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 18018
_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' . . . 18018 1
2 '3D 1H-15N NOESY' . . . 18018 1
3 '3D 1H-13C NOESY aliphatic' . . . 18018 1
4 '3D 1H-13C NOESY aromatic' . . . 18018 1
5 '5D APSY CBCACONH' . . . 18018 1
6 '4D APSY HACANH' . . . 18018 1
7 '5D APSY HACACONH' . . . 18018 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 4 4 PHE H H 1 8.328 0.007 . 1 . . . A 4 PHE H . 18018 1
2 . 1 1 4 4 PHE HA H 1 4.683 0.007 . 1 . . . A 4 PHE HA . 18018 1
3 . 1 1 4 4 PHE HB2 H 1 3.270 0.007 . 2 . . . A 4 PHE HB2 . 18018 1
4 . 1 1 4 4 PHE HB3 H 1 3.148 0.007 . 2 . . . A 4 PHE HB3 . 18018 1
5 . 1 1 4 4 PHE CA C 13 57.607 0.17 . 1 . . . A 4 PHE CA . 18018 1
6 . 1 1 4 4 PHE CB C 13 38.895 0.17 . 1 . . . A 4 PHE CB . 18018 1
7 . 1 1 4 4 PHE CD1 C 13 129.144 0.17 . 3 . . . A 4 PHE CD1 . 18018 1
8 . 1 1 4 4 PHE N N 15 122.548 0.12 . 1 . . . A 4 PHE N . 18018 1
9 . 1 1 7 7 ARG H H 1 8.321 0.007 . 1 . . . A 7 ARG H . 18018 1
10 . 1 1 7 7 ARG HA H 1 4.256 0.007 . 1 . . . A 7 ARG HA . 18018 1
11 . 1 1 7 7 ARG HB2 H 1 1.967 0.007 . 2 . . . A 7 ARG QB . 18018 1
12 . 1 1 7 7 ARG HB3 H 1 1.967 0.007 . 2 . . . A 7 ARG QB . 18018 1
13 . 1 1 7 7 ARG HG2 H 1 1.796 0.007 . 2 . . . A 7 ARG HG2 . 18018 1
14 . 1 1 7 7 ARG HD2 H 1 2.792 0.007 . 2 . . . A 7 ARG QD . 18018 1
15 . 1 1 7 7 ARG HD3 H 1 2.792 0.007 . 2 . . . A 7 ARG QD . 18018 1
16 . 1 1 7 7 ARG C C 13 176.683 0.17 . 1 . . . A 7 ARG C . 18018 1
17 . 1 1 7 7 ARG CA C 13 57.087 0.17 . 1 . . . A 7 ARG CA . 18018 1
18 . 1 1 7 7 ARG CB C 13 29.362 0.17 . 1 . . . A 7 ARG CB . 18018 1
19 . 1 1 7 7 ARG CG C 13 26.831 0.17 . 1 . . . A 7 ARG CG . 18018 1
20 . 1 1 7 7 ARG CD C 13 43.080 0.17 . 1 . . . A 7 ARG CD . 18018 1
21 . 1 1 7 7 ARG N N 15 121.962 0.12 . 1 . . . A 7 ARG N . 18018 1
22 . 1 1 8 8 GLU H H 1 8.388 0.007 . 1 . . . A 8 GLU H . 18018 1
23 . 1 1 8 8 GLU HA H 1 4.251 0.007 . 1 . . . A 8 GLU HA . 18018 1
24 . 1 1 8 8 GLU HB2 H 1 2.143 0.007 . 2 . . . A 8 GLU HB2 . 18018 1
25 . 1 1 8 8 GLU HB3 H 1 2.377 0.007 . 2 . . . A 8 GLU HB3 . 18018 1
26 . 1 1 8 8 GLU HG2 H 1 2.352 0.007 . 2 . . . A 8 GLU QG . 18018 1
27 . 1 1 8 8 GLU HG3 H 1 2.352 0.007 . 2 . . . A 8 GLU QG . 18018 1
28 . 1 1 8 8 GLU C C 13 176.964 0.17 . 1 . . . A 8 GLU C . 18018 1
29 . 1 1 8 8 GLU CA C 13 56.933 0.17 . 1 . . . A 8 GLU CA . 18018 1
30 . 1 1 8 8 GLU CB C 13 28.855 0.17 . 1 . . . A 8 GLU CB . 18018 1
31 . 1 1 8 8 GLU CG C 13 35.681 0.17 . 1 . . . A 8 GLU CG . 18018 1
32 . 1 1 8 8 GLU N N 15 121.095 0.12 . 1 . . . A 8 GLU N . 18018 1
33 . 1 1 9 9 ARG H H 1 8.268 0.007 . 1 . . . A 9 ARG H . 18018 1
34 . 1 1 9 9 ARG HA H 1 4.340 0.007 . 1 . . . A 9 ARG HA . 18018 1
35 . 1 1 9 9 ARG HB2 H 1 1.961 0.007 . 2 . . . A 9 ARG HB2 . 18018 1
36 . 1 1 9 9 ARG HG2 H 1 1.768 0.007 . 2 . . . A 9 ARG HG2 . 18018 1
37 . 1 1 9 9 ARG HG3 H 1 1.817 0.007 . 2 . . . A 9 ARG HG3 . 18018 1
38 . 1 1 9 9 ARG HD2 H 1 3.318 0.007 . 2 . . . A 9 ARG QD . 18018 1
39 . 1 1 9 9 ARG HD3 H 1 3.318 0.007 . 2 . . . A 9 ARG QD . 18018 1
40 . 1 1 9 9 ARG C C 13 176.563 0.17 . 1 . . . A 9 ARG C . 18018 1
41 . 1 1 9 9 ARG CA C 13 56.413 0.17 . 1 . . . A 9 ARG CA . 18018 1
42 . 1 1 9 9 ARG CB C 13 29.669 0.17 . 1 . . . A 9 ARG CB . 18018 1
43 . 1 1 9 9 ARG CG C 13 26.709 0.17 . 1 . . . A 9 ARG CG . 18018 1
44 . 1 1 9 9 ARG CD C 13 42.662 0.17 . 1 . . . A 9 ARG CD . 18018 1
45 . 1 1 9 9 ARG N N 15 121.310 0.12 . 1 . . . A 9 ARG N . 18018 1
46 . 1 1 10 10 ALA H H 1 8.222 0.007 . 1 . . . A 10 ALA H . 18018 1
47 . 1 1 10 10 ALA HA H 1 4.318 0.007 . 1 . . . A 10 ALA HA . 18018 1
48 . 1 1 10 10 ALA HB1 H 1 1.508 0.007 . 1 . . . A 10 ALA QB . 18018 1
49 . 1 1 10 10 ALA HB2 H 1 1.508 0.007 . 1 . . . A 10 ALA QB . 18018 1
50 . 1 1 10 10 ALA HB3 H 1 1.508 0.007 . 1 . . . A 10 ALA QB . 18018 1
51 . 1 1 10 10 ALA C C 13 178.129 0.17 . 1 . . . A 10 ALA C . 18018 1
52 . 1 1 10 10 ALA CA C 13 52.947 0.17 . 1 . . . A 10 ALA CA . 18018 1
53 . 1 1 10 10 ALA CB C 13 17.756 0.17 . 1 . . . A 10 ALA CB . 18018 1
54 . 1 1 10 10 ALA N N 15 124.224 0.12 . 1 . . . A 10 ALA N . 18018 1
55 . 1 1 11 11 HIS H H 1 8.486 0.007 . 1 . . . A 11 HIS H . 18018 1
56 . 1 1 11 11 HIS HA H 1 4.699 0.007 . 1 . . . A 11 HIS HA . 18018 1
57 . 1 1 11 11 HIS HB2 H 1 3.414 0.007 . 2 . . . A 11 HIS HB2 . 18018 1
58 . 1 1 11 11 HIS HD2 H 1 7.224 0.007 . 1 . . . A 11 HIS HD2 . 18018 1
59 . 1 1 11 11 HIS C C 13 175.013 0.17 . 1 . . . A 11 HIS C . 18018 1
60 . 1 1 11 11 HIS CA C 13 56.255 0.17 . 1 . . . A 11 HIS CA . 18018 1
61 . 1 1 11 11 HIS CB C 13 28.767 0.17 . 1 . . . A 11 HIS CB . 18018 1
62 . 1 1 11 11 HIS CD2 C 13 116.812 0.17 . 1 . . . A 11 HIS CD2 . 18018 1
63 . 1 1 11 11 HIS N N 15 118.081 0.12 . 1 . . . A 11 HIS N . 18018 1
64 . 1 1 12 12 GLU H H 1 8.370 0.007 . 1 . . . A 12 GLU H . 18018 1
65 . 1 1 12 12 GLU HA H 1 4.278 0.007 . 1 . . . A 12 GLU HA . 18018 1
66 . 1 1 12 12 GLU HB2 H 1 2.210 0.007 . 2 . . . A 12 GLU QB . 18018 1
67 . 1 1 12 12 GLU HB3 H 1 2.210 0.007 . 2 . . . A 12 GLU QB . 18018 1
68 . 1 1 12 12 GLU HG2 H 1 2.420 0.007 . 2 . . . A 12 GLU QG . 18018 1
69 . 1 1 12 12 GLU HG3 H 1 2.420 0.007 . 2 . . . A 12 GLU QG . 18018 1
70 . 1 1 12 12 GLU C C 13 176.808 0.17 . 1 . . . A 12 GLU C . 18018 1
71 . 1 1 12 12 GLU CA C 13 57.621 0.17 . 1 . . . A 12 GLU CA . 18018 1
72 . 1 1 12 12 GLU CB C 13 28.853 0.17 . 1 . . . A 12 GLU CB . 18018 1
73 . 1 1 12 12 GLU CG C 13 35.763 0.17 . 1 . . . A 12 GLU CG . 18018 1
74 . 1 1 12 12 GLU N N 15 121.492 0.12 . 1 . . . A 12 GLU N . 18018 1
75 . 1 1 13 13 ALA H H 1 8.426 0.007 . 1 . . . A 13 ALA H . 18018 1
76 . 1 1 13 13 ALA HA H 1 4.304 0.007 . 1 . . . A 13 ALA HA . 18018 1
77 . 1 1 13 13 ALA HB1 H 1 1.579 0.007 . 1 . . . A 13 ALA QB . 18018 1
78 . 1 1 13 13 ALA HB2 H 1 1.579 0.007 . 1 . . . A 13 ALA QB . 18018 1
79 . 1 1 13 13 ALA HB3 H 1 1.579 0.007 . 1 . . . A 13 ALA QB . 18018 1
80 . 1 1 13 13 ALA C C 13 178.197 0.17 . 1 . . . A 13 ALA C . 18018 1
81 . 1 1 13 13 ALA CA C 13 54.051 0.17 . 1 . . . A 13 ALA CA . 18018 1
82 . 1 1 13 13 ALA CB C 13 17.788 0.17 . 1 . . . A 13 ALA CB . 18018 1
83 . 1 1 13 13 ALA N N 15 123.583 0.12 . 1 . . . A 13 ALA N . 18018 1
84 . 1 1 14 14 LYS H H 1 8.073 0.007 . 1 . . . A 14 LYS H . 18018 1
85 . 1 1 14 14 LYS HA H 1 4.218 0.007 . 1 . . . A 14 LYS HA . 18018 1
86 . 1 1 14 14 LYS HB2 H 1 1.753 0.007 . 2 . . . A 14 LYS HB2 . 18018 1
87 . 1 1 14 14 LYS HB3 H 1 1.853 0.007 . 2 . . . A 14 LYS HB3 . 18018 1
88 . 1 1 14 14 LYS HG2 H 1 1.324 0.007 . 2 . . . A 14 LYS HG2 . 18018 1
89 . 1 1 14 14 LYS HG3 H 1 1.445 0.007 . 2 . . . A 14 LYS HG3 . 18018 1
90 . 1 1 14 14 LYS C C 13 176.757 0.17 . 1 . . . A 14 LYS C . 18018 1
91 . 1 1 14 14 LYS CA C 13 57.110 0.17 . 1 . . . A 14 LYS CA . 18018 1
92 . 1 1 14 14 LYS CB C 13 31.743 0.17 . 1 . . . A 14 LYS CB . 18018 1
93 . 1 1 14 14 LYS CG C 13 24.028 0.17 . 1 . . . A 14 LYS CG . 18018 1
94 . 1 1 14 14 LYS N N 15 119.772 0.12 . 1 . . . A 14 LYS N . 18018 1
95 . 1 1 15 15 PHE H H 1 7.926 0.007 . 1 . . . A 15 PHE H . 18018 1
96 . 1 1 15 15 PHE HA H 1 4.444 0.007 . 1 . . . A 15 PHE HA . 18018 1
97 . 1 1 15 15 PHE HB2 H 1 2.995 0.007 . 2 . . . A 15 PHE HB2 . 18018 1
98 . 1 1 15 15 PHE HB3 H 1 3.392 0.007 . 2 . . . A 15 PHE HB3 . 18018 1
99 . 1 1 15 15 PHE HD1 H 1 7.401 0.007 . 3 . . . A 15 PHE HD1 . 18018 1
100 . 1 1 15 15 PHE HD2 H 1 7.365 0.007 . 3 . . . A 15 PHE HD2 . 18018 1
101 . 1 1 15 15 PHE C C 13 175.635 0.17 . 1 . . . A 15 PHE C . 18018 1
102 . 1 1 15 15 PHE CA C 13 59.001 0.17 . 1 . . . A 15 PHE CA . 18018 1
103 . 1 1 15 15 PHE CB C 13 38.491 0.17 . 1 . . . A 15 PHE CB . 18018 1
104 . 1 1 15 15 PHE CD1 C 13 129.158 0.17 . 3 . . . A 15 PHE CD1 . 18018 1
105 . 1 1 15 15 PHE CD2 C 13 129.026 0.17 . 3 . . . A 15 PHE CD2 . 18018 1
106 . 1 1 15 15 PHE N N 15 118.073 0.12 . 1 . . . A 15 PHE N . 18018 1
107 . 1 1 16 16 ALA H H 1 8.137 0.007 . 1 . . . A 16 ALA H . 18018 1
108 . 1 1 16 16 ALA HA H 1 4.306 0.007 . 1 . . . A 16 ALA HA . 18018 1
109 . 1 1 16 16 ALA HB1 H 1 1.480 0.007 . 1 . . . A 16 ALA QB . 18018 1
110 . 1 1 16 16 ALA HB2 H 1 1.480 0.007 . 1 . . . A 16 ALA QB . 18018 1
111 . 1 1 16 16 ALA HB3 H 1 1.480 0.007 . 1 . . . A 16 ALA QB . 18018 1
112 . 1 1 16 16 ALA C C 13 177.641 0.17 . 1 . . . A 16 ALA C . 18018 1
113 . 1 1 16 16 ALA CA C 13 53.052 0.17 . 1 . . . A 16 ALA CA . 18018 1
114 . 1 1 16 16 ALA CB C 13 18.021 0.17 . 1 . . . A 16 ALA CB . 18018 1
115 . 1 1 16 16 ALA N N 15 122.453 0.12 . 1 . . . A 16 ALA N . 18018 1
116 . 1 1 17 17 HIS H H 1 8.051 0.007 . 1 . . . A 17 HIS H . 18018 1
117 . 1 1 17 17 HIS HA H 1 4.825 0.007 . 1 . . . A 17 HIS HA . 18018 1
118 . 1 1 17 17 HIS HB2 H 1 3.266 0.007 . 2 . . . A 17 HIS HB2 . 18018 1
119 . 1 1 17 17 HIS HB3 H 1 3.510 0.007 . 2 . . . A 17 HIS HB3 . 18018 1
120 . 1 1 17 17 HIS HD2 H 1 7.388 0.007 . 1 . . . A 17 HIS HD2 . 18018 1
121 . 1 1 17 17 HIS CA C 13 55.095 0.17 . 1 . . . A 17 HIS CA . 18018 1
122 . 1 1 17 17 HIS CB C 13 28.958 0.17 . 1 . . . A 17 HIS CB . 18018 1
123 . 1 1 17 17 HIS CD2 C 13 117.722 0.17 . 1 . . . A 17 HIS CD2 . 18018 1
124 . 1 1 17 17 HIS N N 15 115.587 0.12 . 1 . . . A 17 HIS N . 18018 1
125 . 1 1 18 18 ASP H H 1 7.913 0.007 . 1 . . . A 18 ASP H . 18018 1
126 . 1 1 18 18 ASP HA H 1 4.790 0.007 . 1 . . . A 18 ASP HA . 18018 1
127 . 1 1 18 18 ASP HB2 H 1 2.665 0.007 . 2 . . . A 18 ASP HB2 . 18018 1
128 . 1 1 18 18 ASP HB3 H 1 2.967 0.007 . 2 . . . A 18 ASP HB3 . 18018 1
129 . 1 1 18 18 ASP CA C 13 53.582 0.17 . 1 . . . A 18 ASP CA . 18018 1
130 . 1 1 18 18 ASP CB C 13 40.787 0.17 . 1 . . . A 18 ASP CB . 18018 1
