Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27086
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27086 1
2 '2D 1H-13C HSQC' . . . 27086 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $TOPSPIN . . 27086 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 LEU H H 1 8.690 0.020 . 1 . . . . 1 LEU H . 27086 1
2 . 1 1 1 1 LEU HA H 1 4.082 0.020 . 1 . . . . 1 LEU HA . 27086 1
3 . 1 1 1 1 LEU HB2 H 1 1.392 0.020 . 2 . . . . 1 LEU HB2 . 27086 1
4 . 1 1 1 1 LEU HB3 H 1 1.458 0.020 . 2 . . . . 1 LEU HB3 . 27086 1
5 . 1 1 1 1 LEU HG H 1 1.231 0.020 . 1 . . . . 1 LEU HG . 27086 1
6 . 1 1 1 1 LEU HD11 H 1 0.732 0.020 . 1 . . . . 1 LEU QD1 . 27086 1
7 . 1 1 1 1 LEU HD12 H 1 0.732 0.020 . 1 . . . . 1 LEU QD1 . 27086 1
8 . 1 1 1 1 LEU HD13 H 1 0.732 0.020 . 1 . . . . 1 LEU QD1 . 27086 1
9 . 1 1 1 1 LEU HD21 H 1 0.789 0.020 . 1 . . . . 1 LEU QD2 . 27086 1
10 . 1 1 1 1 LEU HD22 H 1 0.789 0.020 . 1 . . . . 1 LEU QD2 . 27086 1
11 . 1 1 1 1 LEU HD23 H 1 0.789 0.020 . 1 . . . . 1 LEU QD2 . 27086 1
12 . 1 1 1 1 LEU CA C 13 52.635 0.300 . 1 . . . . 1 LEU CA . 27086 1
13 . 1 1 1 1 LEU CB C 13 42.402 0.300 . 1 . . . . 1 LEU CB . 27086 1
14 . 1 1 1 1 LEU CG C 13 29.739 0.300 . 1 . . . . 1 LEU CG . 27086 1
15 . 1 1 1 1 LEU CD1 C 13 21.235 0.300 . 1 . . . . 1 LEU CD1 . 27086 1
16 . 1 1 1 1 LEU CD2 C 13 19.649 0.300 . 1 . . . . 1 LEU CD2 . 27086 1
17 . 1 1 1 1 LEU N N 15 128.169 0.300 . 1 . . . . 1 LEU N . 27086 1
18 . 1 1 2 2 LYS H H 1 8.161 0.020 . 1 . . . . 2 LYS H . 27086 1
19 . 1 1 2 2 LYS HA H 1 5.240 0.020 . 1 . . . . 2 LYS HA . 27086 1
20 . 1 1 2 2 LYS HB2 H 1 1.358 0.020 . 1 . . . . 2 LYS HB2 . 27086 1
21 . 1 1 2 2 LYS HB3 H 1 1.289 0.020 . 1 . . . . 2 LYS HB3 . 27086 1
22 . 1 1 2 2 LYS HG2 H 1 1.291 0.020 . 2 . . . . 2 LYS HG2 . 27086 1
23 . 1 1 2 2 LYS HG3 H 1 1.282 0.020 . 2 . . . . 2 LYS HG3 . 27086 1
24 . 1 1 2 2 LYS HD2 H 1 1.185 0.020 . 2 . . . . 2 LYS QD . 27086 1
25 . 1 1 2 2 LYS HD3 H 1 1.185 0.020 . 2 . . . . 2 LYS QD . 27086 1
26 . 1 1 2 2 LYS HE2 H 1 2.795 0.020 . 2 . . . . 2 LYS HE2 . 27086 1
27 . 1 1 2 2 LYS HE3 H 1 2.861 0.020 . 2 . . . . 2 LYS HE3 . 27086 1
28 . 1 1 2 2 LYS CA C 13 51.719 0.300 . 1 . . . . 2 LYS CA . 27086 1
29 . 1 1 2 2 LYS CB C 13 32.854 0.300 . 1 . . . . 2 LYS CB . 27086 1
30 . 1 1 2 2 LYS CG C 13 21.960 0.300 . 1 . . . . 2 LYS CG . 27086 1
31 . 1 1 2 2 LYS CD C 13 26.786 0.300 . 1 . . . . 2 LYS CD . 27086 1
32 . 1 1 2 2 LYS CE C 13 39.125 0.300 . 1 . . . . 2 LYS CE . 27086 1
33 . 1 1 2 2 LYS N N 15 122.796 0.300 . 1 . . . . 2 LYS N . 27086 1
34 . 1 1 3 3 CYS H H 1 8.716 0.020 . 1 . . . . 3 CYS H . 27086 1
35 . 1 1 3 3 CYS HA H 1 5.073 0.020 . 1 . . . . 3 CYS HA . 27086 1
36 . 1 1 3 3 CYS HB2 H 1 2.416 0.020 . 1 . . . . 3 CYS HB2 . 27086 1
37 . 1 1 3 3 CYS HB3 H 1 2.808 0.020 . 1 . . . . 3 CYS HB3 . 27086 1
38 . 1 1 3 3 CYS CA C 13 49.345 0.300 . 1 . . . . 3 CYS CA . 27086 1
39 . 1 1 3 3 CYS CB C 13 38.393 0.300 . 1 . . . . 3 CYS CB . 27086 1
40 . 1 1 3 3 CYS N N 15 117.188 0.300 . 1 . . . . 3 CYS N . 27086 1
41 . 1 1 4 4 ASN H H 1 9.643 0.020 . 1 . . . . 4 ASN H . 27086 1
42 . 1 1 4 4 ASN HA H 1 4.879 0.020 . 1 . . . . 4 ASN HA . 27086 1
43 . 1 1 4 4 ASN HB2 H 1 2.242 0.020 . 1 . . . . 4 ASN HB2 . 27086 1
44 . 1 1 4 4 ASN HB3 H 1 2.661 0.020 . 1 . . . . 4 ASN HB3 . 27086 1
45 . 1 1 4 4 ASN HD21 H 1 7.597 0.020 . 1 . . . . 4 ASN HD21 . 27086 1
46 . 1 1 4 4 ASN HD22 H 1 6.647 0.020 . 1 . . . . 4 ASN HD22 . 27086 1
47 . 1 1 4 4 ASN CA C 13 52.017 0.300 . 1 . . . . 4 ASN CA . 27086 1
48 . 1 1 4 4 ASN CB C 13 36.053 0.300 . 1 . . . . 4 ASN CB . 27086 1
49 . 1 1 4 4 ASN N N 15 121.856 0.300 . 1 . . . . 4 ASN N . 27086 1
50 . 1 1 4 4 ASN ND2 N 15 115.034 0.300 . 1 . . . . 4 ASN ND2 . 27086 1
51 . 1 1 5 5 LYS H H 1 7.918 0.020 . 1 . . . . 5 LYS H . 27086 1
52 . 1 1 5 5 LYS HA H 1 4.218 0.020 . 1 . . . . 5 LYS HA . 27086 1
53 . 1 1 5 5 LYS HB2 H 1 1.509 0.020 . 1 . . . . 5 LYS HB2 . 27086 1
54 . 1 1 5 5 LYS HB3 H 1 2.041 0.020 . 1 . . . . 5 LYS HB3 . 27086 1
55 . 1 1 5 5 LYS HG2 H 1 1.215 0.020 . 2 . . . . 5 LYS QG . 27086 1
56 . 1 1 5 5 LYS HG3 H 1 1.215 0.020 . 2 . . . . 5 LYS QG . 27086 1
57 . 1 1 5 5 LYS HD2 H 1 1.556 0.020 . 2 . . . . 5 LYS HD2 . 27086 1
58 . 1 1 5 5 LYS HD3 H 1 1.568 0.020 . 2 . . . . 5 LYS HD3 . 27086 1
59 . 1 1 5 5 LYS HE2 H 1 2.796 0.020 . 2 . . . . 5 LYS HE2 . 27086 1
60 . 1 1 5 5 LYS HE3 H 1 2.861 0.020 . 2 . . . . 5 LYS HE3 . 27086 1
61 . 1 1 5 5 LYS CA C 13 52.462 0.300 . 1 . . . . 5 LYS CA . 27086 1
62 . 1 1 5 5 LYS CB C 13 30.876 0.300 . 1 . . . . 5 LYS CB . 27086 1
63 . 1 1 5 5 LYS CG C 13 23.434 0.300 . 1 . . . . 5 LYS CG . 27086 1
64 . 1 1 5 5 LYS CD C 13 26.785 0.300 . 1 . . . . 5 LYS CD . 27086 1
65 . 1 1 5 5 LYS CE C 13 39.174 0.300 . 1 . . . . 5 LYS CE . 27086 1
66 . 1 1 5 5 LYS N N 15 118.585 0.300 . 1 . . . . 5 LYS N . 27086 1
67 . 1 1 6 6 LEU H H 1 8.164 0.020 . 1 . . . . 6 LEU H . 27086 1
68 . 1 1 6 6 LEU HA H 1 3.636 0.020 . 1 . . . . 6 LEU HA . 27086 1
69 . 1 1 6 6 LEU HB2 H 1 1.613 0.020 . 1 . . . . 6 LEU HB2 . 27086 1
70 . 1 1 6 6 LEU HB3 H 1 1.715 0.020 . 1 . . . . 6 LEU HB3 . 27086 1
71 . 1 1 6 6 LEU HG H 1 1.517 0.020 . 1 . . . . 6 LEU HG . 27086 1
72 . 1 1 6 6 LEU HD11 H 1 0.655 0.020 . 1 . . . . 6 LEU QD1 . 27086 1
73 . 1 1 6 6 LEU HD12 H 1 0.655 0.020 . 1 . . . . 6 LEU QD1 . 27086 1
74 . 1 1 6 6 LEU HD13 H 1 0.655 0.020 . 1 . . . . 6 LEU QD1 . 27086 1
75 . 1 1 6 6 LEU HD21 H 1 0.835 0.020 . 1 . . . . 6 LEU QD2 . 27086 1
76 . 1 1 6 6 LEU HD22 H 1 0.835 0.020 . 1 . . . . 6 LEU QD2 . 27086 1
77 . 1 1 6 6 LEU HD23 H 1 0.835 0.020 . 1 . . . . 6 LEU QD2 . 27086 1
78 . 1 1 6 6 LEU CA C 13 56.406 0.300 . 1 . . . . 6 LEU CA . 27086 1
79 . 1 1 6 6 LEU CB C 13 39.242 0.300 . 1 . . . . 6 LEU CB . 27086 1
80 . 1 1 6 6 LEU CG C 13 24.241 0.300 . 1 . . . . 6 LEU CG . 27086 1
81 . 1 1 6 6 LEU CD1 C 13 20.746 0.300 . 1 . . . . 6 LEU CD1 . 27086 1
82 . 1 1 6 6 LEU CD2 C 13 22.664 0.300 . 1 . . . . 6 LEU CD2 . 27086 1
83 . 1 1 6 6 LEU N N 15 117.929 0.300 . 1 . . . . 6 LEU N . 27086 1
84 . 1 1 7 7 VAL H H 1 7.559 0.020 . 1 . . . . 7 VAL H . 27086 1
85 . 1 1 7 7 VAL HA H 1 4.427 0.020 . 1 . . . . 7 VAL HA . 27086 1
86 . 1 1 7 7 VAL HB H 1 2.087 0.020 . 1 . . . . 7 VAL HB . 27086 1
87 . 1 1 7 7 VAL HG11 H 1 0.930 0.020 . 1 . . . . 7 VAL QG1 . 27086 1
88 . 1 1 7 7 VAL HG12 H 1 0.930 0.020 . 1 . . . . 7 VAL QG1 . 27086 1
89 . 1 1 7 7 VAL HG13 H 1 0.930 0.020 . 1 . . . . 7 VAL QG1 . 27086 1
90 . 1 1 7 7 VAL HG21 H 1 0.967 0.020 . 1 . . . . 7 VAL QG2 . 27086 1
91 . 1 1 7 7 VAL HG22 H 1 0.967 0.020 . 1 . . . . 7 VAL QG2 . 27086 1
