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 11274
_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 11274 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11274 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 . . 11274 1
2 $NMRPipe . . 11274 1
3 $NMRView . . 11274 1
4 $Kujira . . 11274 1
5 $CYANA . . 11274 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 6 6 SER HA H 1 4.505 0.030 . 1 . . . . 6 SER HA . 11274 1
2 . 1 1 6 6 SER HB2 H 1 3.928 0.030 . 1 . . . . 6 SER HB2 . 11274 1
3 . 1 1 6 6 SER HB3 H 1 3.928 0.030 . 1 . . . . 6 SER HB3 . 11274 1
4 . 1 1 6 6 SER C C 13 175.015 0.300 . 1 . . . . 6 SER C . 11274 1
5 . 1 1 6 6 SER CA C 13 58.639 0.300 . 1 . . . . 6 SER CA . 11274 1
6 . 1 1 6 6 SER CB C 13 64.073 0.300 . 1 . . . . 6 SER CB . 11274 1
7 . 1 1 7 7 GLY H H 1 8.413 0.030 . 1 . . . . 7 GLY H . 11274 1
8 . 1 1 7 7 GLY HA2 H 1 3.970 0.030 . 1 . . . . 7 GLY HA2 . 11274 1
9 . 1 1 7 7 GLY HA3 H 1 3.970 0.030 . 1 . . . . 7 GLY HA3 . 11274 1
10 . 1 1 7 7 GLY C C 13 173.465 0.300 . 1 . . . . 7 GLY C . 11274 1
11 . 1 1 7 7 GLY CA C 13 45.095 0.300 . 1 . . . . 7 GLY CA . 11274 1
12 . 1 1 7 7 GLY N N 15 110.929 0.300 . 1 . . . . 7 GLY N . 11274 1
13 . 1 1 8 8 ALA H H 1 8.132 0.030 . 1 . . . . 8 ALA H . 11274 1
14 . 1 1 8 8 ALA HA H 1 4.618 0.030 . 1 . . . . 8 ALA HA . 11274 1
15 . 1 1 8 8 ALA HB1 H 1 1.360 0.030 . 1 . . . . 8 ALA HB . 11274 1
16 . 1 1 8 8 ALA HB2 H 1 1.360 0.030 . 1 . . . . 8 ALA HB . 11274 1
17 . 1 1 8 8 ALA HB3 H 1 1.360 0.030 . 1 . . . . 8 ALA HB . 11274 1
18 . 1 1 8 8 ALA C C 13 175.766 0.300 . 1 . . . . 8 ALA C . 11274 1
19 . 1 1 8 8 ALA CA C 13 50.531 0.300 . 1 . . . . 8 ALA CA . 11274 1
20 . 1 1 8 8 ALA CB C 13 18.259 0.300 . 1 . . . . 8 ALA CB . 11274 1
21 . 1 1 8 8 ALA N N 15 125.056 0.300 . 1 . . . . 8 ALA N . 11274 1
22 . 1 1 9 9 PRO HA H 1 4.374 0.030 . 1 . . . . 9 PRO HA . 11274 1
23 . 1 1 9 9 PRO HB2 H 1 1.914 0.030 . 2 . . . . 9 PRO HB2 . 11274 1
24 . 1 1 9 9 PRO HB3 H 1 2.302 0.030 . 2 . . . . 9 PRO HB3 . 11274 1
25 . 1 1 9 9 PRO HD2 H 1 3.672 0.030 . 2 . . . . 9 PRO HD2 . 11274 1
26 . 1 1 9 9 PRO HD3 H 1 3.806 0.030 . 2 . . . . 9 PRO HD3 . 11274 1
27 . 1 1 9 9 PRO HG2 H 1 2.027 0.030 . 1 . . . . 9 PRO HG2 . 11274 1
28 . 1 1 9 9 PRO HG3 H 1 2.027 0.030 . 1 . . . . 9 PRO HG3 . 11274 1
29 . 1 1 9 9 PRO C C 13 177.268 0.300 . 1 . . . . 9 PRO C . 11274 1
30 . 1 1 9 9 PRO CA C 13 63.599 0.300 . 1 . . . . 9 PRO CA . 11274 1
31 . 1 1 9 9 PRO CB C 13 31.992 0.300 . 1 . . . . 9 PRO CB . 11274 1
32 . 1 1 9 9 PRO CD C 13 50.438 0.300 . 1 . . . . 9 PRO CD . 11274 1
33 . 1 1 9 9 PRO CG C 13 27.209 0.300 . 1 . . . . 9 PRO CG . 11274 1
34 . 1 1 10 10 GLU H H 1 8.655 0.030 . 1 . . . . 10 GLU H . 11274 1
35 . 1 1 10 10 GLU HA H 1 4.235 0.030 . 1 . . . . 10 GLU HA . 11274 1
36 . 1 1 10 10 GLU HB2 H 1 1.934 0.030 . 2 . . . . 10 GLU HB2 . 11274 1
37 . 1 1 10 10 GLU HB3 H 1 2.036 0.030 . 2 . . . . 10 GLU HB3 . 11274 1
38 . 1 1 10 10 GLU HG2 H 1 2.279 0.030 . 1 . . . . 10 GLU HG2 . 11274 1
39 . 1 1 10 10 GLU HG3 H 1 2.279 0.030 . 1 . . . . 10 GLU HG3 . 11274 1
40 . 1 1 10 10 GLU C C 13 176.590 0.300 . 1 . . . . 10 GLU C . 11274 1
41 . 1 1 10 10 GLU CA C 13 56.806 0.300 . 1 . . . . 10 GLU CA . 11274 1
42 . 1 1 10 10 GLU CB C 13 30.016 0.300 . 1 . . . . 10 GLU CB . 11274 1
43 . 1 1 10 10 GLU CG C 13 36.579 0.300 . 1 . . . . 10 GLU CG . 11274 1
44 . 1 1 10 10 GLU N N 15 120.409 0.300 . 1 . . . . 10 GLU N . 11274 1
45 . 1 1 11 11 GLU H H 1 8.337 0.030 . 1 . . . . 11 GLU H . 11274 1
46 . 1 1 11 11 GLU HA H 1 4.288 0.030 . 1 . . . . 11 GLU HA . 11274 1
47 . 1 1 11 11 GLU HB2 H 1 2.016 0.030 . 1 . . . . 11 GLU HB2 . 11274 1
48 . 1 1 11 11 GLU HB3 H 1 2.016 0.030 . 1 . . . . 11 GLU HB3 . 11274 1
49 . 1 1 11 11 GLU HG2 H 1 2.261 0.030 . 1 . . . . 11 GLU HG2 . 11274 1
50 . 1 1 11 11 GLU HG3 H 1 2.261 0.030 . 1 . . . . 11 GLU HG3 . 11274 1
51 . 1 1 11 11 GLU C C 13 176.420 0.300 . 1 . . . . 11 GLU C . 11274 1
52 . 1 1 11 11 GLU CA C 13 56.493 0.300 . 1 . . . . 11 GLU CA . 11274 1
53 . 1 1 11 11 GLU CB C 13 30.280 0.300 . 1 . . . . 11 GLU CB . 11274 1
54 . 1 1 11 11 GLU CG C 13 36.415 0.300 . 1 . . . . 11 GLU CG . 11274 1
55 . 1 1 11 11 GLU N N 15 121.945 0.300 . 1 . . . . 11 GLU N . 11274 1
56 . 1 1 12 12 ARG H H 1 8.289 0.030 . 1 . . . . 12 ARG H . 11274 1
57 . 1 1 12 12 ARG HA H 1 4.348 0.030 . 1 . . . . 12 ARG HA . 11274 1
58 . 1 1 12 12 ARG HB2 H 1 1.751 0.030 . 2 . . . . 12 ARG HB2 . 11274 1
59 . 1 1 12 12 ARG HB3 H 1 1.847 0.030 . 2 . . . . 12 ARG HB3 . 11274 1
60 . 1 1 12 12 ARG HD2 H 1 3.196 0.030 . 1 . . . . 12 ARG HD2 . 11274 1
61 . 1 1 12 12 ARG HD3 H 1 3.196 0.030 . 1 . . . . 12 ARG HD3 . 11274 1
62 . 1 1 12 12 ARG HG2 H 1 1.632 0.030 . 1 . . . . 12 ARG HG2 . 11274 1
63 . 1 1 12 12 ARG HG3 H 1 1.632 0.030 . 1 . . . . 12 ARG HG3 . 11274 1
64 . 1 1 12 12 ARG C C 13 175.935 0.300 . 1 . . . . 12 ARG C . 11274 1
65 . 1 1 12 12 ARG CA C 13 56.001 0.300 . 1 . . . . 12 ARG CA . 11274 1
66 . 1 1 12 12 ARG CB C 13 31.114 0.300 . 1 . . . . 12 ARG CB . 11274 1
67 . 1 1 12 12 ARG CD C 13 43.335 0.300 . 1 . . . . 12 ARG CD . 11274 1
68 . 1 1 12 12 ARG CG C 13 26.942 0.300 . 1 . . . . 12 ARG CG . 11274 1
69 . 1 1 12 12 ARG N N 15 121.912 0.300 . 1 . . . . 12 ARG N . 11274 1
70 . 1 1 13 13 ASP H H 1 8.393 0.030 . 1 . . . . 13 ASP H . 11274 1
71 . 1 1 13 13 ASP HA H 1 4.572 0.030 . 1 . . . . 13 ASP HA . 11274 1
72 . 1 1 13 13 ASP HB2 H 1 2.680 0.030 . 2 . . . . 13 ASP HB2 . 11274 1
73 . 1 1 13 13 ASP HB3 H 1 2.572 0.030 . 2 . . . . 13 ASP HB3 . 11274 1
74 . 1 1 13 13 ASP C C 13 176.202 0.300 . 1 . . . . 13 ASP C . 11274 1
75 . 1 1 13 13 ASP CA C 13 54.417 0.300 . 1 . . . . 13 ASP CA . 11274 1
76 . 1 1 13 13 ASP CB C 13 41.051 0.300 . 1 . . . . 13 ASP CB . 11274 1
77 . 1 1 13 13 ASP N N 15 121.780 0.300 . 1 . . . . 13 ASP N . 11274 1
78 . 1 1 14 14 LEU H H 1 8.168 0.030 . 1 . . . . 14 LEU H . 11274 1
79 . 1 1 14 14 LEU HA H 1 4.453 0.030 . 1 . . . . 14 LEU HA . 11274 1
80 . 1 1 14 14 LEU HB2 H 1 1.592 0.030 . 2 . . . . 14 LEU HB2 . 11274 1
81 . 1 1 14 14 LEU HB3 H 1 1.426 0.030 . 2 . . . . 14 LEU HB3 . 11274 1
82 . 1 1 14 14 LEU HD11 H 1 0.897 0.030 . 1 . . . . 14 LEU HD1 . 11274 1
83 . 1 1 14 14 LEU HD12 H 1 0.897 0.030 . 1 . . . . 14 LEU HD1 . 11274 1
84 . 1 1 14 14 LEU HD13 H 1 0.897 0.030 . 1 . . . . 14 LEU HD1 . 11274 1
85 . 1 1 14 14 LEU HD21 H 1 0.790 0.030 . 1 . . . . 14 LEU HD2 . 11274 1
86 . 1 1 14 14 LEU HD22 H 1 0.790 0.030 . 1 . . . . 14 LEU HD2 . 11274 1
87 . 1 1 14 14 LEU HD23 H 1 0.790 0.030 . 1 . . . . 14 LEU HD2 . 11274 1
88 . 1 1 14 14 LEU HG H 1 1.683 0.030 . 1 . . . . 14 LEU HG . 11274 1