131 . 1 1 18 18 ASP N N 15 121.432 0.12 . 1 . . . A 18 ASP N . 18018 1
132 . 1 1 19 19 ALA H H 1 8.599 0.007 . 1 . . . A 19 ALA H . 18018 1
133 . 1 1 19 19 ALA HA H 1 4.296 0.007 . 1 . . . A 19 ALA HA . 18018 1
134 . 1 1 19 19 ALA HB1 H 1 1.592 0.007 . 1 . . . A 19 ALA QB . 18018 1
135 . 1 1 19 19 ALA HB2 H 1 1.592 0.007 . 1 . . . A 19 ALA QB . 18018 1
136 . 1 1 19 19 ALA HB3 H 1 1.592 0.007 . 1 . . . A 19 ALA QB . 18018 1
137 . 1 1 19 19 ALA CA C 13 54.047 0.17 . 1 . . . A 19 ALA CA . 18018 1
138 . 1 1 19 19 ALA CB C 13 17.859 0.17 . 1 . . . A 19 ALA CB . 18018 1
139 . 1 1 19 19 ALA N N 15 126.983 0.12 . 1 . . . A 19 ALA N . 18018 1
140 . 1 1 20 20 GLU H H 1 8.377 0.007 . 1 . . . A 20 GLU H . 18018 1
141 . 1 1 20 20 GLU HA H 1 4.329 0.007 . 1 . . . A 20 GLU HA . 18018 1
142 . 1 1 20 20 GLU HB2 H 1 2.288 0.007 . 2 . . . A 20 GLU QB . 18018 1
143 . 1 1 20 20 GLU HB3 H 1 2.288 0.007 . 2 . . . A 20 GLU QB . 18018 1
144 . 1 1 20 20 GLU HG2 H 1 2.467 0.007 . 2 . . . A 20 GLU HG2 . 18018 1
145 . 1 1 20 20 GLU CA C 13 58.378 0.17 . 1 . . . A 20 GLU CA . 18018 1
146 . 1 1 20 20 GLU CB C 13 28.877 0.17 . 1 . . . A 20 GLU CB . 18018 1
147 . 1 1 20 20 GLU CG C 13 35.465 0.17 . 1 . . . A 20 GLU CG . 18018 1
148 . 1 1 20 20 GLU N N 15 119.997 0.12 . 1 . . . A 20 GLU N . 18018 1
149 . 1 1 21 21 LEU H H 1 8.117 0.007 . 1 . . . A 21 LEU H . 18018 1
150 . 1 1 21 21 LEU HA H 1 4.163 0.007 . 1 . . . A 21 LEU HA . 18018 1
151 . 1 1 21 21 LEU HB2 H 1 1.684 0.007 . 2 . . . A 21 LEU HB2 . 18018 1
152 . 1 1 21 21 LEU HB3 H 1 1.731 0.007 . 2 . . . A 21 LEU HB3 . 18018 1
153 . 1 1 21 21 LEU HD11 H 1 0.737 0.007 . 2 . . . A 21 LEU QD1 . 18018 1
154 . 1 1 21 21 LEU HD12 H 1 0.737 0.007 . 2 . . . A 21 LEU QD1 . 18018 1
155 . 1 1 21 21 LEU HD13 H 1 0.737 0.007 . 2 . . . A 21 LEU QD1 . 18018 1
156 . 1 1 21 21 LEU HD21 H 1 0.912 0.007 . 2 . . . A 21 LEU QD2 . 18018 1
157 . 1 1 21 21 LEU HD22 H 1 0.912 0.007 . 2 . . . A 21 LEU QD2 . 18018 1
158 . 1 1 21 21 LEU HD23 H 1 0.912 0.007 . 2 . . . A 21 LEU QD2 . 18018 1
159 . 1 1 21 21 LEU CA C 13 57.125 0.17 . 1 . . . A 21 LEU CA . 18018 1
160 . 1 1 21 21 LEU CB C 13 41.030 0.17 . 1 . . . A 21 LEU CB . 18018 1
161 . 1 1 21 21 LEU CD1 C 13 23.646 0.17 . 2 . . . A 21 LEU CD1 . 18018 1
162 . 1 1 21 21 LEU CD2 C 13 24.384 0.17 . 2 . . . A 21 LEU CD2 . 18018 1
163 . 1 1 21 21 LEU N N 15 122.484 0.12 . 1 . . . A 21 LEU N . 18018 1
164 . 1 1 22 22 ASN H H 1 8.507 0.007 . 1 . . . A 22 ASN H . 18018 1
165 . 1 1 22 22 ASN HA H 1 4.692 0.007 . 1 . . . A 22 ASN HA . 18018 1
166 . 1 1 22 22 ASN HB2 H 1 3.151 0.007 . 2 . . . A 22 ASN HB2 . 18018 1
167 . 1 1 22 22 ASN HB3 H 1 2.937 0.007 . 2 . . . A 22 ASN HB3 . 18018 1
168 . 1 1 22 22 ASN HD21 H 1 7.110 0.007 . 2 . . . A 22 ASN HD21 . 18018 1
169 . 1 1 22 22 ASN HD22 H 1 7.685 0.007 . 2 . . . A 22 ASN HD22 . 18018 1
170 . 1 1 22 22 ASN CA C 13 56.338 0.17 . 1 . . . A 22 ASN CA . 18018 1
171 . 1 1 22 22 ASN CB C 13 40.138 0.17 . 1 . . . A 22 ASN CB . 18018 1
172 . 1 1 22 22 ASN N N 15 117.879 0.12 . 1 . . . A 22 ASN N . 18018 1
173 . 1 1 22 22 ASN ND2 N 15 114.862 0.12 . 1 . . . A 22 ASN ND2 . 18018 1
174 . 1 1 23 23 PHE H H 1 8.465 0.007 . 1 . . . A 23 PHE H . 18018 1
175 . 1 1 23 23 PHE HA H 1 4.463 0.007 . 1 . . . A 23 PHE HA . 18018 1
176 . 1 1 23 23 PHE HB2 H 1 3.431 0.007 . 2 . . . A 23 PHE QB . 18018 1
177 . 1 1 23 23 PHE HB3 H 1 3.431 0.007 . 2 . . . A 23 PHE QB . 18018 1
178 . 1 1 23 23 PHE HD1 H 1 7.487 0.007 . 3 . . . A 23 PHE HD1 . 18018 1
179 . 1 1 23 23 PHE CA C 13 60.239 0.17 . 1 . . . A 23 PHE CA . 18018 1
180 . 1 1 23 23 PHE CB C 13 38.032 0.17 . 1 . . . A 23 PHE CB . 18018 1
181 . 1 1 23 23 PHE CD1 C 13 125.592 0.17 . 3 . . . A 23 PHE CD1 . 18018 1
182 . 1 1 23 23 PHE CD2 C 13 129.097 0.17 . 3 . . . A 23 PHE CD2 . 18018 1
183 . 1 1 23 23 PHE N N 15 121.096 0.12 . 1 . . . A 23 PHE N . 18018 1
184 . 1 1 24 24 LYS H H 1 8.427 0.007 . 1 . . . A 24 LYS H . 18018 1
185 . 1 1 24 24 LYS HA H 1 4.171 0.007 . 1 . . . A 24 LYS HA . 18018 1
186 . 1 1 24 24 LYS HB2 H 1 2.009 0.007 . 2 . . . A 24 LYS HB2 . 18018 1
187 . 1 1 24 24 LYS HB3 H 1 2.251 0.007 . 2 . . . A 24 LYS HB3 . 18018 1
188 . 1 1 24 24 LYS HG2 H 1 2.009 0.007 . 2 . . . A 24 LYS HG2 . 18018 1
189 . 1 1 24 24 LYS HG3 H 1 1.665 0.007 . 2 . . . A 24 LYS HG3 . 18018 1
190 . 1 1 24 24 LYS HD2 H 1 1.879 0.007 . 2 . . . A 24 LYS HD2 . 18018 1
191 . 1 1 24 24 LYS HD3 H 1 1.831 0.007 . 2 . . . A 24 LYS HD3 . 18018 1
192 . 1 1 24 24 LYS HE2 H 1 3.139 0.007 . 2 . . . A 24 LYS QE . 18018 1
193 . 1 1 24 24 LYS HE3 H 1 3.139 0.007 . 2 . . . A 24 LYS QE . 18018 1
194 . 1 1 24 24 LYS C C 13 179.309 0.17 . 1 . . . A 24 LYS C . 18018 1
195 . 1 1 24 24 LYS CA C 13 59.041 0.17 . 1 . . . A 24 LYS CA . 18018 1
196 . 1 1 24 24 LYS CB C 13 32.387 0.17 . 1 . . . A 24 LYS CB . 18018 1
197 . 1 1 24 24 LYS CG C 13 25.717 0.17 . 1 . . . A 24 LYS CG . 18018 1
198 . 1 1 24 24 LYS CD C 13 29.046 0.17 . 1 . . . A 24 LYS CD . 18018 1
199 . 1 1 24 24 LYS CE C 13 41.527 0.17 . 1 . . . A 24 LYS CE . 18018 1
200 . 1 1 24 24 LYS N N 15 120.580 0.12 . 1 . . . A 24 LYS N . 18018 1
201 . 1 1 25 25 ALA H H 1 8.768 0.007 . 1 . . . A 25 ALA H . 18018 1
202 . 1 1 25 25 ALA HA H 1 4.121 0.007 . 1 . . . A 25 ALA HA . 18018 1
203 . 1 1 25 25 ALA HB1 H 1 1.586 0.007 . 1 . . . A 25 ALA QB . 18018 1
204 . 1 1 25 25 ALA HB2 H 1 1.586 0.007 . 1 . . . A 25 ALA QB . 18018 1
205 . 1 1 25 25 ALA HB3 H 1 1.586 0.007 . 1 . . . A 25 ALA QB . 18018 1
206 . 1 1 25 25 ALA C C 13 178.243 0.17 . 1 . . . A 25 ALA C . 18018 1
207 . 1 1 25 25 ALA CA C 13 54.465 0.17 . 1 . . . A 25 ALA CA . 18018 1
208 . 1 1 25 25 ALA CB C 13 17.699 0.17 . 1 . . . A 25 ALA CB . 18018 1
209 . 1 1 25 25 ALA N N 15 123.682 0.12 . 1 . . . A 25 ALA N . 18018 1
210 . 1 1 26 26 GLU H H 1 8.532 0.007 . 1 . . . A 26 GLU H . 18018 1
211 . 1 1 26 26 GLU HA H 1 4.021 0.007 . 1 . . . A 26 GLU HA . 18018 1
212 . 1 1 26 26 GLU HB2 H 1 2.370 0.007 . 2 . . . A 26 GLU HB2 . 18018 1
213 . 1 1 26 26 GLU HB3 H 1 2.136 0.007 . 2 . . . A 26 GLU HB3 . 18018 1
214 . 1 1 26 26 GLU C C 13 177.265 0.17 . 1 . . . A 26 GLU C . 18018 1
215 . 1 1 26 26 GLU CA C 13 58.461 0.17 . 1 . . . A 26 GLU CA . 18018 1
216 . 1 1 26 26 GLU CB C 13 28.762 0.17 . 1 . . . A 26 GLU CB . 18018 1
217 . 1 1 26 26 GLU CG C 13 35.454 0.17 . 1 . . . A 26 GLU CG . 18018 1
218 . 1 1 26 26 GLU N N 15 122.051 0.12 . 1 . . . A 26 GLU N . 18018 1
219 . 1 1 27 27 ALA H H 1 8.048 0.007 . 1 . . . A 27 ALA H . 18018 1
220 . 1 1 27 27 ALA HA H 1 4.325 0.007 . 1 . . . A 27 ALA HA . 18018 1
221 . 1 1 27 27 ALA HB1 H 1 1.515 0.007 . 1 . . . A 27 ALA QB . 18018 1
222 . 1 1 27 27 ALA HB2 H 1 1.515 0.007 . 1 . . . A 27 ALA QB . 18018 1
223 . 1 1 27 27 ALA HB3 H 1 1.515 0.007 . 1 . . . A 27 ALA QB . 18018 1
224 . 1 1 27 27 ALA C C 13 180.552 0.17 . 1 . . . A 27 ALA C . 18018 1
225 . 1 1 27 27 ALA CA C 13 54.169 0.17 . 1 . . . A 27 ALA CA . 18018 1
226 . 1 1 27 27 ALA CB C 13 17.109 0.17 . 1 . . . A 27 ALA CB . 18018 1
227 . 1 1 27 27 ALA N N 15 122.124 0.12 . 1 . . . A 27 ALA N . 18018 1
228 . 1 1 28 28 ARG H H 1 8.046 0.007 . 1 . . . A 28 ARG H . 18018 1
229 . 1 1 28 28 ARG HA H 1 4.412 0.007 . 1 . . . A 28 ARG HA . 18018 1
230 . 1 1 28 28 ARG HB2 H 1 2.173 0.007 . 2 . . . A 28 ARG QB . 18018 1
231 . 1 1 28 28 ARG HB3 H 1 2.173 0.007 . 2 . . . A 28 ARG QB . 18018 1
232 . 1 1 28 28 ARG HG2 H 1 1.478 0.007 . 2 . . . A 28 ARG QG . 18018 1
233 . 1 1 28 28 ARG HG3 H 1 1.478 0.007 . 2 . . . A 28 ARG QG . 18018 1
234 . 1 1 28 28 ARG HD2 H 1 3.315 0.007 . 2 . . . A 28 ARG QD . 18018 1
235 . 1 1 28 28 ARG HD3 H 1 3.315 0.007 . 2 . . . A 28 ARG QD . 18018 1
236 . 1 1 28 28 ARG C C 13 176.309 0.17 . 1 . . . A 28 ARG C . 18018 1
237 . 1 1 28 28 ARG CA C 13 55.969 0.17 . 1 . . . A 28 ARG CA . 18018 1
238 . 1 1 28 28 ARG CB C 13 26.915 0.17 . 1 . . . A 28 ARG CB . 18018 1
239 . 1 1 28 28 ARG CG C 13 25.312 0.17 . 1 . . . A 28 ARG CG . 18018 1
240 . 1 1 28 28 ARG N N 15 120.501 0.12 . 1 . . . A 28 ARG N . 18018 1
241 . 1 1 29 29 ARG H H 1 8.908 0.007 . 1 . . . A 29 ARG H . 18018 1
242 . 1 1 29 29 ARG HA H 1 3.698 0.007 . 1 . . . A 29 ARG HA . 18018 1
243 . 1 1 29 29 ARG HB2 H 1 1.961 0.007 . 2 . . . A 29 ARG QB . 18018 1
244 . 1 1 29 29 ARG HB3 H 1 1.961 0.007 . 2 . . . A 29 ARG QB . 18018 1
245 . 1 1 29 29 ARG HG2 H 1 2.433 0.007 . 2 . . . A 29 ARG QG . 18018 1
246 . 1 1 29 29 ARG HG3 H 1 2.433 0.007 . 2 . . . A 29 ARG QG . 18018 1
247 . 1 1 29 29 ARG CA C 13 59.416 0.17 . 1 . . . A 29 ARG CA . 18018 1
248 . 1 1 29 29 ARG CB C 13 28.148 0.17 . 1 . . . A 29 ARG CB . 18018 1
249 . 1 1 29 29 ARG CG C 13 28.183 0.17 . 1 . . . A 29 ARG CG . 18018 1
250 . 1 1 29 29 ARG CD C 13 41.660 0.17 . 1 . . . A 29 ARG CD . 18018 1
251 . 1 1 29 29 ARG N N 15 122.842 0.12 . 1 . . . A 29 ARG N . 18018 1
252 . 1 1 30 30 ASN H H 1 8.402 0.007 . 1 . . . A 30 ASN H . 18018 1
253 . 1 1 30 30 ASN HA H 1 4.634 0.007 . 1 . . . A 30 ASN HA . 18018 1
254 . 1 1 30 30 ASN HB2 H 1 3.109 0.007 . 2 . . . A 30 ASN QB . 18018 1
255 . 1 1 30 30 ASN HB3 H 1 3.109 0.007 . 2 . . . A 30 ASN QB . 18018 1
256 . 1 1 30 30 ASN HD21 H 1 7.630 0.007 . 2 . . . A 30 ASN HD21 . 18018 1
257 . 1 1 30 30 ASN HD22 H 1 7.901 0.007 . 2 . . . A 30 ASN HD22 . 18018 1
258 . 1 1 30 30 ASN C C 13 175.888 0.17 . 1 . . . A 30 ASN C . 18018 1
259 . 1 1 30 30 ASN CA C 13 55.407 0.17 . 1 . . . A 30 ASN CA . 18018 1
260 . 1 1 30 30 ASN CB C 13 35.935 0.17 . 1 . . . A 30 ASN CB . 18018 1
261 . 1 1 30 30 ASN N N 15 120.150 0.12 . 1 . . . A 30 ASN N . 18018 1
262 . 1 1 30 30 ASN ND2 N 15 112.296 0.12 . 1 . . . A 30 ASN ND2 . 18018 1
263 . 1 1 31 31 ARG H H 1 7.996 0.007 . 1 . . . A 31 ARG H . 18018 1