92 . 1 1 7 7 VAL HG23 H 1 0.967 0.020 . 1 . . . . 7 VAL QG2 . 27086 1
93 . 1 1 7 7 VAL CA C 13 56.694 0.300 . 1 . . . . 7 VAL CA . 27086 1
94 . 1 1 7 7 VAL CB C 13 28.613 0.300 . 1 . . . . 7 VAL CB . 27086 1
95 . 1 1 7 7 VAL CG1 C 13 17.790 0.300 . 1 . . . . 7 VAL CG1 . 27086 1
96 . 1 1 7 7 VAL CG2 C 13 18.693 0.300 . 1 . . . . 7 VAL CG2 . 27086 1
97 . 1 1 7 7 VAL N N 15 117.156 0.300 . 1 . . . . 7 VAL N . 27086 1
98 . 1 1 8 8 PRO HA H 1 4.484 0.020 . 1 . . . . 8 PRO HA . 27086 1
99 . 1 1 8 8 PRO HB2 H 1 1.825 0.020 . 1 . . . . 8 PRO HB2 . 27086 1
100 . 1 1 8 8 PRO HB3 H 1 2.190 0.020 . 1 . . . . 8 PRO HB3 . 27086 1
101 . 1 1 8 8 PRO HG2 H 1 1.830 0.020 . 1 . . . . 8 PRO HG2 . 27086 1
102 . 1 1 8 8 PRO HG3 H 1 1.940 0.020 . 1 . . . . 8 PRO HG3 . 27086 1
103 . 1 1 8 8 PRO HD2 H 1 3.789 0.020 . 1 . . . . 8 PRO HD2 . 27086 1
104 . 1 1 8 8 PRO HD3 H 1 3.930 0.020 . 1 . . . . 8 PRO HD3 . 27086 1
105 . 1 1 8 8 PRO CA C 13 63.074 0.300 . 1 . . . . 8 PRO CA . 27086 1
106 . 1 1 8 8 PRO CB C 13 28.076 0.300 . 1 . . . . 8 PRO CB . 27086 1
107 . 1 1 8 8 PRO CG C 13 24.473 0.300 . 1 . . . . 8 PRO CG . 27086 1
108 . 1 1 8 8 PRO CD C 13 48.589 0.300 . 1 . . . . 8 PRO CD . 27086 1
109 . 1 1 9 9 ILE H H 1 7.070 0.020 . 1 . . . . 9 ILE H . 27086 1
110 . 1 1 9 9 ILE HA H 1 4.142 0.020 . 1 . . . . 9 ILE HA . 27086 1
111 . 1 1 9 9 ILE HB H 1 2.033 0.020 . 1 . . . . 9 ILE HB . 27086 1
112 . 1 1 9 9 ILE HG12 H 1 1.049 0.020 . 1 . . . . 9 ILE HG12 . 27086 1
113 . 1 1 9 9 ILE HG13 H 1 1.293 0.020 . 1 . . . . 9 ILE HG13 . 27086 1
114 . 1 1 9 9 ILE HG21 H 1 0.875 0.020 . 1 . . . . 9 ILE QG2 . 27086 1
115 . 1 1 9 9 ILE HG22 H 1 0.875 0.020 . 1 . . . . 9 ILE QG2 . 27086 1
116 . 1 1 9 9 ILE HG23 H 1 0.875 0.020 . 1 . . . . 9 ILE QG2 . 27086 1
117 . 1 1 9 9 ILE HD11 H 1 0.845 0.020 . 1 . . . . 9 ILE QD1 . 27086 1
118 . 1 1 9 9 ILE HD12 H 1 0.845 0.020 . 1 . . . . 9 ILE QD1 . 27086 1
119 . 1 1 9 9 ILE HD13 H 1 0.845 0.020 . 1 . . . . 9 ILE QD1 . 27086 1
120 . 1 1 9 9 ILE CA C 13 59.093 0.300 . 1 . . . . 9 ILE CA . 27086 1
121 . 1 1 9 9 ILE CB C 13 35.450 0.300 . 1 . . . . 9 ILE CB . 27086 1
122 . 1 1 9 9 ILE CG1 C 13 24.515 0.300 . 1 . . . . 9 ILE CG1 . 27086 1
123 . 1 1 9 9 ILE CG2 C 13 15.456 0.300 . 1 . . . . 9 ILE CG2 . 27086 1
124 . 1 1 9 9 ILE CD1 C 13 10.975 0.300 . 1 . . . . 9 ILE CD1 . 27086 1
125 . 1 1 9 9 ILE N N 15 115.011 0.300 . 1 . . . . 9 ILE N . 27086 1
126 . 1 1 10 10 ALA H H 1 7.888 0.020 . 1 . . . . 10 ALA H . 27086 1
127 . 1 1 10 10 ALA HA H 1 4.568 0.020 . 1 . . . . 10 ALA HA . 27086 1
128 . 1 1 10 10 ALA HB1 H 1 1.338 0.020 . 1 . . . . 10 ALA HB . 27086 1
129 . 1 1 10 10 ALA HB2 H 1 1.338 0.020 . 1 . . . . 10 ALA HB . 27086 1
130 . 1 1 10 10 ALA HB3 H 1 1.338 0.020 . 1 . . . . 10 ALA HB . 27086 1
131 . 1 1 10 10 ALA CA C 13 48.160 0.300 . 1 . . . . 10 ALA CA . 27086 1
132 . 1 1 10 10 ALA CB C 13 19.142 0.300 . 1 . . . . 10 ALA CB . 27086 1
133 . 1 1 10 10 ALA N N 15 124.326 0.300 . 1 . . . . 10 ALA N . 27086 1
134 . 1 1 11 11 TYR H H 1 7.868 0.020 . 1 . . . . 11 TYR H . 27086 1
135 . 1 1 11 11 TYR HA H 1 5.229 0.020 . 1 . . . . 11 TYR HA . 27086 1
136 . 1 1 11 11 TYR HB2 H 1 2.667 0.020 . 1 . . . . 11 TYR HB2 . 27086 1
137 . 1 1 11 11 TYR HB3 H 1 2.793 0.020 . 1 . . . . 11 TYR HB3 . 27086 1
138 . 1 1 11 11 TYR HD1 H 1 6.694 0.020 . 3 . . . . 11 TYR QD . 27086 1
139 . 1 1 11 11 TYR HD2 H 1 6.694 0.020 . 3 . . . . 11 TYR QD . 27086 1
140 . 1 1 11 11 TYR HE1 H 1 6.751 0.020 . 3 . . . . 11 TYR QE . 27086 1
141 . 1 1 11 11 TYR HE2 H 1 6.751 0.020 . 3 . . . . 11 TYR QE . 27086 1
142 . 1 1 11 11 TYR CA C 13 52.926 0.300 . 1 . . . . 11 TYR CA . 27086 1
143 . 1 1 11 11 TYR CB C 13 38.451 0.300 . 1 . . . . 11 TYR CB . 27086 1
144 . 1 1 11 11 TYR CG C 13 125.870 0.300 . 1 . . . . 11 TYR CG . 27086 1
145 . 1 1 11 11 TYR CD1 C 13 130.410 0.300 . 1 . . . . 11 TYR CD1 . 27086 1
146 . 1 1 11 11 TYR CD2 C 13 130.400 0.300 . 1 . . . . 11 TYR CD2 . 27086 1
147 . 1 1 11 11 TYR CE1 C 13 115.530 0.300 . 1 . . . . 11 TYR CE1 . 27086 1
148 . 1 1 11 11 TYR CE2 C 13 115.530 0.300 . 1 . . . . 11 TYR CE2 . 27086 1
149 . 1 1 11 11 TYR CZ C 13 155.030 0.300 . 1 . . . . 11 TYR CZ . 27086 1
150 . 1 1 11 11 TYR N N 15 114.800 0.300 . 1 . . . . 11 TYR N . 27086 1
151 . 1 1 12 12 LYS H H 1 9.090 0.020 . 1 . . . . 12 LYS H . 27086 1
152 . 1 1 12 12 LYS HA H 1 4.695 0.020 . 1 . . . . 12 LYS HA . 27086 1
153 . 1 1 12 12 LYS HB2 H 1 1.719 0.020 . 1 . . . . 12 LYS HB2 . 27086 1
154 . 1 1 12 12 LYS HB3 H 1 1.686 0.020 . 1 . . . . 12 LYS HB3 . 27086 1
155 . 1 1 12 12 LYS HG2 H 1 1.235 0.020 . 1 . . . . 12 LYS HG2 . 27086 1
156 . 1 1 12 12 LYS HG3 H 1 1.371 0.020 . 1 . . . . 12 LYS HG3 . 27086 1
157 . 1 1 12 12 LYS HD2 H 1 1.673 0.020 . 2 . . . . 12 LYS QD . 27086 1
158 . 1 1 12 12 LYS HD3 H 1 1.673 0.020 . 2 . . . . 12 LYS QD . 27086 1
159 . 1 1 12 12 LYS HE2 H 1 2.994 0.020 . 2 . . . . 12 LYS QE . 27086 1
160 . 1 1 12 12 LYS HE3 H 1 2.994 0.020 . 2 . . . . 12 LYS QE . 27086 1
161 . 1 1 12 12 LYS CA C 13 51.501 0.300 . 1 . . . . 12 LYS CA . 27086 1
162 . 1 1 12 12 LYS CB C 13 33.358 0.300 . 1 . . . . 12 LYS CB . 27086 1
163 . 1 1 12 12 LYS CG C 13 21.085 0.300 . 1 . . . . 12 LYS CG . 27086 1
164 . 1 1 12 12 LYS CD C 13 26.876 0.300 . 1 . . . . 12 LYS CD . 27086 1
165 . 1 1 12 12 LYS CE C 13 39.236 0.300 . 1 . . . . 12 LYS CE . 27086 1
166 . 1 1 12 12 LYS N N 15 118.442 0.300 . 1 . . . . 12 LYS N . 27086 1
167 . 1 1 13 13 THR H H 1 8.590 0.020 . 1 . . . . 13 THR H . 27086 1
168 . 1 1 13 13 THR HA H 1 4.529 0.020 . 1 . . . . 13 THR HA . 27086 1
169 . 1 1 13 13 THR HB H 1 4.028 0.020 . 1 . . . . 13 THR HB . 27086 1
170 . 1 1 13 13 THR HG21 H 1 1.250 0.020 . 1 . . . . 13 THR QG2 . 27086 1
171 . 1 1 13 13 THR HG22 H 1 1.250 0.020 . 1 . . . . 13 THR QG2 . 27086 1
172 . 1 1 13 13 THR HG23 H 1 1.250 0.020 . 1 . . . . 13 THR QG2 . 27086 1
173 . 1 1 13 13 THR CA C 13 60.423 0.300 . 1 . . . . 13 THR CA . 27086 1
174 . 1 1 13 13 THR CB C 13 66.138 0.300 . 1 . . . . 13 THR CB . 27086 1
175 . 1 1 13 13 THR CG2 C 13 19.857 0.300 . 1 . . . . 13 THR CG2 . 27086 1
176 . 1 1 13 13 THR N N 15 119.653 0.300 . 1 . . . . 13 THR N . 27086 1
177 . 1 1 14 14 CYS H H 1 9.357 0.020 . 1 . . . . 14 CYS H . 27086 1
178 . 1 1 14 14 CYS HA H 1 4.952 0.020 . 1 . . . . 14 CYS HA . 27086 1
179 . 1 1 14 14 CYS HB2 H 1 2.856 0.020 . 1 . . . . 14 CYS HB2 . 27086 1
180 . 1 1 14 14 CYS HB3 H 1 3.418 0.020 . 1 . . . . 14 CYS HB3 . 27086 1
181 . 1 1 14 14 CYS CA C 13 49.313 0.300 . 1 . . . . 14 CYS CA . 27086 1