89 . 1 1 14 14 LEU C C 13 178.527 0.300 . 1 . . . . 14 LEU C . 11274 1
90 . 1 1 14 14 LEU CA C 13 54.558 0.300 . 1 . . . . 14 LEU CA . 11274 1
91 . 1 1 14 14 LEU CB C 13 43.271 0.300 . 1 . . . . 14 LEU CB . 11274 1
92 . 1 1 14 14 LEU CD1 C 13 26.456 0.300 . 2 . . . . 14 LEU CD1 . 11274 1
93 . 1 1 14 14 LEU CD2 C 13 23.669 0.300 . 2 . . . . 14 LEU CD2 . 11274 1
94 . 1 1 14 14 LEU CG C 13 27.021 0.300 . 1 . . . . 14 LEU CG . 11274 1
95 . 1 1 14 14 LEU N N 15 121.542 0.300 . 1 . . . . 14 LEU N . 11274 1
96 . 1 1 15 15 THR H H 1 8.363 0.030 . 1 . . . . 15 THR H . 11274 1
97 . 1 1 15 15 THR HA H 1 4.300 0.030 . 1 . . . . 15 THR HA . 11274 1
98 . 1 1 15 15 THR HB H 1 4.619 0.030 . 1 . . . . 15 THR HB . 11274 1
99 . 1 1 15 15 THR HG21 H 1 1.165 0.030 . 1 . . . . 15 THR HG2 . 11274 1
100 . 1 1 15 15 THR HG22 H 1 1.165 0.030 . 1 . . . . 15 THR HG2 . 11274 1
101 . 1 1 15 15 THR HG23 H 1 1.165 0.030 . 1 . . . . 15 THR HG2 . 11274 1
102 . 1 1 15 15 THR C C 13 176.057 0.300 . 1 . . . . 15 THR C . 11274 1
103 . 1 1 15 15 THR CA C 13 61.103 0.300 . 1 . . . . 15 THR CA . 11274 1
104 . 1 1 15 15 THR CB C 13 70.769 0.300 . 1 . . . . 15 THR CB . 11274 1
105 . 1 1 15 15 THR CG2 C 13 21.671 0.300 . 1 . . . . 15 THR CG2 . 11274 1
106 . 1 1 15 15 THR N N 15 112.993 0.300 . 1 . . . . 15 THR N . 11274 1
107 . 1 1 16 16 GLN HA H 1 4.024 0.030 . 1 . . . . 16 GLN HA . 11274 1
108 . 1 1 16 16 GLN HB2 H 1 2.166 0.030 . 2 . . . . 16 GLN HB2 . 11274 1
109 . 1 1 16 16 GLN HB3 H 1 2.009 0.030 . 2 . . . . 16 GLN HB3 . 11274 1
110 . 1 1 16 16 GLN HE21 H 1 6.839 0.030 . 2 . . . . 16 GLN HE21 . 11274 1
111 . 1 1 16 16 GLN HE22 H 1 7.815 0.030 . 2 . . . . 16 GLN HE22 . 11274 1
112 . 1 1 16 16 GLN HG2 H 1 2.407 0.030 . 1 . . . . 16 GLN HG2 . 11274 1
113 . 1 1 16 16 GLN HG3 H 1 2.407 0.030 . 1 . . . . 16 GLN HG3 . 11274 1
114 . 1 1 16 16 GLN C C 13 178.140 0.300 . 1 . . . . 16 GLN C . 11274 1
115 . 1 1 16 16 GLN CA C 13 59.554 0.300 . 1 . . . . 16 GLN CA . 11274 1
116 . 1 1 16 16 GLN CB C 13 27.649 0.300 . 1 . . . . 16 GLN CB . 11274 1
117 . 1 1 16 16 GLN CG C 13 33.537 0.300 . 1 . . . . 16 GLN CG . 11274 1
118 . 1 1 16 16 GLN NE2 N 15 112.798 0.300 . 1 . . . . 16 GLN NE2 . 11274 1
119 . 1 1 17 17 GLU H H 1 8.483 0.030 . 1 . . . . 17 GLU H . 11274 1
120 . 1 1 17 17 GLU HA H 1 4.041 0.030 . 1 . . . . 17 GLU HA . 11274 1
121 . 1 1 17 17 GLU HB2 H 1 1.824 0.030 . 2 . . . . 17 GLU HB2 . 11274 1
122 . 1 1 17 17 GLU HB3 H 1 2.046 0.030 . 2 . . . . 17 GLU HB3 . 11274 1
123 . 1 1 17 17 GLU HG2 H 1 2.318 0.030 . 2 . . . . 17 GLU HG2 . 11274 1
124 . 1 1 17 17 GLU HG3 H 1 2.113 0.030 . 2 . . . . 17 GLU HG3 . 11274 1
125 . 1 1 17 17 GLU C C 13 179.206 0.300 . 1 . . . . 17 GLU C . 11274 1
126 . 1 1 17 17 GLU CA C 13 59.483 0.300 . 1 . . . . 17 GLU CA . 11274 1
127 . 1 1 17 17 GLU CB C 13 29.577 0.300 . 1 . . . . 17 GLU CB . 11274 1
128 . 1 1 17 17 GLU CG C 13 36.643 0.300 . 1 . . . . 17 GLU CG . 11274 1
129 . 1 1 17 17 GLU N N 15 119.124 0.300 . 1 . . . . 17 GLU N . 11274 1
130 . 1 1 18 18 GLN H H 1 7.544 0.030 . 1 . . . . 18 GLN H . 11274 1
131 . 1 1 18 18 GLN HA H 1 3.512 0.030 . 1 . . . . 18 GLN HA . 11274 1
132 . 1 1 18 18 GLN HB2 H 1 0.990 0.030 . 2 . . . . 18 GLN HB2 . 11274 1
133 . 1 1 18 18 GLN HB3 H 1 1.916 0.030 . 2 . . . . 18 GLN HB3 . 11274 1
134 . 1 1 18 18 GLN HE21 H 1 6.269 0.030 . 2 . . . . 18 GLN HE21 . 11274 1
135 . 1 1 18 18 GLN HE22 H 1 5.384 0.030 . 2 . . . . 18 GLN HE22 . 11274 1
136 . 1 1 18 18 GLN HG2 H 1 1.773 0.030 . 2 . . . . 18 GLN HG2 . 11274 1
137 . 1 1 18 18 GLN HG3 H 1 0.373 0.030 . 2 . . . . 18 GLN HG3 . 11274 1
138 . 1 1 18 18 GLN C C 13 177.970 0.300 . 1 . . . . 18 GLN C . 11274 1
139 . 1 1 18 18 GLN CA C 13 59.061 0.300 . 1 . . . . 18 GLN CA . 11274 1
140 . 1 1 18 18 GLN CB C 13 28.389 0.300 . 1 . . . . 18 GLN CB . 11274 1
141 . 1 1 18 18 GLN CG C 13 33.836 0.300 . 1 . . . . 18 GLN CG . 11274 1
142 . 1 1 18 18 GLN N N 15 118.585 0.300 . 1 . . . . 18 GLN N . 11274 1
143 . 1 1 18 18 GLN NE2 N 15 107.788 0.300 . 1 . . . . 18 GLN NE2 . 11274 1
144 . 1 1 19 19 THR H H 1 8.426 0.030 . 1 . . . . 19 THR H . 11274 1
145 . 1 1 19 19 THR HA H 1 3.795 0.030 . 1 . . . . 19 THR HA . 11274 1
146 . 1 1 19 19 THR HB H 1 4.334 0.030 . 1 . . . . 19 THR HB . 11274 1
147 . 1 1 19 19 THR HG21 H 1 1.241 0.030 . 1 . . . . 19 THR HG2 . 11274 1
148 . 1 1 19 19 THR HG22 H 1 1.241 0.030 . 1 . . . . 19 THR HG2 . 11274 1
149 . 1 1 19 19 THR HG23 H 1 1.241 0.030 . 1 . . . . 19 THR HG2 . 11274 1
150 . 1 1 19 19 THR C C 13 176.105 0.300 . 1 . . . . 19 THR C . 11274 1
151 . 1 1 19 19 THR CA C 13 67.821 0.300 . 1 . . . . 19 THR CA . 11274 1
152 . 1 1 19 19 THR CB C 13 68.617 0.300 . 1 . . . . 19 THR CB . 11274 1
153 . 1 1 19 19 THR CG2 C 13 21.613 0.300 . 1 . . . . 19 THR CG2 . 11274 1
154 . 1 1 19 19 THR N N 15 116.842 0.300 . 1 . . . . 19 THR N . 11274 1
155 . 1 1 20 20 GLU H H 1 8.053 0.030 . 1 . . . . 20 GLU H . 11274 1
156 . 1 1 20 20 GLU HA H 1 4.030 0.030 . 1 . . . . 20 GLU HA . 11274 1
157 . 1 1 20 20 GLU HB2 H 1 2.203 0.030 . 2 . . . . 20 GLU HB2 . 11274 1
158 . 1 1 20 20 GLU HB3 H 1 2.096 0.030 . 2 . . . . 20 GLU HB3 . 11274 1
159 . 1 1 20 20 GLU HG2 H 1 2.282 0.030 . 2 . . . . 20 GLU HG2 . 11274 1
160 . 1 1 20 20 GLU HG3 H 1 2.496 0.030 . 2 . . . . 20 GLU HG3 . 11274 1
161 . 1 1 20 20 GLU C C 13 180.005 0.300 . 1 . . . . 20 GLU C . 11274 1
162 . 1 1 20 20 GLU CA C 13 59.905 0.300 . 1 . . . . 20 GLU CA . 11274 1
163 . 1 1 20 20 GLU CB C 13 29.294 0.300 . 1 . . . . 20 GLU CB . 11274 1
164 . 1 1 20 20 GLU CG C 13 36.616 0.300 . 1 . . . . 20 GLU CG . 11274 1
165 . 1 1 20 20 GLU N N 15 120.308 0.300 . 1 . . . . 20 GLU N . 11274 1
166 . 1 1 21 21 LYS H H 1 8.061 0.030 . 1 . . . . 21 LYS H . 11274 1
167 . 1 1 21 21 LYS HA H 1 4.223 0.030 . 1 . . . . 21 LYS HA . 11274 1
168 . 1 1 21 21 LYS HB2 H 1 1.901 0.030 . 2 . . . . 21 LYS HB2 . 11274 1
169 . 1 1 21 21 LYS HB3 H 1 2.450 0.030 . 2 . . . . 21 LYS HB3 . 11274 1
170 . 1 1 21 21 LYS HD2 H 1 2.113 0.030 . 2 . . . . 21 LYS HD2 . 11274 1
171 . 1 1 21 21 LYS HD3 H 1 1.922 0.030 . 2 . . . . 21 LYS HD3 . 11274 1
172 . 1 1 21 21 LYS HE2 H 1 3.099 0.030 . 2 . . . . 21 LYS HE2 . 11274 1
173 . 1 1 21 21 LYS HE3 H 1 3.223 0.030 . 2 . . . . 21 LYS HE3 . 11274 1
174 . 1 1 21 21 LYS HG2 H 1 1.593 0.030 . 2 . . . . 21 LYS HG2 . 11274 1
175 . 1 1 21 21 LYS HG3 H 1 2.034 0.030 . 2 . . . . 21 LYS HG3 . 11274 1
176 . 1 1 21 21 LYS C C 13 178.213 0.300 . 1 . . . . 21 LYS C . 11274 1
177 . 1 1 21 21 LYS CA C 13 60.363 0.300 . 1 . . . . 21 LYS CA . 11274 1
178 . 1 1 21 21 LYS CB C 13 34.079 0.300 . 1 . . . . 21 LYS CB . 11274 1