264 . 1 1 31 31 ARG HA H 1 4.282 0.007 . 1 . . . A 31 ARG HA . 18018 1
265 . 1 1 31 31 ARG HB2 H 1 2.126 0.007 . 2 . . . A 31 ARG QB . 18018 1
266 . 1 1 31 31 ARG HB3 H 1 2.126 0.007 . 2 . . . A 31 ARG QB . 18018 1
267 . 1 1 31 31 ARG C C 13 177.804 0.17 . 1 . . . A 31 ARG C . 18018 1
268 . 1 1 31 31 ARG CA C 13 58.950 0.17 . 1 . . . A 31 ARG CA . 18018 1
269 . 1 1 31 31 ARG CB C 13 29.121 0.17 . 1 . . . A 31 ARG CB . 18018 1
270 . 1 1 31 31 ARG N N 15 123.400 0.12 . 1 . . . A 31 ARG N . 18018 1
271 . 1 1 32 32 LEU H H 1 8.742 0.007 . 1 . . . A 32 LEU H . 18018 1
272 . 1 1 32 32 LEU HA H 1 4.291 0.007 . 1 . . . A 32 LEU HA . 18018 1
273 . 1 1 32 32 LEU HB2 H 1 1.746 0.007 . 2 . . . A 32 LEU HB2 . 18018 1
274 . 1 1 32 32 LEU HB3 H 1 2.213 0.007 . 2 . . . A 32 LEU HB3 . 18018 1
275 . 1 1 32 32 LEU HD11 H 1 1.081 0.007 . 2 . . . A 32 LEU QD1 . 18018 1
276 . 1 1 32 32 LEU HD12 H 1 1.081 0.007 . 2 . . . A 32 LEU QD1 . 18018 1
277 . 1 1 32 32 LEU HD13 H 1 1.081 0.007 . 2 . . . A 32 LEU QD1 . 18018 1
278 . 1 1 32 32 LEU HD21 H 1 0.980 0.007 . 2 . . . A 32 LEU QD2 . 18018 1
279 . 1 1 32 32 LEU HD22 H 1 0.980 0.007 . 2 . . . A 32 LEU QD2 . 18018 1
280 . 1 1 32 32 LEU HD23 H 1 0.980 0.007 . 2 . . . A 32 LEU QD2 . 18018 1
281 . 1 1 32 32 LEU C C 13 180.602 0.17 . 1 . . . A 32 LEU C . 18018 1
282 . 1 1 32 32 LEU CA C 13 57.246 0.17 . 1 . . . A 32 LEU CA . 18018 1
283 . 1 1 32 32 LEU CB C 13 41.170 0.17 . 1 . . . A 32 LEU CB . 18018 1
284 . 1 1 32 32 LEU CD1 C 13 21.153 0.17 . 2 . . . A 32 LEU CD1 . 18018 1
285 . 1 1 32 32 LEU CD2 C 13 24.652 0.17 . 2 . . . A 32 LEU CD2 . 18018 1
286 . 1 1 32 32 LEU N N 15 119.872 0.12 . 1 . . . A 32 LEU N . 18018 1
287 . 1 1 33 33 LEU H H 1 9.249 0.007 . 1 . . . A 33 LEU H . 18018 1
288 . 1 1 33 33 LEU HA H 1 4.301 0.007 . 1 . . . A 33 LEU HA . 18018 1
289 . 1 1 33 33 LEU HB2 H 1 1.878 0.007 . 2 . . . A 33 LEU HB2 . 18018 1
290 . 1 1 33 33 LEU HB3 H 1 2.273 0.007 . 2 . . . A 33 LEU HB3 . 18018 1
291 . 1 1 33 33 LEU HD11 H 1 0.908 0.007 . 2 . . . A 33 LEU QD1 . 18018 1
292 . 1 1 33 33 LEU HD12 H 1 0.908 0.007 . 2 . . . A 33 LEU QD1 . 18018 1
293 . 1 1 33 33 LEU HD13 H 1 0.908 0.007 . 2 . . . A 33 LEU QD1 . 18018 1
294 . 1 1 33 33 LEU HD21 H 1 1.074 0.007 . 2 . . . A 33 LEU QD2 . 18018 1
295 . 1 1 33 33 LEU HD22 H 1 1.074 0.007 . 2 . . . A 33 LEU QD2 . 18018 1
296 . 1 1 33 33 LEU HD23 H 1 1.074 0.007 . 2 . . . A 33 LEU QD2 . 18018 1
297 . 1 1 33 33 LEU C C 13 177.992 0.17 . 1 . . . A 33 LEU C . 18018 1
298 . 1 1 33 33 LEU CA C 13 57.015 0.17 . 1 . . . A 33 LEU CA . 18018 1
299 . 1 1 33 33 LEU CB C 13 42.239 0.17 . 1 . . . A 33 LEU CB . 18018 1
300 . 1 1 33 33 LEU CD1 C 13 24.719 0.17 . 2 . . . A 33 LEU CD1 . 18018 1
301 . 1 1 33 33 LEU CD2 C 13 26.146 0.17 . 2 . . . A 33 LEU CD2 . 18018 1
302 . 1 1 33 33 LEU N N 15 124.468 0.12 . 1 . . . A 33 LEU N . 18018 1
303 . 1 1 34 34 GLY H H 1 8.873 0.007 . 1 . . . A 34 GLY H . 18018 1
304 . 1 1 34 34 GLY HA2 H 1 4.170 0.007 . 2 . . . A 34 GLY QA . 18018 1
305 . 1 1 34 34 GLY HA3 H 1 4.170 0.007 . 2 . . . A 34 GLY QA . 18018 1
306 . 1 1 34 34 GLY C C 13 174.530 0.17 . 1 . . . A 34 GLY C . 18018 1
307 . 1 1 34 34 GLY CA C 13 47.447 0.17 . 1 . . . A 34 GLY CA . 18018 1
308 . 1 1 34 34 GLY N N 15 109.045 0.12 . 1 . . . A 34 GLY N . 18018 1
309 . 1 1 35 35 GLU H H 1 8.920 0.007 . 1 . . . A 35 GLU H . 18018 1
310 . 1 1 35 35 GLU HA H 1 4.177 0.007 . 1 . . . A 35 GLU HA . 18018 1
311 . 1 1 35 35 GLU HB2 H 1 2.368 0.007 . 2 . . . A 35 GLU QB . 18018 1
312 . 1 1 35 35 GLU HB3 H 1 2.368 0.007 . 2 . . . A 35 GLU QB . 18018 1
313 . 1 1 35 35 GLU HG2 H 1 2.758 0.007 . 2 . . . A 35 GLU HG2 . 18018 1
314 . 1 1 35 35 GLU HG3 H 1 2.388 0.007 . 2 . . . A 35 GLU HG3 . 18018 1
315 . 1 1 35 35 GLU C C 13 178.866 0.17 . 1 . . . A 35 GLU C . 18018 1
316 . 1 1 35 35 GLU CA C 13 59.031 0.17 . 1 . . . A 35 GLU CA . 18018 1
317 . 1 1 35 35 GLU CB C 13 28.963 0.17 . 1 . . . A 35 GLU CB . 18018 1
318 . 1 1 35 35 GLU CG C 13 36.391 0.17 . 1 . . . A 35 GLU CG . 18018 1
319 . 1 1 35 35 GLU N N 15 123.414 0.12 . 1 . . . A 35 GLU N . 18018 1
320 . 1 1 36 36 TRP H H 1 8.510 0.007 . 1 . . . A 36 TRP H . 18018 1
321 . 1 1 36 36 TRP HA H 1 4.583 0.007 . 1 . . . A 36 TRP HA . 18018 1
322 . 1 1 36 36 TRP HB2 H 1 3.847 0.007 . 2 . . . A 36 TRP HB2 . 18018 1
323 . 1 1 36 36 TRP HB3 H 1 3.594 0.007 . 2 . . . A 36 TRP HB3 . 18018 1
324 . 1 1 36 36 TRP HD1 H 1 7.548 0.007 . 1 . . . A 36 TRP HD1 . 18018 1
325 . 1 1 36 36 TRP HE1 H 1 10.546 0.007 . 1 . . . A 36 TRP HE1 . 18018 1
326 . 1 1 36 36 TRP HE3 H 1 7.938 0.007 . 1 . . . A 36 TRP HE3 . 18018 1
327 . 1 1 36 36 TRP HZ2 H 1 7.410 0.007 . 1 . . . A 36 TRP HZ2 . 18018 1
328 . 1 1 36 36 TRP HZ3 H 1 6.846 0.007 . 1 . . . A 36 TRP HZ3 . 18018 1
329 . 1 1 36 36 TRP HH2 H 1 6.762 0.007 . 1 . . . A 36 TRP HH2 . 18018 1
330 . 1 1 36 36 TRP C C 13 177.618 0.17 . 1 . . . A 36 TRP C . 18018 1
331 . 1 1 36 36 TRP CA C 13 59.618 0.17 . 1 . . . A 36 TRP CA . 18018 1
332 . 1 1 36 36 TRP CB C 13 26.594 0.17 . 1 . . . A 36 TRP CB . 18018 1
333 . 1 1 36 36 TRP CD1 C 13 124.570 0.17 . 1 . . . A 36 TRP CD1 . 18018 1
334 . 1 1 36 36 TRP CE3 C 13 117.737 0.17 . 1 . . . A 36 TRP CE3 . 18018 1
335 . 1 1 36 36 TRP CZ2 C 13 112.177 0.17 . 1 . . . A 36 TRP CZ2 . 18018 1
336 . 1 1 36 36 TRP CZ3 C 13 117.769 0.17 . 1 . . . A 36 TRP CZ3 . 18018 1
337 . 1 1 36 36 TRP CH2 C 13 120.133 0.17 . 1 . . . A 36 TRP CH2 . 18018 1
338 . 1 1 36 36 TRP N N 15 124.774 0.12 . 1 . . . A 36 TRP N . 18018 1
339 . 1 1 36 36 TRP NE1 N 15 132.002 0.12 . 1 . . . A 36 TRP NE1 . 18018 1
340 . 1 1 37 37 ALA H H 1 9.122 0.007 . 1 . . . A 37 ALA H . 18018 1
341 . 1 1 37 37 ALA HA H 1 3.377 0.007 . 1 . . . A 37 ALA HA . 18018 1
342 . 1 1 37 37 ALA HB1 H 1 1.723 0.007 . 1 . . . A 37 ALA QB . 18018 1
343 . 1 1 37 37 ALA HB2 H 1 1.723 0.007 . 1 . . . A 37 ALA QB . 18018 1
344 . 1 1 37 37 ALA HB3 H 1 1.723 0.007 . 1 . . . A 37 ALA QB . 18018 1
345 . 1 1 37 37 ALA C C 13 177.427 0.17 . 1 . . . A 37 ALA C . 18018 1
346 . 1 1 37 37 ALA CA C 13 53.849 0.17 . 1 . . . A 37 ALA CA . 18018 1
347 . 1 1 37 37 ALA CB C 13 19.046 0.17 . 1 . . . A 37 ALA CB . 18018 1
348 . 1 1 37 37 ALA N N 15 123.777 0.12 . 1 . . . A 37 ALA N . 18018 1
349 . 1 1 38 38 ALA H H 1 8.772 0.007 . 1 . . . A 38 ALA H . 18018 1
350 . 1 1 38 38 ALA HA H 1 3.494 0.007 . 1 . . . A 38 ALA HA . 18018 1
351 . 1 1 38 38 ALA HB1 H 1 1.719 0.007 . 1 . . . A 38 ALA QB . 18018 1
352 . 1 1 38 38 ALA HB2 H 1 1.719 0.007 . 1 . . . A 38 ALA QB . 18018 1
353 . 1 1 38 38 ALA HB3 H 1 1.719 0.007 . 1 . . . A 38 ALA QB . 18018 1
354 . 1 1 38 38 ALA C C 13 178.670 0.17 . 1 . . . A 38 ALA C . 18018 1
355 . 1 1 38 38 ALA CA C 13 54.443 0.17 . 1 . . . A 38 ALA CA . 18018 1
356 . 1 1 38 38 ALA CB C 13 17.689 0.17 . 1 . . . A 38 ALA CB . 18018 1
357 . 1 1 38 38 ALA N N 15 119.259 0.12 . 1 . . . A 38 ALA N . 18018 1
358 . 1 1 39 39 GLY H H 1 7.733 0.007 . 1 . . . A 39 GLY H . 18018 1
359 . 1 1 39 39 GLY HA2 H 1 4.081 0.007 . 2 . . . A 39 GLY HA2 . 18018 1
360 . 1 1 39 39 GLY HA3 H 1 4.026 0.007 . 2 . . . A 39 GLY HA3 . 18018 1
361 . 1 1 39 39 GLY C C 13 177.232 0.17 . 1 . . . A 39 GLY C . 18018 1
362 . 1 1 39 39 GLY CA C 13 46.422 0.17 . 1 . . . A 39 GLY CA . 18018 1
363 . 1 1 39 39 GLY N N 15 104.027 0.12 . 1 . . . A 39 GLY N . 18018 1
364 . 1 1 40 40 LEU H H 1 7.492 0.007 . 1 . . . A 40 LEU H . 18018 1
365 . 1 1 40 40 LEU HA H 1 4.085 0.007 . 1 . . . A 40 LEU HA . 18018 1
366 . 1 1 40 40 LEU HB2 H 1 1.607 0.007 . 2 . . . A 40 LEU HB2 . 18018 1
367 . 1 1 40 40 LEU HB3 H 1 1.085 0.007 . 2 . . . A 40 LEU HB3 . 18018 1
368 . 1 1 40 40 LEU HG H 1 1.277 0.007 . 1 . . . A 40 LEU HG . 18018 1
369 . 1 1 40 40 LEU HD11 H 1 0.761 0.007 . 2 . . . A 40 LEU QD1 . 18018 1
370 . 1 1 40 40 LEU HD12 H 1 0.761 0.007 . 2 . . . A 40 LEU QD1 . 18018 1
371 . 1 1 40 40 LEU HD13 H 1 0.761 0.007 . 2 . . . A 40 LEU QD1 . 18018 1
372 . 1 1 40 40 LEU HD21 H 1 0.266 0.007 . 2 . . . A 40 LEU QD2 . 18018 1
373 . 1 1 40 40 LEU HD22 H 1 0.266 0.007 . 2 . . . A 40 LEU QD2 . 18018 1
374 . 1 1 40 40 LEU HD23 H 1 0.266 0.007 . 2 . . . A 40 LEU QD2 . 18018 1
375 . 1 1 40 40 LEU C C 13 178.203 0.17 . 1 . . . A 40 LEU C . 18018 1
376 . 1 1 40 40 LEU CA C 13 56.718 0.17 . 1 . . . A 40 LEU CA . 18018 1
377 . 1 1 40 40 LEU CB C 13 41.339 0.17 . 1 . . . A 40 LEU CB . 18018 1
378 . 1 1 40 40 LEU CG C 13 26.799 0.17 . 1 . . . A 40 LEU CG . 18018 1
379 . 1 1 40 40 LEU CD1 C 13 22.707 0.17 . 2 . . . A 40 LEU CD1 . 18018 1
380 . 1 1 40 40 LEU CD2 C 13 24.719 0.17 . 2 . . . A 40 LEU CD2 . 18018 1
381 . 1 1 40 40 LEU N N 15 125.448 0.12 . 1 . . . A 40 LEU N . 18018 1
382 . 1 1 41 41 LEU H H 1 7.676 0.007 . 1 . . . A 41 LEU H . 18018 1
383 . 1 1 41 41 LEU HA H 1 4.107 0.007 . 1 . . . A 41 LEU HA . 18018 1
384 . 1 1 41 41 LEU HB2 H 1 1.480 0.007 . 2 . . . A 41 LEU HB2 . 18018 1
385 . 1 1 41 41 LEU HB3 H 1 1.593 0.007 . 2 . . . A 41 LEU HB3 . 18018 1
386 . 1 1 41 41 LEU HG H 1 1.480 0.007 . 1 . . . A 41 LEU HG . 18018 1
387 . 1 1 41 41 LEU HD11 H 1 0.813 0.007 . 2 . . . A 41 LEU QD1 . 18018 1
388 . 1 1 41 41 LEU HD12 H 1 0.813 0.007 . 2 . . . A 41 LEU QD1 . 18018 1
389 . 1 1 41 41 LEU HD13 H 1 0.813 0.007 . 2 . . . A 41 LEU QD1 . 18018 1
390 . 1 1 41 41 LEU HD21 H 1 0.218 0.007 . 2 . . . A 41 LEU QD2 . 18018 1
391 . 1 1 41 41 LEU HD22 H 1 0.218 0.007 . 2 . . . A 41 LEU QD2 . 18018 1
392 . 1 1 41 41 LEU HD23 H 1 0.218 0.007 . 2 . . . A 41 LEU QD2 . 18018 1
393 . 1 1 41 41 LEU C C 13 176.119 0.17 . 1 . . . A 41 LEU C . 18018 1
394 . 1 1 41 41 LEU CA C 13 53.882 0.17 . 1 . . . A 41 LEU CA . 18018 1