182 . 1 1 14 14 CYS CB C 13 34.878 0.300 . 1 . . . . 14 CYS CB . 27086 1
183 . 1 1 14 14 CYS N N 15 128.054 0.300 . 1 . . . . 14 CYS N . 27086 1
184 . 1 1 15 15 PRO HA H 1 4.550 0.020 . 1 . . . . 15 PRO HA . 27086 1
185 . 1 1 15 15 PRO HB2 H 1 1.869 0.020 . 1 . . . . 15 PRO HB2 . 27086 1
186 . 1 1 15 15 PRO HB3 H 1 2.364 0.020 . 1 . . . . 15 PRO HB3 . 27086 1
187 . 1 1 15 15 PRO HG2 H 1 1.879 0.020 . 1 . . . . 15 PRO HG2 . 27086 1
188 . 1 1 15 15 PRO HG3 H 1 2.120 0.020 . 1 . . . . 15 PRO HG3 . 27086 1
189 . 1 1 15 15 PRO HD2 H 1 3.397 0.020 . 1 . . . . 15 PRO HD2 . 27086 1
190 . 1 1 15 15 PRO HD3 H 1 3.956 0.020 . 1 . . . . 15 PRO HD3 . 27086 1
191 . 1 1 15 15 PRO CA C 13 59.438 0.300 . 1 . . . . 15 PRO CA . 27086 1
192 . 1 1 15 15 PRO CB C 13 29.710 0.300 . 1 . . . . 15 PRO CB . 27086 1
193 . 1 1 15 15 PRO CG C 13 24.880 0.300 . 1 . . . . 15 PRO CG . 27086 1
194 . 1 1 15 15 PRO CD C 13 47.954 0.300 . 1 . . . . 15 PRO CD . 27086 1
195 . 1 1 16 16 GLU H H 1 8.550 0.020 . 1 . . . . 16 GLU H . 27086 1
196 . 1 1 16 16 GLU HA H 1 3.981 0.020 . 1 . . . . 16 GLU HA . 27086 1
197 . 1 1 16 16 GLU HB2 H 1 1.969 0.020 . 1 . . . . 16 GLU HB2 . 27086 1
198 . 1 1 16 16 GLU HB3 H 1 1.916 0.020 . 1 . . . . 16 GLU HB3 . 27086 1
199 . 1 1 16 16 GLU HG2 H 1 2.275 0.020 . 2 . . . . 16 GLU QG . 27086 1
200 . 1 1 16 16 GLU HG3 H 1 2.275 0.020 . 2 . . . . 16 GLU QG . 27086 1
201 . 1 1 16 16 GLU CA C 13 55.516 0.300 . 1 . . . . 16 GLU CA . 27086 1
202 . 1 1 16 16 GLU CB C 13 26.806 0.300 . 1 . . . . 16 GLU CB . 27086 1
203 . 1 1 16 16 GLU CG C 13 33.294 0.300 . 1 . . . . 16 GLU CG . 27086 1
204 . 1 1 16 16 GLU N N 15 120.932 0.300 . 1 . . . . 16 GLU N . 27086 1
205 . 1 1 17 17 GLY H H 1 8.907 0.020 . 1 . . . . 17 GLY H . 27086 1
206 . 1 1 17 17 GLY HA2 H 1 3.643 0.020 . 1 . . . . 17 GLY HA2 . 27086 1
207 . 1 1 17 17 GLY HA3 H 1 4.280 0.020 . 1 . . . . 17 GLY HA3 . 27086 1
208 . 1 1 17 17 GLY CA C 13 42.233 0.300 . 1 . . . . 17 GLY CA . 27086 1
209 . 1 1 17 17 GLY N N 15 112.816 0.300 . 1 . . . . 17 GLY N . 27086 1
210 . 1 1 18 18 LYS H H 1 7.711 0.020 . 1 . . . . 18 LYS H . 27086 1
211 . 1 1 18 18 LYS HA H 1 4.250 0.020 . 1 . . . . 18 LYS HA . 27086 1
212 . 1 1 18 18 LYS HB2 H 1 1.323 0.020 . 2 . . . . 18 LYS HB2 . 27086 1
213 . 1 1 18 18 LYS HB3 H 1 1.928 0.020 . 2 . . . . 18 LYS HB3 . 27086 1
214 . 1 1 18 18 LYS HG2 H 1 1.059 0.020 . 2 . . . . 18 LYS HG2 . 27086 1
215 . 1 1 18 18 LYS HG3 H 1 1.311 0.020 . 2 . . . . 18 LYS HG3 . 27086 1
216 . 1 1 18 18 LYS HD2 H 1 1.364 0.020 . 1 . . . . 18 LYS QD . 27086 1
217 . 1 1 18 18 LYS HD3 H 1 1.364 0.020 . 1 . . . . 18 LYS QD . 27086 1
218 . 1 1 18 18 LYS HE2 H 1 2.909 0.020 . 2 . . . . 18 LYS QE . 27086 1
219 . 1 1 18 18 LYS HE3 H 1 2.909 0.020 . 2 . . . . 18 LYS QE . 27086 1
220 . 1 1 18 18 LYS CA C 13 52.901 0.300 . 1 . . . . 18 LYS CA . 27086 1
221 . 1 1 18 18 LYS CB C 13 29.275 0.300 . 1 . . . . 18 LYS CB . 27086 1
222 . 1 1 18 18 LYS CG C 13 23.290 0.300 . 1 . . . . 18 LYS CG . 27086 1
223 . 1 1 18 18 LYS CD C 13 27.008 0.300 . 1 . . . . 18 LYS CD . 27086 1
224 . 1 1 18 18 LYS CE C 13 39.867 0.300 . 1 . . . . 18 LYS CE . 27086 1
225 . 1 1 18 18 LYS N N 15 120.765 0.300 . 1 . . . . 18 LYS N . 27086 1
226 . 1 1 19 19 ASN H H 1 7.899 0.020 . 1 . . . . 19 ASN H . 27086 1
227 . 1 1 19 19 ASN HA H 1 4.868 0.020 . 1 . . . . 19 ASN HA . 27086 1
228 . 1 1 19 19 ASN HB2 H 1 2.614 0.020 . 1 . . . . 19 ASN HB2 . 27086 1
229 . 1 1 19 19 ASN HB3 H 1 2.955 0.020 . 1 . . . . 19 ASN HB3 . 27086 1
230 . 1 1 19 19 ASN HD21 H 1 7.449 0.020 . 1 . . . . 19 ASN HD21 . 27086 1
231 . 1 1 19 19 ASN HD22 H 1 6.976 0.020 . 1 . . . . 19 ASN HD22 . 27086 1
232 . 1 1 19 19 ASN CA C 13 50.480 0.300 . 1 . . . . 19 ASN CA . 27086 1
233 . 1 1 19 19 ASN CB C 13 36.963 0.300 . 1 . . . . 19 ASN CB . 27086 1
234 . 1 1 19 19 ASN N N 15 118.560 0.300 . 1 . . . . 19 ASN N . 27086 1
235 . 1 1 19 19 ASN ND2 N 15 113.002 0.300 . 1 . . . . 19 ASN ND2 . 27086 1
236 . 1 1 20 20 LEU H H 1 8.229 0.020 . 1 . . . . 20 LEU H . 27086 1
237 . 1 1 20 20 LEU HA H 1 4.756 0.020 . 1 . . . . 20 LEU HA . 27086 1
238 . 1 1 20 20 LEU HB2 H 1 1.347 0.020 . 1 . . . . 20 LEU HB2 . 27086 1
239 . 1 1 20 20 LEU HB3 H 1 1.634 0.020 . 1 . . . . 20 LEU HB3 . 27086 1
240 . 1 1 20 20 LEU HG H 1 1.476 0.020 . 1 . . . . 20 LEU HG . 27086 1
241 . 1 1 20 20 LEU HD11 H 1 0.701 0.020 . 1 . . . . 20 LEU QD1 . 27086 1
242 . 1 1 20 20 LEU HD12 H 1 0.701 0.020 . 1 . . . . 20 LEU QD1 . 27086 1
243 . 1 1 20 20 LEU HD13 H 1 0.701 0.020 . 1 . . . . 20 LEU QD1 . 27086 1
244 . 1 1 20 20 LEU HD21 H 1 0.834 0.020 . 1 . . . . 20 LEU QD2 . 27086 1
245 . 1 1 20 20 LEU HD22 H 1 0.834 0.020 . 1 . . . . 20 LEU QD2 . 27086 1
246 . 1 1 20 20 LEU HD23 H 1 0.834 0.020 . 1 . . . . 20 LEU QD2 . 27086 1
247 . 1 1 20 20 LEU CA C 13 51.629 0.300 . 1 . . . . 20 LEU CA . 27086 1
248 . 1 1 20 20 LEU CB C 13 43.648 0.300 . 1 . . . . 20 LEU CB . 27086 1
249 . 1 1 20 20 LEU CG C 13 23.907 0.300 . 1 . . . . 20 LEU CG . 27086 1
250 . 1 1 20 20 LEU CD1 C 13 24.018 0.300 . 1 . . . . 20 LEU CD1 . 27086 1
251 . 1 1 20 20 LEU CD2 C 13 21.436 0.300 . 1 . . . . 20 LEU CD2 . 27086 1
252 . 1 1 20 20 LEU N N 15 119.071 0.300 . 1 . . . . 20 LEU N . 27086 1
253 . 1 1 21 21 CYS H H 1 9.003 0.020 . 1 . . . . 21 CYS H . 27086 1
254 . 1 1 21 21 CYS HA H 1 6.060 0.020 . 1 . . . . 21 CYS HA . 27086 1
255 . 1 1 21 21 CYS HB2 H 1 2.942 0.020 . 1 . . . . 21 CYS HB2 . 27086 1
256 . 1 1 21 21 CYS HB3 H 1 3.006 0.020 . 1 . . . . 21 CYS HB3 . 27086 1
257 . 1 1 21 21 CYS CA C 13 49.170 0.300 . 1 . . . . 21 CYS CA . 27086 1
258 . 1 1 21 21 CYS CB C 13 36.244 0.300 . 1 . . . . 21 CYS CB . 27086 1
259 . 1 1 21 21 CYS N N 15 115.503 0.300 . 1 . . . . 21 CYS N . 27086 1
260 . 1 1 22 22 TYR H H 1 8.993 0.020 . 1 . . . . 22 TYR H . 27086 1
261 . 1 1 22 22 TYR HA H 1 6.051 0.020 . 1 . . . . 22 TYR HA . 27086 1
262 . 1 1 22 22 TYR HB2 H 1 2.929 0.020 . 1 . . . . 22 TYR HB2 . 27086 1
263 . 1 1 22 22 TYR HB3 H 1 3.079 0.020 . 1 . . . . 22 TYR HB3 . 27086 1
264 . 1 1 22 22 TYR HD1 H 1 6.570 0.020 . 3 . . . . 22 TYR QD . 27086 1
265 . 1 1 22 22 TYR HD2 H 1 6.570 0.020 . 3 . . . . 22 TYR QD . 27086 1
266 . 1 1 22 22 TYR HE1 H 1 6.530 0.020 . 3 . . . . 22 TYR QE . 27086 1
267 . 1 1 22 22 TYR HE2 H 1 6.530 0.020 . 3 . . . . 22 TYR QE . 27086 1
268 . 1 1 22 22 TYR CA C 13 53.559 0.300 . 1 . . . . 22 TYR CA . 27086 1
269 . 1 1 22 22 TYR CB C 13 41.604 0.300 . 1 . . . . 22 TYR CB . 27086 1
270 . 1 1 22 22 TYR CG C 13 126.290 0.300 . 1 . . . . 22 TYR CG . 27086 1
271 . 1 1 22 22 TYR CD1 C 13 130.550 0.300 . 1 . . . . 22 TYR CD1 . 27086 1
