Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11327
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11327 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11327 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 $XWINNMR . . 11327 1
2 $NMRPipe . . 11327 1
3 $NMRView . . 11327 1
4 $Kujira . . 11327 1
5 $CYANA . . 11327 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 7 7 GLY HA2 H 1 3.921 0.030 . 1 . . . . 7 GLY HA2 . 11327 1
2 . 1 1 7 7 GLY HA3 H 1 3.921 0.030 . 1 . . . . 7 GLY HA3 . 11327 1
3 . 1 1 7 7 GLY C C 13 173.480 0.300 . 1 . . . . 7 GLY C . 11327 1
4 . 1 1 7 7 GLY CA C 13 45.064 0.300 . 1 . . . . 7 GLY CA . 11327 1
5 . 1 1 8 8 HIS H H 1 8.125 0.030 . 1 . . . . 8 HIS H . 11327 1
6 . 1 1 8 8 HIS HA H 1 4.805 0.030 . 1 . . . . 8 HIS HA . 11327 1
7 . 1 1 8 8 HIS HB2 H 1 2.995 0.030 . 2 . . . . 8 HIS HB2 . 11327 1
8 . 1 1 8 8 HIS HB3 H 1 3.100 0.030 . 2 . . . . 8 HIS HB3 . 11327 1
9 . 1 1 8 8 HIS HD2 H 1 7.188 0.030 . 1 . . . . 8 HIS HD2 . 11327 1
10 . 1 1 8 8 HIS HE1 H 1 7.954 0.030 . 1 . . . . 8 HIS HE1 . 11327 1
11 . 1 1 8 8 HIS C C 13 173.586 0.300 . 1 . . . . 8 HIS C . 11327 1
12 . 1 1 8 8 HIS CA C 13 54.624 0.300 . 1 . . . . 8 HIS CA . 11327 1
13 . 1 1 8 8 HIS CB C 13 30.907 0.300 . 1 . . . . 8 HIS CB . 11327 1
14 . 1 1 8 8 HIS CD2 C 13 121.245 0.300 . 1 . . . . 8 HIS CD2 . 11327 1
15 . 1 1 8 8 HIS CE1 C 13 138.556 0.300 . 1 . . . . 8 HIS CE1 . 11327 1
16 . 1 1 8 8 HIS N N 15 121.217 0.300 . 1 . . . . 8 HIS N . 11327 1
17 . 1 1 9 9 PRO HA H 1 4.454 0.030 . 1 . . . . 9 PRO HA . 11327 1
18 . 1 1 9 9 PRO HB2 H 1 1.912 0.030 . 2 . . . . 9 PRO HB2 . 11327 1
19 . 1 1 9 9 PRO HB3 H 1 2.306 0.030 . 2 . . . . 9 PRO HB3 . 11327 1
20 . 1 1 9 9 PRO HD2 H 1 3.765 0.030 . 2 . . . . 9 PRO HD2 . 11327 1
21 . 1 1 9 9 PRO HD3 H 1 3.430 0.030 . 2 . . . . 9 PRO HD3 . 11327 1
22 . 1 1 9 9 PRO HG2 H 1 2.012 0.030 . 1 . . . . 9 PRO HG2 . 11327 1
23 . 1 1 9 9 PRO HG3 H 1 2.012 0.030 . 1 . . . . 9 PRO HG3 . 11327 1
24 . 1 1 9 9 PRO C C 13 175.926 0.300 . 1 . . . . 9 PRO C . 11327 1
25 . 1 1 9 9 PRO CA C 13 63.336 0.300 . 1 . . . . 9 PRO CA . 11327 1
26 . 1 1 9 9 PRO CB C 13 32.151 0.300 . 1 . . . . 9 PRO CB . 11327 1
27 . 1 1 9 9 PRO CD C 13 50.718 0.300 . 1 . . . . 9 PRO CD . 11327 1
28 . 1 1 9 9 PRO CG C 13 27.402 0.300 . 1 . . . . 9 PRO CG . 11327 1
29 . 1 1 10 10 MET H H 1 8.305 0.030 . 1 . . . . 10 MET H . 11327 1
30 . 1 1 10 10 MET HA H 1 5.282 0.030 . 1 . . . . 10 MET HA . 11327 1
31 . 1 1 10 10 MET HB2 H 1 1.834 0.030 . 2 . . . . 10 MET HB2 . 11327 1
32 . 1 1 10 10 MET HB3 H 1 2.111 0.030 . 2 . . . . 10 MET HB3 . 11327 1
33 . 1 1 10 10 MET HE1 H 1 1.938 0.030 . 1 . . . . 10 MET HE . 11327 1
34 . 1 1 10 10 MET HE2 H 1 1.938 0.030 . 1 . . . . 10 MET HE . 11327 1
35 . 1 1 10 10 MET HE3 H 1 1.938 0.030 . 1 . . . . 10 MET HE . 11327 1
36 . 1 1 10 10 MET HG2 H 1 2.715 0.030 . 1 . . . . 10 MET HG2 . 11327 1
37 . 1 1 10 10 MET HG3 H 1 2.715 0.030 . 1 . . . . 10 MET HG3 . 11327 1
38 . 1 1 10 10 MET C C 13 176.375 0.300 . 1 . . . . 10 MET C . 11327 1
39 . 1 1 10 10 MET CA C 13 52.581 0.300 . 1 . . . . 10 MET CA . 11327 1
40 . 1 1 10 10 MET CB C 13 32.887 0.300 . 1 . . . . 10 MET CB . 11327 1
41 . 1 1 10 10 MET CE C 13 16.674 0.300 . 1 . . . . 10 MET CE . 11327 1
42 . 1 1 10 10 MET CG C 13 32.329 0.300 . 1 . . . . 10 MET CG . 11327 1
43 . 1 1 10 10 MET N N 15 120.246 0.300 . 1 . . . . 10 MET N . 11327 1
44 . 1 1 11 11 CYS H H 1 8.760 0.030 . 1 . . . . 11 CYS H . 11327 1
45 . 1 1 11 11 CYS HA H 1 4.063 0.030 . 1 . . . . 11 CYS HA . 11327 1
46 . 1 1 11 11 CYS HB2 H 1 3.692 0.030 . 2 . . . . 11 CYS HB2 . 11327 1
47 . 1 1 11 11 CYS HB3 H 1 2.742 0.030 . 2 . . . . 11 CYS HB3 . 11327 1
48 . 1 1 11 11 CYS C C 13 176.027 0.300 . 1 . . . . 11 CYS C . 11327 1
49 . 1 1 11 11 CYS CA C 13 60.529 0.300 . 1 . . . . 11 CYS CA . 11327 1
50 . 1 1 11 11 CYS CB C 13 28.493 0.300 . 1 . . . . 11 CYS CB . 11327 1
51 . 1 1 11 11 CYS N N 15 125.140 0.300 . 1 . . . . 11 CYS N . 11327 1
52 . 1 1 12 12 LYS H H 1 8.490 0.030 . 1 . . . . 12 LYS H . 11327 1
53 . 1 1 12 12 LYS HA H 1 4.094 0.030 . 1 . . . . 12 LYS HA . 11327 1
54 . 1 1 12 12 LYS HB2 H 1 1.882 0.030 . 1 . . . . 12 LYS HB2 . 11327 1
55 . 1 1 12 12 LYS HB3 H 1 1.882 0.030 . 1 . . . . 12 LYS HB3 . 11327 1
56 . 1 1 12 12 LYS HD2 H 1 1.727 0.030 . 1 . . . . 12 LYS HD2 . 11327 1
57 . 1 1 12 12 LYS HD3 H 1 1.727 0.030 . 1 . . . . 12 LYS HD3 . 11327 1
58 . 1 1 12 12 LYS HE2 H 1 3.028 0.030 . 1 . . . . 12 LYS HE2 . 11327 1
59 . 1 1 12 12 LYS HE3 H 1 3.028 0.030 . 1 . . . . 12 LYS HE3 . 11327 1
60 . 1 1 12 12 LYS HG2 H 1 1.510 0.030 . 2 . . . . 12 LYS HG2 . 11327 1
61 . 1 1 12 12 LYS HG3 H 1 1.569 0.030 . 2 . . . . 12 LYS HG3 . 11327 1
62 . 1 1 12 12 LYS C C 13 177.514 0.300 . 1 . . . . 12 LYS C . 11327 1
63 . 1 1 12 12 LYS CA C 13 58.508 0.300 . 1 . . . . 12 LYS CA . 11327 1
64 . 1 1 12 12 LYS CB C 13 32.660 0.300 . 1 . . . . 12 LYS CB . 11327 1
65 . 1 1 12 12 LYS CD C 13 28.968 0.300 . 1 . . . . 12 LYS CD . 11327 1
66 . 1 1 12 12 LYS CE C 13 41.853 0.300 . 1 . . . . 12 LYS CE . 11327 1
67 . 1 1 12 12 LYS CG C 13 25.159 0.300 . 1 . . . . 12 LYS CG . 11327 1
68 . 1 1 12 12 LYS N N 15 127.057 0.300 . 1 . . . . 12 LYS N . 11327 1
69 . 1 1 13 13 GLU H H 1 8.942 0.030 . 1 . . . . 13 GLU H . 11327 1
70 . 1 1 13 13 GLU HA H 1 4.149 0.030 . 1 . . . . 13 GLU HA . 11327 1
71 . 1 1 13 13 GLU HB2 H 1 1.467 0.030 . 2 . . . . 13 GLU HB2 . 11327 1
72 . 1 1 13 13 GLU HB3 H 1 1.575 0.030 . 2 . . . . 13 GLU HB3 . 11327 1
73 . 1 1 13 13 GLU HG2 H 1 1.826 0.030 . 2 . . . . 13 GLU HG2 . 11327 1
74 . 1 1 13 13 GLU HG3 H 1 1.935 0.030 . 2 . . . . 13 GLU HG3 . 11327 1
75 . 1 1 13 13 GLU C C 13 176.251 0.300 . 1 . . . . 13 GLU C . 11327 1
76 . 1 1 13 13 GLU CA C 13 57.026 0.300 . 1 . . . . 13 GLU CA . 11327 1
77 . 1 1 13 13 GLU CB C 13 30.667 0.300 . 1 . . . . 13 GLU CB . 11327 1
78 . 1 1 13 13 GLU CG C 13 35.511 0.300 . 1 . . . . 13 GLU CG . 11327 1
79 . 1 1 13 13 GLU N N 15 121.302 0.300 . 1 . . . . 13 GLU N . 11327 1
80 . 1 1 14 14 HIS H H 1 8.020 0.030 . 1 . . . . 14 HIS H . 11327 1
81 . 1 1 14 14 HIS HA H 1 4.691 0.030 . 1 . . . . 14 HIS HA . 11327 1
82 . 1 1 14 14 HIS HB2 H 1 3.475 0.030 . 2 . . . . 14 HIS HB2 . 11327 1