395 . 1 1 41 41 LEU CB C 13 41.653 0.17 . 1 . . . A 41 LEU CB . 18018 1
396 . 1 1 41 41 LEU CG C 13 25.122 0.17 . 1 . . . A 41 LEU CG . 18018 1
397 . 1 1 41 41 LEU CD1 C 13 21.432 0.17 . 2 . . . A 41 LEU CD1 . 18018 1
398 . 1 1 41 41 LEU CD2 C 13 23.646 0.17 . 2 . . . A 41 LEU CD2 . 18018 1
399 . 1 1 41 41 LEU N N 15 117.234 0.12 . 1 . . . A 41 LEU N . 18018 1
400 . 1 1 42 42 GLY H H 1 7.869 0.007 . 1 . . . A 42 GLY H . 18018 1
401 . 1 1 42 42 GLY HA2 H 1 3.892 0.007 . 2 . . . A 42 GLY HA2 . 18018 1
402 . 1 1 42 42 GLY HA3 H 1 4.142 0.007 . 2 . . . A 42 GLY HA3 . 18018 1
403 . 1 1 42 42 GLY C C 13 173.775 0.17 . 1 . . . A 42 GLY C . 18018 1
404 . 1 1 42 42 GLY CA C 13 45.248 0.17 . 1 . . . A 42 GLY CA . 18018 1
405 . 1 1 42 42 GLY N N 15 109.595 0.12 . 1 . . . A 42 GLY N . 18018 1
406 . 1 1 43 43 LYS H H 1 8.079 0.007 . 1 . . . A 43 LYS H . 18018 1
407 . 1 1 43 43 LYS HA H 1 4.712 0.007 . 1 . . . A 43 LYS HA . 18018 1
408 . 1 1 43 43 LYS HB2 H 1 1.594 0.007 . 2 . . . A 43 LYS HB2 . 18018 1
409 . 1 1 43 43 LYS HB3 H 1 1.381 0.007 . 2 . . . A 43 LYS HB3 . 18018 1
410 . 1 1 43 43 LYS HG2 H 1 1.205 0.007 . 2 . . . A 43 LYS HG2 . 18018 1
411 . 1 1 43 43 LYS HG3 H 1 1.558 0.007 . 2 . . . A 43 LYS HG3 . 18018 1
412 . 1 1 43 43 LYS HE2 H 1 2.669 0.007 . 2 . . . A 43 LYS HE2 . 18018 1
413 . 1 1 43 43 LYS C C 13 175.246 0.17 . 1 . . . A 43 LYS C . 18018 1
414 . 1 1 43 43 LYS CA C 13 54.770 0.17 . 1 . . . A 43 LYS CA . 18018 1
415 . 1 1 43 43 LYS CB C 13 33.771 0.17 . 1 . . . A 43 LYS CB . 18018 1
416 . 1 1 43 43 LYS CG C 13 24.719 0.17 . 1 . . . A 43 LYS CG . 18018 1
417 . 1 1 43 43 LYS CE C 13 41.305 0.17 . 1 . . . A 43 LYS CE . 18018 1
418 . 1 1 43 43 LYS N N 15 119.965 0.12 . 1 . . . A 43 LYS N . 18018 1
419 . 1 1 44 44 THR H H 1 8.934 0.007 . 1 . . . A 44 THR H . 18018 1
420 . 1 1 44 44 THR HA H 1 4.749 0.007 . 1 . . . A 44 THR HA . 18018 1
421 . 1 1 44 44 THR HB H 1 4.378 0.007 . 1 . . . A 44 THR HB . 18018 1
422 . 1 1 44 44 THR HG21 H 1 1.241 0.007 . 1 . . . A 44 THR QG2 . 18018 1
423 . 1 1 44 44 THR HG22 H 1 1.241 0.007 . 1 . . . A 44 THR QG2 . 18018 1
424 . 1 1 44 44 THR HG23 H 1 1.241 0.007 . 1 . . . A 44 THR QG2 . 18018 1
425 . 1 1 44 44 THR C C 13 174.392 0.17 . 1 . . . A 44 THR C . 18018 1
426 . 1 1 44 44 THR CA C 13 58.992 0.17 . 1 . . . A 44 THR CA . 18018 1
427 . 1 1 44 44 THR CB C 13 71.762 0.17 . 1 . . . A 44 THR CB . 18018 1
428 . 1 1 44 44 THR CG2 C 13 20.627 0.17 . 1 . . . A 44 THR CG2 . 18018 1
429 . 1 1 44 44 THR N N 15 114.199 0.12 . 1 . . . A 44 THR N . 18018 1
430 . 1 1 45 45 GLY H H 1 8.862 0.007 . 1 . . . A 45 GLY H . 18018 1
431 . 1 1 45 45 GLY HA2 H 1 3.986 0.007 . 2 . . . A 45 GLY HA2 . 18018 1
432 . 1 1 45 45 GLY HA3 H 1 4.149 0.007 . 2 . . . A 45 GLY HA3 . 18018 1
433 . 1 1 45 45 GLY C C 13 175.330 0.17 . 1 . . . A 45 GLY C . 18018 1
434 . 1 1 45 45 GLY CA C 13 46.145 0.17 . 1 . . . A 45 GLY CA . 18018 1
435 . 1 1 45 45 GLY N N 15 109.657 0.12 . 1 . . . A 45 GLY N . 18018 1
436 . 1 1 46 46 ASP H H 1 9.283 0.007 . 1 . . . A 46 ASP H . 18018 1
437 . 1 1 46 46 ASP HA H 1 4.533 0.007 . 1 . . . A 46 ASP HA . 18018 1
438 . 1 1 46 46 ASP HB2 H 1 2.812 0.007 . 2 . . . A 46 ASP HB2 . 18018 1
439 . 1 1 46 46 ASP HB3 H 1 2.895 0.007 . 2 . . . A 46 ASP HB3 . 18018 1
440 . 1 1 46 46 ASP C C 13 177.343 0.17 . 1 . . . A 46 ASP C . 18018 1
441 . 1 1 46 46 ASP CA C 13 56.485 0.17 . 1 . . . A 46 ASP CA . 18018 1
442 . 1 1 46 46 ASP CB C 13 39.878 0.17 . 1 . . . A 46 ASP CB . 18018 1
443 . 1 1 46 46 ASP N N 15 128.403 0.12 . 1 . . . A 46 ASP N . 18018 1
444 . 1 1 47 47 ASP H H 1 8.488 0.007 . 1 . . . A 47 ASP H . 18018 1
445 . 1 1 47 47 ASP HA H 1 4.636 0.007 . 1 . . . A 47 ASP HA . 18018 1
446 . 1 1 47 47 ASP HB2 H 1 2.934 0.007 . 2 . . . A 47 ASP HB2 . 18018 1
447 . 1 1 47 47 ASP HB3 H 1 3.152 0.007 . 2 . . . A 47 ASP HB3 . 18018 1
448 . 1 1 47 47 ASP CA C 13 56.140 0.17 . 1 . . . A 47 ASP CA . 18018 1
449 . 1 1 47 47 ASP CB C 13 39.976 0.17 . 1 . . . A 47 ASP CB . 18018 1
450 . 1 1 47 47 ASP N N 15 121.367 0.12 . 1 . . . A 47 ASP N . 18018 1
451 . 1 1 48 48 ALA H H 1 7.235 0.007 . 1 . . . A 48 ALA H . 18018 1
452 . 1 1 48 48 ALA HA H 1 3.917 0.007 . 1 . . . A 48 ALA HA . 18018 1
453 . 1 1 48 48 ALA HB1 H 1 1.329 0.007 . 1 . . . A 48 ALA QB . 18018 1
454 . 1 1 48 48 ALA HB2 H 1 1.329 0.007 . 1 . . . A 48 ALA QB . 18018 1
455 . 1 1 48 48 ALA HB3 H 1 1.329 0.007 . 1 . . . A 48 ALA QB . 18018 1
456 . 1 1 48 48 ALA CA C 13 54.047 0.17 . 1 . . . A 48 ALA CA . 18018 1
457 . 1 1 48 48 ALA CB C 13 16.642 0.17 . 1 . . . A 48 ALA CB . 18018 1
458 . 1 1 48 48 ALA N N 15 123.210 0.12 . 1 . . . A 48 ALA N . 18018 1
459 . 1 1 49 49 ARG H H 1 7.777 0.007 . 1 . . . A 49 ARG H . 18018 1
460 . 1 1 49 49 ARG HA H 1 4.108 0.007 . 1 . . . A 49 ARG HA . 18018 1
461 . 1 1 49 49 ARG HB2 H 1 2.051 0.007 . 2 . . . A 49 ARG QB . 18018 1
462 . 1 1 49 49 ARG HB3 H 1 2.051 0.007 . 2 . . . A 49 ARG QB . 18018 1
463 . 1 1 49 49 ARG HG2 H 1 1.733 0.007 . 2 . . . A 49 ARG HG2 . 18018 1
464 . 1 1 49 49 ARG HG3 H 1 1.858 0.007 . 2 . . . A 49 ARG HG3 . 18018 1
465 . 1 1 49 49 ARG HD3 H 1 3.377 0.007 . 2 . . . A 49 ARG HD3 . 18018 1
466 . 1 1 49 49 ARG CA C 13 58.700 0.17 . 1 . . . A 49 ARG CA . 18018 1
467 . 1 1 49 49 ARG CB C 13 29.565 0.17 . 1 . . . A 49 ARG CB . 18018 1
468 . 1 1 49 49 ARG CG C 13 26.866 0.17 . 1 . . . A 49 ARG CG . 18018 1
469 . 1 1 49 49 ARG CD C 13 42.632 0.17 . 1 . . . A 49 ARG CD . 18018 1
470 . 1 1 49 49 ARG N N 15 120.088 0.12 . 1 . . . A 49 ARG N . 18018 1
471 . 1 1 50 50 ALA H H 1 8.350 0.007 . 1 . . . A 50 ALA H . 18018 1
472 . 1 1 50 50 ALA HA H 1 4.191 0.007 . 1 . . . A 50 ALA HA . 18018 1
473 . 1 1 50 50 ALA HB1 H 1 1.649 0.007 . 1 . . . A 50 ALA QB . 18018 1
474 . 1 1 50 50 ALA HB2 H 1 1.649 0.007 . 1 . . . A 50 ALA QB . 18018 1
475 . 1 1 50 50 ALA HB3 H 1 1.649 0.007 . 1 . . . A 50 ALA QB . 18018 1
476 . 1 1 50 50 ALA CA C 13 54.083 0.17 . 1 . . . A 50 ALA CA . 18018 1
477 . 1 1 50 50 ALA CB C 13 17.279 0.17 . 1 . . . A 50 ALA CB . 18018 1
478 . 1 1 50 50 ALA N N 15 120.988 0.12 . 1 . . . A 50 ALA N . 18018 1
479 . 1 1 51 51 TYR H H 1 8.054 0.007 . 1 . . . A 51 TYR H . 18018 1
480 . 1 1 51 51 TYR HA H 1 4.201 0.007 . 1 . . . A 51 TYR HA . 18018 1
481 . 1 1 51 51 TYR HB2 H 1 3.245 0.007 . 2 . . . A 51 TYR HB2 . 18018 1
482 . 1 1 51 51 TYR HB3 H 1 2.985 0.007 . 2 . . . A 51 TYR HB3 . 18018 1
483 . 1 1 51 51 TYR HD1 H 1 7.035 0.007 . 3 . . . A 51 TYR QD . 18018 1
484 . 1 1 51 51 TYR HD2 H 1 7.035 0.007 . 3 . . . A 51 TYR QD . 18018 1
485 . 1 1 51 51 TYR HE1 H 1 6.729 0.007 . 3 . . . A 51 TYR QE . 18018 1
486 . 1 1 51 51 TYR HE2 H 1 6.729 0.007 . 3 . . . A 51 TYR QE . 18018 1
487 . 1 1 51 51 TYR C C 13 178.335 0.17 . 1 . . . A 51 TYR C . 18018 1
488 . 1 1 51 51 TYR CA C 13 61.087 0.17 . 1 . . . A 51 TYR CA . 18018 1
489 . 1 1 51 51 TYR CB C 13 37.840 0.17 . 1 . . . A 51 TYR CB . 18018 1
490 . 1 1 51 51 TYR CD1 C 13 129.412 0.17 . 3 . . . A 51 TYR CD1 . 18018 1
491 . 1 1 51 51 TYR CD2 C 13 129.444 0.17 . 3 . . . A 51 TYR CD2 . 18018 1
492 . 1 1 51 51 TYR CE1 C 13 115.525 0.17 . 3 . . . A 51 TYR CE1 . 18018 1
493 . 1 1 51 51 TYR CE2 C 13 115.525 0.17 . 3 . . . A 51 TYR CE2 . 18018 1
494 . 1 1 51 51 TYR N N 15 119.264 0.12 . 1 . . . A 51 TYR N . 18018 1
495 . 1 1 52 52 ALA H H 1 8.611 0.007 . 1 . . . A 52 ALA H . 18018 1
496 . 1 1 52 52 ALA HA H 1 3.867 0.007 . 1 . . . A 52 ALA HA . 18018 1
497 . 1 1 52 52 ALA HB1 H 1 1.706 0.007 . 1 . . . A 52 ALA QB . 18018 1
498 . 1 1 52 52 ALA HB2 H 1 1.706 0.007 . 1 . . . A 52 ALA QB . 18018 1
499 . 1 1 52 52 ALA HB3 H 1 1.706 0.007 . 1 . . . A 52 ALA QB . 18018 1
500 . 1 1 52 52 ALA C C 13 178.352 0.17 . 1 . . . A 52 ALA C . 18018 1
501 . 1 1 52 52 ALA CA C 13 55.070 0.17 . 1 . . . A 52 ALA CA . 18018 1
502 . 1 1 52 52 ALA CB C 13 16.835 0.17 . 1 . . . A 52 ALA CB . 18018 1
503 . 1 1 52 52 ALA N N 15 124.002 0.12 . 1 . . . A 52 ALA N . 18018 1
504 . 1 1 53 53 LEU H H 1 7.591 0.007 . 1 . . . A 53 LEU H . 18018 1
505 . 1 1 53 53 LEU HA H 1 4.284 0.007 . 1 . . . A 53 LEU HA . 18018 1
506 . 1 1 53 53 LEU HB2 H 1 1.767 0.007 . 2 . . . A 53 LEU HB2 . 18018 1
507 . 1 1 53 53 LEU HB3 H 1 1.942 0.007 . 2 . . . A 53 LEU HB3 . 18018 1
508 . 1 1 53 53 LEU HG H 1 1.982 0.007 . 1 . . . A 53 LEU HG . 18018 1
509 . 1 1 53 53 LEU HD11 H 1 1.003 0.007 . 2 . . . A 53 LEU QD1 . 18018 1
510 . 1 1 53 53 LEU HD12 H 1 1.003 0.007 . 2 . . . A 53 LEU QD1 . 18018 1
511 . 1 1 53 53 LEU HD13 H 1 1.003 0.007 . 2 . . . A 53 LEU QD1 . 18018 1
512 . 1 1 53 53 LEU C C 13 177.452 0.17 . 1 . . . A 53 LEU C . 18018 1
513 . 1 1 53 53 LEU CA C 13 55.862 0.17 . 1 . . . A 53 LEU CA . 18018 1
514 . 1 1 53 53 LEU CB C 13 41.275 0.17 . 1 . . . A 53 LEU CB . 18018 1
515 . 1 1 53 53 LEU CG C 13 26.195 0.17 . 1 . . . A 53 LEU CG . 18018 1
516 . 1 1 53 53 LEU CD1 C 13 22.233 0.17 . 2 . . . A 53 LEU CD1 . 18018 1
517 . 1 1 53 53 LEU N N 15 116.323 0.12 . 1 . . . A 53 LEU N . 18018 1
518 . 1 1 54 54 THR H H 1 7.947 0.007 . 1 . . . A 54 THR H . 18018 1
519 . 1 1 54 54 THR HA H 1 4.392 0.007 . 1 . . . A 54 THR HA . 18018 1
520 . 1 1 54 54 THR HB H 1 4.322 0.007 . 1 . . . A 54 THR HB . 18018 1
521 . 1 1 54 54 THR HG21 H 1 1.419 0.007 . 1 . . . A 54 THR QG2 . 18018 1
522 . 1 1 54 54 THR HG22 H 1 1.419 0.007 . 1 . . . A 54 THR QG2 . 18018 1
523 . 1 1 54 54 THR HG23 H 1 1.419 0.007 . 1 . . . A 54 THR QG2 . 18018 1
524 . 1 1 54 54 THR CA C 13 62.390 0.17 . 1 . . . A 54 THR CA . 18018 1
525 . 1 1 54 54 THR CG2 C 13 20.780 0.17 . 1 . . . A 54 THR CG2 . 18018 1
526 . 1 1 54 54 THR N N 15 110.782 0.12 . 1 . . . A 54 THR N . 18018 1
527 . 1 1 55 55 VAL H H 1 7.171 0.007 . 1 . . . A 55 VAL H . 18018 1