272 . 1 1 22 22 TYR CD2 C 13 130.550 0.300 . 1 . . . . 22 TYR CD2 . 27086 1
273 . 1 1 22 22 TYR CE1 C 13 114.780 0.300 . 1 . . . . 22 TYR CE1 . 27086 1
274 . 1 1 22 22 TYR CE2 C 13 114.780 0.300 . 1 . . . . 22 TYR CE2 . 27086 1
275 . 1 1 22 22 TYR CZ C 13 155.560 0.300 . 1 . . . . 22 TYR CZ . 27086 1
276 . 1 1 22 22 TYR N N 15 115.043 0.300 . 1 . . . . 22 TYR N . 27086 1
277 . 1 1 23 23 LYS H H 1 9.079 0.020 . 1 . . . . 23 LYS H . 27086 1
278 . 1 1 23 23 LYS HA H 1 4.796 0.020 . 1 . . . . 23 LYS HA . 27086 1
279 . 1 1 23 23 LYS HB2 H 1 1.461 0.020 . 1 . . . . 23 LYS HB2 . 27086 1
280 . 1 1 23 23 LYS HB3 H 1 1.613 0.020 . 1 . . . . 23 LYS HB3 . 27086 1
281 . 1 1 23 23 LYS HG2 H 1 1.386 0.020 . 2 . . . . 23 LYS HG2 . 27086 1
282 . 1 1 23 23 LYS HG3 H 1 1.460 0.020 . 2 . . . . 23 LYS HG3 . 27086 1
283 . 1 1 23 23 LYS HD2 H 1 1.730 0.020 . 2 . . . . 23 LYS HD2 . 27086 1
284 . 1 1 23 23 LYS HD3 H 1 1.741 0.020 . 2 . . . . 23 LYS HD3 . 27086 1
285 . 1 1 23 23 LYS HE2 H 1 2.969 0.020 . 2 . . . . 23 LYS HE2 . 27086 1
286 . 1 1 23 23 LYS HE3 H 1 3.042 0.020 . 2 . . . . 23 LYS HE3 . 27086 1
287 . 1 1 23 23 LYS CA C 13 52.501 0.300 . 1 . . . . 23 LYS CA . 27086 1
288 . 1 1 23 23 LYS CB C 13 34.061 0.300 . 1 . . . . 23 LYS CB . 27086 1
289 . 1 1 23 23 LYS CG C 13 22.010 0.300 . 1 . . . . 23 LYS CG . 27086 1
290 . 1 1 23 23 LYS CD C 13 27.243 0.300 . 1 . . . . 23 LYS CD . 27086 1
291 . 1 1 23 23 LYS CE C 13 39.292 0.300 . 1 . . . . 23 LYS CE . 27086 1
292 . 1 1 23 23 LYS N N 15 120.204 0.300 . 1 . . . . 23 LYS N . 27086 1
293 . 1 1 24 24 MET H H 1 8.296 0.020 . 1 . . . . 24 MET H . 27086 1
294 . 1 1 24 24 MET HA H 1 5.095 0.020 . 1 . . . . 24 MET HA . 27086 1
295 . 1 1 24 24 MET HB2 H 1 1.502 0.020 . 1 . . . . 24 MET HB2 . 27086 1
296 . 1 1 24 24 MET HB3 H 1 1.751 0.020 . 1 . . . . 24 MET HB3 . 27086 1
297 . 1 1 24 24 MET HG2 H 1 1.277 0.020 . 1 . . . . 24 MET HG2 . 27086 1
298 . 1 1 24 24 MET HG3 H 1 1.647 0.020 . 1 . . . . 24 MET HG3 . 27086 1
299 . 1 1 24 24 MET CA C 13 51.037 0.300 . 1 . . . . 24 MET CA . 27086 1
300 . 1 1 24 24 MET CB C 13 36.073 0.300 . 1 . . . . 24 MET CB . 27086 1
301 . 1 1 24 24 MET CG C 13 29.783 0.300 . 1 . . . . 24 MET CG . 27086 1
302 . 1 1 24 24 MET N N 15 122.826 0.300 . 1 . . . . 24 MET N . 27086 1
303 . 1 1 25 25 PHE H H 1 9.520 0.020 . 1 . . . . 25 PHE H . 27086 1
304 . 1 1 25 25 PHE HA H 1 4.818 0.020 . 1 . . . . 25 PHE HA . 27086 1
305 . 1 1 25 25 PHE HB2 H 1 2.446 0.020 . 1 . . . . 25 PHE HB2 . 27086 1
306 . 1 1 25 25 PHE HB3 H 1 3.349 0.020 . 1 . . . . 25 PHE HB3 . 27086 1
307 . 1 1 25 25 PHE HD1 H 1 7.044 0.020 . 3 . . . . 25 PHE QD . 27086 1
308 . 1 1 25 25 PHE HD2 H 1 7.044 0.020 . 3 . . . . 25 PHE QD . 27086 1
309 . 1 1 25 25 PHE HE1 H 1 7.153 0.020 . 3 . . . . 25 PHE QE . 27086 1
310 . 1 1 25 25 PHE HE2 H 1 7.153 0.020 . 3 . . . . 25 PHE QE . 27086 1
311 . 1 1 25 25 PHE HZ H 1 6.902 0.020 . 1 . . . . 25 PHE HZ . 27086 1
312 . 1 1 25 25 PHE CA C 13 53.834 0.300 . 1 . . . . 25 PHE CA . 27086 1
313 . 1 1 25 25 PHE CB C 13 39.939 0.300 . 1 . . . . 25 PHE CB . 27086 1
314 . 1 1 25 25 PHE CG C 13 136.200 0.300 . 1 . . . . 25 PHE CG . 27086 1
315 . 1 1 25 25 PHE CD1 C 13 129.400 0.300 . 1 . . . . 25 PHE CD1 . 27086 1
316 . 1 1 25 25 PHE CD2 C 13 129.400 0.300 . 1 . . . . 25 PHE CD2 . 27086 1
317 . 1 1 25 25 PHE CE1 C 13 127.800 0.300 . 1 . . . . 25 PHE CE1 . 27086 1
318 . 1 1 25 25 PHE CE2 C 13 127.800 0.300 . 1 . . . . 25 PHE CE2 . 27086 1
319 . 1 1 25 25 PHE CZ C 13 127.300 0.300 . 1 . . . . 25 PHE CZ . 27086 1
320 . 1 1 25 25 PHE N N 15 124.993 0.300 . 1 . . . . 25 PHE N . 27086 1
321 . 1 1 26 26 MET H H 1 9.318 0.020 . 1 . . . . 26 MET H . 27086 1
322 . 1 1 26 26 MET HA H 1 5.075 0.020 . 1 . . . . 26 MET HA . 27086 1
323 . 1 1 26 26 MET HB2 H 1 1.994 0.020 . 1 . . . . 26 MET HB2 . 27086 1
324 . 1 1 26 26 MET HB3 H 1 2.312 0.020 . 1 . . . . 26 MET HB3 . 27086 1
325 . 1 1 26 26 MET HG2 H 1 2.591 0.020 . 1 . . . . 26 MET HG2 . 27086 1
326 . 1 1 26 26 MET HG3 H 1 2.832 0.020 . 1 . . . . 26 MET HG3 . 27086 1
327 . 1 1 26 26 MET CA C 13 51.493 0.300 . 1 . . . . 26 MET CA . 27086 1
328 . 1 1 26 26 MET CB C 13 27.976 0.300 . 1 . . . . 26 MET CB . 27086 1
329 . 1 1 26 26 MET CG C 13 29.239 0.300 . 1 . . . . 26 MET CG . 27086 1
330 . 1 1 26 26 MET N N 15 119.610 0.300 . 1 . . . . 26 MET N . 27086 1
331 . 1 1 27 27 MET H H 1 8.374 0.020 . 1 . . . . 27 MET H . 27086 1
332 . 1 1 27 27 MET HA H 1 4.114 0.020 . 1 . . . . 27 MET HA . 27086 1
333 . 1 1 27 27 MET HB2 H 1 1.872 0.020 . 1 . . . . 27 MET HB2 . 27086 1
334 . 1 1 27 27 MET HB3 H 1 1.991 0.020 . 1 . . . . 27 MET HB3 . 27086 1
335 . 1 1 27 27 MET HG2 H 1 2.089 0.020 . 1 . . . . 27 MET HG2 . 27086 1
336 . 1 1 27 27 MET HG3 H 1 2.603 0.020 . 1 . . . . 27 MET HG3 . 27086 1
337 . 1 1 27 27 MET CA C 13 54.099 0.300 . 1 . . . . 27 MET CA . 27086 1
338 . 1 1 27 27 MET CB C 13 28.409 0.300 . 1 . . . . 27 MET CB . 27086 1
339 . 1 1 27 27 MET CG C 13 30.040 0.300 . 1 . . . . 27 MET CG . 27086 1
340 . 1 1 27 27 MET N N 15 121.735 0.300 . 1 . . . . 27 MET N . 27086 1
341 . 1 1 28 28 SER H H 1 7.676 0.020 . 1 . . . . 28 SER H . 27086 1
342 . 1 1 28 28 SER HA H 1 4.158 0.020 . 1 . . . . 28 SER HA . 27086 1
343 . 1 1 28 28 SER HB2 H 1 3.763 0.020 . 1 . . . . 28 SER HB2 . 27086 1
344 . 1 1 28 28 SER HB3 H 1 4.022 0.020 . 1 . . . . 28 SER HB3 . 27086 1
345 . 1 1 28 28 SER CA C 13 56.448 0.300 . 1 . . . . 28 SER CA . 27086 1
346 . 1 1 28 28 SER CB C 13 60.434 0.300 . 1 . . . . 28 SER CB . 27086 1
347 . 1 1 28 28 SER N N 15 109.489 0.300 . 1 . . . . 28 SER N . 27086 1
348 . 1 1 29 29 ASP H H 1 7.952 0.020 . 1 . . . . 29 ASP H . 27086 1
349 . 1 1 29 29 ASP HA H 1 4.616 0.020 . 1 . . . . 29 ASP HA . 27086 1
350 . 1 1 29 29 ASP HB2 H 1 2.638 0.020 . 1 . . . . 29 ASP HB2 . 27086 1
351 . 1 1 29 29 ASP HB3 H 1 2.861 0.020 . 1 . . . . 29 ASP HB3 . 27086 1
352 . 1 1 29 29 ASP CA C 13 52.324 0.300 . 1 . . . . 29 ASP CA . 27086 1
353 . 1 1 29 29 ASP CB C 13 38.516 0.300 . 1 . . . . 29 ASP CB . 27086 1
354 . 1 1 29 29 ASP N N 15 119.979 0.300 . 1 . . . . 29 ASP N . 27086 1
355 . 1 1 30 30 LEU H H 1 8.800 0.020 . 1 . . . . 30 LEU H . 27086 1
356 . 1 1 30 30 LEU HA H 1 3.981 0.020 . 1 . . . . 30 LEU HA . 27086 1
357 . 1 1 30 30 LEU HB2 H 1 1.266 0.020 . 1 . . . . 30 LEU HB2 . 27086 1
358 . 1 1 30 30 LEU HB3 H 1 1.447 0.020 . 1 . . . . 30 LEU HB3 . 27086 1
359 . 1 1 30 30 LEU HG H 1 1.597 0.020 . 1 . . . . 30 LEU HG . 27086 1
360 . 1 1 30 30 LEU HD11 H 1 0.631 0.020 . 1 . . . . 30 LEU QD1 . 27086 1