179 . 1 1 21 21 LYS CD C 13 30.988 0.300 . 1 . . . . 21 LYS CD . 11274 1
180 . 1 1 21 21 LYS CE C 13 42.828 0.300 . 1 . . . . 21 LYS CE . 11274 1
181 . 1 1 21 21 LYS CG C 13 27.124 0.300 . 1 . . . . 21 LYS CG . 11274 1
182 . 1 1 21 21 LYS N N 15 119.847 0.300 . 1 . . . . 21 LYS N . 11274 1
183 . 1 1 22 22 LEU H H 1 8.665 0.030 . 1 . . . . 22 LEU H . 11274 1
184 . 1 1 22 22 LEU HA H 1 3.960 0.030 . 1 . . . . 22 LEU HA . 11274 1
185 . 1 1 22 22 LEU HB2 H 1 2.034 0.030 . 1 . . . . 22 LEU HB2 . 11274 1
186 . 1 1 22 22 LEU HB3 H 1 2.034 0.030 . 1 . . . . 22 LEU HB3 . 11274 1
187 . 1 1 22 22 LEU HD11 H 1 1.040 0.030 . 1 . . . . 22 LEU HD1 . 11274 1
188 . 1 1 22 22 LEU HD12 H 1 1.040 0.030 . 1 . . . . 22 LEU HD1 . 11274 1
189 . 1 1 22 22 LEU HD13 H 1 1.040 0.030 . 1 . . . . 22 LEU HD1 . 11274 1
190 . 1 1 22 22 LEU HD21 H 1 0.942 0.030 . 1 . . . . 22 LEU HD2 . 11274 1
191 . 1 1 22 22 LEU HD22 H 1 0.942 0.030 . 1 . . . . 22 LEU HD2 . 11274 1
192 . 1 1 22 22 LEU HD23 H 1 0.942 0.030 . 1 . . . . 22 LEU HD2 . 11274 1
193 . 1 1 22 22 LEU HG H 1 1.885 0.030 . 1 . . . . 22 LEU HG . 11274 1
194 . 1 1 22 22 LEU C C 13 178.770 0.300 . 1 . . . . 22 LEU C . 11274 1
195 . 1 1 22 22 LEU CA C 13 59.378 0.300 . 1 . . . . 22 LEU CA . 11274 1
196 . 1 1 22 22 LEU CB C 13 42.284 0.300 . 1 . . . . 22 LEU CB . 11274 1
197 . 1 1 22 22 LEU CD1 C 13 26.562 0.300 . 2 . . . . 22 LEU CD1 . 11274 1
198 . 1 1 22 22 LEU CD2 C 13 25.315 0.300 . 2 . . . . 22 LEU CD2 . 11274 1
199 . 1 1 22 22 LEU CG C 13 27.600 0.300 . 1 . . . . 22 LEU CG . 11274 1
200 . 1 1 22 22 LEU N N 15 121.160 0.300 . 1 . . . . 22 LEU N . 11274 1
201 . 1 1 23 23 LEU H H 1 7.958 0.030 . 1 . . . . 23 LEU H . 11274 1
202 . 1 1 23 23 LEU HA H 1 4.144 0.030 . 1 . . . . 23 LEU HA . 11274 1
203 . 1 1 23 23 LEU HB2 H 1 1.912 0.030 . 2 . . . . 23 LEU HB2 . 11274 1
204 . 1 1 23 23 LEU HB3 H 1 1.642 0.030 . 2 . . . . 23 LEU HB3 . 11274 1
205 . 1 1 23 23 LEU HD11 H 1 0.868 0.030 . 1 . . . . 23 LEU HD1 . 11274 1
206 . 1 1 23 23 LEU HD12 H 1 0.868 0.030 . 1 . . . . 23 LEU HD1 . 11274 1
207 . 1 1 23 23 LEU HD13 H 1 0.868 0.030 . 1 . . . . 23 LEU HD1 . 11274 1
208 . 1 1 23 23 LEU HD21 H 1 0.919 0.030 . 1 . . . . 23 LEU HD2 . 11274 1
209 . 1 1 23 23 LEU HD22 H 1 0.919 0.030 . 1 . . . . 23 LEU HD2 . 11274 1
210 . 1 1 23 23 LEU HD23 H 1 0.919 0.030 . 1 . . . . 23 LEU HD2 . 11274 1
211 . 1 1 23 23 LEU HG H 1 1.919 0.030 . 1 . . . . 23 LEU HG . 11274 1
212 . 1 1 23 23 LEU C C 13 180.223 0.300 . 1 . . . . 23 LEU C . 11274 1
213 . 1 1 23 23 LEU CA C 13 58.146 0.300 . 1 . . . . 23 LEU CA . 11274 1
214 . 1 1 23 23 LEU CB C 13 41.462 0.300 . 1 . . . . 23 LEU CB . 11274 1
215 . 1 1 23 23 LEU CD1 C 13 25.151 0.300 . 2 . . . . 23 LEU CD1 . 11274 1
216 . 1 1 23 23 LEU CD2 C 13 22.869 0.300 . 2 . . . . 23 LEU CD2 . 11274 1
217 . 1 1 23 23 LEU CG C 13 27.161 0.300 . 1 . . . . 23 LEU CG . 11274 1
218 . 1 1 23 23 LEU N N 15 118.653 0.300 . 1 . . . . 23 LEU N . 11274 1
219 . 1 1 24 24 GLN H H 1 8.149 0.030 . 1 . . . . 24 GLN H . 11274 1
220 . 1 1 24 24 GLN HA H 1 4.189 0.030 . 1 . . . . 24 GLN HA . 11274 1
221 . 1 1 24 24 GLN HB2 H 1 2.300 0.030 . 2 . . . . 24 GLN HB2 . 11274 1
222 . 1 1 24 24 GLN HB3 H 1 2.187 0.030 . 2 . . . . 24 GLN HB3 . 11274 1
223 . 1 1 24 24 GLN HE21 H 1 6.788 0.030 . 2 . . . . 24 GLN HE21 . 11274 1
224 . 1 1 24 24 GLN HE22 H 1 7.322 0.030 . 2 . . . . 24 GLN HE22 . 11274 1
225 . 1 1 24 24 GLN HG2 H 1 2.639 0.030 . 2 . . . . 24 GLN HG2 . 11274 1
226 . 1 1 24 24 GLN HG3 H 1 2.359 0.030 . 2 . . . . 24 GLN HG3 . 11274 1
227 . 1 1 24 24 GLN C C 13 178.649 0.300 . 1 . . . . 24 GLN C . 11274 1
228 . 1 1 24 24 GLN CA C 13 59.096 0.300 . 1 . . . . 24 GLN CA . 11274 1
229 . 1 1 24 24 GLN CB C 13 28.698 0.300 . 1 . . . . 24 GLN CB . 11274 1
230 . 1 1 24 24 GLN CG C 13 33.866 0.300 . 1 . . . . 24 GLN CG . 11274 1
231 . 1 1 24 24 GLN N N 15 120.086 0.300 . 1 . . . . 24 GLN N . 11274 1
232 . 1 1 24 24 GLN NE2 N 15 109.935 0.300 . 1 . . . . 24 GLN NE2 . 11274 1
233 . 1 1 25 25 PHE H H 1 9.063 0.030 . 1 . . . . 25 PHE H . 11274 1
234 . 1 1 25 25 PHE HA H 1 4.037 0.030 . 1 . . . . 25 PHE HA . 11274 1
235 . 1 1 25 25 PHE HB2 H 1 3.181 0.030 . 2 . . . . 25 PHE HB2 . 11274 1
236 . 1 1 25 25 PHE HB3 H 1 3.306 0.030 . 2 . . . . 25 PHE HB3 . 11274 1
237 . 1 1 25 25 PHE HD1 H 1 7.027 0.030 . 1 . . . . 25 PHE HD1 . 11274 1
238 . 1 1 25 25 PHE HD2 H 1 7.027 0.030 . 1 . . . . 25 PHE HD2 . 11274 1
239 . 1 1 25 25 PHE HE1 H 1 7.115 0.030 . 1 . . . . 25 PHE HE1 . 11274 1
240 . 1 1 25 25 PHE HE2 H 1 7.115 0.030 . 1 . . . . 25 PHE HE2 . 11274 1
241 . 1 1 25 25 PHE HZ H 1 7.117 0.030 . 1 . . . . 25 PHE HZ . 11274 1
242 . 1 1 25 25 PHE C C 13 178.697 0.300 . 1 . . . . 25 PHE C . 11274 1
243 . 1 1 25 25 PHE CA C 13 62.262 0.300 . 1 . . . . 25 PHE CA . 11274 1
244 . 1 1 25 25 PHE CB C 13 40.558 0.300 . 1 . . . . 25 PHE CB . 11274 1
245 . 1 1 25 25 PHE CD1 C 13 131.181 0.300 . 1 . . . . 25 PHE CD1 . 11274 1
246 . 1 1 25 25 PHE CD2 C 13 131.181 0.300 . 1 . . . . 25 PHE CD2 . 11274 1
247 . 1 1 25 25 PHE CE1 C 13 129.884 0.300 . 1 . . . . 25 PHE CE1 . 11274 1
248 . 1 1 25 25 PHE CE2 C 13 129.884 0.300 . 1 . . . . 25 PHE CE2 . 11274 1
249 . 1 1 25 25 PHE CZ C 13 131.977 0.300 . 1 . . . . 25 PHE CZ . 11274 1
250 . 1 1 25 25 PHE N N 15 120.437 0.300 . 1 . . . . 25 PHE N . 11274 1
251 . 1 1 26 26 GLN H H 1 8.937 0.030 . 1 . . . . 26 GLN H . 11274 1
252 . 1 1 26 26 GLN HA H 1 3.789 0.030 . 1 . . . . 26 GLN HA . 11274 1
253 . 1 1 26 26 GLN HB2 H 1 2.334 0.030 . 2 . . . . 26 GLN HB2 . 11274 1
254 . 1 1 26 26 GLN HB3 H 1 2.261 0.030 . 2 . . . . 26 GLN HB3 . 11274 1
255 . 1 1 26 26 GLN HE21 H 1 7.200 0.030 . 2 . . . . 26 GLN HE21 . 11274 1
256 . 1 1 26 26 GLN HE22 H 1 6.265 0.030 . 2 . . . . 26 GLN HE22 . 11274 1
257 . 1 1 26 26 GLN HG2 H 1 2.681 0.030 . 2 . . . . 26 GLN HG2 . 11274 1
258 . 1 1 26 26 GLN HG3 H 1 2.297 0.030 . 2 . . . . 26 GLN HG3 . 11274 1
259 . 1 1 26 26 GLN C C 13 178.285 0.300 . 1 . . . . 26 GLN C . 11274 1
260 . 1 1 26 26 GLN CA C 13 60.679 0.300 . 1 . . . . 26 GLN CA . 11274 1
261 . 1 1 26 26 GLN CB C 13 29.106 0.300 . 1 . . . . 26 GLN CB . 11274 1
262 . 1 1 26 26 GLN CG C 13 34.576 0.300 . 1 . . . . 26 GLN CG . 11274 1
263 . 1 1 26 26 GLN N N 15 122.718 0.300 . 1 . . . . 26 GLN N . 11274 1
264 . 1 1 26 26 GLN NE2 N 15 109.626 0.300 . 1 . . . . 26 GLN NE2 . 11274 1
265 . 1 1 27 27 ASP H H 1 8.103 0.030 . 1 . . . . 27 ASP H . 11274 1
266 . 1 1 27 27 ASP HA H 1 4.337 0.030 . 1 . . . . 27 ASP HA . 11274 1
267 . 1 1 27 27 ASP HB2 H 1 2.722 0.030 . 2 . . . . 27 ASP HB2 . 11274 1
268 . 1 1 27 27 ASP HB3 H 1 2.840 0.030 . 2 . . . . 27 ASP HB3 . 11274 1