83 . 1 1 14 14 HIS HB3 H 1 3.131 0.030 . 2 . . . . 14 HIS HB3 . 11327 1
84 . 1 1 14 14 HIS HD2 H 1 7.269 0.030 . 1 . . . . 14 HIS HD2 . 11327 1
85 . 1 1 14 14 HIS HE1 H 1 8.084 0.030 . 1 . . . . 14 HIS HE1 . 11327 1
86 . 1 1 14 14 HIS C C 13 174.329 0.300 . 1 . . . . 14 HIS C . 11327 1
87 . 1 1 14 14 HIS CA C 13 56.269 0.300 . 1 . . . . 14 HIS CA . 11327 1
88 . 1 1 14 14 HIS CB C 13 29.928 0.300 . 1 . . . . 14 HIS CB . 11327 1
89 . 1 1 14 14 HIS CD2 C 13 119.236 0.300 . 1 . . . . 14 HIS CD2 . 11327 1
90 . 1 1 14 14 HIS CE1 C 13 138.554 0.300 . 1 . . . . 14 HIS CE1 . 11327 1
91 . 1 1 14 14 HIS N N 15 122.943 0.300 . 1 . . . . 14 HIS N . 11327 1
92 . 1 1 15 15 GLU H H 1 8.127 0.030 . 1 . . . . 15 GLU H . 11327 1
93 . 1 1 15 15 GLU HA H 1 4.326 0.030 . 1 . . . . 15 GLU HA . 11327 1
94 . 1 1 15 15 GLU HB2 H 1 1.976 0.030 . 2 . . . . 15 GLU HB2 . 11327 1
95 . 1 1 15 15 GLU HB3 H 1 2.043 0.030 . 2 . . . . 15 GLU HB3 . 11327 1
96 . 1 1 15 15 GLU HG2 H 1 2.236 0.030 . 1 . . . . 15 GLU HG2 . 11327 1
97 . 1 1 15 15 GLU HG3 H 1 2.236 0.030 . 1 . . . . 15 GLU HG3 . 11327 1
98 . 1 1 15 15 GLU C C 13 176.097 0.300 . 1 . . . . 15 GLU C . 11327 1
99 . 1 1 15 15 GLU CA C 13 58.965 0.300 . 1 . . . . 15 GLU CA . 11327 1
100 . 1 1 15 15 GLU CB C 13 29.600 0.300 . 1 . . . . 15 GLU CB . 11327 1
101 . 1 1 15 15 GLU CG C 13 36.377 0.300 . 1 . . . . 15 GLU CG . 11327 1
102 . 1 1 15 15 GLU N N 15 118.420 0.300 . 1 . . . . 15 GLU N . 11327 1
103 . 1 1 16 16 ASP H H 1 8.585 0.030 . 1 . . . . 16 ASP H . 11327 1
104 . 1 1 16 16 ASP HA H 1 4.707 0.030 . 1 . . . . 16 ASP HA . 11327 1
105 . 1 1 16 16 ASP HB2 H 1 2.720 0.030 . 1 . . . . 16 ASP HB2 . 11327 1
106 . 1 1 16 16 ASP HB3 H 1 2.720 0.030 . 1 . . . . 16 ASP HB3 . 11327 1
107 . 1 1 16 16 ASP C C 13 175.715 0.300 . 1 . . . . 16 ASP C . 11327 1
108 . 1 1 16 16 ASP CA C 13 53.568 0.300 . 1 . . . . 16 ASP CA . 11327 1
109 . 1 1 16 16 ASP CB C 13 41.128 0.300 . 1 . . . . 16 ASP CB . 11327 1
110 . 1 1 16 16 ASP N N 15 116.218 0.300 . 1 . . . . 16 ASP N . 11327 1
111 . 1 1 17 17 GLU H H 1 8.563 0.030 . 1 . . . . 17 GLU H . 11327 1
112 . 1 1 17 17 GLU HA H 1 4.659 0.030 . 1 . . . . 17 GLU HA . 11327 1
113 . 1 1 17 17 GLU HB2 H 1 2.163 0.030 . 2 . . . . 17 GLU HB2 . 11327 1
114 . 1 1 17 17 GLU HB3 H 1 2.347 0.030 . 2 . . . . 17 GLU HB3 . 11327 1
115 . 1 1 17 17 GLU HG2 H 1 2.177 0.030 . 1 . . . . 17 GLU HG2 . 11327 1
116 . 1 1 17 17 GLU HG3 H 1 2.177 0.030 . 1 . . . . 17 GLU HG3 . 11327 1
117 . 1 1 17 17 GLU C C 13 174.731 0.300 . 1 . . . . 17 GLU C . 11327 1
118 . 1 1 17 17 GLU CA C 13 54.430 0.300 . 1 . . . . 17 GLU CA . 11327 1
119 . 1 1 17 17 GLU CB C 13 31.833 0.300 . 1 . . . . 17 GLU CB . 11327 1
120 . 1 1 17 17 GLU CG C 13 34.721 0.300 . 1 . . . . 17 GLU CG . 11327 1
121 . 1 1 17 17 GLU N N 15 123.096 0.300 . 1 . . . . 17 GLU N . 11327 1
122 . 1 1 18 18 LYS H H 1 8.414 0.030 . 1 . . . . 18 LYS H . 11327 1
123 . 1 1 18 18 LYS HA H 1 4.759 0.030 . 1 . . . . 18 LYS HA . 11327 1
124 . 1 1 18 18 LYS HB2 H 1 1.680 0.030 . 2 . . . . 18 LYS HB2 . 11327 1
125 . 1 1 18 18 LYS HB3 H 1 1.610 0.030 . 2 . . . . 18 LYS HB3 . 11327 1
126 . 1 1 18 18 LYS HD2 H 1 1.470 0.030 . 1 . . . . 18 LYS HD2 . 11327 1
127 . 1 1 18 18 LYS HD3 H 1 1.470 0.030 . 1 . . . . 18 LYS HD3 . 11327 1
128 . 1 1 18 18 LYS HE2 H 1 2.844 0.030 . 1 . . . . 18 LYS HE2 . 11327 1
129 . 1 1 18 18 LYS HE3 H 1 2.844 0.030 . 1 . . . . 18 LYS HE3 . 11327 1
130 . 1 1 18 18 LYS HG2 H 1 1.509 0.030 . 2 . . . . 18 LYS HG2 . 11327 1
131 . 1 1 18 18 LYS HG3 H 1 1.568 0.030 . 2 . . . . 18 LYS HG3 . 11327 1
132 . 1 1 18 18 LYS C C 13 176.878 0.300 . 1 . . . . 18 LYS C . 11327 1
133 . 1 1 18 18 LYS CA C 13 56.513 0.300 . 1 . . . . 18 LYS CA . 11327 1
134 . 1 1 18 18 LYS CB C 13 33.691 0.300 . 1 . . . . 18 LYS CB . 11327 1
135 . 1 1 18 18 LYS CD C 13 29.397 0.300 . 1 . . . . 18 LYS CD . 11327 1
136 . 1 1 18 18 LYS CE C 13 41.796 0.300 . 1 . . . . 18 LYS CE . 11327 1
137 . 1 1 18 18 LYS CG C 13 25.229 0.300 . 1 . . . . 18 LYS CG . 11327 1
138 . 1 1 18 18 LYS N N 15 124.241 0.300 . 1 . . . . 18 LYS N . 11327 1
139 . 1 1 19 19 ILE H H 1 7.920 0.030 . 1 . . . . 19 ILE H . 11327 1
140 . 1 1 19 19 ILE HA H 1 3.867 0.030 . 1 . . . . 19 ILE HA . 11327 1
141 . 1 1 19 19 ILE HB H 1 1.891 0.030 . 1 . . . . 19 ILE HB . 11327 1
142 . 1 1 19 19 ILE HD11 H 1 0.712 0.030 . 1 . . . . 19 ILE HD1 . 11327 1
143 . 1 1 19 19 ILE HD12 H 1 0.712 0.030 . 1 . . . . 19 ILE HD1 . 11327 1
144 . 1 1 19 19 ILE HD13 H 1 0.712 0.030 . 1 . . . . 19 ILE HD1 . 11327 1
145 . 1 1 19 19 ILE HG12 H 1 1.098 0.030 . 2 . . . . 19 ILE HG12 . 11327 1
146 . 1 1 19 19 ILE HG13 H 1 1.389 0.030 . 2 . . . . 19 ILE HG13 . 11327 1
147 . 1 1 19 19 ILE HG21 H 1 0.984 0.030 . 1 . . . . 19 ILE HG2 . 11327 1
148 . 1 1 19 19 ILE HG22 H 1 0.984 0.030 . 1 . . . . 19 ILE HG2 . 11327 1
149 . 1 1 19 19 ILE HG23 H 1 0.984 0.030 . 1 . . . . 19 ILE HG2 . 11327 1
150 . 1 1 19 19 ILE C C 13 176.814 0.300 . 1 . . . . 19 ILE C . 11327 1
151 . 1 1 19 19 ILE CA C 13 60.444 0.300 . 1 . . . . 19 ILE CA . 11327 1
152 . 1 1 19 19 ILE CB C 13 35.626 0.300 . 1 . . . . 19 ILE CB . 11327 1
153 . 1 1 19 19 ILE CD1 C 13 10.655 0.300 . 1 . . . . 19 ILE CD1 . 11327 1
154 . 1 1 19 19 ILE CG1 C 13 26.933 0.300 . 1 . . . . 19 ILE CG1 . 11327 1
155 . 1 1 19 19 ILE CG2 C 13 17.560 0.300 . 1 . . . . 19 ILE CG2 . 11327 1
156 . 1 1 19 19 ILE N N 15 119.821 0.300 . 1 . . . . 19 ILE N . 11327 1
157 . 1 1 20 20 ASN H H 1 8.158 0.030 . 1 . . . . 20 ASN H . 11327 1
158 . 1 1 20 20 ASN HA H 1 4.790 0.030 . 1 . . . . 20 ASN HA . 11327 1
159 . 1 1 20 20 ASN HB2 H 1 2.634 0.030 . 2 . . . . 20 ASN HB2 . 11327 1
160 . 1 1 20 20 ASN HB3 H 1 3.181 0.030 . 2 . . . . 20 ASN HB3 . 11327 1
161 . 1 1 20 20 ASN HD21 H 1 7.530 0.030 . 2 . . . . 20 ASN HD21 . 11327 1
162 . 1 1 20 20 ASN HD22 H 1 6.935 0.030 . 2 . . . . 20 ASN HD22 . 11327 1
163 . 1 1 20 20 ASN C C 13 175.202 0.300 . 1 . . . . 20 ASN C . 11327 1
164 . 1 1 20 20 ASN CA C 13 52.781 0.300 . 1 . . . . 20 ASN CA . 11327 1
165 . 1 1 20 20 ASN CB C 13 38.893 0.300 . 1 . . . . 20 ASN CB . 11327 1
166 . 1 1 20 20 ASN N N 15 125.795 0.300 . 1 . . . . 20 ASN N . 11327 1
167 . 1 1 21 21 ILE H H 1 8.540 0.030 . 1 . . . . 21 ILE H . 11327 1