361 . 1 1 30 30 LEU HD12 H 1 0.631 0.020 . 1 . . . . 30 LEU QD1 . 27086 1
362 . 1 1 30 30 LEU HD13 H 1 0.631 0.020 . 1 . . . . 30 LEU QD1 . 27086 1
363 . 1 1 30 30 LEU HD21 H 1 0.777 0.020 . 1 . . . . 30 LEU QD2 . 27086 1
364 . 1 1 30 30 LEU HD22 H 1 0.777 0.020 . 1 . . . . 30 LEU QD2 . 27086 1
365 . 1 1 30 30 LEU HD23 H 1 0.777 0.020 . 1 . . . . 30 LEU QD2 . 27086 1
366 . 1 1 30 30 LEU CA C 13 52.559 0.300 . 1 . . . . 30 LEU CA . 27086 1
367 . 1 1 30 30 LEU CB C 13 37.866 0.300 . 1 . . . . 30 LEU CB . 27086 1
368 . 1 1 30 30 LEU CG C 13 23.907 0.300 . 1 . . . . 30 LEU CG . 27086 1
369 . 1 1 30 30 LEU CD1 C 13 20.771 0.300 . 1 . . . . 30 LEU CD1 . 27086 1
370 . 1 1 30 30 LEU CD2 C 13 22.798 0.300 . 1 . . . . 30 LEU CD2 . 27086 1
371 . 1 1 30 30 LEU N N 15 125.236 0.300 . 1 . . . . 30 LEU N . 27086 1
372 . 1 1 31 31 THR H H 1 8.720 0.020 . 1 . . . . 31 THR H . 27086 1
373 . 1 1 31 31 THR HA H 1 4.355 0.020 . 1 . . . . 31 THR HA . 27086 1
374 . 1 1 31 31 THR HB H 1 4.283 0.020 . 1 . . . . 31 THR HB . 27086 1
375 . 1 1 31 31 THR HG21 H 1 1.154 0.020 . 1 . . . . 31 THR QG2 . 27086 1
376 . 1 1 31 31 THR HG22 H 1 1.154 0.020 . 1 . . . . 31 THR QG2 . 27086 1
377 . 1 1 31 31 THR HG23 H 1 1.154 0.020 . 1 . . . . 31 THR QG2 . 27086 1
378 . 1 1 31 31 THR CA C 13 60.575 0.300 . 1 . . . . 31 THR CA . 27086 1
379 . 1 1 31 31 THR CB C 13 67.264 0.300 . 1 . . . . 31 THR CB . 27086 1
380 . 1 1 31 31 THR CG2 C 13 19.036 0.300 . 1 . . . . 31 THR CG2 . 27086 1
381 . 1 1 31 31 THR N N 15 109.527 0.300 . 1 . . . . 31 THR N . 27086 1
382 . 1 1 32 32 ILE H H 1 7.142 0.020 . 1 . . . . 32 ILE H . 27086 1
383 . 1 1 32 32 ILE HA H 1 4.824 0.020 . 1 . . . . 32 ILE HA . 27086 1
384 . 1 1 32 32 ILE HB H 1 1.839 0.020 . 1 . . . . 32 ILE HB . 27086 1
385 . 1 1 32 32 ILE HG12 H 1 1.149 0.020 . 1 . . . . 32 ILE HG12 . 27086 1
386 . 1 1 32 32 ILE HG13 H 1 1.589 0.020 . 1 . . . . 32 ILE HG13 . 27086 1
387 . 1 1 32 32 ILE HG21 H 1 0.856 0.020 . 1 . . . . 32 ILE QG2 . 27086 1
388 . 1 1 32 32 ILE HG22 H 1 0.856 0.020 . 1 . . . . 32 ILE QG2 . 27086 1
389 . 1 1 32 32 ILE HG23 H 1 0.856 0.020 . 1 . . . . 32 ILE QG2 . 27086 1
390 . 1 1 32 32 ILE HD11 H 1 0.830 0.020 . 1 . . . . 32 ILE QD1 . 27086 1
391 . 1 1 32 32 ILE HD12 H 1 0.830 0.020 . 1 . . . . 32 ILE QD1 . 27086 1
392 . 1 1 32 32 ILE HD13 H 1 0.830 0.020 . 1 . . . . 32 ILE QD1 . 27086 1
393 . 1 1 32 32 ILE CA C 13 54.768 0.300 . 1 . . . . 32 ILE CA . 27086 1
394 . 1 1 32 32 ILE CB C 13 38.030 0.300 . 1 . . . . 32 ILE CB . 27086 1
395 . 1 1 32 32 ILE CG1 C 13 24.247 0.300 . 1 . . . . 32 ILE CG1 . 27086 1
396 . 1 1 32 32 ILE CG2 C 13 14.068 0.300 . 1 . . . . 32 ILE CG2 . 27086 1
397 . 1 1 32 32 ILE CD1 C 13 10.000 0.300 . 1 . . . . 32 ILE CD1 . 27086 1
398 . 1 1 32 32 ILE N N 15 121.841 0.300 . 1 . . . . 32 ILE N . 27086 1
399 . 1 1 33 33 PRO HA H 1 4.008 0.020 . 1 . . . . 33 PRO HA . 27086 1
400 . 1 1 33 33 PRO HB2 H 1 1.157 0.020 . 1 . . . . 33 PRO HB2 . 27086 1
401 . 1 1 33 33 PRO HB3 H 1 1.493 0.020 . 1 . . . . 33 PRO HB3 . 27086 1
402 . 1 1 33 33 PRO HG2 H 1 1.655 0.020 . 1 . . . . 33 PRO HG2 . 27086 1
403 . 1 1 33 33 PRO HG3 H 1 1.864 0.020 . 1 . . . . 33 PRO HG3 . 27086 1
404 . 1 1 33 33 PRO HD2 H 1 3.825 0.020 . 1 . . . . 33 PRO HD2 . 27086 1
405 . 1 1 33 33 PRO HD3 H 1 3.890 0.020 . 1 . . . . 33 PRO HD3 . 27086 1
406 . 1 1 33 33 PRO CA C 13 59.778 0.300 . 1 . . . . 33 PRO CA . 27086 1
407 . 1 1 33 33 PRO CB C 13 29.161 0.300 . 1 . . . . 33 PRO CB . 27086 1
408 . 1 1 33 33 PRO CG C 13 24.083 0.300 . 1 . . . . 33 PRO CG . 27086 1
409 . 1 1 33 33 PRO CD C 13 48.209 0.300 . 1 . . . . 33 PRO CD . 27086 1
410 . 1 1 34 34 VAL H H 1 8.753 0.020 . 1 . . . . 34 VAL H . 27086 1
411 . 1 1 34 34 VAL HA H 1 4.368 0.020 . 1 . . . . 34 VAL HA . 27086 1
412 . 1 1 34 34 VAL HB H 1 2.240 0.020 . 1 . . . . 34 VAL HB . 27086 1
413 . 1 1 34 34 VAL HG11 H 1 0.790 0.020 . 1 . . . . 34 VAL QG1 . 27086 1
414 . 1 1 34 34 VAL HG12 H 1 0.790 0.020 . 1 . . . . 34 VAL QG1 . 27086 1
415 . 1 1 34 34 VAL HG13 H 1 0.790 0.020 . 1 . . . . 34 VAL QG1 . 27086 1
416 . 1 1 34 34 VAL HG21 H 1 0.987 0.020 . 1 . . . . 34 VAL QG2 . 27086 1
417 . 1 1 34 34 VAL HG22 H 1 0.987 0.020 . 1 . . . . 34 VAL QG2 . 27086 1
418 . 1 1 34 34 VAL HG23 H 1 0.987 0.020 . 1 . . . . 34 VAL QG2 . 27086 1
419 . 1 1 34 34 VAL CA C 13 58.604 0.300 . 1 . . . . 34 VAL CA . 27086 1
420 . 1 1 34 34 VAL CB C 13 30.169 0.300 . 1 . . . . 34 VAL CB . 27086 1
421 . 1 1 34 34 VAL CG1 C 13 17.195 0.300 . 1 . . . . 34 VAL CG1 . 27086 1
422 . 1 1 34 34 VAL CG2 C 13 19.312 0.300 . 1 . . . . 34 VAL CG2 . 27086 1
423 . 1 1 34 34 VAL N N 15 112.752 0.300 . 1 . . . . 34 VAL N . 27086 1
424 . 1 1 35 35 LYS H H 1 7.364 0.020 . 1 . . . . 35 LYS H . 27086 1
425 . 1 1 35 35 LYS HA H 1 4.509 0.020 . 1 . . . . 35 LYS HA . 27086 1
426 . 1 1 35 35 LYS HB2 H 1 1.684 0.020 . 1 . . . . 35 LYS HB2 . 27086 1
427 . 1 1 35 35 LYS HB3 H 1 1.925 0.020 . 1 . . . . 35 LYS HB3 . 27086 1
428 . 1 1 35 35 LYS HG2 H 1 1.497 0.020 . 1 . . . . 35 LYS HG2 . 27086 1
429 . 1 1 35 35 LYS HG3 H 1 1.565 0.020 . 1 . . . . 35 LYS HG3 . 27086 1
430 . 1 1 35 35 LYS HD2 H 1 1.759 0.020 . 1 . . . . 35 LYS HD2 . 27086 1
431 . 1 1 35 35 LYS HD3 H 1 1.827 0.020 . 1 . . . . 35 LYS HD3 . 27086 1
432 . 1 1 35 35 LYS HE2 H 1 3.026 0.020 . 2 . . . . 35 LYS QE . 27086 1
433 . 1 1 35 35 LYS HE3 H 1 3.026 0.020 . 2 . . . . 35 LYS QE . 27086 1
434 . 1 1 35 35 LYS CA C 13 53.736 0.300 . 1 . . . . 35 LYS CA . 27086 1
435 . 1 1 35 35 LYS CB C 13 36.113 0.300 . 1 . . . . 35 LYS CB . 27086 1
436 . 1 1 35 35 LYS CG C 13 23.630 0.300 . 1 . . . . 35 LYS CG . 27086 1
437 . 1 1 35 35 LYS CD C 13 27.011 0.300 . 1 . . . . 35 LYS CD . 27086 1
438 . 1 1 35 35 LYS CE C 13 39.459 0.300 . 1 . . . . 35 LYS CE . 27086 1
439 . 1 1 35 35 LYS N N 15 118.035 0.300 . 1 . . . . 35 LYS N . 27086 1
440 . 1 1 36 36 ARG H H 1 8.249 0.020 . 1 . . . . 36 ARG H . 27086 1
441 . 1 1 36 36 ARG HA H 1 4.362 0.020 . 1 . . . . 36 ARG HA . 27086 1
442 . 1 1 36 36 ARG HB2 H 1 0.991 0.020 . 1 . . . . 36 ARG HB2 . 27086 1
443 . 1 1 36 36 ARG HB3 H 1 1.441 0.020 . 1 . . . . 36 ARG HB3 . 27086 1
444 . 1 1 36 36 ARG HG2 H 1 1.356 0.020 . 1 . . . . 36 ARG HG2 . 27086 1
445 . 1 1 36 36 ARG HG3 H 1 1.468 0.020 . 1 . . . . 36 ARG HG3 . 27086 1
446 . 1 1 36 36 ARG HD2 H 1 2.836 0.020 . 2 . . . . 36 ARG HD2 . 27086 1
447 . 1 1 36 36 ARG HD3 H 1 3.002 0.020 . 2 . . . . 36 ARG HD3 . 27086 1
448 . 1 1 36 36 ARG HE H 1 7.810 0.020 . 1 . . . . 36 ARG HE . 27086 1
449 . 1 1 36 36 ARG CA C 13 52.851 0.300 . 1 . . . . 36 ARG CA . 27086 1