528 . 1 1 55 55 VAL HA H 1 3.882 0.007 . 1 . . . A 55 VAL HA . 18018 1
529 . 1 1 55 55 VAL HB H 1 2.284 0.007 . 1 . . . A 55 VAL HB . 18018 1
530 . 1 1 55 55 VAL HG11 H 1 1.013 0.007 . 2 . . . A 55 VAL QG1 . 18018 1
531 . 1 1 55 55 VAL HG12 H 1 1.013 0.007 . 2 . . . A 55 VAL QG1 . 18018 1
532 . 1 1 55 55 VAL HG13 H 1 1.013 0.007 . 2 . . . A 55 VAL QG1 . 18018 1
533 . 1 1 55 55 VAL HG21 H 1 0.846 0.007 . 2 . . . A 55 VAL QG2 . 18018 1
534 . 1 1 55 55 VAL HG22 H 1 0.846 0.007 . 2 . . . A 55 VAL QG2 . 18018 1
535 . 1 1 55 55 VAL HG23 H 1 0.846 0.007 . 2 . . . A 55 VAL QG2 . 18018 1
536 . 1 1 55 55 VAL CA C 13 62.744 0.17 . 1 . . . A 55 VAL CA . 18018 1
537 . 1 1 55 55 VAL CB C 13 29.871 0.17 . 1 . . . A 55 VAL CB . 18018 1
538 . 1 1 55 55 VAL CG1 C 13 21.880 0.17 . 2 . . . A 55 VAL CG1 . 18018 1
539 . 1 1 55 55 VAL CG2 C 13 21.598 0.17 . 2 . . . A 55 VAL CG2 . 18018 1
540 . 1 1 55 55 VAL N N 15 123.763 0.12 . 1 . . . A 55 VAL N . 18018 1
541 . 1 1 56 56 VAL H H 1 7.409 0.007 . 1 . . . A 56 VAL H . 18018 1
542 . 1 1 56 56 VAL HA H 1 4.390 0.007 . 1 . . . A 56 VAL HA . 18018 1
543 . 1 1 56 56 VAL HB H 1 2.296 0.007 . 1 . . . A 56 VAL HB . 18018 1
544 . 1 1 56 56 VAL HG11 H 1 1.036 0.007 . 2 . . . A 56 VAL QG1 . 18018 1
545 . 1 1 56 56 VAL HG12 H 1 1.036 0.007 . 2 . . . A 56 VAL QG1 . 18018 1
546 . 1 1 56 56 VAL HG13 H 1 1.036 0.007 . 2 . . . A 56 VAL QG1 . 18018 1
547 . 1 1 56 56 VAL HG21 H 1 1.046 0.007 . 2 . . . A 56 VAL QG2 . 18018 1
548 . 1 1 56 56 VAL HG22 H 1 1.046 0.007 . 2 . . . A 56 VAL QG2 . 18018 1
549 . 1 1 56 56 VAL HG23 H 1 1.046 0.007 . 2 . . . A 56 VAL QG2 . 18018 1
550 . 1 1 56 56 VAL CA C 13 60.780 0.17 . 1 . . . A 56 VAL CA . 18018 1
551 . 1 1 56 56 VAL CB C 13 33.490 0.17 . 1 . . . A 56 VAL CB . 18018 1
552 . 1 1 56 56 VAL CG1 C 13 19.406 0.17 . 2 . . . A 56 VAL CG1 . 18018 1
553 . 1 1 56 56 VAL CG2 C 13 20.895 0.17 . 2 . . . A 56 VAL CG2 . 18018 1
554 . 1 1 56 56 VAL N N 15 118.917 0.12 . 1 . . . A 56 VAL N . 18018 1
555 . 1 1 57 57 THR H H 1 7.916 0.007 . 1 . . . A 57 THR H . 18018 1
556 . 1 1 57 57 THR HA H 1 4.532 0.007 . 1 . . . A 57 THR HA . 18018 1
557 . 1 1 57 57 THR HB H 1 4.303 0.007 . 1 . . . A 57 THR HB . 18018 1
558 . 1 1 57 57 THR HG21 H 1 1.248 0.007 . 1 . . . A 57 THR QG2 . 18018 1
559 . 1 1 57 57 THR HG22 H 1 1.248 0.007 . 1 . . . A 57 THR QG2 . 18018 1
560 . 1 1 57 57 THR HG23 H 1 1.248 0.007 . 1 . . . A 57 THR QG2 . 18018 1
561 . 1 1 57 57 THR CA C 13 60.614 0.17 . 1 . . . A 57 THR CA . 18018 1
562 . 1 1 57 57 THR CB C 13 68.892 0.17 . 1 . . . A 57 THR CB . 18018 1
563 . 1 1 57 57 THR CG2 C 13 20.675 0.17 . 1 . . . A 57 THR CG2 . 18018 1
564 . 1 1 57 57 THR N N 15 115.599 0.12 . 1 . . . A 57 THR N . 18018 1
565 . 1 1 58 58 SER H H 1 8.580 0.007 . 1 . . . A 58 SER H . 18018 1
566 . 1 1 58 58 SER HA H 1 4.547 0.007 . 1 . . . A 58 SER HA . 18018 1
567 . 1 1 58 58 SER HB2 H 1 3.985 0.007 . 2 . . . A 58 SER HB2 . 18018 1
568 . 1 1 58 58 SER HB3 H 1 3.916 0.007 . 2 . . . A 58 SER HB3 . 18018 1
569 . 1 1 58 58 SER CA C 13 57.770 0.17 . 1 . . . A 58 SER CA . 18018 1
570 . 1 1 58 58 SER CB C 13 63.162 0.17 . 1 . . . A 58 SER CB . 18018 1
571 . 1 1 58 58 SER N N 15 120.007 0.12 . 1 . . . A 58 SER N . 18018 1
572 . 1 1 59 59 ASP H H 1 8.399 0.007 . 1 . . . A 59 ASP H . 18018 1
573 . 1 1 59 59 ASP HA H 1 4.690 0.007 . 1 . . . A 59 ASP HA . 18018 1
574 . 1 1 59 59 ASP HB2 H 1 2.675 0.007 . 2 . . . A 59 ASP HB2 . 18018 1
575 . 1 1 59 59 ASP HB3 H 1 2.539 0.007 . 2 . . . A 59 ASP HB3 . 18018 1
576 . 1 1 59 59 ASP CA C 13 53.456 0.17 . 1 . . . A 59 ASP CA . 18018 1
577 . 1 1 59 59 ASP CB C 13 40.748 0.17 . 1 . . . A 59 ASP CB . 18018 1
578 . 1 1 59 59 ASP N N 15 122.731 0.12 . 1 . . . A 59 ASP N . 18018 1
579 . 1 1 60 60 PHE HA H 1 4.168 0.007 . 1 . . . A 60 PHE HA . 18018 1
580 . 1 1 60 60 PHE HB2 H 1 2.414 0.007 . 2 . . . A 60 PHE HB2 . 18018 1
581 . 1 1 60 60 PHE HB3 H 1 2.705 0.007 . 2 . . . A 60 PHE HB3 . 18018 1
582 . 1 1 60 60 PHE HD1 H 1 7.280 0.007 . 3 . . . A 60 PHE QD . 18018 1
583 . 1 1 60 60 PHE HD2 H 1 7.280 0.007 . 3 . . . A 60 PHE QD . 18018 1
584 . 1 1 60 60 PHE CA C 13 60.054 0.17 . 1 . . . A 60 PHE CA . 18018 1
585 . 1 1 60 60 PHE CB C 13 35.813 0.17 . 1 . . . A 60 PHE CB . 18018 1
586 . 1 1 60 60 PHE CD2 C 13 126.734 0.17 . 3 . . . A 60 PHE CD2 . 18018 1
587 . 1 1 60 60 PHE CE2 C 13 128.387 0.17 . 3 . . . A 60 PHE CE2 . 18018 1
588 . 1 1 63 63 PRO HA H 1 4.596 0.007 . 1 . . . A 63 PRO HA . 18018 1
589 . 1 1 63 63 PRO HB2 H 1 2.426 0.007 . 2 . . . A 63 PRO HB2 . 18018 1
590 . 1 1 63 63 PRO HG2 H 1 2.120 0.007 . 2 . . . A 63 PRO HG2 . 18018 1
591 . 1 1 63 63 PRO HG3 H 1 2.200 0.007 . 2 . . . A 63 PRO HG3 . 18018 1
592 . 1 1 63 63 PRO HD2 H 1 3.888 0.007 . 2 . . . A 63 PRO QD . 18018 1
593 . 1 1 63 63 PRO HD3 H 1 3.888 0.007 . 2 . . . A 63 PRO QD . 18018 1
594 . 1 1 63 63 PRO CA C 13 62.948 0.17 . 1 . . . A 63 PRO CA . 18018 1
595 . 1 1 63 63 PRO CB C 13 31.527 0.17 . 1 . . . A 63 PRO CB . 18018 1
596 . 1 1 63 63 PRO CG C 13 26.921 0.17 . 1 . . . A 63 PRO CG . 18018 1
597 . 1 1 63 63 PRO CD C 13 49.883 0.17 . 1 . . . A 63 PRO CD . 18018 1
598 . 1 1 64 64 GLY H H 1 8.725 0.007 . 1 . . . A 64 GLY H . 18018 1
599 . 1 1 64 64 GLY HA2 H 1 4.174 0.007 . 2 . . . A 64 GLY HA2 . 18018 1
600 . 1 1 64 64 GLY HA3 H 1 4.272 0.007 . 2 . . . A 64 GLY HA3 . 18018 1
601 . 1 1 64 64 GLY CA C 13 44.670 0.17 . 1 . . . A 64 GLY CA . 18018 1
602 . 1 1 64 64 GLY N N 15 110.688 0.12 . 1 . . . A 64 GLY N . 18018 1
603 . 1 1 65 65 ASP H H 1 8.649 0.007 . 1 . . . A 65 ASP H . 18018 1
604 . 1 1 65 65 ASP HA H 1 4.663 0.007 . 1 . . . A 65 ASP HA . 18018 1
605 . 1 1 65 65 ASP HB2 H 1 2.820 0.007 . 2 . . . A 65 ASP HB2 . 18018 1
606 . 1 1 65 65 ASP HB3 H 1 2.891 0.007 . 2 . . . A 65 ASP HB3 . 18018 1
607 . 1 1 65 65 ASP CA C 13 55.765 0.17 . 1 . . . A 65 ASP CA . 18018 1
608 . 1 1 65 65 ASP CB C 13 40.462 0.17 . 1 . . . A 65 ASP CB . 18018 1
609 . 1 1 65 65 ASP N N 15 122.028 0.12 . 1 . . . A 65 ASP N . 18018 1
610 . 1 1 67 67 ASP H H 1 8.181 0.007 . 1 . . . A 67 ASP H . 18018 1
611 . 1 1 67 67 ASP HA H 1 4.581 0.007 . 1 . . . A 67 ASP HA . 18018 1
612 . 1 1 67 67 ASP HB2 H 1 3.007 0.007 . 2 . . . A 67 ASP HB2 . 18018 1
613 . 1 1 67 67 ASP HB3 H 1 2.911 0.007 . 2 . . . A 67 ASP HB3 . 18018 1
614 . 1 1 67 67 ASP CA C 13 56.553 0.17 . 1 . . . A 67 ASP CA . 18018 1
615 . 1 1 67 67 ASP CB C 13 39.871 0.17 . 1 . . . A 67 ASP CB . 18018 1
616 . 1 1 67 67 ASP N N 15 120.095 0.12 . 1 . . . A 67 ASP N . 18018 1
617 . 1 1 68 68 VAL H H 1 8.014 0.007 . 1 . . . A 68 VAL H . 18018 1
618 . 1 1 68 68 VAL HA H 1 3.817 0.007 . 1 . . . A 68 VAL HA . 18018 1
619 . 1 1 68 68 VAL HB H 1 2.241 0.007 . 1 . . . A 68 VAL HB . 18018 1
620 . 1 1 68 68 VAL HG11 H 1 1.077 0.007 . 2 . . . A 68 VAL QG1 . 18018 1
621 . 1 1 68 68 VAL HG12 H 1 1.077 0.007 . 2 . . . A 68 VAL QG1 . 18018 1
622 . 1 1 68 68 VAL HG13 H 1 1.077 0.007 . 2 . . . A 68 VAL QG1 . 18018 1
623 . 1 1 68 68 VAL HG21 H 1 0.988 0.007 . 2 . . . A 68 VAL QG2 . 18018 1
624 . 1 1 68 68 VAL HG22 H 1 0.988 0.007 . 2 . . . A 68 VAL QG2 . 18018 1
625 . 1 1 68 68 VAL HG23 H 1 0.988 0.007 . 2 . . . A 68 VAL QG2 . 18018 1
626 . 1 1 68 68 VAL CA C 13 65.715 0.17 . 1 . . . A 68 VAL CA . 18018 1
627 . 1 1 68 68 VAL CB C 13 31.425 0.17 . 1 . . . A 68 VAL CB . 18018 1
628 . 1 1 68 68 VAL CG1 C 13 22.065 0.17 . 2 . . . A 68 VAL CG1 . 18018 1
629 . 1 1 68 68 VAL CG2 C 13 20.675 0.17 . 2 . . . A 68 VAL CG2 . 18018 1
630 . 1 1 68 68 VAL N N 15 123.206 0.12 . 1 . . . A 68 VAL N . 18018 1
631 . 1 1 69 69 PHE H H 1 8.501 0.007 . 1 . . . A 69 PHE H . 18018 1
632 . 1 1 69 69 PHE HA H 1 4.122 0.007 . 1 . . . A 69 PHE HA . 18018 1
633 . 1 1 69 69 PHE HB2 H 1 3.230 0.007 . 2 . . . A 69 PHE HB2 . 18018 1
634 . 1 1 69 69 PHE HB3 H 1 3.324 0.007 . 2 . . . A 69 PHE HB3 . 18018 1
635 . 1 1 69 69 PHE HD1 H 1 7.291 0.007 . 3 . . . A 69 PHE QD . 18018 1
636 . 1 1 69 69 PHE HD2 H 1 7.291 0.007 . 3 . . . A 69 PHE QD . 18018 1
637 . 1 1 69 69 PHE HE1 H 1 7.439 0.007 . 3 . . . A 69 PHE QE . 18018 1
638 . 1 1 69 69 PHE HE2 H 1 7.439 0.007 . 3 . . . A 69 PHE QE . 18018 1
639 . 1 1 69 69 PHE CA C 13 61.742 0.17 . 1 . . . A 69 PHE CA . 18018 1
640 . 1 1 69 69 PHE CB C 13 38.241 0.17 . 1 . . . A 69 PHE CB . 18018 1
641 . 1 1 69 69 PHE CD2 C 13 129.514 0.17 . 3 . . . A 69 PHE CD2 . 18018 1
642 . 1 1 69 69 PHE CE2 C 13 128.380 0.17 . 3 . . . A 69 PHE CE2 . 18018 1
643 . 1 1 69 69 PHE N N 15 120.318 0.12 . 1 . . . A 69 PHE N . 18018 1
644 . 1 1 70 70 ARG H H 1 8.598 0.007 . 1 . . . A 70 ARG H . 18018 1
645 . 1 1 70 70 ARG HA H 1 3.712 0.007 . 1 . . . A 70 ARG HA . 18018 1
646 . 1 1 70 70 ARG HB2 H 1 2.168 0.007 . 2 . . . A 70 ARG HB2 . 18018 1
647 . 1 1 70 70 ARG HB3 H 1 2.003 0.007 . 2 . . . A 70 ARG HB3 . 18018 1
648 . 1 1 70 70 ARG HG2 H 1 1.894 0.007 . 2 . . . A 70 ARG HG2 . 18018 1
649 . 1 1 70 70 ARG C C 13 178.813 0.17 . 1 . . . A 70 ARG C . 18018 1
650 . 1 1 70 70 ARG CA C 13 58.846 0.17 . 1 . . . A 70 ARG CA . 18018 1
651 . 1 1 70 70 ARG CB C 13 29.782 0.17 . 1 . . . A 70 ARG CB . 18018 1
652 . 1 1 70 70 ARG CG C 13 27.871 0.17 . 1 . . . A 70 ARG CG . 18018 1
653 . 1 1 70 70 ARG CD C 13 42.748 0.17 . 1 . . . A 70 ARG CD . 18018 1
654 . 1 1 70 70 ARG N N 15 117.820 0.12 . 1 . . . A 70 ARG N . 18018 1
655 . 1 1 71 71 LYS H H 1 7.658 0.007 . 1 . . . A 71 LYS H . 18018 1
656 . 1 1 71 71 LYS HA H 1 4.223 0.007 . 1 . . . A 71 LYS HA . 18018 1
657 . 1 1 71 71 LYS HB3 H 1 2.151 0.007 . 2 . . . A 71 LYS HB3 . 18018 1
658 . 1 1 71 71 LYS HG2 H 1 1.789 0.007 . 2 . . . A 71 LYS HG2 . 18018 1
659 . 1 1 71 71 LYS C C 13 177.020 0.17 . 1 . . . A 71 LYS C . 18018 1
