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 11331
_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 11331 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11331 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 . . 11331 1
2 $NMRPipe . . 11331 1
3 $NMRView . . 11331 1
4 $Kujira . . 11331 1
5 $CYANA . . 11331 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 4.473 0.030 . 1 . . . . 6 SER HA . 11331 1
2 . 1 1 6 6 SER HB2 H 1 3.894 0.030 . 1 . . . . 6 SER HB2 . 11331 1
3 . 1 1 6 6 SER HB3 H 1 3.894 0.030 . 1 . . . . 6 SER HB3 . 11331 1
4 . 1 1 6 6 SER C C 13 174.977 0.300 . 1 . . . . 6 SER C . 11331 1
5 . 1 1 6 6 SER CA C 13 58.497 0.300 . 1 . . . . 6 SER CA . 11331 1
6 . 1 1 6 6 SER CB C 13 63.703 0.300 . 1 . . . . 6 SER CB . 11331 1
7 . 1 1 7 7 GLY H H 1 8.411 0.030 . 1 . . . . 7 GLY H . 11331 1
8 . 1 1 7 7 GLY HA2 H 1 3.971 0.030 . 1 . . . . 7 GLY HA2 . 11331 1
9 . 1 1 7 7 GLY HA3 H 1 3.971 0.030 . 1 . . . . 7 GLY HA3 . 11331 1
10 . 1 1 7 7 GLY C C 13 173.844 0.300 . 1 . . . . 7 GLY C . 11331 1
11 . 1 1 7 7 GLY CA C 13 45.268 0.300 . 1 . . . . 7 GLY CA . 11331 1
12 . 1 1 7 7 GLY N N 15 110.913 0.300 . 1 . . . . 7 GLY N . 11331 1
13 . 1 1 8 8 VAL H H 1 7.953 0.030 . 1 . . . . 8 VAL H . 11331 1
14 . 1 1 8 8 VAL HA H 1 4.168 0.030 . 1 . . . . 8 VAL HA . 11331 1
15 . 1 1 8 8 VAL HB H 1 2.062 0.030 . 1 . . . . 8 VAL HB . 11331 1
16 . 1 1 8 8 VAL HG11 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11331 1
17 . 1 1 8 8 VAL HG12 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11331 1
18 . 1 1 8 8 VAL HG13 H 1 0.900 0.030 . 1 . . . . 8 VAL HG1 . 11331 1
19 . 1 1 8 8 VAL HG21 H 1 0.885 0.030 . 1 . . . . 8 VAL HG2 . 11331 1
20 . 1 1 8 8 VAL HG22 H 1 0.885 0.030 . 1 . . . . 8 VAL HG2 . 11331 1
21 . 1 1 8 8 VAL HG23 H 1 0.885 0.030 . 1 . . . . 8 VAL HG2 . 11331 1
22 . 1 1 8 8 VAL C C 13 176.043 0.300 . 1 . . . . 8 VAL C . 11331 1
23 . 1 1 8 8 VAL CA C 13 61.763 0.300 . 1 . . . . 8 VAL CA . 11331 1
24 . 1 1 8 8 VAL CB C 13 32.729 0.300 . 1 . . . . 8 VAL CB . 11331 1
25 . 1 1 8 8 VAL CG1 C 13 21.152 0.300 . 2 . . . . 8 VAL CG1 . 11331 1
26 . 1 1 8 8 VAL CG2 C 13 20.409 0.300 . 2 . . . . 8 VAL CG2 . 11331 1
27 . 1 1 8 8 VAL N N 15 118.824 0.300 . 1 . . . . 8 VAL N . 11331 1
28 . 1 1 9 9 GLU H H 1 8.475 0.030 . 1 . . . . 9 GLU H . 11331 1
29 . 1 1 9 9 GLU HA H 1 4.579 0.030 . 1 . . . . 9 GLU HA . 11331 1
30 . 1 1 9 9 GLU HB2 H 1 2.020 0.030 . 2 . . . . 9 GLU HB2 . 11331 1
31 . 1 1 9 9 GLU HB3 H 1 1.880 0.030 . 2 . . . . 9 GLU HB3 . 11331 1
32 . 1 1 9 9 GLU HG2 H 1 2.297 0.030 . 1 . . . . 9 GLU HG2 . 11331 1
33 . 1 1 9 9 GLU HG3 H 1 2.297 0.030 . 1 . . . . 9 GLU HG3 . 11331 1