168 . 1 1 21 21 ILE HA H 1 4.904 0.030 . 1 . . . . 21 ILE HA . 11327 1
169 . 1 1 21 21 ILE HB H 1 1.774 0.030 . 1 . . . . 21 ILE HB . 11327 1
170 . 1 1 21 21 ILE HD11 H 1 0.527 0.030 . 1 . . . . 21 ILE HD1 . 11327 1
171 . 1 1 21 21 ILE HD12 H 1 0.527 0.030 . 1 . . . . 21 ILE HD1 . 11327 1
172 . 1 1 21 21 ILE HD13 H 1 0.527 0.030 . 1 . . . . 21 ILE HD1 . 11327 1
173 . 1 1 21 21 ILE HG12 H 1 0.946 0.030 . 1 . . . . 21 ILE HG12 . 11327 1
174 . 1 1 21 21 ILE HG13 H 1 0.946 0.030 . 1 . . . . 21 ILE HG13 . 11327 1
175 . 1 1 21 21 ILE HG21 H 1 0.900 0.030 . 1 . . . . 21 ILE HG2 . 11327 1
176 . 1 1 21 21 ILE HG22 H 1 0.900 0.030 . 1 . . . . 21 ILE HG2 . 11327 1
177 . 1 1 21 21 ILE HG23 H 1 0.900 0.030 . 1 . . . . 21 ILE HG2 . 11327 1
178 . 1 1 21 21 ILE C C 13 172.360 0.300 . 1 . . . . 21 ILE C . 11327 1
179 . 1 1 21 21 ILE CA C 13 59.674 0.300 . 1 . . . . 21 ILE CA . 11327 1
180 . 1 1 21 21 ILE CB C 13 43.331 0.300 . 1 . . . . 21 ILE CB . 11327 1
181 . 1 1 21 21 ILE CD1 C 13 14.415 0.300 . 1 . . . . 21 ILE CD1 . 11327 1
182 . 1 1 21 21 ILE CG1 C 13 26.412 0.300 . 1 . . . . 21 ILE CG1 . 11327 1
183 . 1 1 21 21 ILE CG2 C 13 19.284 0.300 . 1 . . . . 21 ILE CG2 . 11327 1
184 . 1 1 21 21 ILE N N 15 117.108 0.300 . 1 . . . . 21 ILE N . 11327 1
185 . 1 1 22 22 TYR H H 1 9.498 0.030 . 1 . . . . 22 TYR H . 11327 1
186 . 1 1 22 22 TYR HA H 1 4.642 0.030 . 1 . . . . 22 TYR HA . 11327 1
187 . 1 1 22 22 TYR HB2 H 1 2.576 0.030 . 2 . . . . 22 TYR HB2 . 11327 1
188 . 1 1 22 22 TYR HB3 H 1 2.681 0.030 . 2 . . . . 22 TYR HB3 . 11327 1
189 . 1 1 22 22 TYR HD1 H 1 6.576 0.030 . 1 . . . . 22 TYR HD1 . 11327 1
190 . 1 1 22 22 TYR HD2 H 1 6.576 0.030 . 1 . . . . 22 TYR HD2 . 11327 1
191 . 1 1 22 22 TYR HE1 H 1 6.600 0.030 . 1 . . . . 22 TYR HE1 . 11327 1
192 . 1 1 22 22 TYR HE2 H 1 6.600 0.030 . 1 . . . . 22 TYR HE2 . 11327 1
193 . 1 1 22 22 TYR C C 13 173.660 0.300 . 1 . . . . 22 TYR C . 11327 1
194 . 1 1 22 22 TYR CA C 13 57.148 0.300 . 1 . . . . 22 TYR CA . 11327 1
195 . 1 1 22 22 TYR CB C 13 42.468 0.300 . 1 . . . . 22 TYR CB . 11327 1
196 . 1 1 22 22 TYR CD1 C 13 132.329 0.300 . 1 . . . . 22 TYR CD1 . 11327 1
197 . 1 1 22 22 TYR CD2 C 13 132.329 0.300 . 1 . . . . 22 TYR CD2 . 11327 1
198 . 1 1 22 22 TYR CE1 C 13 117.556 0.300 . 1 . . . . 22 TYR CE1 . 11327 1
199 . 1 1 22 22 TYR CE2 C 13 117.556 0.300 . 1 . . . . 22 TYR CE2 . 11327 1
200 . 1 1 22 22 TYR N N 15 122.953 0.300 . 1 . . . . 22 TYR N . 11327 1
201 . 1 1 23 23 CYS H H 1 8.438 0.030 . 1 . . . . 23 CYS H . 11327 1
202 . 1 1 23 23 CYS HA H 1 4.523 0.030 . 1 . . . . 23 CYS HA . 11327 1
203 . 1 1 23 23 CYS HB2 H 1 2.635 0.030 . 2 . . . . 23 CYS HB2 . 11327 1
204 . 1 1 23 23 CYS HB3 H 1 1.662 0.030 . 2 . . . . 23 CYS HB3 . 11327 1
205 . 1 1 23 23 CYS C C 13 175.994 0.300 . 1 . . . . 23 CYS C . 11327 1
206 . 1 1 23 23 CYS CA C 13 59.702 0.300 . 1 . . . . 23 CYS CA . 11327 1
207 . 1 1 23 23 CYS CB C 13 28.330 0.300 . 1 . . . . 23 CYS CB . 11327 1
208 . 1 1 23 23 CYS N N 15 129.171 0.300 . 1 . . . . 23 CYS N . 11327 1
209 . 1 1 24 24 LEU H H 1 9.094 0.030 . 1 . . . . 24 LEU H . 11327 1
210 . 1 1 24 24 LEU HA H 1 4.083 0.030 . 1 . . . . 24 LEU HA . 11327 1
211 . 1 1 24 24 LEU HB2 H 1 1.693 0.030 . 2 . . . . 24 LEU HB2 . 11327 1
212 . 1 1 24 24 LEU HB3 H 1 1.566 0.030 . 2 . . . . 24 LEU HB3 . 11327 1
213 . 1 1 24 24 LEU HD11 H 1 0.976 0.030 . 1 . . . . 24 LEU HD1 . 11327 1
214 . 1 1 24 24 LEU HD12 H 1 0.976 0.030 . 1 . . . . 24 LEU HD1 . 11327 1
215 . 1 1 24 24 LEU HD13 H 1 0.976 0.030 . 1 . . . . 24 LEU HD1 . 11327 1
216 . 1 1 24 24 LEU HD21 H 1 0.889 0.030 . 1 . . . . 24 LEU HD2 . 11327 1
217 . 1 1 24 24 LEU HD22 H 1 0.889 0.030 . 1 . . . . 24 LEU HD2 . 11327 1
218 . 1 1 24 24 LEU HD23 H 1 0.889 0.030 . 1 . . . . 24 LEU HD2 . 11327 1
219 . 1 1 24 24 LEU HG H 1 1.697 0.030 . 1 . . . . 24 LEU HG . 11327 1
220 . 1 1 24 24 LEU C C 13 178.463 0.300 . 1 . . . . 24 LEU C . 11327 1
221 . 1 1 24 24 LEU CA C 13 57.242 0.300 . 1 . . . . 24 LEU CA . 11327 1
222 . 1 1 24 24 LEU CB C 13 42.035 0.300 . 1 . . . . 24 LEU CB . 11327 1
223 . 1 1 24 24 LEU CD1 C 13 23.539 0.300 . 2 . . . . 24 LEU CD1 . 11327 1
224 . 1 1 24 24 LEU CD2 C 13 26.002 0.300 . 2 . . . . 24 LEU CD2 . 11327 1
225 . 1 1 24 24 LEU CG C 13 27.842 0.300 . 1 . . . . 24 LEU CG . 11327 1
226 . 1 1 24 24 LEU N N 15 130.074 0.300 . 1 . . . . 24 LEU N . 11327 1
227 . 1 1 25 25 THR H H 1 8.285 0.030 . 1 . . . . 25 THR H . 11327 1
228 . 1 1 25 25 THR HA H 1 4.002 0.030 . 1 . . . . 25 THR HA . 11327 1
229 . 1 1 25 25 THR HB H 1 4.339 0.030 . 1 . . . . 25 THR HB . 11327 1
230 . 1 1 25 25 THR HG21 H 1 1.402 0.030 . 1 . . . . 25 THR HG2 . 11327 1
231 . 1 1 25 25 THR HG22 H 1 1.402 0.030 . 1 . . . . 25 THR HG2 . 11327 1
232 . 1 1 25 25 THR HG23 H 1 1.402 0.030 . 1 . . . . 25 THR HG2 . 11327 1
233 . 1 1 25 25 THR C C 13 176.631 0.300 . 1 . . . . 25 THR C . 11327 1
234 . 1 1 25 25 THR CA C 13 67.168 0.300 . 1 . . . . 25 THR CA . 11327 1
235 . 1 1 25 25 THR CB C 13 70.416 0.300 . 1 . . . . 25 THR CB . 11327 1
236 . 1 1 25 25 THR CG2 C 13 23.289 0.300 . 1 . . . . 25 THR CG2 . 11327 1
237 . 1 1 25 25 THR N N 15 120.858 0.300 . 1 . . . . 25 THR N . 11327 1
238 . 1 1 26 26 CYS H H 1 10.188 0.030 . 1 . . . . 26 CYS H . 11327 1
239 . 1 1 26 26 CYS HA H 1 4.056 0.030 . 1 . . . . 26 CYS HA . 11327 1
240 . 1 1 26 26 CYS HB2 H 1 3.187 0.030 . 2 . . . . 26 CYS HB2 . 11327 1
241 . 1 1 26 26 CYS HB3 H 1 2.765 0.030 . 2 . . . . 26 CYS HB3 . 11327 1
242 . 1 1 26 26 CYS C C 13 174.807 0.300 . 1 . . . . 26 CYS C . 11327 1
243 . 1 1 26 26 CYS CA C 13 61.282 0.300 . 1 . . . . 26 CYS CA . 11327 1
244 . 1 1 26 26 CYS CB C 13 32.019 0.300 . 1 . . . . 26 CYS CB . 11327 1
245 . 1 1 26 26 CYS N N 15 124.286 0.300 . 1 . . . . 26 CYS N . 11327 1
246 . 1 1 27 27 GLU H H 1 7.770 0.030 . 1 . . . . 27 GLU H . 11327 1
247 . 1 1 27 27 GLU HA H 1 3.761 0.030 . 1 . . . . 27 GLU HA . 11327 1
248 . 1 1 27 27 GLU HB2 H 1 2.288 0.030 . 2 . . . . 27 GLU HB2 . 11327 1
249 . 1 1 27 27 GLU HB3 H 1 2.121 0.030 . 2 . . . . 27 GLU HB3 . 11327 1
250 . 1 1 27 27 GLU HG2 H 1 2.146 0.030 . 1 . . . . 27 GLU HG2 . 11327 1
251 . 1 1 27 27 GLU HG3 H 1 2.146 0.030 . 1 . . . . 27 GLU HG3 . 11327 1