660 . 1 1 71 71 LYS CA C 13 58.490 0.17 . 1 . . . A 71 LYS CA . 18018 1
661 . 1 1 71 71 LYS CB C 13 31.886 0.17 . 1 . . . A 71 LYS CB . 18018 1
662 . 1 1 71 71 LYS CG C 13 26.730 0.17 . 1 . . . A 71 LYS CG . 18018 1
663 . 1 1 71 71 LYS CD C 13 29.047 0.17 . 1 . . . A 71 LYS CD . 18018 1
664 . 1 1 71 71 LYS N N 15 121.726 0.12 . 1 . . . A 71 LYS N . 18018 1
665 . 1 1 72 72 LEU H H 1 8.173 0.007 . 1 . . . A 72 LEU H . 18018 1
666 . 1 1 72 72 LEU HA H 1 4.025 0.007 . 1 . . . A 72 LEU HA . 18018 1
667 . 1 1 72 72 LEU HB2 H 1 2.088 0.007 . 2 . . . A 72 LEU HB2 . 18018 1
668 . 1 1 72 72 LEU HB3 H 1 1.393 0.007 . 2 . . . A 72 LEU HB3 . 18018 1
669 . 1 1 72 72 LEU HG H 1 1.099 0.007 . 1 . . . A 72 LEU HG . 18018 1
670 . 1 1 72 72 LEU HD21 H 1 1.100 0.007 . 2 . . . A 72 LEU QD2 . 18018 1
671 . 1 1 72 72 LEU HD22 H 1 1.100 0.007 . 2 . . . A 72 LEU QD2 . 18018 1
672 . 1 1 72 72 LEU HD23 H 1 1.100 0.007 . 2 . . . A 72 LEU QD2 . 18018 1
673 . 1 1 72 72 LEU C C 13 177.378 0.17 . 1 . . . A 72 LEU C . 18018 1
674 . 1 1 72 72 LEU CA C 13 56.986 0.17 . 1 . . . A 72 LEU CA . 18018 1
675 . 1 1 72 72 LEU CB C 13 41.846 0.17 . 1 . . . A 72 LEU CB . 18018 1
676 . 1 1 72 72 LEU CG C 13 26.393 0.17 . 1 . . . A 72 LEU CG . 18018 1
677 . 1 1 72 72 LEU CD2 C 13 22.875 0.17 . 2 . . . A 72 LEU CD2 . 18018 1
678 . 1 1 72 72 LEU N N 15 119.355 0.12 . 1 . . . A 72 LEU N . 18018 1
679 . 1 1 73 73 ALA H H 1 9.151 0.007 . 1 . . . A 73 ALA H . 18018 1
680 . 1 1 73 73 ALA HA H 1 3.732 0.007 . 1 . . . A 73 ALA HA . 18018 1
681 . 1 1 73 73 ALA HB1 H 1 0.956 0.007 . 1 . . . A 73 ALA QB . 18018 1
682 . 1 1 73 73 ALA HB2 H 1 0.956 0.007 . 1 . . . A 73 ALA QB . 18018 1
683 . 1 1 73 73 ALA HB3 H 1 0.956 0.007 . 1 . . . A 73 ALA QB . 18018 1
684 . 1 1 73 73 ALA C C 13 179.644 0.17 . 1 . . . A 73 ALA C . 18018 1
685 . 1 1 73 73 ALA CA C 13 53.824 0.17 . 1 . . . A 73 ALA CA . 18018 1
686 . 1 1 73 73 ALA CB C 13 16.536 0.17 . 1 . . . A 73 ALA CB . 18018 1
687 . 1 1 73 73 ALA N N 15 121.169 0.12 . 1 . . . A 73 ALA N . 18018 1
688 . 1 1 74 74 ALA H H 1 7.379 0.007 . 1 . . . A 74 ALA H . 18018 1
689 . 1 1 74 74 ALA HA H 1 4.363 0.007 . 1 . . . A 74 ALA HA . 18018 1
690 . 1 1 74 74 ALA HB1 H 1 1.649 0.007 . 1 . . . A 74 ALA QB . 18018 1
691 . 1 1 74 74 ALA HB2 H 1 1.649 0.007 . 1 . . . A 74 ALA QB . 18018 1
692 . 1 1 74 74 ALA HB3 H 1 1.649 0.007 . 1 . . . A 74 ALA QB . 18018 1
693 . 1 1 74 74 ALA C C 13 179.752 0.17 . 1 . . . A 74 ALA C . 18018 1
694 . 1 1 74 74 ALA CA C 13 53.524 0.17 . 1 . . . A 74 ALA CA . 18018 1
695 . 1 1 74 74 ALA CB C 13 17.644 0.17 . 1 . . . A 74 ALA CB . 18018 1
696 . 1 1 74 74 ALA N N 15 119.383 0.12 . 1 . . . A 74 ALA N . 18018 1
697 . 1 1 75 75 ASP H H 1 8.474 0.007 . 1 . . . A 75 ASP H . 18018 1
698 . 1 1 75 75 ASP HA H 1 4.495 0.007 . 1 . . . A 75 ASP HA . 18018 1
699 . 1 1 75 75 ASP HB2 H 1 2.846 0.007 . 2 . . . A 75 ASP HB2 . 18018 1
700 . 1 1 75 75 ASP HB3 H 1 2.694 0.007 . 2 . . . A 75 ASP HB3 . 18018 1
701 . 1 1 75 75 ASP C C 13 177.704 0.17 . 1 . . . A 75 ASP C . 18018 1
702 . 1 1 75 75 ASP CA C 13 55.987 0.17 . 1 . . . A 75 ASP CA . 18018 1
703 . 1 1 75 75 ASP CB C 13 38.944 0.17 . 1 . . . A 75 ASP CB . 18018 1
704 . 1 1 75 75 ASP N N 15 120.226 0.12 . 1 . . . A 75 ASP N . 18018 1
705 . 1 1 76 76 LEU H H 1 8.599 0.007 . 1 . . . A 76 LEU H . 18018 1
706 . 1 1 76 76 LEU HA H 1 4.392 0.007 . 1 . . . A 76 LEU HA . 18018 1
707 . 1 1 76 76 LEU HB2 H 1 2.007 0.007 . 2 . . . A 76 LEU HB2 . 18018 1
708 . 1 1 76 76 LEU HB3 H 1 1.684 0.007 . 2 . . . A 76 LEU HB3 . 18018 1
709 . 1 1 76 76 LEU HG H 1 1.743 0.007 . 1 . . . A 76 LEU HG . 18018 1
710 . 1 1 76 76 LEU HD11 H 1 0.640 0.007 . 2 . . . A 76 LEU QD1 . 18018 1
711 . 1 1 76 76 LEU HD12 H 1 0.640 0.007 . 2 . . . A 76 LEU QD1 . 18018 1
712 . 1 1 76 76 LEU HD13 H 1 0.640 0.007 . 2 . . . A 76 LEU QD1 . 18018 1
713 . 1 1 76 76 LEU HD21 H 1 0.683 0.007 . 2 . . . A 76 LEU QD2 . 18018 1
714 . 1 1 76 76 LEU HD22 H 1 0.683 0.007 . 2 . . . A 76 LEU QD2 . 18018 1
715 . 1 1 76 76 LEU HD23 H 1 0.683 0.007 . 2 . . . A 76 LEU QD2 . 18018 1
716 . 1 1 76 76 LEU C C 13 174.790 0.17 . 1 . . . A 76 LEU C . 18018 1
717 . 1 1 76 76 LEU CA C 13 52.624 0.17 . 1 . . . A 76 LEU CA . 18018 1
718 . 1 1 76 76 LEU CB C 13 40.199 0.17 . 1 . . . A 76 LEU CB . 18018 1
719 . 1 1 76 76 LEU CG C 13 26.084 0.17 . 1 . . . A 76 LEU CG . 18018 1
720 . 1 1 76 76 LEU CD1 C 13 21.888 0.17 . 2 . . . A 76 LEU CD1 . 18018 1
721 . 1 1 76 76 LEU CD2 C 13 25.961 0.17 . 2 . . . A 76 LEU CD2 . 18018 1
722 . 1 1 76 76 LEU N N 15 115.468 0.12 . 1 . . . A 76 LEU N . 18018 1
723 . 1 1 77 77 GLU H H 1 7.115 0.007 . 1 . . . A 77 GLU H . 18018 1
724 . 1 1 77 77 GLU HA H 1 4.340 0.007 . 1 . . . A 77 GLU HA . 18018 1
725 . 1 1 77 77 GLU HB2 H 1 2.365 0.007 . 2 . . . A 77 GLU HB2 . 18018 1
726 . 1 1 77 77 GLU HB3 H 1 2.119 0.007 . 2 . . . A 77 GLU HB3 . 18018 1
727 . 1 1 77 77 GLU HG2 H 1 2.406 0.007 . 2 . . . A 77 GLU HG2 . 18018 1
728 . 1 1 77 77 GLU HG3 H 1 2.521 0.007 . 2 . . . A 77 GLU HG3 . 18018 1
729 . 1 1 77 77 GLU C C 13 176.953 0.17 . 1 . . . A 77 GLU C . 18018 1
730 . 1 1 77 77 GLU CA C 13 58.311 0.17 . 1 . . . A 77 GLU CA . 18018 1
731 . 1 1 77 77 GLU CB C 13 28.615 0.17 . 1 . . . A 77 GLU CB . 18018 1
732 . 1 1 77 77 GLU CG C 13 35.157 0.17 . 1 . . . A 77 GLU CG . 18018 1
733 . 1 1 77 77 GLU N N 15 124.833 0.12 . 1 . . . A 77 GLU N . 18018 1
734 . 1 1 78 78 GLY H H 1 9.371 0.007 . 1 . . . A 78 GLY H . 18018 1
735 . 1 1 78 78 GLY HA2 H 1 4.454 0.007 . 2 . . . A 78 GLY HA2 . 18018 1
736 . 1 1 78 78 GLY HA3 H 1 3.855 0.007 . 2 . . . A 78 GLY HA3 . 18018 1
737 . 1 1 78 78 GLY C C 13 173.075 0.17 . 1 . . . A 78 GLY C . 18018 1
738 . 1 1 78 78 GLY CA C 13 45.105 0.17 . 1 . . . A 78 GLY CA . 18018 1
739 . 1 1 78 78 GLY N N 15 118.193 0.12 . 1 . . . A 78 GLY N . 18018 1
740 . 1 1 79 79 LYS H H 1 8.799 0.007 . 1 . . . A 79 LYS H . 18018 1
741 . 1 1 79 79 LYS HA H 1 4.631 0.007 . 1 . . . A 79 LYS HA . 18018 1
742 . 1 1 79 79 LYS HB2 H 1 1.789 0.007 . 2 . . . A 79 LYS HB2 . 18018 1
743 . 1 1 79 79 LYS HB3 H 1 1.677 0.007 . 2 . . . A 79 LYS HB3 . 18018 1
744 . 1 1 79 79 LYS HG2 H 1 1.390 0.007 . 2 . . . A 79 LYS QG . 18018 1
745 . 1 1 79 79 LYS HG3 H 1 1.390 0.007 . 2 . . . A 79 LYS QG . 18018 1
746 . 1 1 79 79 LYS HD2 H 1 1.584 0.007 . 2 . . . A 79 LYS HD2 . 18018 1
747 . 1 1 79 79 LYS HD3 H 1 1.682 0.007 . 2 . . . A 79 LYS HD3 . 18018 1
748 . 1 1 79 79 LYS HE2 H 1 3.102 0.007 . 2 . . . A 79 LYS QE . 18018 1
749 . 1 1 79 79 LYS HE3 H 1 3.102 0.007 . 2 . . . A 79 LYS QE . 18018 1
750 . 1 1 79 79 LYS C C 13 175.050 0.17 . 1 . . . A 79 LYS C . 18018 1
751 . 1 1 79 79 LYS CA C 13 55.225 0.17 . 1 . . . A 79 LYS CA . 18018 1
752 . 1 1 79 79 LYS CB C 13 34.062 0.17 . 1 . . . A 79 LYS CB . 18018 1
753 . 1 1 79 79 LYS CG C 13 24.233 0.17 . 1 . . . A 79 LYS CG . 18018 1
754 . 1 1 79 79 LYS CD C 13 27.874 0.17 . 1 . . . A 79 LYS CD . 18018 1
755 . 1 1 79 79 LYS CE C 13 41.884 0.17 . 1 . . . A 79 LYS CE . 18018 1
756 . 1 1 79 79 LYS N N 15 120.237 0.12 . 1 . . . A 79 LYS N . 18018 1
757 . 1 1 80 80 ALA H H 1 8.126 0.007 . 1 . . . A 80 ALA H . 18018 1
758 . 1 1 80 80 ALA HA H 1 4.864 0.007 . 1 . . . A 80 ALA HA . 18018 1
759 . 1 1 80 80 ALA HB1 H 1 1.474 0.007 . 1 . . . A 80 ALA QB . 18018 1
760 . 1 1 80 80 ALA HB2 H 1 1.474 0.007 . 1 . . . A 80 ALA QB . 18018 1
761 . 1 1 80 80 ALA HB3 H 1 1.474 0.007 . 1 . . . A 80 ALA QB . 18018 1
762 . 1 1 80 80 ALA C C 13 174.051 0.17 . 1 . . . A 80 ALA C . 18018 1
763 . 1 1 80 80 ALA CA C 13 50.871 0.17 . 1 . . . A 80 ALA CA . 18018 1
764 . 1 1 80 80 ALA CB C 13 21.127 0.17 . 1 . . . A 80 ALA CB . 18018 1
765 . 1 1 80 80 ALA N N 15 121.135 0.12 . 1 . . . A 80 ALA N . 18018 1
766 . 1 1 81 81 ASP H H 1 8.283 0.007 . 1 . . . A 81 ASP H . 18018 1
767 . 1 1 81 81 ASP HA H 1 4.868 0.007 . 1 . . . A 81 ASP HA . 18018 1
768 . 1 1 81 81 ASP HB2 H 1 2.942 0.007 . 2 . . . A 81 ASP HB2 . 18018 1
769 . 1 1 81 81 ASP HB3 H 1 3.439 0.007 . 2 . . . A 81 ASP HB3 . 18018 1
770 . 1 1 81 81 ASP CA C 13 50.969 0.17 . 1 . . . A 81 ASP CA . 18018 1
771 . 1 1 81 81 ASP CB C 13 41.286 0.17 . 1 . . . A 81 ASP CB . 18018 1
772 . 1 1 81 81 ASP N N 15 121.569 0.12 . 1 . . . A 81 ASP N . 18018 1
773 . 1 1 82 82 GLU H H 1 8.891 0.007 . 1 . . . A 82 GLU H . 18018 1
774 . 1 1 82 82 GLU HA H 1 4.166 0.007 . 1 . . . A 82 GLU HA . 18018 1
775 . 1 1 82 82 GLU HB2 H 1 2.488 0.007 . 2 . . . A 82 GLU HB2 . 18018 1
776 . 1 1 82 82 GLU HB3 H 1 2.360 0.007 . 2 . . . A 82 GLU HB3 . 18018 1
777 . 1 1 82 82 GLU HG2 H 1 2.407 0.007 . 2 . . . A 82 GLU QG . 18018 1
778 . 1 1 82 82 GLU HG3 H 1 2.407 0.007 . 2 . . . A 82 GLU QG . 18018 1
779 . 1 1 82 82 GLU C C 13 177.350 0.17 . 1 . . . A 82 GLU C . 18018 1
780 . 1 1 82 82 GLU CA C 13 60.218 0.17 . 1 . . . A 82 GLU CA . 18018 1
781 . 1 1 82 82 GLU CB C 13 28.625 0.17 . 1 . . . A 82 GLU CB . 18018 1
782 . 1 1 82 82 GLU CG C 13 35.882 0.17 . 1 . . . A 82 GLU CG . 18018 1
783 . 1 1 82 82 GLU N N 15 120.044 0.12 . 1 . . . A 82 GLU N . 18018 1
784 . 1 1 83 83 GLU H H 1 8.827 0.007 . 1 . . . A 83 GLU H . 18018 1
785 . 1 1 83 83 GLU HA H 1 4.147 0.007 . 1 . . . A 83 GLU HA . 18018 1
786 . 1 1 83 83 GLU HB2 H 1 2.184 0.007 . 2 . . . A 83 GLU HB2 . 18018 1
787 . 1 1 83 83 GLU HB3 H 1 2.270 0.007 . 2 . . . A 83 GLU HB3 . 18018 1
788 . 1 1 83 83 GLU HG2 H 1 2.489 0.007 . 2 . . . A 83 GLU QG . 18018 1
789 . 1 1 83 83 GLU HG3 H 1 2.489 0.007 . 2 . . . A 83 GLU QG . 18018 1
790 . 1 1 83 83 GLU C C 13 178.794 0.17 . 1 . . . A 83 GLU C . 18018 1
791 . 1 1 83 83 GLU CA C 13 59.082 0.17 . 1 . . . A 83 GLU CA . 18018 1