269 . 1 1 27 27 ASP C C 13 178.455 0.300 . 1 . . . . 27 ASP C . 11274 1
270 . 1 1 27 27 ASP CA C 13 57.584 0.300 . 1 . . . . 27 ASP CA . 11274 1
271 . 1 1 27 27 ASP CB C 13 41.298 0.300 . 1 . . . . 27 ASP CB . 11274 1
272 . 1 1 27 27 ASP N N 15 120.468 0.300 . 1 . . . . 27 ASP N . 11274 1
273 . 1 1 28 28 LEU H H 1 7.932 0.030 . 1 . . . . 28 LEU H . 11274 1
274 . 1 1 28 28 LEU HA H 1 4.105 0.030 . 1 . . . . 28 LEU HA . 11274 1
275 . 1 1 28 28 LEU HB2 H 1 1.383 0.030 . 2 . . . . 28 LEU HB2 . 11274 1
276 . 1 1 28 28 LEU HB3 H 1 1.735 0.030 . 2 . . . . 28 LEU HB3 . 11274 1
277 . 1 1 28 28 LEU HD11 H 1 0.875 0.030 . 1 . . . . 28 LEU HD1 . 11274 1
278 . 1 1 28 28 LEU HD12 H 1 0.875 0.030 . 1 . . . . 28 LEU HD1 . 11274 1
279 . 1 1 28 28 LEU HD13 H 1 0.875 0.030 . 1 . . . . 28 LEU HD1 . 11274 1
280 . 1 1 28 28 LEU HD21 H 1 0.880 0.030 . 1 . . . . 28 LEU HD2 . 11274 1
281 . 1 1 28 28 LEU HD22 H 1 0.880 0.030 . 1 . . . . 28 LEU HD2 . 11274 1
282 . 1 1 28 28 LEU HD23 H 1 0.880 0.030 . 1 . . . . 28 LEU HD2 . 11274 1
283 . 1 1 28 28 LEU HG H 1 1.834 0.030 . 1 . . . . 28 LEU HG . 11274 1
284 . 1 1 28 28 LEU C C 13 179.133 0.300 . 1 . . . . 28 LEU C . 11274 1
285 . 1 1 28 28 LEU CA C 13 57.232 0.300 . 1 . . . . 28 LEU CA . 11274 1
286 . 1 1 28 28 LEU CB C 13 43.682 0.300 . 1 . . . . 28 LEU CB . 11274 1
287 . 1 1 28 28 LEU CD1 C 13 25.808 0.300 . 2 . . . . 28 LEU CD1 . 11274 1
288 . 1 1 28 28 LEU CD2 C 13 23.175 0.300 . 2 . . . . 28 LEU CD2 . 11274 1
289 . 1 1 28 28 LEU CG C 13 26.915 0.300 . 1 . . . . 28 LEU CG . 11274 1
290 . 1 1 28 28 LEU N N 15 116.877 0.300 . 1 . . . . 28 LEU N . 11274 1
291 . 1 1 29 29 THR H H 1 7.544 0.030 . 1 . . . . 29 THR H . 11274 1
292 . 1 1 29 29 THR HA H 1 4.172 0.030 . 1 . . . . 29 THR HA . 11274 1
293 . 1 1 29 29 THR HB H 1 3.758 0.030 . 1 . . . . 29 THR HB . 11274 1
294 . 1 1 29 29 THR HG21 H 1 0.487 0.030 . 1 . . . . 29 THR HG2 . 11274 1
295 . 1 1 29 29 THR HG22 H 1 0.487 0.030 . 1 . . . . 29 THR HG2 . 11274 1
296 . 1 1 29 29 THR HG23 H 1 0.487 0.030 . 1 . . . . 29 THR HG2 . 11274 1
297 . 1 1 29 29 THR C C 13 176.493 0.300 . 1 . . . . 29 THR C . 11274 1
298 . 1 1 29 29 THR CA C 13 62.649 0.300 . 1 . . . . 29 THR CA . 11274 1
299 . 1 1 29 29 THR CB C 13 71.447 0.300 . 1 . . . . 29 THR CB . 11274 1
300 . 1 1 29 29 THR CG2 C 13 20.960 0.300 . 1 . . . . 29 THR CG2 . 11274 1
301 . 1 1 29 29 THR N N 15 105.379 0.300 . 1 . . . . 29 THR N . 11274 1
302 . 1 1 30 30 GLY H H 1 8.454 0.030 . 1 . . . . 30 GLY H . 11274 1
303 . 1 1 30 30 GLY HA2 H 1 3.788 0.030 . 2 . . . . 30 GLY HA2 . 11274 1
304 . 1 1 30 30 GLY HA3 H 1 4.002 0.030 . 2 . . . . 30 GLY HA3 . 11274 1
305 . 1 1 30 30 GLY C C 13 174.458 0.300 . 1 . . . . 30 GLY C . 11274 1
306 . 1 1 30 30 GLY CA C 13 46.207 0.300 . 1 . . . . 30 GLY CA . 11274 1
307 . 1 1 30 30 GLY N N 15 112.396 0.300 . 1 . . . . 30 GLY N . 11274 1
308 . 1 1 31 31 ILE H H 1 7.194 0.030 . 1 . . . . 31 ILE H . 11274 1
309 . 1 1 31 31 ILE HA H 1 3.737 0.030 . 1 . . . . 31 ILE HA . 11274 1
310 . 1 1 31 31 ILE HB H 1 1.636 0.030 . 1 . . . . 31 ILE HB . 11274 1
311 . 1 1 31 31 ILE HD11 H 1 0.895 0.030 . 1 . . . . 31 ILE HD1 . 11274 1
312 . 1 1 31 31 ILE HD12 H 1 0.895 0.030 . 1 . . . . 31 ILE HD1 . 11274 1
313 . 1 1 31 31 ILE HD13 H 1 0.895 0.030 . 1 . . . . 31 ILE HD1 . 11274 1
314 . 1 1 31 31 ILE HG12 H 1 0.970 0.030 . 2 . . . . 31 ILE HG12 . 11274 1
315 . 1 1 31 31 ILE HG13 H 1 1.321 0.030 . 2 . . . . 31 ILE HG13 . 11274 1
316 . 1 1 31 31 ILE HG21 H 1 0.972 0.030 . 1 . . . . 31 ILE HG2 . 11274 1
317 . 1 1 31 31 ILE HG22 H 1 0.972 0.030 . 1 . . . . 31 ILE HG2 . 11274 1
318 . 1 1 31 31 ILE HG23 H 1 0.972 0.030 . 1 . . . . 31 ILE HG2 . 11274 1
319 . 1 1 31 31 ILE C C 13 176.250 0.300 . 1 . . . . 31 ILE C . 11274 1
320 . 1 1 31 31 ILE CA C 13 62.601 0.300 . 1 . . . . 31 ILE CA . 11274 1
321 . 1 1 31 31 ILE CB C 13 38.420 0.300 . 1 . . . . 31 ILE CB . 11274 1
322 . 1 1 31 31 ILE CD1 C 13 13.064 0.300 . 1 . . . . 31 ILE CD1 . 11274 1
323 . 1 1 31 31 ILE CG1 C 13 28.632 0.300 . 1 . . . . 31 ILE CG1 . 11274 1
324 . 1 1 31 31 ILE CG2 C 13 18.404 0.300 . 1 . . . . 31 ILE CG2 . 11274 1
325 . 1 1 31 31 ILE N N 15 121.693 0.300 . 1 . . . . 31 ILE N . 11274 1
326 . 1 1 32 32 GLU H H 1 8.412 0.030 . 1 . . . . 32 GLU H . 11274 1
327 . 1 1 32 32 GLU HA H 1 3.919 0.030 . 1 . . . . 32 GLU HA . 11274 1
328 . 1 1 32 32 GLU HB2 H 1 1.953 0.030 . 2 . . . . 32 GLU HB2 . 11274 1
329 . 1 1 32 32 GLU HB3 H 1 2.027 0.030 . 2 . . . . 32 GLU HB3 . 11274 1
330 . 1 1 32 32 GLU HG2 H 1 2.209 0.030 . 2 . . . . 32 GLU HG2 . 11274 1
331 . 1 1 32 32 GLU HG3 H 1 2.345 0.030 . 2 . . . . 32 GLU HG3 . 11274 1
332 . 1 1 32 32 GLU C C 13 177.026 0.300 . 1 . . . . 32 GLU C . 11274 1
333 . 1 1 32 32 GLU CA C 13 58.780 0.300 . 1 . . . . 32 GLU CA . 11274 1
334 . 1 1 32 32 GLU CB C 13 30.609 0.300 . 1 . . . . 32 GLU CB . 11274 1
335 . 1 1 32 32 GLU CG C 13 37.043 0.300 . 1 . . . . 32 GLU CG . 11274 1
336 . 1 1 32 32 GLU N N 15 127.205 0.300 . 1 . . . . 32 GLU N . 11274 1
337 . 1 1 33 33 SER H H 1 7.556 0.030 . 1 . . . . 33 SER H . 11274 1
338 . 1 1 33 33 SER HA H 1 4.592 0.030 . 1 . . . . 33 SER HA . 11274 1
339 . 1 1 33 33 SER HB2 H 1 4.074 0.030 . 2 . . . . 33 SER HB2 . 11274 1
340 . 1 1 33 33 SER HB3 H 1 3.834 0.030 . 2 . . . . 33 SER HB3 . 11274 1
341 . 1 1 33 33 SER C C 13 176.250 0.300 . 1 . . . . 33 SER C . 11274 1
342 . 1 1 33 33 SER CA C 13 56.659 0.300 . 1 . . . . 33 SER CA . 11274 1
343 . 1 1 33 33 SER CB C 13 63.207 0.300 . 1 . . . . 33 SER CB . 11274 1
344 . 1 1 33 33 SER N N 15 111.324 0.300 . 1 . . . . 33 SER N . 11274 1
345 . 1 1 34 34 MET HA H 1 4.181 0.030 . 1 . . . . 34 MET HA . 11274 1
346 . 1 1 34 34 MET HB2 H 1 2.246 0.030 . 2 . . . . 34 MET HB2 . 11274 1
347 . 1 1 34 34 MET HB3 H 1 2.093 0.030 . 2 . . . . 34 MET HB3 . 11274 1
348 . 1 1 34 34 MET HE1 H 1 2.105 0.030 . 1 . . . . 34 MET HE . 11274 1
349 . 1 1 34 34 MET HE2 H 1 2.105 0.030 . 1 . . . . 34 MET HE . 11274 1
350 . 1 1 34 34 MET HE3 H 1 2.105 0.030 . 1 . . . . 34 MET HE . 11274 1
351 . 1 1 34 34 MET HG2 H 1 2.632 0.030 . 2 . . . . 34 MET HG2 . 11274 1
352 . 1 1 34 34 MET HG3 H 1 2.748 0.030 . 2 . . . . 34 MET HG3 . 11274 1
353 . 1 1 34 34 MET C C 13 178.552 0.300 . 1 . . . . 34 MET C . 11274 1
354 . 1 1 34 34 MET CA C 13 58.885 0.300 . 1 . . . . 34 MET CA . 11274 1
355 . 1 1 34 34 MET CB C 13 32.089 0.300 . 1 . . . . 34 MET CB . 11274 1
356 . 1 1 34 34 MET CE C 13 17.299 0.300 . 1 . . . . 34 MET CE . 11274 1
357 . 1 1 34 34 MET CG C 13 32.730 0.300 . 1 . . . . 34 MET CG . 11274 1
358 . 1 1 35 35 ASP H H 1 8.320 0.030 . 1 . . . . 35 ASP H . 11274 1