252 . 1 1 27 27 GLU C C 13 175.349 0.300 . 1 . . . . 27 GLU C . 11327 1
253 . 1 1 27 27 GLU CA C 13 57.117 0.300 . 1 . . . . 27 GLU CA . 11327 1
254 . 1 1 27 27 GLU CB C 13 26.597 0.300 . 1 . . . . 27 GLU CB . 11327 1
255 . 1 1 27 27 GLU CG C 13 36.863 0.300 . 1 . . . . 27 GLU CG . 11327 1
256 . 1 1 27 27 GLU N N 15 117.453 0.300 . 1 . . . . 27 GLU N . 11327 1
257 . 1 1 28 28 VAL H H 1 6.745 0.030 . 1 . . . . 28 VAL H . 11327 1
258 . 1 1 28 28 VAL HA H 1 4.916 0.030 . 1 . . . . 28 VAL HA . 11327 1
259 . 1 1 28 28 VAL HB H 1 2.049 0.030 . 1 . . . . 28 VAL HB . 11327 1
260 . 1 1 28 28 VAL HG11 H 1 0.848 0.030 . 1 . . . . 28 VAL HG1 . 11327 1
261 . 1 1 28 28 VAL HG12 H 1 0.848 0.030 . 1 . . . . 28 VAL HG1 . 11327 1
262 . 1 1 28 28 VAL HG13 H 1 0.848 0.030 . 1 . . . . 28 VAL HG1 . 11327 1
263 . 1 1 28 28 VAL HG21 H 1 0.772 0.030 . 1 . . . . 28 VAL HG2 . 11327 1
264 . 1 1 28 28 VAL HG22 H 1 0.772 0.030 . 1 . . . . 28 VAL HG2 . 11327 1
265 . 1 1 28 28 VAL HG23 H 1 0.772 0.030 . 1 . . . . 28 VAL HG2 . 11327 1
266 . 1 1 28 28 VAL C C 13 171.982 0.300 . 1 . . . . 28 VAL C . 11327 1
267 . 1 1 28 28 VAL CA C 13 57.592 0.300 . 1 . . . . 28 VAL CA . 11327 1
268 . 1 1 28 28 VAL CB C 13 35.341 0.300 . 1 . . . . 28 VAL CB . 11327 1
269 . 1 1 28 28 VAL CG1 C 13 21.860 0.300 . 2 . . . . 28 VAL CG1 . 11327 1
270 . 1 1 28 28 VAL CG2 C 13 19.246 0.300 . 2 . . . . 28 VAL CG2 . 11327 1
271 . 1 1 28 28 VAL N N 15 111.105 0.300 . 1 . . . . 28 VAL N . 11327 1
272 . 1 1 29 29 PRO HA H 1 4.982 0.030 . 1 . . . . 29 PRO HA . 11327 1
273 . 1 1 29 29 PRO HB2 H 1 2.300 0.030 . 2 . . . . 29 PRO HB2 . 11327 1
274 . 1 1 29 29 PRO HB3 H 1 1.982 0.030 . 2 . . . . 29 PRO HB3 . 11327 1
275 . 1 1 29 29 PRO HD2 H 1 3.733 0.030 . 2 . . . . 29 PRO HD2 . 11327 1
276 . 1 1 29 29 PRO HD3 H 1 4.000 0.030 . 2 . . . . 29 PRO HD3 . 11327 1
277 . 1 1 29 29 PRO HG2 H 1 2.023 0.030 . 2 . . . . 29 PRO HG2 . 11327 1
278 . 1 1 29 29 PRO HG3 H 1 2.240 0.030 . 2 . . . . 29 PRO HG3 . 11327 1
279 . 1 1 29 29 PRO C C 13 175.889 0.300 . 1 . . . . 29 PRO C . 11327 1
280 . 1 1 29 29 PRO CA C 13 62.052 0.300 . 1 . . . . 29 PRO CA . 11327 1
281 . 1 1 29 29 PRO CB C 13 32.483 0.300 . 1 . . . . 29 PRO CB . 11327 1
282 . 1 1 29 29 PRO CD C 13 51.503 0.300 . 1 . . . . 29 PRO CD . 11327 1
283 . 1 1 29 29 PRO CG C 13 27.816 0.300 . 1 . . . . 29 PRO CG . 11327 1
284 . 1 1 30 30 THR H H 1 9.170 0.030 . 1 . . . . 30 THR H . 11327 1
285 . 1 1 30 30 THR HA H 1 4.826 0.030 . 1 . . . . 30 THR HA . 11327 1
286 . 1 1 30 30 THR HB H 1 3.830 0.030 . 1 . . . . 30 THR HB . 11327 1
287 . 1 1 30 30 THR HG21 H 1 0.487 0.030 . 1 . . . . 30 THR HG2 . 11327 1
288 . 1 1 30 30 THR HG22 H 1 0.487 0.030 . 1 . . . . 30 THR HG2 . 11327 1
289 . 1 1 30 30 THR HG23 H 1 0.487 0.030 . 1 . . . . 30 THR HG2 . 11327 1
290 . 1 1 30 30 THR C C 13 171.287 0.300 . 1 . . . . 30 THR C . 11327 1
291 . 1 1 30 30 THR CA C 13 59.825 0.300 . 1 . . . . 30 THR CA . 11327 1
292 . 1 1 30 30 THR CB C 13 68.559 0.300 . 1 . . . . 30 THR CB . 11327 1
293 . 1 1 30 30 THR CG2 C 13 17.038 0.300 . 1 . . . . 30 THR CG2 . 11327 1
294 . 1 1 30 30 THR N N 15 120.186 0.300 . 1 . . . . 30 THR N . 11327 1
295 . 1 1 31 31 CYS H H 1 8.970 0.030 . 1 . . . . 31 CYS H . 11327 1
296 . 1 1 31 31 CYS HA H 1 6.018 0.030 . 1 . . . . 31 CYS HA . 11327 1
297 . 1 1 31 31 CYS HB2 H 1 2.660 0.030 . 2 . . . . 31 CYS HB2 . 11327 1
298 . 1 1 31 31 CYS HB3 H 1 3.867 0.030 . 2 . . . . 31 CYS HB3 . 11327 1
299 . 1 1 31 31 CYS C C 13 176.973 0.300 . 1 . . . . 31 CYS C . 11327 1
300 . 1 1 31 31 CYS CA C 13 54.950 0.300 . 1 . . . . 31 CYS CA . 11327 1
301 . 1 1 31 31 CYS CB C 13 35.838 0.300 . 1 . . . . 31 CYS CB . 11327 1
302 . 1 1 31 31 CYS N N 15 121.919 0.300 . 1 . . . . 31 CYS N . 11327 1
303 . 1 1 32 32 SER H H 1 9.455 0.030 . 1 . . . . 32 SER H . 11327 1
304 . 1 1 32 32 SER HA H 1 3.503 0.030 . 1 . . . . 32 SER HA . 11327 1
305 . 1 1 32 32 SER HB2 H 1 3.768 0.030 . 2 . . . . 32 SER HB2 . 11327 1
306 . 1 1 32 32 SER HB3 H 1 3.971 0.030 . 2 . . . . 32 SER HB3 . 11327 1
307 . 1 1 32 32 SER CA C 13 62.304 0.300 . 1 . . . . 32 SER CA . 11327 1
308 . 1 1 32 32 SER CB C 13 62.304 0.300 . 1 . . . . 32 SER CB . 11327 1
309 . 1 1 32 32 SER N N 15 117.052 0.300 . 1 . . . . 32 SER N . 11327 1
310 . 1 1 33 33 MET H H 1 9.054 0.030 . 1 . . . . 33 MET H . 11327 1
311 . 1 1 33 33 MET HA H 1 4.190 0.030 . 1 . . . . 33 MET HA . 11327 1
312 . 1 1 33 33 MET HB2 H 1 1.251 0.030 . 2 . . . . 33 MET HB2 . 11327 1
313 . 1 1 33 33 MET HB3 H 1 0.853 0.030 . 2 . . . . 33 MET HB3 . 11327 1
314 . 1 1 33 33 MET HE1 H 1 2.085 0.030 . 1 . . . . 33 MET HE . 11327 1
315 . 1 1 33 33 MET HE2 H 1 2.085 0.030 . 1 . . . . 33 MET HE . 11327 1
316 . 1 1 33 33 MET HE3 H 1 2.085 0.030 . 1 . . . . 33 MET HE . 11327 1
317 . 1 1 33 33 MET HG2 H 1 2.393 0.030 . 1 . . . . 33 MET HG2 . 11327 1
318 . 1 1 33 33 MET HG3 H 1 2.393 0.030 . 1 . . . . 33 MET HG3 . 11327 1
319 . 1 1 33 33 MET C C 13 179.133 0.300 . 1 . . . . 33 MET C . 11327 1
320 . 1 1 33 33 MET CA C 13 58.066 0.300 . 1 . . . . 33 MET CA . 11327 1
321 . 1 1 33 33 MET CB C 13 30.667 0.300 . 1 . . . . 33 MET CB . 11327 1
322 . 1 1 33 33 MET CE C 13 17.896 0.300 . 1 . . . . 33 MET CE . 11327 1
323 . 1 1 33 33 MET CG C 13 33.176 0.300 . 1 . . . . 33 MET CG . 11327 1
324 . 1 1 33 33 MET N N 15 126.905 0.300 . 1 . . . . 33 MET N . 11327 1
325 . 1 1 34 34 CYS H H 1 8.826 0.030 . 1 . . . . 34 CYS H . 11327 1
326 . 1 1 34 34 CYS HA H 1 4.193 0.030 . 1 . . . . 34 CYS HA . 11327 1
327 . 1 1 34 34 CYS HB2 H 1 3.009 0.030 . 2 . . . . 34 CYS HB2 . 11327 1
328 . 1 1 34 34 CYS HB3 H 1 3.965 0.030 . 2 . . . . 34 CYS HB3 . 11327 1
329 . 1 1 34 34 CYS C C 13 177.670 0.300 . 1 . . . . 34 CYS C . 11327 1
330 . 1 1 34 34 CYS CA C 13 65.946 0.300 . 1 . . . . 34 CYS CA . 11327 1
331 . 1 1 34 34 CYS CB C 13 30.266 0.300 . 1 . . . . 34 CYS CB . 11327 1
332 . 1 1 34 34 CYS N N 15 125.188 0.300 . 1 . . . . 34 CYS N . 11327 1
333 . 1 1 35 35 LYS H H 1 7.075 0.030 . 1 . . . . 35 LYS H . 11327 1
334 . 1 1 35 35 LYS HA H 1 4.041 0.030 . 1 . . . . 35 LYS HA . 11327 1
335 . 1 1 35 35 LYS HB2 H 1 1.920 0.030 . 2 . . . . 35 LYS HB2 . 11327 1
336 . 1 1 35 35 LYS HB3 H 1 1.333 0.030 . 2 . . . . 35 LYS HB3 . 11327 1