450 . 1 1 36 36 ARG CB C 13 34.475 0.300 . 1 . . . . 36 ARG CB . 27086 1
451 . 1 1 36 36 ARG CG C 13 27.252 0.300 . 1 . . . . 36 ARG CG . 27086 1
452 . 1 1 36 36 ARG CD C 13 41.087 0.300 . 1 . . . . 36 ARG CD . 27086 1
453 . 1 1 36 36 ARG N N 15 121.280 0.300 . 1 . . . . 36 ARG N . 27086 1
454 . 1 1 37 37 GLY H H 1 6.541 0.020 . 1 . . . . 37 GLY H . 27086 1
455 . 1 1 37 37 GLY HA2 H 1 3.832 0.020 . 1 . . . . 37 GLY HA2 . 27086 1
456 . 1 1 37 37 GLY HA3 H 1 4.096 0.020 . 1 . . . . 37 GLY HA3 . 27086 1
457 . 1 1 37 37 GLY CA C 13 43.665 0.300 . 1 . . . . 37 GLY CA . 27086 1
458 . 1 1 37 37 GLY N N 15 104.683 0.300 . 1 . . . . 37 GLY N . 27086 1
459 . 1 1 38 38 CYS H H 1 8.712 0.020 . 1 . . . . 38 CYS H . 27086 1
460 . 1 1 38 38 CYS HA H 1 5.903 0.020 . 1 . . . . 38 CYS HA . 27086 1
461 . 1 1 38 38 CYS HB2 H 1 2.912 0.020 . 1 . . . . 38 CYS HB2 . 27086 1
462 . 1 1 38 38 CYS HB3 H 1 3.408 0.020 . 1 . . . . 38 CYS HB3 . 27086 1
463 . 1 1 38 38 CYS CA C 13 53.333 0.300 . 1 . . . . 38 CYS CA . 27086 1
464 . 1 1 38 38 CYS CB C 13 44.799 0.300 . 1 . . . . 38 CYS CB . 27086 1
465 . 1 1 38 38 CYS N N 15 121.189 0.300 . 1 . . . . 38 CYS N . 27086 1
466 . 1 1 39 39 ILE H H 1 9.865 0.020 . 1 . . . . 39 ILE H . 27086 1
467 . 1 1 39 39 ILE HA H 1 4.363 0.020 . 1 . . . . 39 ILE HA . 27086 1
468 . 1 1 39 39 ILE HB H 1 1.675 0.020 . 1 . . . . 39 ILE HB . 27086 1
469 . 1 1 39 39 ILE HG12 H 1 1.395 0.020 . 1 . . . . 39 ILE HG12 . 27086 1
470 . 1 1 39 39 ILE HG13 H 1 1.595 0.020 . 1 . . . . 39 ILE HG13 . 27086 1
471 . 1 1 39 39 ILE HG21 H 1 0.529 0.020 . 1 . . . . 39 ILE QG2 . 27086 1
472 . 1 1 39 39 ILE HG22 H 1 0.529 0.020 . 1 . . . . 39 ILE QG2 . 27086 1
473 . 1 1 39 39 ILE HG23 H 1 0.529 0.020 . 1 . . . . 39 ILE QG2 . 27086 1
474 . 1 1 39 39 ILE HD11 H 1 0.371 0.020 . 1 . . . . 39 ILE QD1 . 27086 1
475 . 1 1 39 39 ILE HD12 H 1 0.371 0.020 . 1 . . . . 39 ILE QD1 . 27086 1
476 . 1 1 39 39 ILE HD13 H 1 0.371 0.020 . 1 . . . . 39 ILE QD1 . 27086 1
477 . 1 1 39 39 ILE CA C 13 59.323 0.300 . 1 . . . . 39 ILE CA . 27086 1
478 . 1 1 39 39 ILE CB C 13 40.234 0.300 . 1 . . . . 39 ILE CB . 27086 1
479 . 1 1 39 39 ILE CG1 C 13 27.237 0.300 . 1 . . . . 39 ILE CG1 . 27086 1
480 . 1 1 39 39 ILE CG2 C 13 13.986 0.300 . 1 . . . . 39 ILE CG2 . 27086 1
481 . 1 1 39 39 ILE CD1 C 13 11.942 0.300 . 1 . . . . 39 ILE CD1 . 27086 1
482 . 1 1 39 39 ILE N N 15 122.987 0.300 . 1 . . . . 39 ILE N . 27086 1
483 . 1 1 40 40 ASP H H 1 8.729 0.020 . 1 . . . . 40 ASP H . 27086 1
484 . 1 1 40 40 ASP HA H 1 4.831 0.020 . 1 . . . . 40 ASP HA . 27086 1
485 . 1 1 40 40 ASP HB2 H 1 2.747 0.020 . 2 . . . . 40 ASP QB . 27086 1
486 . 1 1 40 40 ASP HB3 H 1 2.747 0.020 . 2 . . . . 40 ASP QB . 27086 1
487 . 1 1 40 40 ASP CA C 13 51.841 0.300 . 1 . . . . 40 ASP CA . 27086 1
488 . 1 1 40 40 ASP CB C 13 37.597 0.300 . 1 . . . . 40 ASP CB . 27086 1
489 . 1 1 40 40 ASP N N 15 118.382 0.300 . 1 . . . . 40 ASP N . 27086 1
490 . 1 1 41 41 VAL H H 1 7.742 0.020 . 1 . . . . 41 VAL H . 27086 1
491 . 1 1 41 41 VAL HA H 1 3.973 0.020 . 1 . . . . 41 VAL HA . 27086 1
492 . 1 1 41 41 VAL HB H 1 1.687 0.020 . 1 . . . . 41 VAL HB . 27086 1
493 . 1 1 41 41 VAL HG11 H 1 0.768 0.020 . 1 . . . . 41 VAL QG1 . 27086 1
494 . 1 1 41 41 VAL HG12 H 1 0.768 0.020 . 1 . . . . 41 VAL QG1 . 27086 1
495 . 1 1 41 41 VAL HG13 H 1 0.768 0.020 . 1 . . . . 41 VAL QG1 . 27086 1
496 . 1 1 41 41 VAL HG21 H 1 0.731 0.020 . 1 . . . . 41 VAL QG2 . 27086 1
497 . 1 1 41 41 VAL HG22 H 1 0.731 0.020 . 1 . . . . 41 VAL QG2 . 27086 1
498 . 1 1 41 41 VAL HG23 H 1 0.731 0.020 . 1 . . . . 41 VAL QG2 . 27086 1
499 . 1 1 41 41 VAL CA C 13 57.691 0.300 . 1 . . . . 41 VAL CA . 27086 1
500 . 1 1 41 41 VAL CB C 13 32.708 0.300 . 1 . . . . 41 VAL CB . 27086 1
501 . 1 1 41 41 VAL CG1 C 13 23.319 0.300 . 1 . . . . 41 VAL CG1 . 27086 1
502 . 1 1 41 41 VAL CG2 C 13 18.039 0.300 . 1 . . . . 41 VAL CG2 . 27086 1
503 . 1 1 41 41 VAL N N 15 120.356 0.300 . 1 . . . . 41 VAL N . 27086 1
504 . 1 1 42 42 CYS H H 1 8.892 0.020 . 1 . . . . 42 CYS H . 27086 1
505 . 1 1 42 42 CYS HA H 1 4.415 0.020 . 1 . . . . 42 CYS HA . 27086 1
506 . 1 1 42 42 CYS HB2 H 1 2.710 0.020 . 1 . . . . 42 CYS HB2 . 27086 1
507 . 1 1 42 42 CYS HB3 H 1 3.051 0.020 . 1 . . . . 42 CYS HB3 . 27086 1
508 . 1 1 42 42 CYS CA C 13 52.308 0.300 . 1 . . . . 42 CYS CA . 27086 1
509 . 1 1 42 42 CYS CB C 13 39.608 0.300 . 1 . . . . 42 CYS CB . 27086 1
510 . 1 1 42 42 CYS N N 15 129.252 0.300 . 1 . . . . 42 CYS N . 27086 1
511 . 1 1 43 43 PRO HA H 1 4.030 0.020 . 1 . . . . 43 PRO HA . 27086 1
512 . 1 1 43 43 PRO HB2 H 1 0.701 0.020 . 1 . . . . 43 PRO HB2 . 27086 1
513 . 1 1 43 43 PRO HB3 H 1 1.802 0.020 . 1 . . . . 43 PRO HB3 . 27086 1
514 . 1 1 43 43 PRO HG2 H 1 0.492 0.020 . 1 . . . . 43 PRO HG2 . 27086 1
515 . 1 1 43 43 PRO HG3 H 1 1.177 0.020 . 1 . . . . 43 PRO HG3 . 27086 1
516 . 1 1 43 43 PRO HD2 H 1 2.273 0.020 . 1 . . . . 43 PRO HD2 . 27086 1
517 . 1 1 43 43 PRO HD3 H 1 3.857 0.020 . 1 . . . . 43 PRO HD3 . 27086 1
518 . 1 1 43 43 PRO CA C 13 59.353 0.300 . 1 . . . . 43 PRO CA . 27086 1
519 . 1 1 43 43 PRO CB C 13 28.984 0.300 . 1 . . . . 43 PRO CB . 27086 1
520 . 1 1 43 43 PRO CG C 13 24.596 0.300 . 1 . . . . 43 PRO CG . 27086 1
521 . 1 1 43 43 PRO CD C 13 48.328 0.300 . 1 . . . . 43 PRO CD . 27086 1
522 . 1 1 44 44 LYS H H 1 7.932 0.020 . 1 . . . . 44 LYS H . 27086 1
523 . 1 1 44 44 LYS HA H 1 4.165 0.020 . 1 . . . . 44 LYS HA . 27086 1
524 . 1 1 44 44 LYS HB2 H 1 1.667 0.020 . 1 . . . . 44 LYS HB2 . 27086 1
525 . 1 1 44 44 LYS HB3 H 1 1.810 0.020 . 1 . . . . 44 LYS HB3 . 27086 1
526 . 1 1 44 44 LYS HG2 H 1 1.507 0.020 . 2 . . . . 44 LYS QG . 27086 1
527 . 1 1 44 44 LYS HG3 H 1 1.507 0.020 . 2 . . . . 44 LYS QG . 27086 1
528 . 1 1 44 44 LYS HD2 H 1 1.649 0.020 . 2 . . . . 44 LYS HD2 . 27086 1
529 . 1 1 44 44 LYS HD3 H 1 1.686 0.020 . 2 . . . . 44 LYS HD3 . 27086 1
530 . 1 1 44 44 LYS HE2 H 1 3.002 0.020 . 1 . . . . 44 LYS QE . 27086 1
531 . 1 1 44 44 LYS HE3 H 1 3.002 0.020 . 1 . . . . 44 LYS QE . 27086 1
532 . 1 1 44 44 LYS CA C 13 53.104 0.300 . 1 . . . . 44 LYS CA . 27086 1
533 . 1 1 44 44 LYS CB C 13 30.643 0.300 . 1 . . . . 44 LYS CB . 27086 1
534 . 1 1 44 44 LYS CG C 13 22.177 0.300 . 1 . . . . 44 LYS CG . 27086 1
535 . 1 1 44 44 LYS CD C 13 26.371 0.300 . 1 . . . . 44 LYS CD . 27086 1
536 . 1 1 44 44 LYS CE C 13 39.403 0.300 . 1 . . . . 44 LYS CE . 27086 1
537 . 1 1 44 44 LYS N N 15 118.996 0.300 . 1 . . . . 44 LYS N . 27086 1
538 . 1 1 45 45 ASN H H 1 8.443 0.020 . 1 . . . . 45 ASN H . 27086 1
539 . 1 1 45 45 ASN HA H 1 4.913 0.020 . 1 . . . . 45 ASN HA . 27086 1