359 . 1 1 35 35 ASP HA H 1 4.320 0.030 . 1 . . . . 35 ASP HA . 11274 1
360 . 1 1 35 35 ASP HB2 H 1 2.572 0.030 . 2 . . . . 35 ASP HB2 . 11274 1
361 . 1 1 35 35 ASP HB3 H 1 2.485 0.030 . 2 . . . . 35 ASP HB3 . 11274 1
362 . 1 1 35 35 ASP C C 13 178.431 0.300 . 1 . . . . 35 ASP C . 11274 1
363 . 1 1 35 35 ASP CA C 13 57.548 0.300 . 1 . . . . 35 ASP CA . 11274 1
364 . 1 1 35 35 ASP CB C 13 40.618 0.300 . 1 . . . . 35 ASP CB . 11274 1
365 . 1 1 35 35 ASP N N 15 119.482 0.300 . 1 . . . . 35 ASP N . 11274 1
366 . 1 1 36 36 GLN H H 1 7.876 0.030 . 1 . . . . 36 GLN H . 11274 1
367 . 1 1 36 36 GLN HA H 1 4.137 0.030 . 1 . . . . 36 GLN HA . 11274 1
368 . 1 1 36 36 GLN HB2 H 1 2.162 0.030 . 1 . . . . 36 GLN HB2 . 11274 1
369 . 1 1 36 36 GLN HB3 H 1 2.162 0.030 . 1 . . . . 36 GLN HB3 . 11274 1
370 . 1 1 36 36 GLN HE21 H 1 6.970 0.030 . 2 . . . . 36 GLN HE21 . 11274 1
371 . 1 1 36 36 GLN HE22 H 1 7.655 0.030 . 2 . . . . 36 GLN HE22 . 11274 1
372 . 1 1 36 36 GLN HG2 H 1 2.409 0.030 . 2 . . . . 36 GLN HG2 . 11274 1
373 . 1 1 36 36 GLN HG3 H 1 2.532 0.030 . 2 . . . . 36 GLN HG3 . 11274 1
374 . 1 1 36 36 GLN C C 13 179.690 0.300 . 1 . . . . 36 GLN C . 11274 1
375 . 1 1 36 36 GLN CA C 13 58.780 0.300 . 1 . . . . 36 GLN CA . 11274 1
376 . 1 1 36 36 GLN CB C 13 28.479 0.300 . 1 . . . . 36 GLN CB . 11274 1
377 . 1 1 36 36 GLN CG C 13 33.701 0.300 . 1 . . . . 36 GLN CG . 11274 1
378 . 1 1 36 36 GLN N N 15 120.582 0.300 . 1 . . . . 36 GLN N . 11274 1
379 . 1 1 36 36 GLN NE2 N 15 112.140 0.300 . 1 . . . . 36 GLN NE2 . 11274 1
380 . 1 1 37 37 CYS H H 1 7.935 0.030 . 1 . . . . 37 CYS H . 11274 1
381 . 1 1 37 37 CYS HA H 1 3.968 0.030 . 1 . . . . 37 CYS HA . 11274 1
382 . 1 1 37 37 CYS HB2 H 1 2.544 0.030 . 2 . . . . 37 CYS HB2 . 11274 1
383 . 1 1 37 37 CYS HB3 H 1 3.408 0.030 . 2 . . . . 37 CYS HB3 . 11274 1
384 . 1 1 37 37 CYS C C 13 175.427 0.300 . 1 . . . . 37 CYS C . 11274 1
385 . 1 1 37 37 CYS CA C 13 64.338 0.300 . 1 . . . . 37 CYS CA . 11274 1
386 . 1 1 37 37 CYS CB C 13 27.351 0.300 . 1 . . . . 37 CYS CB . 11274 1
387 . 1 1 37 37 CYS N N 15 118.302 0.300 . 1 . . . . 37 CYS N . 11274 1
388 . 1 1 38 38 ARG H H 1 8.427 0.030 . 1 . . . . 38 ARG H . 11274 1
389 . 1 1 38 38 ARG HA H 1 3.533 0.030 . 1 . . . . 38 ARG HA . 11274 1
390 . 1 1 38 38 ARG HB2 H 1 1.893 0.030 . 2 . . . . 38 ARG HB2 . 11274 1
391 . 1 1 38 38 ARG HB3 H 1 2.007 0.030 . 2 . . . . 38 ARG HB3 . 11274 1
392 . 1 1 38 38 ARG HD2 H 1 3.255 0.030 . 1 . . . . 38 ARG HD2 . 11274 1
393 . 1 1 38 38 ARG HD3 H 1 3.255 0.030 . 1 . . . . 38 ARG HD3 . 11274 1
394 . 1 1 38 38 ARG HE H 1 7.772 0.030 . 1 . . . . 38 ARG HE . 11274 1
395 . 1 1 38 38 ARG HG2 H 1 1.705 0.030 . 2 . . . . 38 ARG HG2 . 11274 1
396 . 1 1 38 38 ARG HG3 H 1 1.655 0.030 . 2 . . . . 38 ARG HG3 . 11274 1
397 . 1 1 38 38 ARG C C 13 176.953 0.300 . 1 . . . . 38 ARG C . 11274 1
398 . 1 1 38 38 ARG CA C 13 60.152 0.300 . 1 . . . . 38 ARG CA . 11274 1
399 . 1 1 38 38 ARG CB C 13 29.796 0.300 . 1 . . . . 38 ARG CB . 11274 1
400 . 1 1 38 38 ARG CD C 13 43.884 0.300 . 1 . . . . 38 ARG CD . 11274 1
401 . 1 1 38 38 ARG CG C 13 27.820 0.300 . 1 . . . . 38 ARG CG . 11274 1
402 . 1 1 38 38 ARG N N 15 119.334 0.300 . 1 . . . . 38 ARG N . 11274 1
403 . 1 1 38 38 ARG NE N 15 84.408 0.300 . 1 . . . . 38 ARG NE . 11274 1
404 . 1 1 39 39 HIS H H 1 8.163 0.030 . 1 . . . . 39 HIS H . 11274 1
405 . 1 1 39 39 HIS HA H 1 4.293 0.030 . 1 . . . . 39 HIS HA . 11274 1
406 . 1 1 39 39 HIS HB2 H 1 3.187 0.030 . 1 . . . . 39 HIS HB2 . 11274 1
407 . 1 1 39 39 HIS HB3 H 1 3.187 0.030 . 1 . . . . 39 HIS HB3 . 11274 1
408 . 1 1 39 39 HIS HD2 H 1 7.069 0.030 . 1 . . . . 39 HIS HD2 . 11274 1
409 . 1 1 39 39 HIS C C 13 177.801 0.300 . 1 . . . . 39 HIS C . 11274 1
410 . 1 1 39 39 HIS CA C 13 59.589 0.300 . 1 . . . . 39 HIS CA . 11274 1
411 . 1 1 39 39 HIS CB C 13 29.577 0.300 . 1 . . . . 39 HIS CB . 11274 1
412 . 1 1 39 39 HIS CD2 C 13 119.989 0.300 . 1 . . . . 39 HIS CD2 . 11274 1
413 . 1 1 39 39 HIS N N 15 117.153 0.300 . 1 . . . . 39 HIS N . 11274 1
414 . 1 1 40 40 THR H H 1 7.937 0.030 . 1 . . . . 40 THR H . 11274 1
415 . 1 1 40 40 THR HA H 1 3.935 0.030 . 1 . . . . 40 THR HA . 11274 1
416 . 1 1 40 40 THR HB H 1 3.947 0.030 . 1 . . . . 40 THR HB . 11274 1
417 . 1 1 40 40 THR HG21 H 1 1.229 0.030 . 1 . . . . 40 THR HG2 . 11274 1
418 . 1 1 40 40 THR HG22 H 1 1.229 0.030 . 1 . . . . 40 THR HG2 . 11274 1
419 . 1 1 40 40 THR HG23 H 1 1.229 0.030 . 1 . . . . 40 THR HG2 . 11274 1
420 . 1 1 40 40 THR C C 13 176.638 0.300 . 1 . . . . 40 THR C . 11274 1
421 . 1 1 40 40 THR CA C 13 66.660 0.300 . 1 . . . . 40 THR CA . 11274 1
422 . 1 1 40 40 THR CB C 13 68.685 0.300 . 1 . . . . 40 THR CB . 11274 1
423 . 1 1 40 40 THR CG2 C 13 22.702 0.300 . 1 . . . . 40 THR CG2 . 11274 1
424 . 1 1 40 40 THR N N 15 114.872 0.300 . 1 . . . . 40 THR N . 11274 1
425 . 1 1 41 41 LEU H H 1 7.653 0.030 . 1 . . . . 41 LEU H . 11274 1
426 . 1 1 41 41 LEU HA H 1 3.202 0.030 . 1 . . . . 41 LEU HA . 11274 1
427 . 1 1 41 41 LEU HB2 H 1 -0.268 0.030 . 2 . . . . 41 LEU HB2 . 11274 1
428 . 1 1 41 41 LEU HB3 H 1 0.711 0.030 . 2 . . . . 41 LEU HB3 . 11274 1
429 . 1 1 41 41 LEU HD11 H 1 0.520 0.030 . 1 . . . . 41 LEU HD1 . 11274 1
430 . 1 1 41 41 LEU HD12 H 1 0.520 0.030 . 1 . . . . 41 LEU HD1 . 11274 1
431 . 1 1 41 41 LEU HD13 H 1 0.520 0.030 . 1 . . . . 41 LEU HD1 . 11274 1
432 . 1 1 41 41 LEU HD21 H 1 0.146 0.030 . 1 . . . . 41 LEU HD2 . 11274 1
433 . 1 1 41 41 LEU HD22 H 1 0.146 0.030 . 1 . . . . 41 LEU HD2 . 11274 1
434 . 1 1 41 41 LEU HD23 H 1 0.146 0.030 . 1 . . . . 41 LEU HD2 . 11274 1
435 . 1 1 41 41 LEU HG H 1 0.635 0.030 . 1 . . . . 41 LEU HG . 11274 1
436 . 1 1 41 41 LEU C C 13 179.642 0.300 . 1 . . . . 41 LEU C . 11274 1
437 . 1 1 41 41 LEU CA C 13 58.441 0.300 . 1 . . . . 41 LEU CA . 11274 1
438 . 1 1 41 41 LEU CB C 13 39.736 0.300 . 1 . . . . 41 LEU CB . 11274 1
439 . 1 1 41 41 LEU CD1 C 13 25.808 0.300 . 2 . . . . 41 LEU CD1 . 11274 1
440 . 1 1 41 41 LEU CD2 C 13 22.989 0.300 . 2 . . . . 41 LEU CD2 . 11274 1
441 . 1 1 41 41 LEU CG C 13 27.396 0.300 . 1 . . . . 41 LEU CG . 11274 1
442 . 1 1 41 41 LEU N N 15 122.368 0.300 . 1 . . . . 41 LEU N . 11274 1
443 . 1 1 42 42 GLU H H 1 8.300 0.030 . 1 . . . . 42 GLU H . 11274 1
444 . 1 1 42 42 GLU HA H 1 3.294 0.030 . 1 . . . . 42 GLU HA . 11274 1
445 . 1 1 42 42 GLU HB2 H 1 1.894 0.030 . 2 . . . . 42 GLU HB2 . 11274 1
446 . 1 1 42 42 GLU HB3 H 1 2.078 0.030 . 2 . . . . 42 GLU HB3 . 11274 1
447 . 1 1 42 42 GLU HG2 H 1 2.358 0.030 . 1 . . . . 42 GLU HG2 . 11274 1
448 . 1 1 42 42 GLU HG3 H 1 2.358 0.030 . 1 . . . . 42 GLU HG3 . 11274 1