337 . 1 1 35 35 LYS HD2 H 1 2.142 0.030 . 1 . . . . 35 LYS HD2 . 11327 1
338 . 1 1 35 35 LYS HD3 H 1 2.142 0.030 . 1 . . . . 35 LYS HD3 . 11327 1
339 . 1 1 35 35 LYS HE2 H 1 2.936 0.030 . 2 . . . . 35 LYS HE2 . 11327 1
340 . 1 1 35 35 LYS HE3 H 1 2.784 0.030 . 2 . . . . 35 LYS HE3 . 11327 1
341 . 1 1 35 35 LYS HG2 H 1 1.369 0.030 . 2 . . . . 35 LYS HG2 . 11327 1
342 . 1 1 35 35 LYS HG3 H 1 2.137 0.030 . 2 . . . . 35 LYS HG3 . 11327 1
343 . 1 1 35 35 LYS C C 13 174.481 0.300 . 1 . . . . 35 LYS C . 11327 1
344 . 1 1 35 35 LYS CA C 13 56.555 0.300 . 1 . . . . 35 LYS CA . 11327 1
345 . 1 1 35 35 LYS CB C 13 31.640 0.300 . 1 . . . . 35 LYS CB . 11327 1
346 . 1 1 35 35 LYS CD C 13 28.649 0.300 . 1 . . . . 35 LYS CD . 11327 1
347 . 1 1 35 35 LYS CE C 13 42.609 0.300 . 1 . . . . 35 LYS CE . 11327 1
348 . 1 1 35 35 LYS CG C 13 28.400 0.300 . 1 . . . . 35 LYS CG . 11327 1
349 . 1 1 35 35 LYS N N 15 118.348 0.300 . 1 . . . . 35 LYS N . 11327 1
350 . 1 1 36 36 VAL H H 1 7.844 0.030 . 1 . . . . 36 VAL H . 11327 1
351 . 1 1 36 36 VAL HA H 1 3.262 0.030 . 1 . . . . 36 VAL HA . 11327 1
352 . 1 1 36 36 VAL HB H 1 1.246 0.030 . 1 . . . . 36 VAL HB . 11327 1
353 . 1 1 36 36 VAL HG11 H 1 -0.471 0.030 . 1 . . . . 36 VAL HG1 . 11327 1
354 . 1 1 36 36 VAL HG12 H 1 -0.471 0.030 . 1 . . . . 36 VAL HG1 . 11327 1
355 . 1 1 36 36 VAL HG13 H 1 -0.471 0.030 . 1 . . . . 36 VAL HG1 . 11327 1
356 . 1 1 36 36 VAL HG21 H 1 0.673 0.030 . 1 . . . . 36 VAL HG2 . 11327 1
357 . 1 1 36 36 VAL HG22 H 1 0.673 0.030 . 1 . . . . 36 VAL HG2 . 11327 1
358 . 1 1 36 36 VAL HG23 H 1 0.673 0.030 . 1 . . . . 36 VAL HG2 . 11327 1
359 . 1 1 36 36 VAL C C 13 176.718 0.300 . 1 . . . . 36 VAL C . 11327 1
360 . 1 1 36 36 VAL CA C 13 66.632 0.300 . 1 . . . . 36 VAL CA . 11327 1
361 . 1 1 36 36 VAL CB C 13 32.639 0.300 . 1 . . . . 36 VAL CB . 11327 1
362 . 1 1 36 36 VAL CG1 C 13 22.380 0.300 . 2 . . . . 36 VAL CG1 . 11327 1
363 . 1 1 36 36 VAL CG2 C 13 24.104 0.300 . 2 . . . . 36 VAL CG2 . 11327 1
364 . 1 1 36 36 VAL N N 15 117.305 0.300 . 1 . . . . 36 VAL N . 11327 1
365 . 1 1 37 37 PHE H H 1 7.958 0.030 . 1 . . . . 37 PHE H . 11327 1
366 . 1 1 37 37 PHE HA H 1 5.031 0.030 . 1 . . . . 37 PHE HA . 11327 1
367 . 1 1 37 37 PHE HB2 H 1 3.524 0.030 . 2 . . . . 37 PHE HB2 . 11327 1
368 . 1 1 37 37 PHE HB3 H 1 2.696 0.030 . 2 . . . . 37 PHE HB3 . 11327 1
369 . 1 1 37 37 PHE HD1 H 1 7.321 0.030 . 1 . . . . 37 PHE HD1 . 11327 1
370 . 1 1 37 37 PHE HD2 H 1 7.321 0.030 . 1 . . . . 37 PHE HD2 . 11327 1
371 . 1 1 37 37 PHE HE1 H 1 7.182 0.030 . 1 . . . . 37 PHE HE1 . 11327 1
372 . 1 1 37 37 PHE HE2 H 1 7.182 0.030 . 1 . . . . 37 PHE HE2 . 11327 1
373 . 1 1 37 37 PHE HZ H 1 6.637 0.030 . 1 . . . . 37 PHE HZ . 11327 1
374 . 1 1 37 37 PHE C C 13 177.046 0.300 . 1 . . . . 37 PHE C . 11327 1
375 . 1 1 37 37 PHE CA C 13 57.102 0.300 . 1 . . . . 37 PHE CA . 11327 1
376 . 1 1 37 37 PHE CB C 13 42.756 0.300 . 1 . . . . 37 PHE CB . 11327 1
377 . 1 1 37 37 PHE CD1 C 13 132.626 0.300 . 1 . . . . 37 PHE CD1 . 11327 1
378 . 1 1 37 37 PHE CD2 C 13 132.626 0.300 . 1 . . . . 37 PHE CD2 . 11327 1
379 . 1 1 37 37 PHE CE1 C 13 131.096 0.300 . 1 . . . . 37 PHE CE1 . 11327 1
380 . 1 1 37 37 PHE CE2 C 13 131.096 0.300 . 1 . . . . 37 PHE CE2 . 11327 1
381 . 1 1 37 37 PHE CZ C 13 128.675 0.300 . 1 . . . . 37 PHE CZ . 11327 1
382 . 1 1 37 37 PHE N N 15 110.463 0.300 . 1 . . . . 37 PHE N . 11327 1
383 . 1 1 38 38 GLY H H 1 6.923 0.030 . 1 . . . . 38 GLY H . 11327 1
384 . 1 1 38 38 GLY HA2 H 1 4.740 0.030 . 2 . . . . 38 GLY HA2 . 11327 1
385 . 1 1 38 38 GLY HA3 H 1 4.320 0.030 . 2 . . . . 38 GLY HA3 . 11327 1
386 . 1 1 38 38 GLY C C 13 176.935 0.300 . 1 . . . . 38 GLY C . 11327 1
387 . 1 1 38 38 GLY CA C 13 45.801 0.300 . 1 . . . . 38 GLY CA . 11327 1
388 . 1 1 38 38 GLY N N 15 108.191 0.300 . 1 . . . . 38 GLY N . 11327 1
389 . 1 1 39 39 ILE H H 1 8.937 0.030 . 1 . . . . 39 ILE H . 11327 1
390 . 1 1 39 39 ILE HA H 1 4.018 0.030 . 1 . . . . 39 ILE HA . 11327 1
391 . 1 1 39 39 ILE HB H 1 1.797 0.030 . 1 . . . . 39 ILE HB . 11327 1
392 . 1 1 39 39 ILE HD11 H 1 0.747 0.030 . 1 . . . . 39 ILE HD1 . 11327 1
393 . 1 1 39 39 ILE HD12 H 1 0.747 0.030 . 1 . . . . 39 ILE HD1 . 11327 1
394 . 1 1 39 39 ILE HD13 H 1 0.747 0.030 . 1 . . . . 39 ILE HD1 . 11327 1
395 . 1 1 39 39 ILE HG12 H 1 1.137 0.030 . 2 . . . . 39 ILE HG12 . 11327 1
396 . 1 1 39 39 ILE HG13 H 1 0.607 0.030 . 2 . . . . 39 ILE HG13 . 11327 1
397 . 1 1 39 39 ILE HG21 H 1 0.767 0.030 . 1 . . . . 39 ILE HG2 . 11327 1
398 . 1 1 39 39 ILE HG22 H 1 0.767 0.030 . 1 . . . . 39 ILE HG2 . 11327 1
399 . 1 1 39 39 ILE HG23 H 1 0.767 0.030 . 1 . . . . 39 ILE HG2 . 11327 1
400 . 1 1 39 39 ILE C C 13 177.287 0.300 . 1 . . . . 39 ILE C . 11327 1
401 . 1 1 39 39 ILE CA C 13 63.724 0.300 . 1 . . . . 39 ILE CA . 11327 1
402 . 1 1 39 39 ILE CB C 13 38.413 0.300 . 1 . . . . 39 ILE CB . 11327 1
403 . 1 1 39 39 ILE CD1 C 13 14.229 0.300 . 1 . . . . 39 ILE CD1 . 11327 1
404 . 1 1 39 39 ILE CG1 C 13 26.369 0.300 . 1 . . . . 39 ILE CG1 . 11327 1
405 . 1 1 39 39 ILE CG2 C 13 17.276 0.300 . 1 . . . . 39 ILE CG2 . 11327 1
406 . 1 1 39 39 ILE N N 15 117.711 0.300 . 1 . . . . 39 ILE N . 11327 1
407 . 1 1 40 40 HIS H H 1 7.408 0.030 . 1 . . . . 40 HIS H . 11327 1
408 . 1 1 40 40 HIS HA H 1 6.147 0.030 . 1 . . . . 40 HIS HA . 11327 1
409 . 1 1 40 40 HIS HB2 H 1 3.401 0.030 . 2 . . . . 40 HIS HB2 . 11327 1
410 . 1 1 40 40 HIS HB3 H 1 2.014 0.030 . 2 . . . . 40 HIS HB3 . 11327 1
411 . 1 1 40 40 HIS HD2 H 1 7.124 0.030 . 1 . . . . 40 HIS HD2 . 11327 1
412 . 1 1 40 40 HIS HE1 H 1 7.796 0.030 . 1 . . . . 40 HIS HE1 . 11327 1
413 . 1 1 40 40 HIS C C 13 176.126 0.300 . 1 . . . . 40 HIS C . 11327 1
414 . 1 1 40 40 HIS CA C 13 56.041 0.300 . 1 . . . . 40 HIS CA . 11327 1
415 . 1 1 40 40 HIS CB C 13 29.810 0.300 . 1 . . . . 40 HIS CB . 11327 1
416 . 1 1 40 40 HIS CD2 C 13 121.885 0.300 . 1 . . . . 40 HIS CD2 . 11327 1
417 . 1 1 40 40 HIS CE1 C 13 140.485 0.300 . 1 . . . . 40 HIS CE1 . 11327 1
418 . 1 1 40 40 HIS N N 15 118.554 0.300 . 1 . . . . 40 HIS N . 11327 1
419 . 1 1 41 41 LYS H H 1 7.391 0.030 . 1 . . . . 41 LYS H . 11327 1
420 . 1 1 41 41 LYS HA H 1 4.913 0.030 . 1 . . . . 41 LYS HA . 11327 1