540 . 1 1 45 45 ASN HB2 H 1 2.821 0.020 . 1 . . . . 45 ASN HB2 . 27086 1
541 . 1 1 45 45 ASN HB3 H 1 3.218 0.020 . 1 . . . . 45 ASN HB3 . 27086 1
542 . 1 1 45 45 ASN HD21 H 1 7.707 0.020 . 1 . . . . 45 ASN HD21 . 27086 1
543 . 1 1 45 45 ASN HD22 H 1 7.381 0.020 . 1 . . . . 45 ASN HD22 . 27086 1
544 . 1 1 45 45 ASN CA C 13 51.002 0.300 . 1 . . . . 45 ASN CA . 27086 1
545 . 1 1 45 45 ASN CB C 13 36.214 0.300 . 1 . . . . 45 ASN CB . 27086 1
546 . 1 1 45 45 ASN N N 15 120.090 0.300 . 1 . . . . 45 ASN N . 27086 1
547 . 1 1 45 45 ASN ND2 N 15 112.097 0.300 . 1 . . . . 45 ASN ND2 . 27086 1
548 . 1 1 46 46 SER H H 1 9.018 0.020 . 1 . . . . 46 SER H . 27086 1
549 . 1 1 46 46 SER HA H 1 4.988 0.020 . 1 . . . . 46 SER HA . 27086 1
550 . 1 1 46 46 SER HB2 H 1 3.942 0.020 . 1 . . . . 46 SER HB2 . 27086 1
551 . 1 1 46 46 SER HB3 H 1 4.412 0.020 . 1 . . . . 46 SER HB3 . 27086 1
552 . 1 1 46 46 SER CA C 13 53.546 0.300 . 1 . . . . 46 SER CA . 27086 1
553 . 1 1 46 46 SER CB C 13 64.272 0.300 . 1 . . . . 46 SER CB . 27086 1
554 . 1 1 46 46 SER N N 15 117.695 0.300 . 1 . . . . 46 SER N . 27086 1
555 . 1 1 47 47 LEU H H 1 8.376 0.020 . 1 . . . . 47 LEU H . 27086 1
556 . 1 1 47 47 LEU HA H 1 4.245 0.020 . 1 . . . . 47 LEU HA . 27086 1
557 . 1 1 47 47 LEU HB2 H 1 1.589 0.020 . 1 . . . . 47 LEU HB2 . 27086 1
558 . 1 1 47 47 LEU HB3 H 1 1.754 0.020 . 1 . . . . 47 LEU HB3 . 27086 1
559 . 1 1 47 47 LEU HG H 1 1.702 0.020 . 1 . . . . 47 LEU HG . 27086 1
560 . 1 1 47 47 LEU HD11 H 1 0.914 0.020 . 1 . . . . 47 LEU QD1 . 27086 1
561 . 1 1 47 47 LEU HD12 H 1 0.914 0.020 . 1 . . . . 47 LEU QD1 . 27086 1
562 . 1 1 47 47 LEU HD13 H 1 0.914 0.020 . 1 . . . . 47 LEU QD1 . 27086 1
563 . 1 1 47 47 LEU HD21 H 1 0.894 0.020 . 1 . . . . 47 LEU QD2 . 27086 1
564 . 1 1 47 47 LEU HD22 H 1 0.894 0.020 . 1 . . . . 47 LEU QD2 . 27086 1
565 . 1 1 47 47 LEU HD23 H 1 0.894 0.020 . 1 . . . . 47 LEU QD2 . 27086 1
566 . 1 1 47 47 LEU CA C 13 54.454 0.300 . 1 . . . . 47 LEU CA . 27086 1
567 . 1 1 47 47 LEU CB C 13 39.185 0.300 . 1 . . . . 47 LEU CB . 27086 1
568 . 1 1 47 47 LEU CG C 13 24.352 0.300 . 1 . . . . 47 LEU CG . 27086 1
569 . 1 1 47 47 LEU CD1 C 13 22.264 0.300 . 1 . . . . 47 LEU CD1 . 27086 1
570 . 1 1 47 47 LEU CD2 C 13 20.614 0.300 . 1 . . . . 47 LEU CD2 . 27086 1
571 . 1 1 47 47 LEU N N 15 117.906 0.300 . 1 . . . . 47 LEU N . 27086 1
572 . 1 1 48 48 LEU H H 1 8.250 0.020 . 1 . . . . 48 LEU H . 27086 1
573 . 1 1 48 48 LEU HA H 1 4.456 0.020 . 1 . . . . 48 LEU HA . 27086 1
574 . 1 1 48 48 LEU HB2 H 1 1.630 0.020 . 1 . . . . 48 LEU HB2 . 27086 1
575 . 1 1 48 48 LEU HB3 H 1 1.697 0.020 . 1 . . . . 48 LEU HB3 . 27086 1
576 . 1 1 48 48 LEU HG H 1 1.624 0.020 . 1 . . . . 48 LEU HG . 27086 1
577 . 1 1 48 48 LEU HD11 H 1 0.846 0.020 . 1 . . . . 48 LEU QD1 . 27086 1
578 . 1 1 48 48 LEU HD12 H 1 0.846 0.020 . 1 . . . . 48 LEU QD1 . 27086 1
579 . 1 1 48 48 LEU HD13 H 1 0.846 0.020 . 1 . . . . 48 LEU QD1 . 27086 1
580 . 1 1 48 48 LEU HD21 H 1 0.934 0.020 . 1 . . . . 48 LEU QD2 . 27086 1
581 . 1 1 48 48 LEU HD22 H 1 0.934 0.020 . 1 . . . . 48 LEU QD2 . 27086 1
582 . 1 1 48 48 LEU HD23 H 1 0.934 0.020 . 1 . . . . 48 LEU QD2 . 27086 1
583 . 1 1 48 48 LEU CA C 13 53.338 0.300 . 1 . . . . 48 LEU CA . 27086 1
584 . 1 1 48 48 LEU CB C 13 42.229 0.300 . 1 . . . . 48 LEU CB . 27086 1
585 . 1 1 48 48 LEU CG C 13 24.526 0.300 . 1 . . . . 48 LEU CG . 27086 1
586 . 1 1 48 48 LEU CD1 C 13 20.309 0.300 . 1 . . . . 48 LEU CD1 . 27086 1
587 . 1 1 48 48 LEU CD2 C 13 22.200 0.300 . 1 . . . . 48 LEU CD2 . 27086 1
588 . 1 1 48 48 LEU N N 15 115.050 0.300 . 1 . . . . 48 LEU N . 27086 1
589 . 1 1 49 49 VAL H H 1 7.554 0.020 . 1 . . . . 49 VAL H . 27086 1
590 . 1 1 49 49 VAL HA H 1 5.029 0.020 . 1 . . . . 49 VAL HA . 27086 1
591 . 1 1 49 49 VAL HB H 1 1.830 0.020 . 1 . . . . 49 VAL HB . 27086 1
592 . 1 1 49 49 VAL HG11 H 1 0.861 0.020 . 1 . . . . 49 VAL QG1 . 27086 1
593 . 1 1 49 49 VAL HG12 H 1 0.861 0.020 . 1 . . . . 49 VAL QG1 . 27086 1
594 . 1 1 49 49 VAL HG13 H 1 0.861 0.020 . 1 . . . . 49 VAL QG1 . 27086 1
595 . 1 1 49 49 VAL CA C 13 57.477 0.300 . 1 . . . . 49 VAL CA . 27086 1
596 . 1 1 49 49 VAL CB C 13 33.666 0.300 . 1 . . . . 49 VAL CB . 27086 1
597 . 1 1 49 49 VAL CG1 C 13 16.958 0.300 . 1 . . . . 49 VAL CG1 . 27086 1
598 . 1 1 49 49 VAL CG2 C 13 19.622 0.300 . 1 . . . . 49 VAL CG2 . 27086 1
599 . 1 1 49 49 VAL N N 15 115.679 0.300 . 1 . . . . 49 VAL N . 27086 1
600 . 1 1 50 50 LYS H H 1 8.802 0.020 . 1 . . . . 50 LYS H . 27086 1
601 . 1 1 50 50 LYS HA H 1 4.761 0.020 . 1 . . . . 50 LYS HA . 27086 1
602 . 1 1 50 50 LYS HB2 H 1 1.581 0.020 . 1 . . . . 50 LYS HB2 . 27086 1
603 . 1 1 50 50 LYS HB3 H 1 1.738 0.020 . 1 . . . . 50 LYS HB3 . 27086 1
604 . 1 1 50 50 LYS HG2 H 1 1.177 0.020 . 2 . . . . 50 LYS HG2 . 27086 1
605 . 1 1 50 50 LYS HG3 H 1 1.464 0.020 . 2 . . . . 50 LYS HG3 . 27086 1
606 . 1 1 50 50 LYS HD2 H 1 1.455 0.020 . 2 . . . . 50 LYS HD2 . 27086 1
607 . 1 1 50 50 LYS HE2 H 1 2.837 0.020 . 2 . . . . 50 LYS QE . 27086 1
608 . 1 1 50 50 LYS HE3 H 1 2.837 0.020 . 2 . . . . 50 LYS QE . 27086 1
609 . 1 1 50 50 LYS CA C 13 51.663 0.300 . 1 . . . . 50 LYS CA . 27086 1
610 . 1 1 50 50 LYS CB C 13 34.724 0.300 . 1 . . . . 50 LYS CB . 27086 1
611 . 1 1 50 50 LYS CG C 13 23.047 0.300 . 1 . . . . 50 LYS CG . 27086 1
612 . 1 1 50 50 LYS CD C 13 27.069 0.300 . 1 . . . . 50 LYS CD . 27086 1
613 . 1 1 50 50 LYS CE C 13 39.633 0.300 . 1 . . . . 50 LYS CE . 27086 1
614 . 1 1 50 50 LYS N N 15 122.356 0.300 . 1 . . . . 50 LYS N . 27086 1
615 . 1 1 51 51 TYR H H 1 9.297 0.020 . 1 . . . . 51 TYR H . 27086 1
616 . 1 1 51 51 TYR HA H 1 5.284 0.020 . 1 . . . . 51 TYR HA . 27086 1
617 . 1 1 51 51 TYR HB2 H 1 2.717 0.020 . 1 . . . . 51 TYR HB2 . 27086 1
618 . 1 1 51 51 TYR HB3 H 1 2.936 0.020 . 1 . . . . 51 TYR HB3 . 27086 1
619 . 1 1 51 51 TYR HD1 H 1 6.795 0.020 . 3 . . . . 51 TYR QD . 27086 1
620 . 1 1 51 51 TYR HD2 H 1 6.795 0.020 . 3 . . . . 51 TYR QD . 27086 1
621 . 1 1 51 51 TYR HE1 H 1 6.424 0.020 . 3 . . . . 51 TYR QE . 27086 1
622 . 1 1 51 51 TYR HE2 H 1 6.424 0.020 . 3 . . . . 51 TYR QE . 27086 1
623 . 1 1 51 51 TYR CA C 13 54.988 0.300 . 1 . . . . 51 TYR CA . 27086 1
624 . 1 1 51 51 TYR CB C 13 39.226 0.300 . 1 . . . . 51 TYR CB . 27086 1
625 . 1 1 51 51 TYR CG C 13 128.980 0.300 . 1 . . . . 51 TYR CG . 27086 1
626 . 1 1 51 51 TYR CD1 C 13 130.150 0.300 . 1 . . . . 51 TYR CD1 . 27086 1
627 . 1 1 51 51 TYR CD2 C 13 130.150 0.300 . 1 . . . . 51 TYR CD2 . 27086 1
628 . 1 1 51 51 TYR CE1 C 13 115.530 0.300 . 1 . . . . 51 TYR CE1 . 27086 1