34 . 1 1 9 9 GLU C C 13 174.435 0.300 . 1 . . . . 9 GLU C . 11331 1
35 . 1 1 9 9 GLU CA C 13 54.336 0.300 . 1 . . . . 9 GLU CA . 11331 1
36 . 1 1 9 9 GLU CB C 13 29.738 0.300 . 1 . . . . 9 GLU CB . 11331 1
37 . 1 1 9 9 GLU CG C 13 35.932 0.300 . 1 . . . . 9 GLU CG . 11331 1
38 . 1 1 9 9 GLU N N 15 126.428 0.300 . 1 . . . . 9 GLU N . 11331 1
39 . 1 1 10 10 PRO HA H 1 4.439 0.030 . 1 . . . . 10 PRO HA . 11331 1
40 . 1 1 10 10 PRO HB2 H 1 2.238 0.030 . 2 . . . . 10 PRO HB2 . 11331 1
41 . 1 1 10 10 PRO HB3 H 1 1.844 0.030 . 2 . . . . 10 PRO HB3 . 11331 1
42 . 1 1 10 10 PRO HD2 H 1 3.831 0.030 . 2 . . . . 10 PRO HD2 . 11331 1
43 . 1 1 10 10 PRO HD3 H 1 3.693 0.030 . 2 . . . . 10 PRO HD3 . 11331 1
44 . 1 1 10 10 PRO HG2 H 1 1.973 0.030 . 1 . . . . 10 PRO HG2 . 11331 1
45 . 1 1 10 10 PRO HG3 H 1 1.973 0.030 . 1 . . . . 10 PRO HG3 . 11331 1
46 . 1 1 10 10 PRO C C 13 176.670 0.300 . 1 . . . . 10 PRO C . 11331 1
47 . 1 1 10 10 PRO CA C 13 63.056 0.300 . 1 . . . . 10 PRO CA . 11331 1
48 . 1 1 10 10 PRO CB C 13 32.048 0.300 . 1 . . . . 10 PRO CB . 11331 1
49 . 1 1 10 10 PRO CD C 13 50.675 0.300 . 1 . . . . 10 PRO CD . 11331 1
50 . 1 1 10 10 PRO CG C 13 27.370 0.300 . 1 . . . . 10 PRO CG . 11331 1
51 . 1 1 11 11 VAL H H 1 8.260 0.030 . 1 . . . . 11 VAL H . 11331 1
52 . 1 1 11 11 VAL HA H 1 4.378 0.030 . 1 . . . . 11 VAL HA . 11331 1
53 . 1 1 11 11 VAL HB H 1 2.057 0.030 . 1 . . . . 11 VAL HB . 11331 1
54 . 1 1 11 11 VAL HG11 H 1 0.959 0.030 . 1 . . . . 11 VAL HG1 . 11331 1
55 . 1 1 11 11 VAL HG12 H 1 0.959 0.030 . 1 . . . . 11 VAL HG1 . 11331 1
56 . 1 1 11 11 VAL HG13 H 1 0.959 0.030 . 1 . . . . 11 VAL HG1 . 11331 1
57 . 1 1 11 11 VAL HG21 H 1 0.980 0.030 . 1 . . . . 11 VAL HG2 . 11331 1
58 . 1 1 11 11 VAL HG22 H 1 0.980 0.030 . 1 . . . . 11 VAL HG2 . 11331 1
59 . 1 1 11 11 VAL HG23 H 1 0.980 0.030 . 1 . . . . 11 VAL HG2 . 11331 1
60 . 1 1 11 11 VAL C C 13 174.948 0.300 . 1 . . . . 11 VAL C . 11331 1
61 . 1 1 11 11 VAL CA C 13 59.892 0.300 . 1 . . . . 11 VAL CA . 11331 1
62 . 1 1 11 11 VAL CB C 13 32.421 0.300 . 1 . . . . 11 VAL CB . 11331 1
63 . 1 1 11 11 VAL CG1 C 13 20.409 0.300 . 2 . . . . 11 VAL CG1 . 11331 1
64 . 1 1 11 11 VAL CG2 C 13 21.152 0.300 . 2 . . . . 11 VAL CG2 . 11331 1
65 . 1 1 11 11 VAL N N 15 121.854 0.300 . 1 . . . . 11 VAL N . 11331 1
66 . 1 1 12 12 PRO HA H 1 4.397 0.030 . 1 . . . . 12 PRO HA . 11331 1
67 . 1 1 12 12 PRO HB2 H 1 2.270 0.030 . 2 . . . . 12 PRO HB2 . 11331 1
68 . 1 1 12 12 PRO HB3 H 1 1.877 0.030 . 2 . . . . 12 PRO HB3 . 11331 1
69 . 1 1 12 12 PRO HD2 H 1 3.839 0.030 . 2 . . . . 12 PRO HD2 . 11331 1
70 . 1 1 12 12 PRO HD3 H 1 3.630 0.030 . 2 . . . . 12 PRO HD3 . 11331 1