421 . 1 1 41 41 LYS HB2 H 1 1.883 0.030 . 2 . . . . 41 LYS HB2 . 11327 1
422 . 1 1 41 41 LYS HB3 H 1 1.697 0.030 . 2 . . . . 41 LYS HB3 . 11327 1
423 . 1 1 41 41 LYS HD2 H 1 1.654 0.030 . 1 . . . . 41 LYS HD2 . 11327 1
424 . 1 1 41 41 LYS HD3 H 1 1.654 0.030 . 1 . . . . 41 LYS HD3 . 11327 1
425 . 1 1 41 41 LYS HE2 H 1 2.846 0.030 . 2 . . . . 41 LYS HE2 . 11327 1
426 . 1 1 41 41 LYS HE3 H 1 3.029 0.030 . 2 . . . . 41 LYS HE3 . 11327 1
427 . 1 1 41 41 LYS HG2 H 1 1.374 0.030 . 2 . . . . 41 LYS HG2 . 11327 1
428 . 1 1 41 41 LYS HG3 H 1 1.515 0.030 . 2 . . . . 41 LYS HG3 . 11327 1
429 . 1 1 41 41 LYS C C 13 179.056 0.300 . 1 . . . . 41 LYS C . 11327 1
430 . 1 1 41 41 LYS CA C 13 59.563 0.300 . 1 . . . . 41 LYS CA . 11327 1
431 . 1 1 41 41 LYS CB C 13 32.857 0.300 . 1 . . . . 41 LYS CB . 11327 1
432 . 1 1 41 41 LYS CD C 13 29.872 0.300 . 1 . . . . 41 LYS CD . 11327 1
433 . 1 1 41 41 LYS CE C 13 41.869 0.300 . 1 . . . . 41 LYS CE . 11327 1
434 . 1 1 41 41 LYS CG C 13 24.116 0.300 . 1 . . . . 41 LYS CG . 11327 1
435 . 1 1 41 41 LYS N N 15 120.447 0.300 . 1 . . . . 41 LYS N . 11327 1
436 . 1 1 42 42 ALA H H 1 8.778 0.030 . 1 . . . . 42 ALA H . 11327 1
437 . 1 1 42 42 ALA HA H 1 4.615 0.030 . 1 . . . . 42 ALA HA . 11327 1
438 . 1 1 42 42 ALA HB1 H 1 1.419 0.030 . 1 . . . . 42 ALA HB . 11327 1
439 . 1 1 42 42 ALA HB2 H 1 1.419 0.030 . 1 . . . . 42 ALA HB . 11327 1
440 . 1 1 42 42 ALA HB3 H 1 1.419 0.030 . 1 . . . . 42 ALA HB . 11327 1
441 . 1 1 42 42 ALA C C 13 177.758 0.300 . 1 . . . . 42 ALA C . 11327 1
442 . 1 1 42 42 ALA CA C 13 51.579 0.300 . 1 . . . . 42 ALA CA . 11327 1
443 . 1 1 42 42 ALA CB C 13 19.026 0.300 . 1 . . . . 42 ALA CB . 11327 1
444 . 1 1 42 42 ALA N N 15 121.730 0.300 . 1 . . . . 42 ALA N . 11327 1
445 . 1 1 43 43 CYS H H 1 7.529 0.030 . 1 . . . . 43 CYS H . 11327 1
446 . 1 1 43 43 CYS HA H 1 4.096 0.030 . 1 . . . . 43 CYS HA . 11327 1
447 . 1 1 43 43 CYS HB2 H 1 2.966 0.030 . 2 . . . . 43 CYS HB2 . 11327 1
448 . 1 1 43 43 CYS HB3 H 1 3.578 0.030 . 2 . . . . 43 CYS HB3 . 11327 1
449 . 1 1 43 43 CYS C C 13 175.870 0.300 . 1 . . . . 43 CYS C . 11327 1
450 . 1 1 43 43 CYS CA C 13 61.105 0.300 . 1 . . . . 43 CYS CA . 11327 1
451 . 1 1 43 43 CYS CB C 13 35.006 0.300 . 1 . . . . 43 CYS CB . 11327 1
452 . 1 1 43 43 CYS N N 15 121.579 0.300 . 1 . . . . 43 CYS N . 11327 1
453 . 1 1 44 44 GLU H H 1 8.437 0.030 . 1 . . . . 44 GLU H . 11327 1
454 . 1 1 44 44 GLU HA H 1 4.525 0.030 . 1 . . . . 44 GLU HA . 11327 1
455 . 1 1 44 44 GLU HB2 H 1 2.061 0.030 . 2 . . . . 44 GLU HB2 . 11327 1
456 . 1 1 44 44 GLU HB3 H 1 1.887 0.030 . 2 . . . . 44 GLU HB3 . 11327 1
457 . 1 1 44 44 GLU HG2 H 1 2.224 0.030 . 2 . . . . 44 GLU HG2 . 11327 1
458 . 1 1 44 44 GLU HG3 H 1 2.342 0.030 . 2 . . . . 44 GLU HG3 . 11327 1
459 . 1 1 44 44 GLU C C 13 175.277 0.300 . 1 . . . . 44 GLU C . 11327 1
460 . 1 1 44 44 GLU CA C 13 55.448 0.300 . 1 . . . . 44 GLU CA . 11327 1
461 . 1 1 44 44 GLU CB C 13 30.434 0.300 . 1 . . . . 44 GLU CB . 11327 1
462 . 1 1 44 44 GLU CG C 13 36.233 0.300 . 1 . . . . 44 GLU CG . 11327 1
463 . 1 1 44 44 GLU N N 15 122.858 0.300 . 1 . . . . 44 GLU N . 11327 1
464 . 1 1 45 45 VAL H H 1 8.378 0.030 . 1 . . . . 45 VAL H . 11327 1
465 . 1 1 45 45 VAL HA H 1 5.537 0.030 . 1 . . . . 45 VAL HA . 11327 1
466 . 1 1 45 45 VAL HB H 1 2.025 0.030 . 1 . . . . 45 VAL HB . 11327 1
467 . 1 1 45 45 VAL HG11 H 1 0.745 0.030 . 1 . . . . 45 VAL HG1 . 11327 1
468 . 1 1 45 45 VAL HG12 H 1 0.745 0.030 . 1 . . . . 45 VAL HG1 . 11327 1
469 . 1 1 45 45 VAL HG13 H 1 0.745 0.030 . 1 . . . . 45 VAL HG1 . 11327 1
470 . 1 1 45 45 VAL HG21 H 1 0.571 0.030 . 1 . . . . 45 VAL HG2 . 11327 1
471 . 1 1 45 45 VAL HG22 H 1 0.571 0.030 . 1 . . . . 45 VAL HG2 . 11327 1
472 . 1 1 45 45 VAL HG23 H 1 0.571 0.030 . 1 . . . . 45 VAL HG2 . 11327 1
473 . 1 1 45 45 VAL C C 13 174.385 0.300 . 1 . . . . 45 VAL C . 11327 1
474 . 1 1 45 45 VAL CA C 13 58.486 0.300 . 1 . . . . 45 VAL CA . 11327 1
475 . 1 1 45 45 VAL CB C 13 35.315 0.300 . 1 . . . . 45 VAL CB . 11327 1
476 . 1 1 45 45 VAL CG1 C 13 21.187 0.300 . 2 . . . . 45 VAL CG1 . 11327 1
477 . 1 1 45 45 VAL CG2 C 13 18.688 0.300 . 2 . . . . 45 VAL CG2 . 11327 1
478 . 1 1 45 45 VAL N N 15 114.010 0.300 . 1 . . . . 45 VAL N . 11327 1
479 . 1 1 46 46 ALA H H 1 9.213 0.030 . 1 . . . . 46 ALA H . 11327 1
480 . 1 1 46 46 ALA HA H 1 5.139 0.030 . 1 . . . . 46 ALA HA . 11327 1
481 . 1 1 46 46 ALA HB1 H 1 1.428 0.030 . 1 . . . . 46 ALA HB . 11327 1
482 . 1 1 46 46 ALA HB2 H 1 1.428 0.030 . 1 . . . . 46 ALA HB . 11327 1
483 . 1 1 46 46 ALA HB3 H 1 1.428 0.030 . 1 . . . . 46 ALA HB . 11327 1
484 . 1 1 46 46 ALA C C 13 173.776 0.300 . 1 . . . . 46 ALA C . 11327 1
485 . 1 1 46 46 ALA CA C 13 49.871 0.300 . 1 . . . . 46 ALA CA . 11327 1
486 . 1 1 46 46 ALA CB C 13 21.667 0.300 . 1 . . . . 46 ALA CB . 11327 1
487 . 1 1 46 46 ALA N N 15 122.854 0.300 . 1 . . . . 46 ALA N . 11327 1
488 . 1 1 47 47 PRO HA H 1 4.461 0.030 . 1 . . . . 47 PRO HA . 11327 1
489 . 1 1 47 47 PRO HB2 H 1 2.160 0.030 . 2 . . . . 47 PRO HB2 . 11327 1
490 . 1 1 47 47 PRO HB3 H 1 1.722 0.030 . 2 . . . . 47 PRO HB3 . 11327 1
491 . 1 1 47 47 PRO HD2 H 1 3.467 0.030 . 1 . . . . 47 PRO HD2 . 11327 1
492 . 1 1 47 47 PRO HD3 H 1 3.467 0.030 . 1 . . . . 47 PRO HD3 . 11327 1
493 . 1 1 47 47 PRO HG2 H 1 1.060 0.030 . 2 . . . . 47 PRO HG2 . 11327 1
494 . 1 1 47 47 PRO HG3 H 1 1.790 0.030 . 2 . . . . 47 PRO HG3 . 11327 1
495 . 1 1 47 47 PRO C C 13 177.207 0.300 . 1 . . . . 47 PRO C . 11327 1
496 . 1 1 47 47 PRO CA C 13 63.067 0.300 . 1 . . . . 47 PRO CA . 11327 1
497 . 1 1 47 47 PRO CB C 13 31.682 0.300 . 1 . . . . 47 PRO CB . 11327 1
498 . 1 1 47 47 PRO CD C 13 50.578 0.300 . 1 . . . . 47 PRO CD . 11327 1
499 . 1 1 47 47 PRO CG C 13 27.635 0.300 . 1 . . . . 47 PRO CG . 11327 1
500 . 1 1 48 48 LEU H H 1 7.828 0.030 . 1 . . . . 48 LEU H . 11327 1
501 . 1 1 48 48 LEU HA H 1 4.040 0.030 . 1 . . . . 48 LEU HA . 11327 1
502 . 1 1 48 48 LEU HB2 H 1 1.624 0.030 . 2 . . . . 48 LEU HB2 . 11327 1
503 . 1 1 48 48 LEU HB3 H 1 1.061 0.030 . 2 . . . . 48 LEU HB3 . 11327 1
504 . 1 1 48 48 LEU HD11 H 1 0.888 0.030 . 1 . . . . 48 LEU HD1 . 11327 1
505 . 1 1 48 48 LEU HD12 H 1 0.888 0.030 . 1 . . . . 48 LEU HD1 . 11327 1