792 . 1 1 83 83 GLU CB C 13 28.375 0.17 . 1 . . . A 83 GLU CB . 18018 1
793 . 1 1 83 83 GLU CG C 13 35.784 0.17 . 1 . . . A 83 GLU CG . 18018 1
794 . 1 1 83 83 GLU N N 15 119.348 0.12 . 1 . . . A 83 GLU N . 18018 1
795 . 1 1 84 84 THR H H 1 8.552 0.007 . 1 . . . A 84 THR H . 18018 1
796 . 1 1 84 84 THR HA H 1 4.131 0.007 . 1 . . . A 84 THR HA . 18018 1
797 . 1 1 84 84 THR HB H 1 3.819 0.007 . 1 . . . A 84 THR HB . 18018 1
798 . 1 1 84 84 THR HG21 H 1 1.608 0.007 . 1 . . . A 84 THR QG2 . 18018 1
799 . 1 1 84 84 THR HG22 H 1 1.608 0.007 . 1 . . . A 84 THR QG2 . 18018 1
800 . 1 1 84 84 THR HG23 H 1 1.608 0.007 . 1 . . . A 84 THR QG2 . 18018 1
801 . 1 1 84 84 THR C C 13 176.165 0.17 . 1 . . . A 84 THR C . 18018 1
802 . 1 1 84 84 THR CA C 13 66.422 0.17 . 1 . . . A 84 THR CA . 18018 1
803 . 1 1 84 84 THR CB C 13 65.645 0.17 . 1 . . . A 84 THR CB . 18018 1
804 . 1 1 84 84 THR CG2 C 13 20.166 0.17 . 1 . . . A 84 THR CG2 . 18018 1
805 . 1 1 84 84 THR N N 15 119.678 0.12 . 1 . . . A 84 THR N . 18018 1
806 . 1 1 85 85 ILE H H 1 8.571 0.007 . 1 . . . A 85 ILE H . 18018 1
807 . 1 1 85 85 ILE HA H 1 3.819 0.007 . 1 . . . A 85 ILE HA . 18018 1
808 . 1 1 85 85 ILE HB H 1 2.239 0.007 . 1 . . . A 85 ILE HB . 18018 1
809 . 1 1 85 85 ILE HG12 H 1 1.065 0.007 . 2 . . . A 85 ILE HG12 . 18018 1
810 . 1 1 85 85 ILE HG13 H 1 2.281 0.007 . 2 . . . A 85 ILE HG13 . 18018 1
811 . 1 1 85 85 ILE HG21 H 1 1.226 0.007 . 1 . . . A 85 ILE QG2 . 18018 1
812 . 1 1 85 85 ILE HG22 H 1 1.226 0.007 . 1 . . . A 85 ILE QG2 . 18018 1
813 . 1 1 85 85 ILE HG23 H 1 1.226 0.007 . 1 . . . A 85 ILE QG2 . 18018 1
814 . 1 1 85 85 ILE HD11 H 1 0.812 0.007 . 1 . . . A 85 ILE QD1 . 18018 1
815 . 1 1 85 85 ILE HD12 H 1 0.812 0.007 . 1 . . . A 85 ILE QD1 . 18018 1
816 . 1 1 85 85 ILE HD13 H 1 0.812 0.007 . 1 . . . A 85 ILE QD1 . 18018 1
817 . 1 1 85 85 ILE C C 13 174.809 0.17 . 1 . . . A 85 ILE C . 18018 1
818 . 1 1 85 85 ILE CA C 13 65.583 0.17 . 1 . . . A 85 ILE CA . 18018 1
819 . 1 1 85 85 ILE CB C 13 38.490 0.17 . 1 . . . A 85 ILE CB . 18018 1
820 . 1 1 85 85 ILE CG1 C 13 29.137 0.17 . 1 . . . A 85 ILE CG1 . 18018 1
821 . 1 1 85 85 ILE CG2 C 13 18.678 0.17 . 1 . . . A 85 ILE CG2 . 18018 1
822 . 1 1 85 85 ILE CD1 C 13 13.247 0.17 . 1 . . . A 85 ILE CD1 . 18018 1
823 . 1 1 85 85 ILE N N 15 123.677 0.12 . 1 . . . A 85 ILE N . 18018 1
824 . 1 1 86 86 ARG H H 1 9.093 0.007 . 1 . . . A 86 ARG H . 18018 1
825 . 1 1 86 86 ARG HA H 1 4.171 0.007 . 1 . . . A 86 ARG HA . 18018 1
826 . 1 1 86 86 ARG HB2 H 1 2.038 0.007 . 2 . . . A 86 ARG HB2 . 18018 1
827 . 1 1 86 86 ARG HB3 H 1 1.883 0.007 . 2 . . . A 86 ARG HB3 . 18018 1
828 . 1 1 86 86 ARG HG2 H 1 1.701 0.007 . 2 . . . A 86 ARG HG2 . 18018 1
829 . 1 1 86 86 ARG HG3 H 1 1.946 0.007 . 2 . . . A 86 ARG HG3 . 18018 1
830 . 1 1 86 86 ARG HD2 H 1 3.032 0.007 . 2 . . . A 86 ARG HD2 . 18018 1
831 . 1 1 86 86 ARG HD3 H 1 3.073 0.007 . 2 . . . A 86 ARG HD3 . 18018 1
832 . 1 1 86 86 ARG CA C 13 59.619 0.17 . 1 . . . A 86 ARG CA . 18018 1
833 . 1 1 86 86 ARG CB C 13 28.858 0.17 . 1 . . . A 86 ARG CB . 18018 1
834 . 1 1 86 86 ARG CG C 13 27.919 0.17 . 1 . . . A 86 ARG CG . 18018 1
835 . 1 1 86 86 ARG CD C 13 42.182 0.17 . 1 . . . A 86 ARG CD . 18018 1
836 . 1 1 86 86 ARG N N 15 119.556 0.12 . 1 . . . A 86 ARG N . 18018 1
837 . 1 1 87 87 ALA H H 1 8.206 0.007 . 1 . . . A 87 ALA H . 18018 1
838 . 1 1 87 87 ALA HA H 1 4.288 0.007 . 1 . . . A 87 ALA HA . 18018 1
839 . 1 1 87 87 ALA HB1 H 1 1.638 0.007 . 1 . . . A 87 ALA QB . 18018 1
840 . 1 1 87 87 ALA HB2 H 1 1.638 0.007 . 1 . . . A 87 ALA QB . 18018 1
841 . 1 1 87 87 ALA HB3 H 1 1.638 0.007 . 1 . . . A 87 ALA QB . 18018 1
842 . 1 1 87 87 ALA CA C 13 54.155 0.17 . 1 . . . A 87 ALA CA . 18018 1
843 . 1 1 87 87 ALA CB C 13 17.072 0.17 . 1 . . . A 87 ALA CB . 18018 1
844 . 1 1 87 87 ALA N N 15 121.431 0.12 . 1 . . . A 87 ALA N . 18018 1
845 . 1 1 88 88 LYS H H 1 8.145 0.007 . 1 . . . A 88 LYS H . 18018 1
846 . 1 1 88 88 LYS HA H 1 3.982 0.007 . 1 . . . A 88 LYS HA . 18018 1
847 . 1 1 88 88 LYS HB2 H 1 1.299 0.007 . 2 . . . A 88 LYS HB2 . 18018 1
848 . 1 1 88 88 LYS HB3 H 1 1.374 0.007 . 2 . . . A 88 LYS HB3 . 18018 1
849 . 1 1 88 88 LYS HG3 H 1 1.132 0.007 . 2 . . . A 88 LYS HG3 . 18018 1
850 . 1 1 88 88 LYS CA C 13 55.873 0.17 . 1 . . . A 88 LYS CA . 18018 1
851 . 1 1 88 88 LYS CB C 13 29.823 0.17 . 1 . . . A 88 LYS CB . 18018 1
852 . 1 1 88 88 LYS CG C 13 26.181 0.17 . 1 . . . A 88 LYS CG . 18018 1
853 . 1 1 88 88 LYS N N 15 122.850 0.12 . 1 . . . A 88 LYS N . 18018 1
854 . 1 1 89 89 MET H H 1 8.468 0.007 . 1 . . . A 89 MET H . 18018 1
855 . 1 1 89 89 MET HA H 1 3.810 0.007 . 1 . . . A 89 MET HA . 18018 1
856 . 1 1 89 89 MET HB2 H 1 2.466 0.007 . 2 . . . A 89 MET HB2 . 18018 1
857 . 1 1 89 89 MET HB3 H 1 3.122 0.007 . 2 . . . A 89 MET HB3 . 18018 1
858 . 1 1 89 89 MET HG3 H 1 1.071 0.007 . 2 . . . A 89 MET HG3 . 18018 1
859 . 1 1 89 89 MET CA C 13 60.096 0.17 . 1 . . . A 89 MET CA . 18018 1
860 . 1 1 89 89 MET CB C 13 32.329 0.17 . 1 . . . A 89 MET CB . 18018 1
861 . 1 1 89 89 MET CG C 13 26.155 0.17 . 1 . . . A 89 MET CG . 18018 1
862 . 1 1 89 89 MET CE C 13 15.620 0.17 . 1 . . . A 89 MET CE . 18018 1
863 . 1 1 89 89 MET N N 15 118.786 0.12 . 1 . . . A 89 MET N . 18018 1
864 . 1 1 90 90 VAL H H 1 7.504 0.007 . 1 . . . A 90 VAL H . 18018 1
865 . 1 1 90 90 VAL HA H 1 3.827 0.007 . 1 . . . A 90 VAL HA . 18018 1
866 . 1 1 90 90 VAL HB H 1 2.286 0.007 . 1 . . . A 90 VAL HB . 18018 1
867 . 1 1 90 90 VAL HG11 H 1 1.216 0.007 . 2 . . . A 90 VAL QG1 . 18018 1
868 . 1 1 90 90 VAL HG12 H 1 1.216 0.007 . 2 . . . A 90 VAL QG1 . 18018 1
869 . 1 1 90 90 VAL HG13 H 1 1.216 0.007 . 2 . . . A 90 VAL QG1 . 18018 1
870 . 1 1 90 90 VAL HG21 H 1 1.106 0.007 . 2 . . . A 90 VAL QG2 . 18018 1
871 . 1 1 90 90 VAL HG22 H 1 1.106 0.007 . 2 . . . A 90 VAL QG2 . 18018 1
872 . 1 1 90 90 VAL HG23 H 1 1.106 0.007 . 2 . . . A 90 VAL QG2 . 18018 1
873 . 1 1 90 90 VAL C C 13 178.017 0.17 . 1 . . . A 90 VAL C . 18018 1
874 . 1 1 90 90 VAL CA C 13 65.625 0.17 . 1 . . . A 90 VAL CA . 18018 1
875 . 1 1 90 90 VAL CB C 13 31.739 0.17 . 1 . . . A 90 VAL CB . 18018 1
876 . 1 1 90 90 VAL CG1 C 13 21.777 0.17 . 2 . . . A 90 VAL CG1 . 18018 1
877 . 1 1 90 90 VAL CG2 C 13 20.462 0.17 . 2 . . . A 90 VAL CG2 . 18018 1
878 . 1 1 90 90 VAL N N 15 120.770 0.12 . 1 . . . A 90 VAL N . 18018 1
879 . 1 1 91 91 GLU H H 1 8.486 0.007 . 1 . . . A 91 GLU H . 18018 1
880 . 1 1 91 91 GLU HA H 1 3.788 0.007 . 1 . . . A 91 GLU HA . 18018 1
881 . 1 1 91 91 GLU HB2 H 1 2.221 0.007 . 2 . . . A 91 GLU QB . 18018 1
882 . 1 1 91 91 GLU HB3 H 1 2.221 0.007 . 2 . . . A 91 GLU QB . 18018 1
883 . 1 1 91 91 GLU HG2 H 1 2.357 0.007 . 2 . . . A 91 GLU QG . 18018 1
884 . 1 1 91 91 GLU HG3 H 1 2.357 0.007 . 2 . . . A 91 GLU QG . 18018 1
885 . 1 1 91 91 GLU C C 13 177.612 0.17 . 1 . . . A 91 GLU C . 18018 1
886 . 1 1 91 91 GLU CA C 13 58.414 0.17 . 1 . . . A 91 GLU CA . 18018 1
887 . 1 1 91 91 GLU CB C 13 31.444 0.17 . 1 . . . A 91 GLU CB . 18018 1
888 . 1 1 91 91 GLU CG C 13 35.584 0.17 . 1 . . . A 91 GLU CG . 18018 1
889 . 1 1 91 91 GLU N N 15 124.409 0.12 . 1 . . . A 91 GLU N . 18018 1
890 . 1 1 92 92 LEU H H 1 8.823 0.007 . 1 . . . A 92 LEU H . 18018 1
891 . 1 1 92 92 LEU HA H 1 4.390 0.007 . 1 . . . A 92 LEU HA . 18018 1
892 . 1 1 92 92 LEU HB2 H 1 1.537 0.007 . 2 . . . A 92 LEU HB2 . 18018 1
893 . 1 1 92 92 LEU HB3 H 1 1.824 0.007 . 2 . . . A 92 LEU HB3 . 18018 1
894 . 1 1 92 92 LEU HG H 1 1.805 0.007 . 1 . . . A 92 LEU HG . 18018 1
895 . 1 1 92 92 LEU HD11 H 1 0.770 0.007 . 2 . . . A 92 LEU QD1 . 18018 1
896 . 1 1 92 92 LEU HD12 H 1 0.770 0.007 . 2 . . . A 92 LEU QD1 . 18018 1
897 . 1 1 92 92 LEU HD13 H 1 0.770 0.007 . 2 . . . A 92 LEU QD1 . 18018 1
898 . 1 1 92 92 LEU HD21 H 1 0.968 0.007 . 2 . . . A 92 LEU QD2 . 18018 1
899 . 1 1 92 92 LEU HD22 H 1 0.968 0.007 . 2 . . . A 92 LEU QD2 . 18018 1
900 . 1 1 92 92 LEU HD23 H 1 0.968 0.007 . 2 . . . A 92 LEU QD2 . 18018 1
901 . 1 1 92 92 LEU C C 13 177.928 0.17 . 1 . . . A 92 LEU C . 18018 1
902 . 1 1 92 92 LEU CA C 13 55.634 0.17 . 1 . . . A 92 LEU CA . 18018 1
903 . 1 1 92 92 LEU CB C 13 40.341 0.17 . 1 . . . A 92 LEU CB . 18018 1
904 . 1 1 92 92 LEU CG C 13 26.370 0.17 . 1 . . . A 92 LEU CG . 18018 1
905 . 1 1 92 92 LEU CD1 C 13 24.450 0.17 . 2 . . . A 92 LEU CD1 . 18018 1
906 . 1 1 92 92 LEU CD2 C 13 21.301 0.17 . 2 . . . A 92 LEU CD2 . 18018 1
907 . 1 1 92 92 LEU N N 15 114.680 0.12 . 1 . . . A 92 LEU N . 18018 1
908 . 1 1 93 93 ARG H H 1 7.690 0.007 . 1 . . . A 93 ARG H . 18018 1
909 . 1 1 93 93 ARG HA H 1 3.943 0.007 . 1 . . . A 93 ARG HA . 18018 1
910 . 1 1 93 93 ARG HB2 H 1 2.153 0.007 . 2 . . . A 93 ARG HB2 . 18018 1
911 . 1 1 93 93 ARG HG2 H 1 1.633 0.007 . 2 . . . A 93 ARG QG . 18018 1
912 . 1 1 93 93 ARG HG3 H 1 1.633 0.007 . 2 . . . A 93 ARG QG . 18018 1
913 . 1 1 93 93 ARG HD3 H 1 3.239 0.007 . 2 . . . A 93 ARG HD3 . 18018 1
914 . 1 1 93 93 ARG C C 13 176.350 0.17 . 1 . . . A 93 ARG C . 18018 1
915 . 1 1 93 93 ARG CA C 13 59.581 0.17 . 1 . . . A 93 ARG CA . 18018 1
916 . 1 1 93 93 ARG CB C 13 28.903 0.17 . 1 . . . A 93 ARG CB . 18018 1
917 . 1 1 93 93 ARG CG C 13 27.164 0.17 . 1 . . . A 93 ARG CG . 18018 1
918 . 1 1 93 93 ARG CD C 13 41.564 0.17 . 1 . . . A 93 ARG CD . 18018 1
919 . 1 1 93 93 ARG N N 15 123.603 0.12 . 1 . . . A 93 ARG N . 18018 1
920 . 1 1 94 94 ALA H H 1 7.269 0.007 . 1 . . . A 94 ALA H . 18018 1
921 . 1 1 94 94 ALA HA H 1 4.261 0.007 . 1 . . . A 94 ALA HA . 18018 1
922 . 1 1 94 94 ALA HB1 H 1 1.708 0.007 . 1 . . . A 94 ALA QB . 18018 1
923 . 1 1 94 94 ALA HB2 H 1 1.708 0.007 . 1 . . . A 94 ALA QB . 18018 1
