6805 1
741 . 1 1 58 58 LYS C C 13 181.5 0.05 . 1 . . . . 58 LYS C . 6805 1
742 . 1 1 58 58 LYS CA C 13 57.6 0.05 . 1 . . . . 58 LYS CA . 6805 1
743 . 1 1 58 58 LYS CB C 13 33.8 0.05 . 1 . . . . 58 LYS CB . 6805 1
744 . 1 1 58 58 LYS CG C 13 24.6 0.05 . 1 . . . . 58 LYS CG . 6805 1
745 . 1 1 58 58 LYS CD C 13 29.0 0.05 . 1 . . . . 58 LYS CD . 6805 1
746 . 1 1 58 58 LYS CE C 13 42.3 0.05 . 1 . . . . 58 LYS CE . 6805 1
747 . 1 1 58 58 LYS N N 15 128.1 0.05 . 1 . . . . 58 LYS N . 6805 1
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