506 . 1 1 48 48 LEU HD13 H 1 0.888 0.030 . 1 . . . . 48 LEU HD1 . 11327 1
507 . 1 1 48 48 LEU HD21 H 1 0.853 0.030 . 1 . . . . 48 LEU HD2 . 11327 1
508 . 1 1 48 48 LEU HD22 H 1 0.853 0.030 . 1 . . . . 48 LEU HD2 . 11327 1
509 . 1 1 48 48 LEU HD23 H 1 0.853 0.030 . 1 . . . . 48 LEU HD2 . 11327 1
510 . 1 1 48 48 LEU HG H 1 1.450 0.030 . 1 . . . . 48 LEU HG . 11327 1
511 . 1 1 48 48 LEU C C 13 177.083 0.300 . 1 . . . . 48 LEU C . 11327 1
512 . 1 1 48 48 LEU CA C 13 56.959 0.300 . 1 . . . . 48 LEU CA . 11327 1
513 . 1 1 48 48 LEU CB C 13 42.609 0.300 . 1 . . . . 48 LEU CB . 11327 1
514 . 1 1 48 48 LEU CD1 C 13 24.217 0.300 . 2 . . . . 48 LEU CD1 . 11327 1
515 . 1 1 48 48 LEU CD2 C 13 25.924 0.300 . 2 . . . . 48 LEU CD2 . 11327 1
516 . 1 1 48 48 LEU CG C 13 26.904 0.300 . 1 . . . . 48 LEU CG . 11327 1
517 . 1 1 48 48 LEU N N 15 125.192 0.300 . 1 . . . . 48 LEU N . 11327 1
518 . 1 1 49 49 GLN H H 1 8.676 0.030 . 1 . . . . 49 GLN H . 11327 1
519 . 1 1 49 49 GLN HA H 1 4.246 0.030 . 1 . . . . 49 GLN HA . 11327 1
520 . 1 1 49 49 GLN HB2 H 1 2.069 0.030 . 2 . . . . 49 GLN HB2 . 11327 1
521 . 1 1 49 49 GLN HB3 H 1 1.952 0.030 . 2 . . . . 49 GLN HB3 . 11327 1
522 . 1 1 49 49 GLN HE21 H 1 6.867 0.030 . 2 . . . . 49 GLN HE21 . 11327 1
523 . 1 1 49 49 GLN HE22 H 1 7.524 0.030 . 2 . . . . 49 GLN HE22 . 11327 1
524 . 1 1 49 49 GLN HG2 H 1 2.345 0.030 . 1 . . . . 49 GLN HG2 . 11327 1
525 . 1 1 49 49 GLN HG3 H 1 2.345 0.030 . 1 . . . . 49 GLN HG3 . 11327 1
526 . 1 1 49 49 GLN C C 13 176.204 0.300 . 1 . . . . 49 GLN C . 11327 1
527 . 1 1 49 49 GLN CA C 13 56.575 0.300 . 1 . . . . 49 GLN CA . 11327 1
528 . 1 1 49 49 GLN CB C 13 28.652 0.300 . 1 . . . . 49 GLN CB . 11327 1
529 . 1 1 49 49 GLN CG C 13 33.769 0.300 . 1 . . . . 49 GLN CG . 11327 1
530 . 1 1 49 49 GLN N N 15 118.539 0.300 . 1 . . . . 49 GLN N . 11327 1
531 . 1 1 49 49 GLN NE2 N 15 112.330 0.300 . 1 . . . . 49 GLN NE2 . 11327 1
532 . 1 1 50 50 SER H H 1 7.887 0.030 . 1 . . . . 50 SER H . 11327 1
533 . 1 1 50 50 SER HA H 1 4.363 0.030 . 1 . . . . 50 SER HA . 11327 1
534 . 1 1 50 50 SER HB2 H 1 3.836 0.030 . 1 . . . . 50 SER HB2 . 11327 1
535 . 1 1 50 50 SER HB3 H 1 3.836 0.030 . 1 . . . . 50 SER HB3 . 11327 1
536 . 1 1 50 50 SER C C 13 174.436 0.300 . 1 . . . . 50 SER C . 11327 1
537 . 1 1 50 50 SER CA C 13 59.116 0.300 . 1 . . . . 50 SER CA . 11327 1
538 . 1 1 50 50 SER CB C 13 63.845 0.300 . 1 . . . . 50 SER CB . 11327 1
539 . 1 1 50 50 SER N N 15 114.864 0.300 . 1 . . . . 50 SER N . 11327 1
540 . 1 1 51 51 VAL H H 1 7.555 0.030 . 1 . . . . 51 VAL H . 11327 1
541 . 1 1 51 51 VAL HA H 1 3.995 0.030 . 1 . . . . 51 VAL HA . 11327 1
542 . 1 1 51 51 VAL HB H 1 1.739 0.030 . 1 . . . . 51 VAL HB . 11327 1
543 . 1 1 51 51 VAL HG11 H 1 0.440 0.030 . 1 . . . . 51 VAL HG1 . 11327 1
544 . 1 1 51 51 VAL HG12 H 1 0.440 0.030 . 1 . . . . 51 VAL HG1 . 11327 1
545 . 1 1 51 51 VAL HG13 H 1 0.440 0.030 . 1 . . . . 51 VAL HG1 . 11327 1
546 . 1 1 51 51 VAL HG21 H 1 0.586 0.030 . 1 . . . . 51 VAL HG2 . 11327 1
547 . 1 1 51 51 VAL HG22 H 1 0.586 0.030 . 1 . . . . 51 VAL HG2 . 11327 1
548 . 1 1 51 51 VAL HG23 H 1 0.586 0.030 . 1 . . . . 51 VAL HG2 . 11327 1
549 . 1 1 51 51 VAL C C 13 175.898 0.300 . 1 . . . . 51 VAL C . 11327 1
550 . 1 1 51 51 VAL CA C 13 62.448 0.300 . 1 . . . . 51 VAL CA . 11327 1
551 . 1 1 51 51 VAL CB C 13 32.674 0.300 . 1 . . . . 51 VAL CB . 11327 1
552 . 1 1 51 51 VAL CG1 C 13 20.606 0.300 . 2 . . . . 51 VAL CG1 . 11327 1
553 . 1 1 51 51 VAL CG2 C 13 20.136 0.300 . 2 . . . . 51 VAL CG2 . 11327 1
554 . 1 1 51 51 VAL N N 15 119.696 0.300 . 1 . . . . 51 VAL N . 11327 1
555 . 1 1 52 52 PHE H H 1 8.087 0.030 . 1 . . . . 52 PHE H . 11327 1
556 . 1 1 52 52 PHE HA H 1 4.565 0.030 . 1 . . . . 52 PHE HA . 11327 1
557 . 1 1 52 52 PHE HB2 H 1 3.065 0.030 . 2 . . . . 52 PHE HB2 . 11327 1
558 . 1 1 52 52 PHE HB3 H 1 2.908 0.030 . 2 . . . . 52 PHE HB3 . 11327 1
559 . 1 1 52 52 PHE HD1 H 1 7.161 0.030 . 1 . . . . 52 PHE HD1 . 11327 1
560 . 1 1 52 52 PHE HD2 H 1 7.161 0.030 . 1 . . . . 52 PHE HD2 . 11327 1
561 . 1 1 52 52 PHE HE1 H 1 7.227 0.030 . 1 . . . . 52 PHE HE1 . 11327 1
562 . 1 1 52 52 PHE HE2 H 1 7.227 0.030 . 1 . . . . 52 PHE HE2 . 11327 1
563 . 1 1 52 52 PHE HZ H 1 7.201 0.030 . 1 . . . . 52 PHE HZ . 11327 1
564 . 1 1 52 52 PHE C C 13 175.718 0.300 . 1 . . . . 52 PHE C . 11327 1
565 . 1 1 52 52 PHE CA C 13 57.624 0.300 . 1 . . . . 52 PHE CA . 11327 1
566 . 1 1 52 52 PHE CB C 13 39.208 0.300 . 1 . . . . 52 PHE CB . 11327 1
567 . 1 1 52 52 PHE CD1 C 13 131.635 0.300 . 1 . . . . 52 PHE CD1 . 11327 1
568 . 1 1 52 52 PHE CD2 C 13 131.635 0.300 . 1 . . . . 52 PHE CD2 . 11327 1
569 . 1 1 52 52 PHE CE1 C 13 131.637 0.300 . 1 . . . . 52 PHE CE1 . 11327 1
570 . 1 1 52 52 PHE CE2 C 13 131.637 0.300 . 1 . . . . 52 PHE CE2 . 11327 1
571 . 1 1 52 52 PHE CZ C 13 129.677 0.300 . 1 . . . . 52 PHE CZ . 11327 1
572 . 1 1 52 52 PHE N N 15 122.444 0.300 . 1 . . . . 52 PHE N . 11327 1
573 . 1 1 53 53 GLN H H 1 8.182 0.030 . 1 . . . . 53 GLN H . 11327 1
574 . 1 1 53 53 GLN HA H 1 4.232 0.030 . 1 . . . . 53 GLN HA . 11327 1
575 . 1 1 53 53 GLN HB2 H 1 1.880 0.030 . 2 . . . . 53 GLN HB2 . 11327 1
576 . 1 1 53 53 GLN HB3 H 1 2.064 0.030 . 2 . . . . 53 GLN HB3 . 11327 1
577 . 1 1 53 53 GLN HE21 H 1 7.432 0.030 . 2 . . . . 53 GLN HE21 . 11327 1
578 . 1 1 53 53 GLN HE22 H 1 6.777 0.030 . 2 . . . . 53 GLN HE22 . 11327 1
579 . 1 1 53 53 GLN HG2 H 1 2.225 0.030 . 1 . . . . 53 GLN HG2 . 11327 1
580 . 1 1 53 53 GLN HG3 H 1 2.225 0.030 . 1 . . . . 53 GLN HG3 . 11327 1
581 . 1 1 53 53 GLN C C 13 176.132 0.300 . 1 . . . . 53 GLN C . 11327 1
582 . 1 1 53 53 GLN CA C 13 55.956 0.300 . 1 . . . . 53 GLN CA . 11327 1
583 . 1 1 53 53 GLN CB C 13 29.397 0.300 . 1 . . . . 53 GLN CB . 11327 1
584 . 1 1 53 53 GLN CG C 13 33.737 0.300 . 1 . . . . 53 GLN CG . 11327 1
585 . 1 1 53 53 GLN N N 15 122.123 0.300 . 1 . . . . 53 GLN N . 11327 1
586 . 1 1 53 53 GLN NE2 N 15 112.154 0.300 . 1 . . . . 53 GLN NE2 . 11327 1
587 . 1 1 54 54 GLY H H 1 7.924 0.030 . 1 . . . . 54 GLY H . 11327 1
588 . 1 1 54 54 GLY HA2 H 1 3.877 0.030 . 1 . . . . 54 GLY HA2 . 11327 1
589 . 1 1 54 54 GLY HA3 H 1 3.877 0.030 . 1 . . . . 54 GLY HA3 . 11327 1