71 . 1 1 12 12 PRO HG2 H 1 1.980 0.030 . 1 . . . . 12 PRO HG2 . 11331 1
72 . 1 1 12 12 PRO HG3 H 1 1.980 0.030 . 1 . . . . 12 PRO HG3 . 11331 1
73 . 1 1 12 12 PRO C C 13 176.637 0.300 . 1 . . . . 12 PRO C . 11331 1
74 . 1 1 12 12 PRO CA C 13 63.247 0.300 . 1 . . . . 12 PRO CA . 11331 1
75 . 1 1 12 12 PRO CB C 13 32.193 0.300 . 1 . . . . 12 PRO CB . 11331 1
76 . 1 1 12 12 PRO CD C 13 50.867 0.300 . 1 . . . . 12 PRO CD . 11331 1
77 . 1 1 12 12 PRO CG C 13 27.275 0.300 . 1 . . . . 12 PRO CG . 11331 1
78 . 1 1 13 13 ASP H H 1 8.449 0.030 . 1 . . . . 13 ASP H . 11331 1
79 . 1 1 13 13 ASP HA H 1 4.596 0.030 . 1 . . . . 13 ASP HA . 11331 1
80 . 1 1 13 13 ASP HB2 H 1 2.665 0.030 . 1 . . . . 13 ASP HB2 . 11331 1
81 . 1 1 13 13 ASP HB3 H 1 2.665 0.030 . 1 . . . . 13 ASP HB3 . 11331 1
82 . 1 1 13 13 ASP C C 13 176.983 0.300 . 1 . . . . 13 ASP C . 11331 1
83 . 1 1 13 13 ASP CA C 13 54.591 0.300 . 1 . . . . 13 ASP CA . 11331 1
84 . 1 1 13 13 ASP CB C 13 41.148 0.300 . 1 . . . . 13 ASP CB . 11331 1
85 . 1 1 13 13 ASP N N 15 120.782 0.300 . 1 . . . . 13 ASP N . 11331 1
86 . 1 1 14 14 THR H H 1 8.068 0.030 . 1 . . . . 14 THR H . 11331 1
87 . 1 1 14 14 THR HA H 1 4.165 0.030 . 1 . . . . 14 THR HA . 11331 1
88 . 1 1 14 14 THR HB H 1 4.231 0.030 . 1 . . . . 14 THR HB . 11331 1
89 . 1 1 14 14 THR HG21 H 1 1.163 0.030 . 1 . . . . 14 THR HG2 . 11331 1
90 . 1 1 14 14 THR HG22 H 1 1.163 0.030 . 1 . . . . 14 THR HG2 . 11331 1
91 . 1 1 14 14 THR HG23 H 1 1.163 0.030 . 1 . . . . 14 THR HG2 . 11331 1
92 . 1 1 14 14 THR C C 13 175.063 0.300 . 1 . . . . 14 THR C . 11331 1
93 . 1 1 14 14 THR CA C 13 62.753 0.300 . 1 . . . . 14 THR CA . 11331 1
94 . 1 1 14 14 THR CB C 13 69.342 0.300 . 1 . . . . 14 THR CB . 11331 1
95 . 1 1 14 14 THR CG2 C 13 21.675 0.300 . 1 . . . . 14 THR CG2 . 11331 1
96 . 1 1 14 14 THR N N 15 113.765 0.300 . 1 . . . . 14 THR N . 11331 1
97 . 1 1 15 15 HIS HA H 1 4.568 0.030 . 1 . . . . 15 HIS HA . 11331 1
98 . 1 1 15 15 HIS HB2 H 1 3.116 0.030 . 1 . . . . 15 HIS HB2 . 11331 1
99 . 1 1 15 15 HIS HB3 H 1 3.116 0.030 . 1 . . . . 15 HIS HB3 . 11331 1
100 . 1 1 15 15 HIS HD2 H 1 7.020 0.030 . 1 . . . . 15 HIS HD2 . 11331 1
101 . 1 1 15 15 HIS HE1 H 1 7.932 0.030 . 1 . . . . 15 HIS HE1 . 11331 1
102 . 1 1 15 15 HIS C C 13 175.542 0.300 . 1 . . . . 15 HIS C . 11331 1
103 . 1 1 15 15 HIS CA C 13 56.795 0.300 . 1 . . . . 15 HIS CA . 11331 1
104 . 1 1 15 15 HIS CB C 13 30.202 0.300 . 1 . . . . 15 HIS CB . 11331 1
105 . 1 1 15 15 HIS CD2 C 13 119.836 0.300 . 1 . . . . 15 HIS CD2 . 11331 1
106 . 1 1 15 15 HIS CE1 C 13 138.150 0.300 . 1 . . . . 15 HIS CE1 . 11331 1
107 . 1 1 16 16 LEU H H 1 8.006 0.030 . 1 . . . . 16 LEU H . 11331 1
108 . 1 1 16 16 LEU HA H 1 4.264 0.030 . 1 . . . . 16 LEU HA . 11331 1