449 . 1 1 42 42 GLU C C 13 180.659 0.300 . 1 . . . . 42 GLU C . 11274 1
450 . 1 1 42 42 GLU CA C 13 59.905 0.300 . 1 . . . . 42 GLU CA . 11274 1
451 . 1 1 42 42 GLU CB C 13 29.047 0.300 . 1 . . . . 42 GLU CB . 11274 1
452 . 1 1 42 42 GLU CG C 13 37.072 0.300 . 1 . . . . 42 GLU CG . 11274 1
453 . 1 1 42 42 GLU N N 15 121.030 0.300 . 1 . . . . 42 GLU N . 11274 1
454 . 1 1 43 43 GLN H H 1 7.657 0.030 . 1 . . . . 43 GLN H . 11274 1
455 . 1 1 43 43 GLN HA H 1 3.868 0.030 . 1 . . . . 43 GLN HA . 11274 1
456 . 1 1 43 43 GLN HB2 H 1 1.964 0.030 . 2 . . . . 43 GLN HB2 . 11274 1
457 . 1 1 43 43 GLN HB3 H 1 1.868 0.030 . 2 . . . . 43 GLN HB3 . 11274 1
458 . 1 1 43 43 GLN HE21 H 1 7.138 0.030 . 2 . . . . 43 GLN HE21 . 11274 1
459 . 1 1 43 43 GLN HE22 H 1 6.772 0.030 . 2 . . . . 43 GLN HE22 . 11274 1
460 . 1 1 43 43 GLN HG2 H 1 2.016 0.030 . 2 . . . . 43 GLN HG2 . 11274 1
461 . 1 1 43 43 GLN HG3 H 1 2.097 0.030 . 2 . . . . 43 GLN HG3 . 11274 1
462 . 1 1 43 43 GLN C C 13 176.541 0.300 . 1 . . . . 43 GLN C . 11274 1
463 . 1 1 43 43 GLN CA C 13 57.935 0.300 . 1 . . . . 43 GLN CA . 11274 1
464 . 1 1 43 43 GLN CB C 13 28.259 0.300 . 1 . . . . 43 GLN CB . 11274 1
465 . 1 1 43 43 GLN CG C 13 33.619 0.300 . 1 . . . . 43 GLN CG . 11274 1
466 . 1 1 43 43 GLN N N 15 119.064 0.300 . 1 . . . . 43 GLN N . 11274 1
467 . 1 1 43 43 GLN NE2 N 15 112.229 0.300 . 1 . . . . 43 GLN NE2 . 11274 1
468 . 1 1 44 44 HIS H H 1 7.029 0.030 . 1 . . . . 44 HIS H . 11274 1
469 . 1 1 44 44 HIS HA H 1 4.541 0.030 . 1 . . . . 44 HIS HA . 11274 1
470 . 1 1 44 44 HIS HB2 H 1 2.387 0.030 . 2 . . . . 44 HIS HB2 . 11274 1
471 . 1 1 44 44 HIS HB3 H 1 3.631 0.030 . 2 . . . . 44 HIS HB3 . 11274 1
472 . 1 1 44 44 HIS HD2 H 1 7.199 0.030 . 1 . . . . 44 HIS HD2 . 11274 1
473 . 1 1 44 44 HIS C C 13 175.160 0.300 . 1 . . . . 44 HIS C . 11274 1
474 . 1 1 44 44 HIS CA C 13 56.247 0.300 . 1 . . . . 44 HIS CA . 11274 1
475 . 1 1 44 44 HIS CB C 13 29.952 0.300 . 1 . . . . 44 HIS CB . 11274 1
476 . 1 1 44 44 HIS CD2 C 13 120.215 0.300 . 1 . . . . 44 HIS CD2 . 11274 1
477 . 1 1 44 44 HIS N N 15 115.031 0.300 . 1 . . . . 44 HIS N . 11274 1
478 . 1 1 45 45 ASN H H 1 8.019 0.030 . 1 . . . . 45 ASN H . 11274 1
479 . 1 1 45 45 ASN HA H 1 4.493 0.030 . 1 . . . . 45 ASN HA . 11274 1
480 . 1 1 45 45 ASN HB2 H 1 2.737 0.030 . 2 . . . . 45 ASN HB2 . 11274 1
481 . 1 1 45 45 ASN HB3 H 1 3.156 0.030 . 2 . . . . 45 ASN HB3 . 11274 1
482 . 1 1 45 45 ASN HD21 H 1 7.615 0.030 . 2 . . . . 45 ASN HD21 . 11274 1
483 . 1 1 45 45 ASN HD22 H 1 6.881 0.030 . 2 . . . . 45 ASN HD22 . 11274 1
484 . 1 1 45 45 ASN C C 13 174.119 0.300 . 1 . . . . 45 ASN C . 11274 1
485 . 1 1 45 45 ASN CA C 13 55.086 0.300 . 1 . . . . 45 ASN CA . 11274 1
486 . 1 1 45 45 ASN CB C 13 37.105 0.300 . 1 . . . . 45 ASN CB . 11274 1
487 . 1 1 45 45 ASN N N 15 118.608 0.300 . 1 . . . . 45 ASN N . 11274 1
488 . 1 1 45 45 ASN ND2 N 15 112.461 0.300 . 1 . . . . 45 ASN ND2 . 11274 1
489 . 1 1 46 46 TRP H H 1 8.680 0.030 . 1 . . . . 46 TRP H . 11274 1
490 . 1 1 46 46 TRP HA H 1 3.103 0.030 . 1 . . . . 46 TRP HA . 11274 1
491 . 1 1 46 46 TRP HB2 H 1 3.324 0.030 . 2 . . . . 46 TRP HB2 . 11274 1
492 . 1 1 46 46 TRP HB3 H 1 3.475 0.030 . 2 . . . . 46 TRP HB3 . 11274 1
493 . 1 1 46 46 TRP HD1 H 1 7.183 0.030 . 1 . . . . 46 TRP HD1 . 11274 1
494 . 1 1 46 46 TRP HE1 H 1 10.423 0.030 . 1 . . . . 46 TRP HE1 . 11274 1
495 . 1 1 46 46 TRP HE3 H 1 7.293 0.030 . 1 . . . . 46 TRP HE3 . 11274 1
496 . 1 1 46 46 TRP HH2 H 1 6.881 0.030 . 1 . . . . 46 TRP HH2 . 11274 1
497 . 1 1 46 46 TRP HZ2 H 1 7.446 0.030 . 1 . . . . 46 TRP HZ2 . 11274 1
498 . 1 1 46 46 TRP HZ3 H 1 7.162 0.030 . 1 . . . . 46 TRP HZ3 . 11274 1
499 . 1 1 46 46 TRP C C 13 172.859 0.300 . 1 . . . . 46 TRP C . 11274 1
500 . 1 1 46 46 TRP CA C 13 59.624 0.300 . 1 . . . . 46 TRP CA . 11274 1
501 . 1 1 46 46 TRP CB C 13 24.616 0.300 . 1 . . . . 46 TRP CB . 11274 1
502 . 1 1 46 46 TRP CD1 C 13 127.462 0.300 . 1 . . . . 46 TRP CD1 . 11274 1
503 . 1 1 46 46 TRP CE3 C 13 118.834 0.300 . 1 . . . . 46 TRP CE3 . 11274 1
504 . 1 1 46 46 TRP CH2 C 13 123.399 0.300 . 1 . . . . 46 TRP CH2 . 11274 1
505 . 1 1 46 46 TRP CZ2 C 13 115.498 0.300 . 1 . . . . 46 TRP CZ2 . 11274 1
506 . 1 1 46 46 TRP CZ3 C 13 123.347 0.300 . 1 . . . . 46 TRP CZ3 . 11274 1
507 . 1 1 46 46 TRP N N 15 108.707 0.300 . 1 . . . . 46 TRP N . 11274 1
508 . 1 1 46 46 TRP NE1 N 15 130.516 0.300 . 1 . . . . 46 TRP NE1 . 11274 1
509 . 1 1 47 47 ASN H H 1 7.413 0.030 . 1 . . . . 47 ASN H . 11274 1
510 . 1 1 47 47 ASN HA H 1 4.927 0.030 . 1 . . . . 47 ASN HA . 11274 1
511 . 1 1 47 47 ASN HB2 H 1 2.816 0.030 . 2 . . . . 47 ASN HB2 . 11274 1
512 . 1 1 47 47 ASN HB3 H 1 3.325 0.030 . 2 . . . . 47 ASN HB3 . 11274 1
513 . 1 1 47 47 ASN HD21 H 1 7.673 0.030 . 2 . . . . 47 ASN HD21 . 11274 1
514 . 1 1 47 47 ASN HD22 H 1 7.131 0.030 . 2 . . . . 47 ASN HD22 . 11274 1
515 . 1 1 47 47 ASN C C 13 174.918 0.300 . 1 . . . . 47 ASN C . 11274 1
516 . 1 1 47 47 ASN CA C 13 52.307 0.300 . 1 . . . . 47 ASN CA . 11274 1
517 . 1 1 47 47 ASN CB C 13 38.799 0.300 . 1 . . . . 47 ASN CB . 11274 1
518 . 1 1 47 47 ASN N N 15 118.494 0.300 . 1 . . . . 47 ASN N . 11274 1
519 . 1 1 47 47 ASN ND2 N 15 112.505 0.300 . 1 . . . . 47 ASN ND2 . 11274 1
520 . 1 1 48 48 ILE H H 1 8.500 0.030 . 1 . . . . 48 ILE H . 11274 1
521 . 1 1 48 48 ILE HA H 1 3.501 0.030 . 1 . . . . 48 ILE HA . 11274 1
522 . 1 1 48 48 ILE HB H 1 1.838 0.030 . 1 . . . . 48 ILE HB . 11274 1
523 . 1 1 48 48 ILE HD11 H 1 1.091 0.030 . 1 . . . . 48 ILE HD1 . 11274 1
524 . 1 1 48 48 ILE HD12 H 1 1.091 0.030 . 1 . . . . 48 ILE HD1 . 11274 1
525 . 1 1 48 48 ILE HD13 H 1 1.091 0.030 . 1 . . . . 48 ILE HD1 . 11274 1
526 . 1 1 48 48 ILE HG12 H 1 1.751 0.030 . 2 . . . . 48 ILE HG12 . 11274 1
527 . 1 1 48 48 ILE HG13 H 1 1.261 0.030 . 2 . . . . 48 ILE HG13 . 11274 1
528 . 1 1 48 48 ILE HG21 H 1 1.014 0.030 . 1 . . . . 48 ILE HG2 . 11274 1
529 . 1 1 48 48 ILE HG22 H 1 1.014 0.030 . 1 . . . . 48 ILE HG2 . 11274 1
530 . 1 1 48 48 ILE HG23 H 1 1.014 0.030 . 1 . . . . 48 ILE HG2 . 11274 1
531 . 1 1 48 48 ILE C C 13 176.250 0.300 . 1 . . . . 48 ILE C . 11274 1
532 . 1 1 48 48 ILE CA C 13 65.147 0.300 . 1 . . . . 48 ILE CA . 11274 1
533 . 1 1 48 48 ILE CB C 13 38.360 0.300 . 1 . . . . 48 ILE CB . 11274 1
534 . 1 1 48 48 ILE CD1 C 13 14.030 0.300 . 1 . . . . 48 ILE CD1 . 11274 1
535 . 1 1 48 48 ILE CG1 C 13 29.452 0.300 . 1 . . . . 48 ILE CG1 . 11274 1
536 . 1 1 48 48 ILE CG2 C 13 17.180 0.300 . 1 . . . . 48 ILE CG2 . 11274 1
537 . 1 1 48 48 ILE N N 15 126.076 0.300 . 1 . . . . 48 ILE N . 11274 1
538 . 1 1 49 49 GLU H H 1 8.340 0.030 . 1 . . . . 49 GLU H . 11274 1