590 . 1 1 54 54 GLY C C 13 173.869 0.300 . 1 . . . . 54 GLY C . 11327 1
591 . 1 1 54 54 GLY CA C 13 45.264 0.300 . 1 . . . . 54 GLY CA . 11327 1
592 . 1 1 54 54 GLY N N 15 109.125 0.300 . 1 . . . . 54 GLY N . 11327 1
593 . 1 1 55 55 GLN H H 1 8.193 0.030 . 1 . . . . 55 GLN H . 11327 1
594 . 1 1 55 55 GLN HA H 1 4.332 0.030 . 1 . . . . 55 GLN HA . 11327 1
595 . 1 1 55 55 GLN HB2 H 1 1.971 0.030 . 2 . . . . 55 GLN HB2 . 11327 1
596 . 1 1 55 55 GLN HB3 H 1 2.087 0.030 . 2 . . . . 55 GLN HB3 . 11327 1
597 . 1 1 55 55 GLN HE21 H 1 6.870 0.030 . 2 . . . . 55 GLN HE21 . 11327 1
598 . 1 1 55 55 GLN HE22 H 1 7.535 0.030 . 2 . . . . 55 GLN HE22 . 11327 1
599 . 1 1 55 55 GLN HG2 H 1 2.344 0.030 . 1 . . . . 55 GLN HG2 . 11327 1
600 . 1 1 55 55 GLN HG3 H 1 2.344 0.030 . 1 . . . . 55 GLN HG3 . 11327 1
601 . 1 1 55 55 GLN C C 13 175.962 0.300 . 1 . . . . 55 GLN C . 11327 1
602 . 1 1 55 55 GLN CA C 13 55.805 0.300 . 1 . . . . 55 GLN CA . 11327 1
603 . 1 1 55 55 GLN CB C 13 29.688 0.300 . 1 . . . . 55 GLN CB . 11327 1
604 . 1 1 55 55 GLN CG C 13 33.696 0.300 . 1 . . . . 55 GLN CG . 11327 1
605 . 1 1 55 55 GLN N N 15 119.791 0.300 . 1 . . . . 55 GLN N . 11327 1
606 . 1 1 55 55 GLN NE2 N 15 112.377 0.300 . 1 . . . . 55 GLN NE2 . 11327 1
607 . 1 1 56 56 LYS H H 1 8.472 0.030 . 1 . . . . 56 LYS H . 11327 1
608 . 1 1 56 56 LYS HA H 1 4.400 0.030 . 1 . . . . 56 LYS HA . 11327 1
609 . 1 1 56 56 LYS HB2 H 1 1.763 0.030 . 2 . . . . 56 LYS HB2 . 11327 1
610 . 1 1 56 56 LYS HB3 H 1 1.845 0.030 . 2 . . . . 56 LYS HB3 . 11327 1
611 . 1 1 56 56 LYS HD2 H 1 1.664 0.030 . 1 . . . . 56 LYS HD2 . 11327 1
612 . 1 1 56 56 LYS HD3 H 1 1.664 0.030 . 1 . . . . 56 LYS HD3 . 11327 1
613 . 1 1 56 56 LYS HE2 H 1 2.971 0.030 . 1 . . . . 56 LYS HE2 . 11327 1
614 . 1 1 56 56 LYS HE3 H 1 2.971 0.030 . 1 . . . . 56 LYS HE3 . 11327 1
615 . 1 1 56 56 LYS HG2 H 1 1.407 0.030 . 1 . . . . 56 LYS HG2 . 11327 1
616 . 1 1 56 56 LYS HG3 H 1 1.407 0.030 . 1 . . . . 56 LYS HG3 . 11327 1
617 . 1 1 56 56 LYS C C 13 176.680 0.300 . 1 . . . . 56 LYS C . 11327 1
618 . 1 1 56 56 LYS CA C 13 56.326 0.300 . 1 . . . . 56 LYS CA . 11327 1
619 . 1 1 56 56 LYS CB C 13 33.136 0.300 . 1 . . . . 56 LYS CB . 11327 1
620 . 1 1 56 56 LYS CD C 13 29.049 0.300 . 1 . . . . 56 LYS CD . 11327 1
621 . 1 1 56 56 LYS CE C 13 42.127 0.300 . 1 . . . . 56 LYS CE . 11327 1
622 . 1 1 56 56 LYS CG C 13 24.690 0.300 . 1 . . . . 56 LYS CG . 11327 1
623 . 1 1 56 56 LYS N N 15 123.242 0.300 . 1 . . . . 56 LYS N . 11327 1
624 . 1 1 57 57 THR H H 1 8.268 0.030 . 1 . . . . 57 THR H . 11327 1
625 . 1 1 57 57 THR HA H 1 4.344 0.030 . 1 . . . . 57 THR HA . 11327 1
626 . 1 1 57 57 THR HB H 1 4.196 0.030 . 1 . . . . 57 THR HB . 11327 1
627 . 1 1 57 57 THR HG21 H 1 1.187 0.030 . 1 . . . . 57 THR HG2 . 11327 1
628 . 1 1 57 57 THR HG22 H 1 1.187 0.030 . 1 . . . . 57 THR HG2 . 11327 1
629 . 1 1 57 57 THR HG23 H 1 1.187 0.030 . 1 . . . . 57 THR HG2 . 11327 1
630 . 1 1 57 57 THR C C 13 174.527 0.300 . 1 . . . . 57 THR C . 11327 1
631 . 1 1 57 57 THR CA C 13 61.849 0.300 . 1 . . . . 57 THR CA . 11327 1
632 . 1 1 57 57 THR CB C 13 69.910 0.300 . 1 . . . . 57 THR CB . 11327 1
633 . 1 1 57 57 THR CG2 C 13 21.659 0.300 . 1 . . . . 57 THR CG2 . 11327 1
634 . 1 1 57 57 THR N N 15 116.240 0.300 . 1 . . . . 57 THR N . 11327 1
635 . 1 1 58 58 GLU H H 1 8.520 0.030 . 1 . . . . 58 GLU H . 11327 1
636 . 1 1 58 58 GLU HA H 1 4.375 0.030 . 1 . . . . 58 GLU HA . 11327 1
637 . 1 1 58 58 GLU HB2 H 1 1.945 0.030 . 2 . . . . 58 GLU HB2 . 11327 1
638 . 1 1 58 58 GLU HB3 H 1 2.089 0.030 . 2 . . . . 58 GLU HB3 . 11327 1
639 . 1 1 58 58 GLU HG2 H 1 2.263 0.030 . 1 . . . . 58 GLU HG2 . 11327 1
640 . 1 1 58 58 GLU HG3 H 1 2.263 0.030 . 1 . . . . 58 GLU HG3 . 11327 1
641 . 1 1 58 58 GLU C C 13 176.382 0.300 . 1 . . . . 58 GLU C . 11327 1
642 . 1 1 58 58 GLU CA C 13 56.570 0.300 . 1 . . . . 58 GLU CA . 11327 1
643 . 1 1 58 58 GLU CB C 13 30.368 0.300 . 1 . . . . 58 GLU CB . 11327 1
644 . 1 1 58 58 GLU CG C 13 36.287 0.300 . 1 . . . . 58 GLU CG . 11327 1
645 . 1 1 58 58 GLU N N 15 123.531 0.300 . 1 . . . . 58 GLU N . 11327 1
646 . 1 1 59 59 SER H H 1 8.420 0.030 . 1 . . . . 59 SER H . 11327 1
647 . 1 1 59 59 SER HA H 1 4.506 0.030 . 1 . . . . 59 SER HA . 11327 1
648 . 1 1 59 59 SER HB2 H 1 3.873 0.030 . 1 . . . . 59 SER HB2 . 11327 1
649 . 1 1 59 59 SER HB3 H 1 3.873 0.030 . 1 . . . . 59 SER HB3 . 11327 1
650 . 1 1 59 59 SER C C 13 174.551 0.300 . 1 . . . . 59 SER C . 11327 1
651 . 1 1 59 59 SER CA C 13 58.277 0.300 . 1 . . . . 59 SER CA . 11327 1
652 . 1 1 59 59 SER CB C 13 63.918 0.300 . 1 . . . . 59 SER CB . 11327 1
653 . 1 1 59 59 SER N N 15 117.105 0.300 . 1 . . . . 59 SER N . 11327 1
654 . 1 1 60 60 GLY H H 1 8.275 0.030 . 1 . . . . 60 GLY H . 11327 1
655 . 1 1 60 60 GLY HA2 H 1 4.167 0.030 . 2 . . . . 60 GLY HA2 . 11327 1
656 . 1 1 60 60 GLY HA3 H 1 4.081 0.030 . 2 . . . . 60 GLY HA3 . 11327 1
657 . 1 1 60 60 GLY C C 13 171.777 0.300 . 1 . . . . 60 GLY C . 11327 1
658 . 1 1 60 60 GLY CA C 13 44.646 0.300 . 1 . . . . 60 GLY CA . 11327 1
659 . 1 1 60 60 GLY N N 15 110.787 0.300 . 1 . . . . 60 GLY N . 11327 1
660 . 1 1 61 61 PRO HA H 1 4.479 0.030 . 1 . . . . 61 PRO HA . 11327 1
661 . 1 1 61 61 PRO HB2 H 1 1.966 0.030 . 2 . . . . 61 PRO HB2 . 11327 1
662 . 1 1 61 61 PRO HB3 H 1 2.290 0.030 . 2 . . . . 61 PRO HB3 . 11327 1
663 . 1 1 61 61 PRO HD2 H 1 3.628 0.030 . 1 . . . . 61 PRO HD2 . 11327 1
664 . 1 1 61 61 PRO HD3 H 1 3.628 0.030 . 1 . . . . 61 PRO HD3 . 11327 1
665 . 1 1 61 61 PRO HG2 H 1 2.017 0.030 . 1 . . . . 61 PRO HG2 . 11327 1
666 . 1 1 61 61 PRO HG3 H 1 2.017 0.030 . 1 . . . . 61 PRO HG3 . 11327 1
667 . 1 1 61 61 PRO C C 13 177.398 0.300 . 1 . . . . 61 PRO C . 11327 1
668 . 1 1 61 61 PRO CA C 13 63.130 0.300 . 1 . . . . 61 PRO CA . 11327 1
669 . 1 1 61 61 PRO CB C 13 32.160 0.300 . 1 . . . . 61 PRO CB . 11327 1
670 . 1 1 61 61 PRO CD C 13 49.795 0.300 . 1 . . . . 61 PRO CD . 11327 1
671 . 1 1 61 61 PRO CG C 13 27.153 0.300 . 1 . . . . 61 PRO CG . 11327 1
672 . 1 1 62 62 SER H H 1 8.530 0.030 . 1 . . . . 62 SER H . 11327 1
673 . 1 1 62 62 SER C C 13 174.692 0.300 . 1 . . . . 62 SER C . 11327 1
674 . 1 1 62 62 SER N N 15 116.451 0.300 . 1 . . . . 62 SER N . 11327 1
stop_
save_