109 . 1 1 16 16 LEU HB2 H 1 1.533 0.030 . 2 . . . . 16 LEU HB2 . 11331 1
110 . 1 1 16 16 LEU HB3 H 1 1.625 0.030 . 2 . . . . 16 LEU HB3 . 11331 1
111 . 1 1 16 16 LEU HD11 H 1 0.873 0.030 . 1 . . . . 16 LEU HD1 . 11331 1
112 . 1 1 16 16 LEU HD12 H 1 0.873 0.030 . 1 . . . . 16 LEU HD1 . 11331 1
113 . 1 1 16 16 LEU HD13 H 1 0.873 0.030 . 1 . . . . 16 LEU HD1 . 11331 1
114 . 1 1 16 16 LEU HD21 H 1 0.798 0.030 . 1 . . . . 16 LEU HD2 . 11331 1
115 . 1 1 16 16 LEU HD22 H 1 0.798 0.030 . 1 . . . . 16 LEU HD2 . 11331 1
116 . 1 1 16 16 LEU HD23 H 1 0.798 0.030 . 1 . . . . 16 LEU HD2 . 11331 1
117 . 1 1 16 16 LEU HG H 1 1.376 0.030 . 1 . . . . 16 LEU HG . 11331 1
118 . 1 1 16 16 LEU C C 13 177.184 0.300 . 1 . . . . 16 LEU C . 11331 1
119 . 1 1 16 16 LEU CA C 13 55.182 0.300 . 1 . . . . 16 LEU CA . 11331 1
120 . 1 1 16 16 LEU CB C 13 41.956 0.300 . 1 . . . . 16 LEU CB . 11331 1
121 . 1 1 16 16 LEU CD1 C 13 25.362 0.300 . 2 . . . . 16 LEU CD1 . 11331 1
122 . 1 1 16 16 LEU CD2 C 13 23.629 0.300 . 2 . . . . 16 LEU CD2 . 11331 1
123 . 1 1 16 16 LEU CG C 13 26.808 0.300 . 1 . . . . 16 LEU CG . 11331 1
124 . 1 1 16 16 LEU N N 15 121.719 0.300 . 1 . . . . 16 LEU N . 11331 1
125 . 1 1 17 17 ARG H H 1 8.097 0.030 . 1 . . . . 17 ARG H . 11331 1
126 . 1 1 17 17 ARG HA H 1 4.282 0.030 . 1 . . . . 17 ARG HA . 11331 1
127 . 1 1 17 17 ARG HB2 H 1 1.877 0.030 . 2 . . . . 17 ARG HB2 . 11331 1
128 . 1 1 17 17 ARG HB3 H 1 1.777 0.030 . 2 . . . . 17 ARG HB3 . 11331 1
129 . 1 1 17 17 ARG HD2 H 1 3.182 0.030 . 1 . . . . 17 ARG HD2 . 11331 1
130 . 1 1 17 17 ARG HD3 H 1 3.182 0.030 . 1 . . . . 17 ARG HD3 . 11331 1
131 . 1 1 17 17 ARG HG2 H 1 1.652 0.030 . 2 . . . . 17 ARG HG2 . 11331 1
132 . 1 1 17 17 ARG HG3 H 1 1.613 0.030 . 2 . . . . 17 ARG HG3 . 11331 1
133 . 1 1 17 17 ARG C C 13 176.650 0.300 . 1 . . . . 17 ARG C . 11331 1
134 . 1 1 17 17 ARG CA C 13 56.466 0.300 . 1 . . . . 17 ARG CA . 11331 1
135 . 1 1 17 17 ARG CB C 13 30.709 0.300 . 1 . . . . 17 ARG CB . 11331 1
136 . 1 1 17 17 ARG CD C 13 43.429 0.300 . 1 . . . . 17 ARG CD . 11331 1
137 . 1 1 17 17 ARG CG C 13 27.337 0.300 . 1 . . . . 17 ARG CG . 11331 1
138 . 1 1 17 17 ARG N N 15 120.068 0.300 . 1 . . . . 17 ARG N . 11331 1
139 . 1 1 18 18 GLY H H 1 8.303 0.030 . 1 . . . . 18 GLY H . 11331 1
140 . 1 1 18 18 GLY HA2 H 1 3.986 0.030 . 2 . . . . 18 GLY HA2 . 11331 1
141 . 1 1 18 18 GLY HA3 H 1 3.914 0.030 . 2 . . . . 18 GLY HA3 . 11331 1
142 . 1 1 18 18 GLY C C 13 173.638 0.300 . 1 . . . . 18 GLY C . 11331 1
143 . 1 1 18 18 GLY CA C 13 45.420 0.300 . 1 . . . . 18 GLY CA . 11331 1
144 . 1 1 18 18 GLY N N 15 108.822 0.300 . 1 . . . . 18 GLY N . 11331 1