539 . 1 1 49 49 GLU HA H 1 3.904 0.030 . 1 . . . . 49 GLU HA . 11274 1
540 . 1 1 49 49 GLU HB2 H 1 2.154 0.030 . 2 . . . . 49 GLU HB2 . 11274 1
541 . 1 1 49 49 GLU HB3 H 1 2.012 0.030 . 2 . . . . 49 GLU HB3 . 11274 1
542 . 1 1 49 49 GLU HG2 H 1 2.308 0.030 . 1 . . . . 49 GLU HG2 . 11274 1
543 . 1 1 49 49 GLU HG3 H 1 2.308 0.030 . 1 . . . . 49 GLU HG3 . 11274 1
544 . 1 1 49 49 GLU C C 13 179.133 0.300 . 1 . . . . 49 GLU C . 11274 1
545 . 1 1 49 49 GLU CA C 13 60.398 0.300 . 1 . . . . 49 GLU CA . 11274 1
546 . 1 1 49 49 GLU CB C 13 28.918 0.300 . 1 . . . . 49 GLU CB . 11274 1
547 . 1 1 49 49 GLU CG C 13 37.072 0.300 . 1 . . . . 49 GLU CG . 11274 1
548 . 1 1 49 49 GLU N N 15 119.798 0.300 . 1 . . . . 49 GLU N . 11274 1
549 . 1 1 50 50 ALA H H 1 7.725 0.030 . 1 . . . . 50 ALA H . 11274 1
550 . 1 1 50 50 ALA HA H 1 4.019 0.030 . 1 . . . . 50 ALA HA . 11274 1
551 . 1 1 50 50 ALA HB1 H 1 1.466 0.030 . 1 . . . . 50 ALA HB . 11274 1
552 . 1 1 50 50 ALA HB2 H 1 1.466 0.030 . 1 . . . . 50 ALA HB . 11274 1
553 . 1 1 50 50 ALA HB3 H 1 1.466 0.030 . 1 . . . . 50 ALA HB . 11274 1
554 . 1 1 50 50 ALA C C 13 179.739 0.300 . 1 . . . . 50 ALA C . 11274 1
555 . 1 1 50 50 ALA CA C 13 54.277 0.300 . 1 . . . . 50 ALA CA . 11274 1
556 . 1 1 50 50 ALA CB C 13 18.523 0.300 . 1 . . . . 50 ALA CB . 11274 1
557 . 1 1 50 50 ALA N N 15 121.126 0.300 . 1 . . . . 50 ALA N . 11274 1
558 . 1 1 51 51 ALA H H 1 7.707 0.030 . 1 . . . . 51 ALA H . 11274 1
559 . 1 1 51 51 ALA HA H 1 2.874 0.030 . 1 . . . . 51 ALA HA . 11274 1
560 . 1 1 51 51 ALA HB1 H 1 1.006 0.030 . 1 . . . . 51 ALA HB . 11274 1
561 . 1 1 51 51 ALA HB2 H 1 1.006 0.030 . 1 . . . . 51 ALA HB . 11274 1
562 . 1 1 51 51 ALA HB3 H 1 1.006 0.030 . 1 . . . . 51 ALA HB . 11274 1
563 . 1 1 51 51 ALA C C 13 179.448 0.300 . 1 . . . . 51 ALA C . 11274 1
564 . 1 1 51 51 ALA CA C 13 54.593 0.300 . 1 . . . . 51 ALA CA . 11274 1
565 . 1 1 51 51 ALA CB C 13 19.263 0.300 . 1 . . . . 51 ALA CB . 11274 1
566 . 1 1 51 51 ALA N N 15 120.354 0.300 . 1 . . . . 51 ALA N . 11274 1
567 . 1 1 52 52 VAL H H 1 8.571 0.030 . 1 . . . . 52 VAL H . 11274 1
568 . 1 1 52 52 VAL HA H 1 3.557 0.030 . 1 . . . . 52 VAL HA . 11274 1
569 . 1 1 52 52 VAL HB H 1 2.169 0.030 . 1 . . . . 52 VAL HB . 11274 1
570 . 1 1 52 52 VAL HG11 H 1 0.872 0.030 . 1 . . . . 52 VAL HG1 . 11274 1
571 . 1 1 52 52 VAL HG12 H 1 0.872 0.030 . 1 . . . . 52 VAL HG1 . 11274 1
572 . 1 1 52 52 VAL HG13 H 1 0.872 0.030 . 1 . . . . 52 VAL HG1 . 11274 1
573 . 1 1 52 52 VAL HG21 H 1 1.062 0.030 . 1 . . . . 52 VAL HG2 . 11274 1
574 . 1 1 52 52 VAL HG22 H 1 1.062 0.030 . 1 . . . . 52 VAL HG2 . 11274 1
575 . 1 1 52 52 VAL HG23 H 1 1.062 0.030 . 1 . . . . 52 VAL HG2 . 11274 1
576 . 1 1 52 52 VAL C C 13 177.873 0.300 . 1 . . . . 52 VAL C . 11274 1
577 . 1 1 52 52 VAL CA C 13 66.238 0.300 . 1 . . . . 52 VAL CA . 11274 1
578 . 1 1 52 52 VAL CB C 13 31.925 0.300 . 1 . . . . 52 VAL CB . 11274 1
579 . 1 1 52 52 VAL CG1 C 13 21.411 0.300 . 2 . . . . 52 VAL CG1 . 11274 1
580 . 1 1 52 52 VAL CG2 C 13 23.567 0.300 . 2 . . . . 52 VAL CG2 . 11274 1
581 . 1 1 52 52 VAL N N 15 117.641 0.300 . 1 . . . . 52 VAL N . 11274 1
582 . 1 1 53 53 GLN H H 1 7.787 0.030 . 1 . . . . 53 GLN H . 11274 1
583 . 1 1 53 53 GLN HA H 1 3.966 0.030 . 1 . . . . 53 GLN HA . 11274 1
584 . 1 1 53 53 GLN HB2 H 1 2.090 0.030 . 1 . . . . 53 GLN HB2 . 11274 1
585 . 1 1 53 53 GLN HB3 H 1 2.090 0.030 . 1 . . . . 53 GLN HB3 . 11274 1
586 . 1 1 53 53 GLN HE21 H 1 7.513 0.030 . 2 . . . . 53 GLN HE21 . 11274 1
587 . 1 1 53 53 GLN HE22 H 1 6.864 0.030 . 2 . . . . 53 GLN HE22 . 11274 1
588 . 1 1 53 53 GLN HG2 H 1 2.436 0.030 . 1 . . . . 53 GLN HG2 . 11274 1
589 . 1 1 53 53 GLN HG3 H 1 2.436 0.030 . 1 . . . . 53 GLN HG3 . 11274 1
590 . 1 1 53 53 GLN C C 13 177.510 0.300 . 1 . . . . 53 GLN C . 11274 1
591 . 1 1 53 53 GLN CA C 13 58.217 0.300 . 1 . . . . 53 GLN CA . 11274 1
592 . 1 1 53 53 GLN CB C 13 28.389 0.300 . 1 . . . . 53 GLN CB . 11274 1
593 . 1 1 53 53 GLN CG C 13 33.866 0.300 . 1 . . . . 53 GLN CG . 11274 1
594 . 1 1 53 53 GLN N N 15 118.633 0.300 . 1 . . . . 53 GLN N . 11274 1
595 . 1 1 53 53 GLN NE2 N 15 112.883 0.300 . 1 . . . . 53 GLN NE2 . 11274 1
596 . 1 1 54 54 ASP H H 1 7.647 0.030 . 1 . . . . 54 ASP H . 11274 1
597 . 1 1 54 54 ASP HA H 1 4.511 0.030 . 1 . . . . 54 ASP HA . 11274 1
598 . 1 1 54 54 ASP HB2 H 1 2.619 0.030 . 2 . . . . 54 ASP HB2 . 11274 1
599 . 1 1 54 54 ASP HB3 H 1 2.768 0.030 . 2 . . . . 54 ASP HB3 . 11274 1
600 . 1 1 54 54 ASP C C 13 177.486 0.300 . 1 . . . . 54 ASP C . 11274 1
601 . 1 1 54 54 ASP CA C 13 56.176 0.300 . 1 . . . . 54 ASP CA . 11274 1
602 . 1 1 54 54 ASP CB C 13 41.380 0.300 . 1 . . . . 54 ASP CB . 11274 1
603 . 1 1 54 54 ASP N N 15 118.453 0.300 . 1 . . . . 54 ASP N . 11274 1
604 . 1 1 55 55 ARG H H 1 7.638 0.030 . 1 . . . . 55 ARG H . 11274 1
605 . 1 1 55 55 ARG HA H 1 4.273 0.030 . 1 . . . . 55 ARG HA . 11274 1
606 . 1 1 55 55 ARG HB2 H 1 1.939 0.030 . 2 . . . . 55 ARG HB2 . 11274 1
607 . 1 1 55 55 ARG HB3 H 1 2.014 0.030 . 2 . . . . 55 ARG HB3 . 11274 1
608 . 1 1 55 55 ARG HD2 H 1 3.315 0.030 . 2 . . . . 55 ARG HD2 . 11274 1
609 . 1 1 55 55 ARG HD3 H 1 3.177 0.030 . 2 . . . . 55 ARG HD3 . 11274 1
610 . 1 1 55 55 ARG HG2 H 1 1.725 0.030 . 1 . . . . 55 ARG HG2 . 11274 1
611 . 1 1 55 55 ARG HG3 H 1 1.725 0.030 . 1 . . . . 55 ARG HG3 . 11274 1
612 . 1 1 55 55 ARG C C 13 177.873 0.300 . 1 . . . . 55 ARG C . 11274 1
613 . 1 1 55 55 ARG CA C 13 57.373 0.300 . 1 . . . . 55 ARG CA . 11274 1
614 . 1 1 55 55 ARG CB C 13 30.034 0.300 . 1 . . . . 55 ARG CB . 11274 1
615 . 1 1 55 55 ARG CD C 13 43.138 0.300 . 1 . . . . 55 ARG CD . 11274 1
616 . 1 1 55 55 ARG CG C 13 27.042 0.300 . 1 . . . . 55 ARG CG . 11274 1
617 . 1 1 55 55 ARG N N 15 118.649 0.300 . 1 . . . . 55 ARG N . 11274 1
618 . 1 1 56 56 LEU H H 1 8.172 0.030 . 1 . . . . 56 LEU H . 11274 1
619 . 1 1 56 56 LEU HA H 1 4.203 0.030 . 1 . . . . 56 LEU HA . 11274 1
620 . 1 1 56 56 LEU HB2 H 1 1.561 0.030 . 2 . . . . 56 LEU HB2 . 11274 1
621 . 1 1 56 56 LEU HB3 H 1 1.768 0.030 . 2 . . . . 56 LEU HB3 . 11274 1
622 . 1 1 56 56 LEU HD11 H 1 0.868 0.030 . 1 . . . . 56 LEU HD1 . 11274 1
623 . 1 1 56 56 LEU HD12 H 1 0.868 0.030 . 1 . . . . 56 LEU HD1 . 11274 1
624 . 1 1 56 56 LEU HD13 H 1 0.868 0.030 . 1 . . . . 56 LEU HD1 . 11274 1
625 . 1 1 56 56 LEU HD21 H 1 0.841 0.030 . 1 . . . . 56 LEU HD2 . 11274 1
626 . 1 1 56 56 LEU HD22 H 1 0.841 0.030 . 1 . . . . 56 LEU HD2 . 11274 1
627 . 1 1 56 56 LEU HD23 H 1 0.841 0.030 . 1 . . . . 56 LEU HD2 . 11274 1
628 . 1 1 56 56 LEU HG H 1 1.703 0.030 . 1 . . . . 56 LEU HG . 11274 1