924 . 1 1 94 94 ALA HB3 H 1 1.708 0.007 . 1 . . . A 94 ALA QB . 18018 1
925 . 1 1 94 94 ALA C C 13 179.805 0.17 . 1 . . . A 94 ALA C . 18018 1
926 . 1 1 94 94 ALA CA C 13 54.529 0.17 . 1 . . . A 94 ALA CA . 18018 1
927 . 1 1 94 94 ALA CB C 13 16.936 0.17 . 1 . . . A 94 ALA CB . 18018 1
928 . 1 1 94 94 ALA N N 15 122.480 0.12 . 1 . . . A 94 ALA N . 18018 1
929 . 1 1 95 95 THR H H 1 8.282 0.007 . 1 . . . A 95 THR H . 18018 1
930 . 1 1 95 95 THR HA H 1 4.045 0.007 . 1 . . . A 95 THR HA . 18018 1
931 . 1 1 95 95 THR HB H 1 4.114 0.007 . 1 . . . A 95 THR HB . 18018 1
932 . 1 1 95 95 THR HG21 H 1 1.339 0.007 . 1 . . . A 95 THR QG2 . 18018 1
933 . 1 1 95 95 THR HG22 H 1 1.339 0.007 . 1 . . . A 95 THR QG2 . 18018 1
934 . 1 1 95 95 THR HG23 H 1 1.339 0.007 . 1 . . . A 95 THR QG2 . 18018 1
935 . 1 1 95 95 THR C C 13 175.007 0.17 . 1 . . . A 95 THR C . 18018 1
936 . 1 1 95 95 THR CA C 13 65.569 0.17 . 1 . . . A 95 THR CA . 18018 1
937 . 1 1 95 95 THR CB C 13 68.334 0.17 . 1 . . . A 95 THR CB . 18018 1
938 . 1 1 95 95 THR CG2 C 13 21.364 0.17 . 1 . . . A 95 THR CG2 . 18018 1
939 . 1 1 95 95 THR N N 15 116.936 0.12 . 1 . . . A 95 THR N . 18018 1
940 . 1 1 96 96 ALA H H 1 8.681 0.007 . 1 . . . A 96 ALA H . 18018 1
941 . 1 1 96 96 ALA HA H 1 3.862 0.007 . 1 . . . A 96 ALA HA . 18018 1
942 . 1 1 96 96 ALA HB1 H 1 1.644 0.007 . 1 . . . A 96 ALA QB . 18018 1
943 . 1 1 96 96 ALA HB2 H 1 1.644 0.007 . 1 . . . A 96 ALA QB . 18018 1
944 . 1 1 96 96 ALA HB3 H 1 1.644 0.007 . 1 . . . A 96 ALA QB . 18018 1
945 . 1 1 96 96 ALA C C 13 178.184 0.17 . 1 . . . A 96 ALA C . 18018 1
946 . 1 1 96 96 ALA CA C 13 54.749 0.17 . 1 . . . A 96 ALA CA . 18018 1
947 . 1 1 96 96 ALA CB C 13 18.770 0.17 . 1 . . . A 96 ALA CB . 18018 1
948 . 1 1 96 96 ALA N N 15 124.095 0.12 . 1 . . . A 96 ALA N . 18018 1
949 . 1 1 97 97 ARG H H 1 8.070 0.007 . 1 . . . A 97 ARG H . 18018 1
950 . 1 1 97 97 ARG HA H 1 3.786 0.007 . 1 . . . A 97 ARG HA . 18018 1
951 . 1 1 97 97 ARG HB2 H 1 1.777 0.007 . 2 . . . A 97 ARG HB2 . 18018 1
952 . 1 1 97 97 ARG HG2 H 1 1.741 0.007 . 2 . . . A 97 ARG HG2 . 18018 1
953 . 1 1 97 97 ARG C C 13 176.770 0.17 . 1 . . . A 97 ARG C . 18018 1
954 . 1 1 97 97 ARG CA C 13 59.561 0.17 . 1 . . . A 97 ARG CA . 18018 1
955 . 1 1 97 97 ARG CB C 13 29.616 0.17 . 1 . . . A 97 ARG CB . 18018 1
956 . 1 1 97 97 ARG CG C 13 27.753 0.17 . 1 . . . A 97 ARG CG . 18018 1
957 . 1 1 97 97 ARG N N 15 117.328 0.12 . 1 . . . A 97 ARG N . 18018 1
958 . 1 1 98 98 GLU H H 1 7.855 0.007 . 1 . . . A 98 GLU H . 18018 1
959 . 1 1 98 98 GLU HA H 1 4.115 0.007 . 1 . . . A 98 GLU HA . 18018 1
960 . 1 1 98 98 GLU HB2 H 1 2.307 0.007 . 2 . . . A 98 GLU HB2 . 18018 1
961 . 1 1 98 98 GLU HB3 H 1 2.361 0.007 . 2 . . . A 98 GLU HB3 . 18018 1
962 . 1 1 98 98 GLU HG2 H 1 2.484 0.007 . 2 . . . A 98 GLU HG2 . 18018 1
963 . 1 1 98 98 GLU HG3 H 1 2.564 0.007 . 2 . . . A 98 GLU HG3 . 18018 1
964 . 1 1 98 98 GLU C C 13 178.865 0.17 . 1 . . . A 98 GLU C . 18018 1
965 . 1 1 98 98 GLU CA C 13 58.489 0.17 . 1 . . . A 98 GLU CA . 18018 1
966 . 1 1 98 98 GLU CB C 13 28.512 0.17 . 1 . . . A 98 GLU CB . 18018 1
967 . 1 1 98 98 GLU CG C 13 35.743 0.17 . 1 . . . A 98 GLU CG . 18018 1
968 . 1 1 98 98 GLU N N 15 118.245 0.12 . 1 . . . A 98 GLU N . 18018 1
969 . 1 1 99 99 GLN H H 1 8.312 0.007 . 1 . . . A 99 GLN H . 18018 1
970 . 1 1 99 99 GLN HA H 1 4.171 0.007 . 1 . . . A 99 GLN HA . 18018 1
971 . 1 1 99 99 GLN HB2 H 1 2.302 0.007 . 2 . . . A 99 GLN HB2 . 18018 1
972 . 1 1 99 99 GLN HB3 H 1 2.041 0.007 . 2 . . . A 99 GLN HB3 . 18018 1
973 . 1 1 99 99 GLN HG2 H 1 2.560 0.007 . 2 . . . A 99 GLN HG2 . 18018 1
974 . 1 1 99 99 GLN HG3 H 1 2.986 0.007 . 2 . . . A 99 GLN HG3 . 18018 1
975 . 1 1 99 99 GLN HE21 H 1 6.515 0.007 . 2 . . . A 99 GLN HE21 . 18018 1
976 . 1 1 99 99 GLN HE22 H 1 7.579 0.007 . 2 . . . A 99 GLN HE22 . 18018 1
977 . 1 1 99 99 GLN C C 13 178.146 0.17 . 1 . . . A 99 GLN C . 18018 1
978 . 1 1 99 99 GLN CA C 13 58.245 0.17 . 1 . . . A 99 GLN CA . 18018 1
979 . 1 1 99 99 GLN CB C 13 27.094 0.17 . 1 . . . A 99 GLN CB . 18018 1
980 . 1 1 99 99 GLN CG C 13 33.058 0.17 . 1 . . . A 99 GLN CG . 18018 1
981 . 1 1 99 99 GLN N N 15 119.735 0.12 . 1 . . . A 99 GLN N . 18018 1
982 . 1 1 99 99 GLN NE2 N 15 109.393 0.12 . 1 . . . A 99 GLN NE2 . 18018 1
983 . 1 1 100 100 ILE H H 1 8.445 0.007 . 1 . . . A 100 ILE H . 18018 1
984 . 1 1 100 100 ILE HA H 1 3.950 0.007 . 1 . . . A 100 ILE HA . 18018 1
985 . 1 1 100 100 ILE HB H 1 2.357 0.007 . 1 . . . A 100 ILE HB . 18018 1
986 . 1 1 100 100 ILE HG12 H 1 1.924 0.007 . 2 . . . A 100 ILE HG12 . 18018 1
987 . 1 1 100 100 ILE HG13 H 1 1.318 0.007 . 2 . . . A 100 ILE HG13 . 18018 1
988 . 1 1 100 100 ILE HG21 H 1 1.195 0.007 . 1 . . . A 100 ILE QG2 . 18018 1
989 . 1 1 100 100 ILE HG22 H 1 1.195 0.007 . 1 . . . A 100 ILE QG2 . 18018 1
990 . 1 1 100 100 ILE HG23 H 1 1.195 0.007 . 1 . . . A 100 ILE QG2 . 18018 1
991 . 1 1 100 100 ILE HD11 H 1 0.897 0.007 . 1 . . . A 100 ILE QD1 . 18018 1
992 . 1 1 100 100 ILE HD12 H 1 0.897 0.007 . 1 . . . A 100 ILE QD1 . 18018 1
993 . 1 1 100 100 ILE HD13 H 1 0.897 0.007 . 1 . . . A 100 ILE QD1 . 18018 1
994 . 1 1 100 100 ILE C C 13 178.315 0.17 . 1 . . . A 100 ILE C . 18018 1
995 . 1 1 100 100 ILE CA C 13 61.604 0.17 . 1 . . . A 100 ILE CA . 18018 1
996 . 1 1 100 100 ILE CB C 13 35.496 0.17 . 1 . . . A 100 ILE CB . 18018 1
997 . 1 1 100 100 ILE CG1 C 13 27.860 0.17 . 1 . . . A 100 ILE CG1 . 18018 1
998 . 1 1 100 100 ILE CG2 C 13 18.419 0.17 . 1 . . . A 100 ILE CG2 . 18018 1
999 . 1 1 100 100 ILE CD1 C 13 9.854 0.17 . 1 . . . A 100 ILE CD1 . 18018 1
1000 . 1 1 100 100 ILE N N 15 119.864 0.12 . 1 . . . A 100 ILE N . 18018 1
1001 . 1 1 101 101 ILE H H 1 8.329 0.007 . 1 . . . A 101 ILE H . 18018 1
1002 . 1 1 101 101 ILE HA H 1 4.012 0.007 . 1 . . . A 101 ILE HA . 18018 1
1003 . 1 1 101 101 ILE HB H 1 2.133 0.007 . 1 . . . A 101 ILE HB . 18018 1
1004 . 1 1 101 101 ILE HG12 H 1 1.687 0.007 . 2 . . . A 101 ILE HG12 . 18018 1
1005 . 1 1 101 101 ILE HG13 H 1 1.505 0.007 . 2 . . . A 101 ILE HG13 . 18018 1
1006 . 1 1 101 101 ILE HG21 H 1 1.020 0.007 . 1 . . . A 101 ILE QG2 . 18018 1
1007 . 1 1 101 101 ILE HG22 H 1 1.020 0.007 . 1 . . . A 101 ILE QG2 . 18018 1
1008 . 1 1 101 101 ILE HG23 H 1 1.020 0.007 . 1 . . . A 101 ILE QG2 . 18018 1
1009 . 1 1 101 101 ILE HD11 H 1 0.848 0.007 . 1 . . . A 101 ILE QD1 . 18018 1
1010 . 1 1 101 101 ILE HD12 H 1 0.848 0.007 . 1 . . . A 101 ILE QD1 . 18018 1
1011 . 1 1 101 101 ILE HD13 H 1 0.848 0.007 . 1 . . . A 101 ILE QD1 . 18018 1
1012 . 1 1 101 101 ILE C C 13 177.006 0.17 . 1 . . . A 101 ILE C . 18018 1
1013 . 1 1 101 101 ILE CA C 13 62.977 0.17 . 1 . . . A 101 ILE CA . 18018 1
1014 . 1 1 101 101 ILE CB C 13 36.661 0.17 . 1 . . . A 101 ILE CB . 18018 1
1015 . 1 1 101 101 ILE CG1 C 13 28.168 0.17 . 1 . . . A 101 ILE CG1 . 18018 1
1016 . 1 1 101 101 ILE CG2 C 13 16.836 0.17 . 1 . . . A 101 ILE CG2 . 18018 1
1017 . 1 1 101 101 ILE CD1 C 13 11.818 0.17 . 1 . . . A 101 ILE CD1 . 18018 1
1018 . 1 1 101 101 ILE N N 15 120.514 0.12 . 1 . . . A 101 ILE N . 18018 1
1019 . 1 1 102 102 SER H H 1 7.882 0.007 . 1 . . . A 102 SER H . 18018 1
1020 . 1 1 102 102 SER HA H 1 4.562 0.007 . 1 . . . A 102 SER HA . 18018 1
1021 . 1 1 102 102 SER HB2 H 1 4.247 0.007 . 2 . . . A 102 SER HB2 . 18018 1
1022 . 1 1 102 102 SER HB3 H 1 4.179 0.007 . 2 . . . A 102 SER HB3 . 18018 1
1023 . 1 1 102 102 SER C C 13 173.845 0.17 . 1 . . . A 102 SER C . 18018 1
1024 . 1 1 102 102 SER CA C 13 59.502 0.17 . 1 . . . A 102 SER CA . 18018 1
1025 . 1 1 102 102 SER CB C 13 63.012 0.17 . 1 . . . A 102 SER CB . 18018 1
1026 . 1 1 102 102 SER N N 15 116.172 0.12 . 1 . . . A 102 SER N . 18018 1
1027 . 1 1 103 103 GLU H H 1 7.735 0.007 . 1 . . . A 103 GLU H . 18018 1
1028 . 1 1 103 103 GLU HA H 1 4.440 0.007 . 1 . . . A 103 GLU HA . 18018 1
1029 . 1 1 103 103 GLU HB2 H 1 2.344 0.007 . 2 . . . A 103 GLU HB2 . 18018 1
1030 . 1 1 103 103 GLU HB3 H 1 2.123 0.007 . 2 . . . A 103 GLU HB3 . 18018 1
1031 . 1 1 103 103 GLU HG2 H 1 2.429 0.007 . 2 . . . A 103 GLU HG2 . 18018 1
1032 . 1 1 103 103 GLU HG3 H 1 2.695 0.007 . 2 . . . A 103 GLU HG3 . 18018 1
1033 . 1 1 103 103 GLU C C 13 175.095 0.17 . 1 . . . A 103 GLU C . 18018 1
1034 . 1 1 103 103 GLU CA C 13 55.628 0.17 . 1 . . . A 103 GLU CA . 18018 1
1035 . 1 1 103 103 GLU CB C 13 29.813 0.17 . 1 . . . A 103 GLU CB . 18018 1
1036 . 1 1 103 103 GLU CG C 13 35.671 0.17 . 1 . . . A 103 GLU CG . 18018 1
1037 . 1 1 103 103 GLU N N 15 122.642 0.12 . 1 . . . A 103 GLU N . 18018 1
1038 . 1 1 104 104 ILE H H 1 7.445 0.007 . 1 . . . A 104 ILE H . 18018 1
1039 . 1 1 104 104 ILE HA H 1 4.060 0.007 . 1 . . . A 104 ILE HA . 18018 1
1040 . 1 1 104 104 ILE HB H 1 1.992 0.007 . 1 . . . A 104 ILE HB . 18018 1
1041 . 1 1 104 104 ILE HG12 H 1 1.282 0.007 . 2 . . . A 104 ILE HG12 . 18018 1
1042 . 1 1 104 104 ILE HG13 H 1 1.815 0.007 . 2 . . . A 104 ILE HG13 . 18018 1
1043 . 1 1 104 104 ILE HD11 H 1 1.013 0.007 . 1 . . . A 104 ILE QD1 . 18018 1
1044 . 1 1 104 104 ILE HD12 H 1 1.013 0.007 . 1 . . . A 104 ILE QD1 . 18018 1
1045 . 1 1 104 104 ILE HD13 H 1 1.013 0.007 . 1 . . . A 104 ILE QD1 . 18018 1
1046 . 1 1 104 104 ILE CA C 13 63.635 0.17 . 1 . . . A 104 ILE CA . 18018 1
1047 . 1 1 104 104 ILE CB C 13 38.347 0.17 . 1 . . . A 104 ILE CB . 18018 1
1048 . 1 1 104 104 ILE CG1 C 13 26.752 0.17 . 1 . . . A 104 ILE CG1 . 18018 1
1049 . 1 1 104 104 ILE CG2 C 13 19.070 0.17 . 1 . . . A 104 ILE CG2 . 18018 1
1050 . 1 1 104 104 ILE CD1 C 13 13.443 0.17 . 1 . . . A 104 ILE CD1 . 18018 1
1051 . 1 1 104 104 ILE N N 15 126.167 0.12 . 1 . . . A 104 ILE N . 18018 1
stop_
save_