145 . 1 1 19 19 ILE H H 1 8.016 0.030 . 1 . . . . 19 ILE H . 11331 1
146 . 1 1 19 19 ILE HA H 1 4.263 0.030 . 1 . . . . 19 ILE HA . 11331 1
147 . 1 1 19 19 ILE HB H 1 1.858 0.030 . 1 . . . . 19 ILE HB . 11331 1
148 . 1 1 19 19 ILE HD11 H 1 0.838 0.030 . 1 . . . . 19 ILE HD1 . 11331 1
149 . 1 1 19 19 ILE HD12 H 1 0.838 0.030 . 1 . . . . 19 ILE HD1 . 11331 1
150 . 1 1 19 19 ILE HD13 H 1 0.838 0.030 . 1 . . . . 19 ILE HD1 . 11331 1
151 . 1 1 19 19 ILE HG12 H 1 1.485 0.030 . 2 . . . . 19 ILE HG12 . 11331 1
152 . 1 1 19 19 ILE HG13 H 1 1.140 0.030 . 2 . . . . 19 ILE HG13 . 11331 1
153 . 1 1 19 19 ILE HG21 H 1 0.913 0.030 . 1 . . . . 19 ILE HG2 . 11331 1
154 . 1 1 19 19 ILE HG22 H 1 0.913 0.030 . 1 . . . . 19 ILE HG2 . 11331 1
155 . 1 1 19 19 ILE HG23 H 1 0.913 0.030 . 1 . . . . 19 ILE HG2 . 11331 1
156 . 1 1 19 19 ILE C C 13 175.893 0.300 . 1 . . . . 19 ILE C . 11331 1
157 . 1 1 19 19 ILE CA C 13 61.270 0.300 . 1 . . . . 19 ILE CA . 11331 1
158 . 1 1 19 19 ILE CB C 13 38.776 0.300 . 1 . . . . 19 ILE CB . 11331 1
159 . 1 1 19 19 ILE CD1 C 13 13.270 0.300 . 1 . . . . 19 ILE CD1 . 11331 1
160 . 1 1 19 19 ILE CG1 C 13 27.334 0.300 . 1 . . . . 19 ILE CG1 . 11331 1
161 . 1 1 19 19 ILE CG2 C 13 17.712 0.300 . 1 . . . . 19 ILE CG2 . 11331 1
162 . 1 1 19 19 ILE N N 15 120.655 0.300 . 1 . . . . 19 ILE N . 11331 1
163 . 1 1 20 20 THR H H 1 8.119 0.030 . 1 . . . . 20 THR H . 11331 1
164 . 1 1 20 20 THR HA H 1 4.841 0.030 . 1 . . . . 20 THR HA . 11331 1
165 . 1 1 20 20 THR HB H 1 4.080 0.030 . 1 . . . . 20 THR HB . 11331 1
166 . 1 1 20 20 THR HG21 H 1 1.129 0.030 . 1 . . . . 20 THR HG2 . 11331 1
167 . 1 1 20 20 THR HG22 H 1 1.129 0.030 . 1 . . . . 20 THR HG2 . 11331 1
168 . 1 1 20 20 THR HG23 H 1 1.129 0.030 . 1 . . . . 20 THR HG2 . 11331 1
169 . 1 1 20 20 THR C C 13 174.038 0.300 . 1 . . . . 20 THR C . 11331 1
170 . 1 1 20 20 THR CA C 13 60.608 0.300 . 1 . . . . 20 THR CA . 11331 1
171 . 1 1 20 20 THR CB C 13 70.942 0.300 . 1 . . . . 20 THR CB . 11331 1
172 . 1 1 20 20 THR CG2 C 13 22.196 0.300 . 1 . . . . 20 THR CG2 . 11331 1
173 . 1 1 20 20 THR N N 15 118.063 0.300 . 1 . . . . 20 THR N . 11331 1
174 . 1 1 21 21 CYS H H 1 8.522 0.030 . 1 . . . . 21 CYS H . 11331 1
175 . 1 1 21 21 CYS HA H 1 3.882 0.030 . 1 . . . . 21 CYS HA . 11331 1
176 . 1 1 21 21 CYS HB2 H 1 3.611 0.030 . 2 . . . . 21 CYS HB2 . 11331 1
177 . 1 1 21 21 CYS HB3 H 1 2.709 0.030 . 2 . . . . 21 CYS HB3 . 11331 1
178 . 1 1 21 21 CYS C C 13 175.776 0.300 . 1 . . . . 21 CYS C . 11331 1
179 . 1 1 21 21 CYS CA C 13 60.098 0.300 . 1 . . . . 21 CYS CA . 11331 1
180 . 1 1 21 21 CYS CB C 13 28.909 0.300 . 1 . . . . 21 CYS CB . 11331 1
181 . 1 1 21 21 CYS N N 15 125.646 0.300 . 1 . . . . 21 CYS N . 11331 1