629 . 1 1 56 56 LEU C C 13 178.406 0.300 . 1 . . . . 56 LEU C . 11274 1
630 . 1 1 56 56 LEU CA C 13 56.594 0.300 . 1 . . . . 56 LEU CA . 11274 1
631 . 1 1 56 56 LEU CB C 13 41.626 0.300 . 1 . . . . 56 LEU CB . 11274 1
632 . 1 1 56 56 LEU CD1 C 13 25.185 0.300 . 2 . . . . 56 LEU CD1 . 11274 1
633 . 1 1 56 56 LEU CD2 C 13 22.987 0.300 . 2 . . . . 56 LEU CD2 . 11274 1
634 . 1 1 56 56 LEU CG C 13 26.959 0.300 . 1 . . . . 56 LEU CG . 11274 1
635 . 1 1 56 56 LEU N N 15 120.356 0.300 . 1 . . . . 56 LEU N . 11274 1
636 . 1 1 57 57 ASN H H 1 8.143 0.030 . 1 . . . . 57 ASN H . 11274 1
637 . 1 1 57 57 ASN HA H 1 4.629 0.030 . 1 . . . . 57 ASN HA . 11274 1
638 . 1 1 57 57 ASN HB2 H 1 2.889 0.030 . 1 . . . . 57 ASN HB2 . 11274 1
639 . 1 1 57 57 ASN HB3 H 1 2.889 0.030 . 1 . . . . 57 ASN HB3 . 11274 1
640 . 1 1 57 57 ASN HD21 H 1 7.719 0.030 . 2 . . . . 57 ASN HD21 . 11274 1
641 . 1 1 57 57 ASN HD22 H 1 6.923 0.030 . 2 . . . . 57 ASN HD22 . 11274 1
642 . 1 1 57 57 ASN C C 13 176.226 0.300 . 1 . . . . 57 ASN C . 11274 1
643 . 1 1 57 57 ASN CA C 13 54.277 0.300 . 1 . . . . 57 ASN CA . 11274 1
644 . 1 1 57 57 ASN CB C 13 38.580 0.300 . 1 . . . . 57 ASN CB . 11274 1
645 . 1 1 57 57 ASN N N 15 118.003 0.300 . 1 . . . . 57 ASN N . 11274 1
646 . 1 1 57 57 ASN ND2 N 15 112.715 0.300 . 1 . . . . 57 ASN ND2 . 11274 1
647 . 1 1 58 58 GLU H H 1 8.111 0.030 . 1 . . . . 58 GLU H . 11274 1
648 . 1 1 58 58 GLU HA H 1 4.224 0.030 . 1 . . . . 58 GLU HA . 11274 1
649 . 1 1 58 58 GLU HB2 H 1 2.125 0.030 . 2 . . . . 58 GLU HB2 . 11274 1
650 . 1 1 58 58 GLU HB3 H 1 2.052 0.030 . 2 . . . . 58 GLU HB3 . 11274 1
651 . 1 1 58 58 GLU HG2 H 1 2.305 0.030 . 1 . . . . 58 GLU HG2 . 11274 1
652 . 1 1 58 58 GLU HG3 H 1 2.305 0.030 . 1 . . . . 58 GLU HG3 . 11274 1
653 . 1 1 58 58 GLU C C 13 177.219 0.300 . 1 . . . . 58 GLU C . 11274 1
654 . 1 1 58 58 GLU CA C 13 57.443 0.300 . 1 . . . . 58 GLU CA . 11274 1
655 . 1 1 58 58 GLU CB C 13 30.280 0.300 . 1 . . . . 58 GLU CB . 11274 1
656 . 1 1 58 58 GLU CG C 13 36.332 0.300 . 1 . . . . 58 GLU CG . 11274 1
657 . 1 1 58 58 GLU N N 15 120.788 0.300 . 1 . . . . 58 GLU N . 11274 1
658 . 1 1 59 59 GLN H H 1 8.219 0.030 . 1 . . . . 59 GLN H . 11274 1
659 . 1 1 59 59 GLN HA H 1 4.289 0.030 . 1 . . . . 59 GLN HA . 11274 1
660 . 1 1 59 59 GLN HB2 H 1 2.056 0.030 . 2 . . . . 59 GLN HB2 . 11274 1
661 . 1 1 59 59 GLN HB3 H 1 2.147 0.030 . 2 . . . . 59 GLN HB3 . 11274 1
662 . 1 1 59 59 GLN HE21 H 1 7.545 0.030 . 2 . . . . 59 GLN HE21 . 11274 1
663 . 1 1 59 59 GLN HE22 H 1 6.824 0.030 . 2 . . . . 59 GLN HE22 . 11274 1
664 . 1 1 59 59 GLN HG2 H 1 2.405 0.030 . 1 . . . . 59 GLN HG2 . 11274 1
665 . 1 1 59 59 GLN HG3 H 1 2.405 0.030 . 1 . . . . 59 GLN HG3 . 11274 1
666 . 1 1 59 59 GLN C C 13 176.541 0.300 . 1 . . . . 59 GLN C . 11274 1
667 . 1 1 59 59 GLN CA C 13 56.387 0.300 . 1 . . . . 59 GLN CA . 11274 1
668 . 1 1 59 59 GLN CB C 13 29.577 0.300 . 1 . . . . 59 GLN CB . 11274 1
669 . 1 1 59 59 GLN CG C 13 33.948 0.300 . 1 . . . . 59 GLN CG . 11274 1
670 . 1 1 59 59 GLN N N 15 119.819 0.300 . 1 . . . . 59 GLN N . 11274 1
671 . 1 1 59 59 GLN NE2 N 15 112.342 0.300 . 1 . . . . 59 GLN NE2 . 11274 1
672 . 1 1 60 60 GLU H H 1 8.346 0.030 . 1 . . . . 60 GLU H . 11274 1
673 . 1 1 60 60 GLU HA H 1 4.266 0.030 . 1 . . . . 60 GLU HA . 11274 1
674 . 1 1 60 60 GLU HB2 H 1 2.059 0.030 . 1 . . . . 60 GLU HB2 . 11274 1
675 . 1 1 60 60 GLU HB3 H 1 2.059 0.030 . 1 . . . . 60 GLU HB3 . 11274 1
676 . 1 1 60 60 GLU HG2 H 1 2.305 0.030 . 1 . . . . 60 GLU HG2 . 11274 1
677 . 1 1 60 60 GLU HG3 H 1 2.305 0.030 . 1 . . . . 60 GLU HG3 . 11274 1
678 . 1 1 60 60 GLU C C 13 177.316 0.300 . 1 . . . . 60 GLU C . 11274 1
679 . 1 1 60 60 GLU CA C 13 57.197 0.300 . 1 . . . . 60 GLU CA . 11274 1
680 . 1 1 60 60 GLU CB C 13 30.280 0.300 . 1 . . . . 60 GLU CB . 11274 1
681 . 1 1 60 60 GLU CG C 13 36.250 0.300 . 1 . . . . 60 GLU CG . 11274 1
682 . 1 1 60 60 GLU N N 15 121.672 0.300 . 1 . . . . 60 GLU N . 11274 1
683 . 1 1 61 61 GLY H H 1 8.368 0.030 . 1 . . . . 61 GLY H . 11274 1
684 . 1 1 61 61 GLY HA2 H 1 4.018 0.030 . 1 . . . . 61 GLY HA2 . 11274 1
685 . 1 1 61 61 GLY HA3 H 1 4.018 0.030 . 1 . . . . 61 GLY HA3 . 11274 1
686 . 1 1 61 61 GLY C C 13 174.385 0.300 . 1 . . . . 61 GLY C . 11274 1
687 . 1 1 61 61 GLY CA C 13 45.552 0.300 . 1 . . . . 61 GLY CA . 11274 1
688 . 1 1 61 61 GLY N N 15 109.925 0.300 . 1 . . . . 61 GLY N . 11274 1
689 . 1 1 62 62 SER H H 1 8.215 0.030 . 1 . . . . 62 SER H . 11274 1
690 . 1 1 62 62 SER C C 13 174.797 0.300 . 1 . . . . 62 SER C . 11274 1
691 . 1 1 62 62 SER CA C 13 58.498 0.300 . 1 . . . . 62 SER CA . 11274 1
692 . 1 1 62 62 SER CB C 13 64.109 0.300 . 1 . . . . 62 SER CB . 11274 1
693 . 1 1 62 62 SER N N 15 115.498 0.300 . 1 . . . . 62 SER N . 11274 1
694 . 1 1 64 64 PRO HA H 1 4.486 0.030 . 1 . . . . 64 PRO HA . 11274 1
695 . 1 1 64 64 PRO HB2 H 1 1.987 0.030 . 2 . . . . 64 PRO HB2 . 11274 1
696 . 1 1 64 64 PRO HB3 H 1 2.313 0.030 . 2 . . . . 64 PRO HB3 . 11274 1
697 . 1 1 64 64 PRO HD2 H 1 3.639 0.030 . 1 . . . . 64 PRO HD2 . 11274 1
698 . 1 1 64 64 PRO HD3 H 1 3.639 0.030 . 1 . . . . 64 PRO HD3 . 11274 1
699 . 1 1 64 64 PRO HG2 H 1 2.058 0.030 . 1 . . . . 64 PRO HG2 . 11274 1
700 . 1 1 64 64 PRO HG3 H 1 2.058 0.030 . 1 . . . . 64 PRO HG3 . 11274 1
701 . 1 1 64 64 PRO C C 13 177.462 0.300 . 1 . . . . 64 PRO C . 11274 1
702 . 1 1 64 64 PRO CA C 13 63.248 0.300 . 1 . . . . 64 PRO CA . 11274 1
703 . 1 1 64 64 PRO CB C 13 32.171 0.300 . 1 . . . . 64 PRO CB . 11274 1
704 . 1 1 64 64 PRO CD C 13 49.899 0.300 . 1 . . . . 64 PRO CD . 11274 1
705 . 1 1 64 64 PRO CG C 13 27.042 0.300 . 1 . . . . 64 PRO CG . 11274 1
706 . 1 1 65 65 SER H H 1 8.553 0.030 . 1 . . . . 65 SER H . 11274 1
707 . 1 1 65 65 SER HA H 1 4.522 0.030 . 1 . . . . 65 SER HA . 11274 1
708 . 1 1 65 65 SER HB2 H 1 3.926 0.030 . 1 . . . . 65 SER HB2 . 11274 1
709 . 1 1 65 65 SER HB3 H 1 3.926 0.030 . 1 . . . . 65 SER HB3 . 11274 1
710 . 1 1 65 65 SER C C 13 174.748 0.300 . 1 . . . . 65 SER C . 11274 1
711 . 1 1 65 65 SER CA C 13 58.393 0.300 . 1 . . . . 65 SER CA . 11274 1
712 . 1 1 65 65 SER CB C 13 63.990 0.300 . 1 . . . . 65 SER CB . 11274 1
713 . 1 1 65 65 SER N N 15 116.526 0.300 . 1 . . . . 65 SER N . 11274 1
714 . 1 1 66 66 SER H H 1 8.363 0.030 . 1 . . . . 66 SER H . 11274 1
715 . 1 1 66 66 SER C C 13 174.070 0.300 . 1 . . . . 66 SER C . 11274 1
716 . 1 1 66 66 SER CA C 13 58.393 0.300 . 1 . . . . 66 SER CA . 11274 1
717 . 1 1 66 66 SER CB C 13 63.990 0.300 . 1 . . . . 66 SER CB . 11274 1
718 . 1 1 66 66 SER N N 15 117.999 0.300 . 1 . . . . 66 SER N . 11274 1
stop_
save_