629 . 1 1 51 51 TYR CE2 C 13 115.530 0.300 . 1 . . . . 51 TYR CE2 . 27086 1
630 . 1 1 51 51 TYR CZ C 13 154.610 0.300 . 1 . . . . 51 TYR CZ . 27086 1
631 . 1 1 51 51 TYR N N 15 124.161 0.300 . 1 . . . . 51 TYR N . 27086 1
632 . 1 1 52 52 VAL H H 1 8.998 0.020 . 1 . . . . 52 VAL H . 27086 1
633 . 1 1 52 52 VAL HA H 1 4.532 0.020 . 1 . . . . 52 VAL HA . 27086 1
634 . 1 1 52 52 VAL HB H 1 2.038 0.020 . 1 . . . . 52 VAL HB . 27086 1
635 . 1 1 52 52 VAL HG11 H 1 1.030 0.020 . 1 . . . . 52 VAL QG1 . 27086 1
636 . 1 1 52 52 VAL HG12 H 1 1.030 0.020 . 1 . . . . 52 VAL QG1 . 27086 1
637 . 1 1 52 52 VAL HG13 H 1 1.030 0.020 . 1 . . . . 52 VAL QG1 . 27086 1
638 . 1 1 52 52 VAL HG21 H 1 1.121 0.020 . 1 . . . . 52 VAL QG2 . 27086 1
639 . 1 1 52 52 VAL HG22 H 1 1.121 0.020 . 1 . . . . 52 VAL QG2 . 27086 1
640 . 1 1 52 52 VAL HG23 H 1 1.121 0.020 . 1 . . . . 52 VAL QG2 . 27086 1
641 . 1 1 52 52 VAL CA C 13 59.680 0.300 . 1 . . . . 52 VAL CA . 27086 1
642 . 1 1 52 52 VAL CB C 13 32.125 0.300 . 1 . . . . 52 VAL CB . 27086 1
643 . 1 1 52 52 VAL CG1 C 13 18.332 0.300 . 1 . . . . 52 VAL CG1 . 27086 1
644 . 1 1 52 52 VAL CG2 C 13 18.239 0.300 . 1 . . . . 52 VAL CG2 . 27086 1
645 . 1 1 52 52 VAL N N 15 121.583 0.300 . 1 . . . . 52 VAL N . 27086 1
646 . 1 1 53 53 CYS H H 1 9.552 0.020 . 1 . . . . 53 CYS H . 27086 1
647 . 1 1 53 53 CYS HA H 1 5.841 0.020 . 1 . . . . 53 CYS HA . 27086 1
648 . 1 1 53 53 CYS HB2 H 1 3.054 0.020 . 1 . . . . 53 CYS HB2 . 27086 1
649 . 1 1 53 53 CYS HB3 H 1 3.759 0.020 . 1 . . . . 53 CYS HB3 . 27086 1
650 . 1 1 53 53 CYS CA C 13 52.243 0.300 . 1 . . . . 53 CYS CA . 27086 1
651 . 1 1 53 53 CYS CB C 13 46.866 0.300 . 1 . . . . 53 CYS CB . 27086 1
652 . 1 1 53 53 CYS N N 15 125.448 0.300 . 1 . . . . 53 CYS N . 27086 1
653 . 1 1 54 54 CYS H H 1 9.214 0.020 . 1 . . . . 54 CYS H . 27086 1
654 . 1 1 54 54 CYS HA H 1 5.061 0.020 . 1 . . . . 54 CYS HA . 27086 1
655 . 1 1 54 54 CYS HB2 H 1 3.385 0.020 . 1 . . . . 54 CYS HB2 . 27086 1
656 . 1 1 54 54 CYS HB3 H 1 3.617 0.020 . 1 . . . . 54 CYS HB3 . 27086 1
657 . 1 1 54 54 CYS CA C 13 52.587 0.300 . 1 . . . . 54 CYS CA . 27086 1
658 . 1 1 54 54 CYS CB C 13 43.282 0.300 . 1 . . . . 54 CYS CB . 27086 1
659 . 1 1 54 54 CYS N N 15 118.382 0.300 . 1 . . . . 54 CYS N . 27086 1
660 . 1 1 55 55 ASN H H 1 8.573 0.020 . 1 . . . . 55 ASN H . 27086 1
661 . 1 1 55 55 ASN HA H 1 5.124 0.020 . 1 . . . . 55 ASN HA . 27086 1
662 . 1 1 55 55 ASN HB2 H 1 2.604 0.020 . 1 . . . . 55 ASN HB2 . 27086 1
663 . 1 1 55 55 ASN HB3 H 1 3.343 0.020 . 1 . . . . 55 ASN HB3 . 27086 1
664 . 1 1 55 55 ASN HD21 H 1 7.541 0.020 . 1 . . . . 55 ASN HD21 . 27086 1
665 . 1 1 55 55 ASN HD22 H 1 6.744 0.020 . 1 . . . . 55 ASN HD22 . 27086 1
666 . 1 1 55 55 ASN CA C 13 50.421 0.300 . 1 . . . . 55 ASN CA . 27086 1
667 . 1 1 55 55 ASN CB C 13 37.316 0.300 . 1 . . . . 55 ASN CB . 27086 1
668 . 1 1 55 55 ASN N N 15 118.728 0.300 . 1 . . . . 55 ASN N . 27086 1
669 . 1 1 55 55 ASN ND2 N 15 109.882 0.300 . 1 . . . . 55 ASN ND2 . 27086 1
670 . 1 1 56 56 THR H H 1 7.603 0.020 . 1 . . . . 56 THR H . 27086 1
671 . 1 1 56 56 THR HA H 1 4.685 0.020 . 1 . . . . 56 THR HA . 27086 1
672 . 1 1 56 56 THR HB H 1 4.251 0.020 . 1 . . . . 56 THR HB . 27086 1
673 . 1 1 56 56 THR HG21 H 1 1.158 0.020 . 1 . . . . 56 THR QG2 . 27086 1
674 . 1 1 56 56 THR HG22 H 1 1.158 0.020 . 1 . . . . 56 THR QG2 . 27086 1
675 . 1 1 56 56 THR HG23 H 1 1.158 0.020 . 1 . . . . 56 THR QG2 . 27086 1
676 . 1 1 56 56 THR CA C 13 57.497 0.300 . 1 . . . . 56 THR CA . 27086 1
677 . 1 1 56 56 THR CB C 13 69.435 0.300 . 1 . . . . 56 THR CB . 27086 1
678 . 1 1 56 56 THR CG2 C 13 19.212 0.300 . 1 . . . . 56 THR CG2 . 27086 1
679 . 1 1 56 56 THR N N 15 110.355 0.300 . 1 . . . . 56 THR N . 27086 1
680 . 1 1 57 57 ASP H H 1 8.211 0.020 . 1 . . . . 57 ASP H . 27086 1
681 . 1 1 57 57 ASP HA H 1 4.773 0.020 . 1 . . . . 57 ASP HA . 27086 1
682 . 1 1 57 57 ASP HB2 H 1 2.243 0.020 . 1 . . . . 57 ASP HB2 . 27086 1
683 . 1 1 57 57 ASP HB3 H 1 2.452 0.020 . 1 . . . . 57 ASP HB3 . 27086 1
684 . 1 1 57 57 ASP CA C 13 53.114 0.300 . 1 . . . . 57 ASP CA . 27086 1
685 . 1 1 57 57 ASP CB C 13 38.967 0.300 . 1 . . . . 57 ASP CB . 27086 1
686 . 1 1 57 57 ASP N N 15 118.377 0.300 . 1 . . . . 57 ASP N . 27086 1
687 . 1 1 58 58 ARG H H 1 9.674 0.020 . 1 . . . . 58 ARG H . 27086 1
688 . 1 1 58 58 ARG HA H 1 3.369 0.020 . 1 . . . . 58 ARG HA . 27086 1
689 . 1 1 58 58 ARG HB2 H 1 1.712 0.020 . 1 . . . . 58 ARG HB2 . 27086 1
690 . 1 1 58 58 ARG HB3 H 1 2.129 0.020 . 1 . . . . 58 ARG HB3 . 27086 1
691 . 1 1 58 58 ARG HG2 H 1 0.744 0.020 . 1 . . . . 58 ARG HG2 . 27086 1
692 . 1 1 58 58 ARG HG3 H 1 1.366 0.020 . 1 . . . . 58 ARG HG3 . 27086 1
693 . 1 1 58 58 ARG HD2 H 1 2.380 0.020 . 1 . . . . 58 ARG HD2 . 27086 1
694 . 1 1 58 58 ARG HD3 H 1 2.776 0.020 . 1 . . . . 58 ARG HD3 . 27086 1
695 . 1 1 58 58 ARG HE H 1 7.800 0.020 . 1 . . . . 58 ARG HE . 27086 1
696 . 1 1 58 58 ARG CA C 13 55.447 0.300 . 1 . . . . 58 ARG CA . 27086 1
697 . 1 1 58 58 ARG CB C 13 24.559 0.300 . 1 . . . . 58 ARG CB . 27086 1
698 . 1 1 58 58 ARG CG C 13 25.173 0.300 . 1 . . . . 58 ARG CG . 27086 1
699 . 1 1 58 58 ARG CD C 13 40.454 0.300 . 1 . . . . 58 ARG CD . 27086 1
700 . 1 1 58 58 ARG N N 15 114.684 0.300 . 1 . . . . 58 ARG N . 27086 1
701 . 1 1 59 59 CYS H H 1 7.623 0.020 . 1 . . . . 59 CYS H . 27086 1
702 . 1 1 59 59 CYS HA H 1 4.432 0.020 . 1 . . . . 59 CYS HA . 27086 1
703 . 1 1 59 59 CYS HB2 H 1 3.327 0.020 . 1 . . . . 59 CYS HB2 . 27086 1
704 . 1 1 59 59 CYS HB3 H 1 3.610 0.020 . 1 . . . . 59 CYS HB3 . 27086 1
705 . 1 1 59 59 CYS CA C 13 53.673 0.300 . 1 . . . . 59 CYS CA . 27086 1
706 . 1 1 59 59 CYS CB C 13 43.243 0.300 . 1 . . . . 59 CYS CB . 27086 1
707 . 1 1 59 59 CYS N N 15 111.813 0.300 . 1 . . . . 59 CYS N . 27086 1
708 . 1 1 60 60 ASN H H 1 9.060 0.020 . 1 . . . . 60 ASN H . 27086 1
709 . 1 1 60 60 ASN HA H 1 4.314 0.020 . 1 . . . . 60 ASN HA . 27086 1
710 . 1 1 60 60 ASN HB2 H 1 2.280 0.020 . 1 . . . . 60 ASN HB2 . 27086 1
711 . 1 1 60 60 ASN HB3 H 1 2.672 0.020 . 1 . . . . 60 ASN HB3 . 27086 1
712 . 1 1 60 60 ASN HD21 H 1 7.519 0.020 . 1 . . . . 60 ASN HD21 . 27086 1
713 . 1 1 60 60 ASN HD22 H 1 7.413 0.020 . 1 . . . . 60 ASN HD22 . 27086 1
714 . 1 1 60 60 ASN CA C 13 51.870 0.300 . 1 . . . . 60 ASN CA . 27086 1
715 . 1 1 60 60 ASN CB C 13 37.016 0.300 . 1 . . . . 60 ASN CB . 27086 1
716 . 1 1 60 60 ASN N N 15 126.494 0.300 . 1 . . . . 60 ASN N . 27086 1
717 . 1 1 60 60 ASN ND2 N 15 114.905 0.300 . 1 . . . . 60 ASN ND2 . 27086 1
stop_
save_