182 . 1 1 22 22 LEU H H 1 8.413 0.030 . 1 . . . . 22 LEU H . 11331 1
183 . 1 1 22 22 LEU HA H 1 4.077 0.030 . 1 . . . . 22 LEU HA . 11331 1
184 . 1 1 22 22 LEU HB2 H 1 1.530 0.030 . 2 . . . . 22 LEU HB2 . 11331 1
185 . 1 1 22 22 LEU HB3 H 1 1.727 0.030 . 2 . . . . 22 LEU HB3 . 11331 1
186 . 1 1 22 22 LEU HD11 H 1 0.944 0.030 . 1 . . . . 22 LEU HD1 . 11331 1
187 . 1 1 22 22 LEU HD12 H 1 0.944 0.030 . 1 . . . . 22 LEU HD1 . 11331 1
188 . 1 1 22 22 LEU HD13 H 1 0.944 0.030 . 1 . . . . 22 LEU HD1 . 11331 1
189 . 1 1 22 22 LEU HD21 H 1 0.884 0.030 . 1 . . . . 22 LEU HD2 . 11331 1
190 . 1 1 22 22 LEU HD22 H 1 0.884 0.030 . 1 . . . . 22 LEU HD2 . 11331 1
191 . 1 1 22 22 LEU HD23 H 1 0.884 0.030 . 1 . . . . 22 LEU HD2 . 11331 1
192 . 1 1 22 22 LEU HG H 1 1.775 0.030 . 1 . . . . 22 LEU HG . 11331 1
193 . 1 1 22 22 LEU C C 13 178.126 0.300 . 1 . . . . 22 LEU C . 11331 1
194 . 1 1 22 22 LEU CA C 13 57.505 0.300 . 1 . . . . 22 LEU CA . 11331 1
195 . 1 1 22 22 LEU CB C 13 42.184 0.300 . 1 . . . . 22 LEU CB . 11331 1
196 . 1 1 22 22 LEU CD1 C 13 24.980 0.300 . 2 . . . . 22 LEU CD1 . 11331 1
197 . 1 1 22 22 LEU CD2 C 13 23.381 0.300 . 2 . . . . 22 LEU CD2 . 11331 1
198 . 1 1 22 22 LEU CG C 13 27.047 0.300 . 1 . . . . 22 LEU CG . 11331 1
199 . 1 1 22 22 LEU N N 15 128.651 0.300 . 1 . . . . 22 LEU N . 11331 1
200 . 1 1 23 23 ASP H H 1 8.636 0.030 . 1 . . . . 23 ASP H . 11331 1
201 . 1 1 23 23 ASP HA H 1 4.532 0.030 . 1 . . . . 23 ASP HA . 11331 1
202 . 1 1 23 23 ASP HB2 H 1 1.958 0.030 . 2 . . . . 23 ASP HB2 . 11331 1
203 . 1 1 23 23 ASP HB3 H 1 2.089 0.030 . 2 . . . . 23 ASP HB3 . 11331 1
204 . 1 1 23 23 ASP C C 13 175.703 0.300 . 1 . . . . 23 ASP C . 11331 1
205 . 1 1 23 23 ASP CA C 13 55.247 0.300 . 1 . . . . 23 ASP CA . 11331 1
206 . 1 1 23 23 ASP CB C 13 42.435 0.300 . 1 . . . . 23 ASP CB . 11331 1
207 . 1 1 23 23 ASP N N 15 120.022 0.300 . 1 . . . . 23 ASP N . 11331 1
208 . 1 1 24 24 HIS H H 1 7.602 0.030 . 1 . . . . 24 HIS H . 11331 1
209 . 1 1 24 24 HIS HA H 1 4.740 0.030 . 1 . . . . 24 HIS HA . 11331 1
210 . 1 1 24 24 HIS HB2 H 1 3.555 0.030 . 2 . . . . 24 HIS HB2 . 11331 1
211 . 1 1 24 24 HIS HB3 H 1 3.079 0.030 . 2 . . . . 24 HIS HB3 . 11331 1
212 . 1 1 24 24 HIS HD2 H 1 7.199 0.030 . 1 . . . . 24 HIS HD2 . 11331 1
213 . 1 1 24 24 HIS HE1 H 1 8.014 0.030 . 1 . . . . 24 HIS HE1 . 11331 1
214 . 1 1 24 24 HIS C C 13 173.812 0.300 . 1 . . . . 24 HIS C . 11331 1
215 . 1 1 24 24 HIS CA C 13 56.568 0.300 . 1 . . . . 24 HIS CA . 11331 1
216 . 1 1 24 24 HIS CB C 13 30.758 0.300 . 1 . . . . 24 HIS CB . 11331 1
217 . 1 1 24 24 HIS CD2 C 13 119.948 0.300 . 1 . . . . 24 HIS CD2 . 11331 1
218 . 1 1 24 24 HIS CE1 C 13 137.164 0.300 . 1 . . . . 24 HIS CE1 . 11331 1
219 . 1 1 24 24 HIS N N 15 122.994 0.300 . 1 . . . . 24 HIS N . 11331 1
220 . 1 1 25 25 GLU H H 1 8.316 0.030 . 1 . . . . 25 GLU H . 11331 1
221 . 1 1 25 25 GLU HA H 1 4.199 0.030 . 1 . . . . 25 GLU HA . 11331 1
222 . 1 1 25 25 GLU HB2 H 1 2.001 0.030 . 1 . . . . 25 GLU HB2 . 11331 1
223 . 1 1 25 25 GLU HB3 H 1 2.001 0.030 . 1 . . . . 25 GLU HB3 . 11331 1
224 . 1 1 25 25 GLU HG2 H 1 2.228 0.030 . 1 . . . . 25 GLU HG2 . 11331 1
225 . 1 1 25 25 GLU HG3 H 1 2.228 0.030 . 1 . . . . 25 GLU HG3 . 11331 1
226 . 1 1 25 25 GLU C C 13 176.714 0.300 . 1 . . . . 25 GLU C . 11331 1
227 . 1 1 25 25 GLU CA C 13 58.791 0.300 . 1 . . . . 25 GLU CA . 11331 1
228 . 1 1 25 25 GLU CB C 13 29.589 0.300 . 1 . . . . 25 GLU CB . 11331 1
229 . 1 1 25 25 GLU CG C 13 35.762 0.300 . 1 . . . . 25 GLU CG . 11331 1
230 . 1 1 25 25 GLU N N 15 119.952 0.300 . 1 . . . . 25 GLU N . 11331 1
231 . 1 1 26 26 ASN H H 1 8.888 0.030 . 1 . . . . 26 ASN H . 11331 1
232 . 1 1 26 26 ASN HA H 1 4.682 0.030 . 1 . . . . 26 ASN HA . 11331 1
233 . 1 1 26 26 ASN HB2 H 1 2.996 0.030 . 2 . . . . 26 ASN HB2 . 11331 1
234 . 1 1 26 26 ASN HB3 H 1 2.899 0.030 . 2 . . . . 26 ASN HB3 . 11331 1
235 . 1 1 26 26 ASN HD21 H 1 7.005 0.030 . 2 . . . . 26 ASN HD21 . 11331 1
236 . 1 1 26 26 ASN HD22 H 1 7.638 0.030 . 2 . . . . 26 ASN HD22 . 11331 1
237 . 1 1 26 26 ASN C C 13 174.887 0.300 . 1 . . . . 26 ASN C . 11331 1
238 . 1 1 26 26 ASN CA C 13 53.837 0.300 . 1 . . . . 26 ASN CA . 11331 1
239 . 1 1 26 26 ASN CB C 13 38.830 0.300 . 1 . . . . 26 ASN CB . 11331 1
240 . 1 1 26 26 ASN N N 15 115.880 0.300 . 1 . . . . 26 ASN N . 11331 1
241 . 1 1 26 26 ASN ND2 N 15 114.172 0.300 . 1 . . . . 26 ASN ND2 . 11331 1
242 . 1 1 27 27 GLU H H 1 8.340 0.030 . 1 . . . . 27 GLU H . 11331 1
243 . 1 1 27 27 GLU HA H 1 4.522 0.030 . 1 . . . . 27 GLU HA . 11331 1
244 . 1 1 27 27 GLU HB2 H 1 2.322 0.030 . 2 . . . . 27 GLU HB2 . 11331 1
245 . 1 1 27 27 GLU HB3 H 1 2.125 0.030 . 2 . . . . 27 GLU HB3 . 11331 1
246 . 1 1 27 27 GLU HG2 H 1 2.561 0.030 . 2 . . . . 27 GLU HG2 . 11331 1
247 . 1 1 27 27 GLU HG3 H 1 2.227 0.030 . 2 . . . . 27 GLU HG3 . 11331 1
248 . 1 1 27 27 GLU C C 13 176.045 0.300 . 1 . . . . 27 GLU C . 11331 1
249 . 1 1 27 27 GLU CA C 13 54.920 0.300 . 1 . . . . 27 GLU CA . 11331 1
250 . 1 1 27 27 GLU CB C 13 32.295 0.300 . 1 . . . . 27 GLU CB . 11331 1
251 . 1 1 27 27 GLU CG C 13 35.869 0.300 . 1 . . . . 27 GLU CG . 11331 1
252 . 1 1 27 27 GLU N N 15 120.479 0.300 . 1 . . . . 27 GLU N . 11331 1
253 . 1 1 28 28 LYS H H 1 8.642 0.030 . 1 . . . . 28 LYS H . 11331 1
254 . 1 1 28 28 LYS HA H 1 4.551 0.030 . 1 . . . . 28 LYS HA . 11331 1
255 . 1 1 28 28 LYS HB2 H 1 1.826 0.030 . 2 . . . . 28 LYS HB2 . 11331 1
256 . 1 1 28 28 LYS HB3 H 1 1.749 0.030 . 2 . . . . 28 LYS HB3 . 11331 1
257 . 1 1 28 28 LYS HD2 H 1 1.628 0.030 . 2 . . . . 28 LYS HD2 . 11331 1
258 . 1 1 28 28 LYS HD3 H 1 1.562 0.030 . 2 . . . . 28 LYS HD3 . 11331 1
259 . 1 1 28 28 LYS HE2 H 1 2.978 0.030 . 1 . . . . 28 LYS HE2 . 11331 1
260 . 1 1 28 28 LYS HE3 H 1 2.978 0.030 . 1 . . . . 28 LYS HE3 . 11331 1
261 . 1 1 28 28 LYS HG2 H 1 1.522 0.030 . 2 . . . . 28 LYS HG2 . 11331 1
262 . 1 1 28 28 LYS HG3 H 1 1.423 0.030 . 2 . . . . 28 LYS HG3 . 11331 1
263 . 1 1 28 28 LYS C C 13 177.403 0.300 . 1 . . . . 28 LYS C . 11331 1
264 . 1 1 28 28 LYS CA C 13 55.325 0.300 . 1 . . . . 28 LYS CA . 11331 1
265 . 1 1 28 28 LYS CB C 13 32.858 0.300 . 1 . . . . 28 LYS CB . 11331 1
266 . 1 1 28 28 LYS CD C 13 28.829 0.300 . 1 . . . . 28 LYS CD . 11331 1
267 . 1 1 28 28 LYS CE C 13 42.448 0.300 . 1 . . . . 28 LYS CE . 11331 1
268 . 1 1 28 28 LYS CG C 13 25.042 0.300 . 1 . . . . 28 LYS CG . 11331 1
269 . 1 1 28 28 LYS N N 15 121.490 0.300 . 1 . . . . 28 LYS N . 11331 1
270 . 1 1 29 29 VAL H H 1 8.171 0.030 . 1 . . . . 29 VAL H . 11331 1
271 . 1 1 29 29 VAL HA H 1 3.790 0.030 . 1 . . . . 29 VAL HA . 11331 1
272 . 1 1 29 29 VAL HB H 1 2.062 0.030 . 1 . . . . 29 VAL HB . 11331 1
273 . 1 1 29 29 VAL HG11 H 1 0.755 0.030 . 1 . . . . 29 VAL HG1 . 11331 1
274 . 1 1 29 29 VAL HG12 H 1 0.755 0.030 . 1 . . . . 29 VAL HG1 . 11331 1
275 . 1 1 29 29 VAL HG13 H 1 0.755 0.030 . 1 . . . . 29 VAL HG1 . 11331 1
276 . 1 1 29 29 VAL HG21 H 1 0.892 0.030 . 1 . . . . 29 VAL HG2 . 11331 1
277 . 1 1 29 29 VAL HG22 H 1 0.892 0.030 . 1 . . . . 29 VAL HG2 . 11331 1
278 . 1 1 29 29 VAL HG23 H 1 0.892 0.030 . 1 . . . . 29 VAL HG2 . 11331 1
279 . 1 1 29 29 VAL C C 13 175.814 0.300 . 1 . . . . 29 VAL C . 11331 1
280 . 1 1 29 29 VAL CA C 13 62.579 0.300 . 1 . . . . 29 VAL CA . 11331 1
281 . 1 1 29 29 VAL CB C 13 31.553 0.300 . 1 . . . . 29 VAL CB . 11331 1
282 . 1 1 29 29 VAL CG1 C 13 21.896 0.300 . 2 . . . . 29 VAL CG1 . 11331 1
283 . 1 1 29 29 VAL CG2 C 13 19.168 0.300 . 2 . . . . 29 VAL CG2 . 11331 1
284 . 1 1 29 29 VAL N N 15 116.876 0.300 . 1 . . . . 29 VAL N . 11331 1
285 . 1 1 30 30 ASN H H 1 8.629 0.030 . 1 . . . . 30 ASN H . 11331 1
286 . 1 1 30 30 ASN HA H 1 4.765 0.030 . 1 . . . . 30 ASN HA . 11331 1
287 . 1 1 30 30 ASN HB2 H 1 2.646 0.030 . 2 . . . . 30 ASN HB2 . 11331 1
288 . 1 1 30 30 ASN HB3 H 1 3.088 0.030 . 2 . . . . 30 ASN HB3 . 11331 1
289 . 1 1 30 30 ASN HD21 H 1 6.305 0.030 . 2 . . . . 30 ASN HD21 . 11331 1
290 . 1 1 30 30 ASN HD22 H 1 7.301 0.030 . 2 . . . . 30 ASN HD22 . 11331 1
291 . 1 1 30 30 ASN C C 13 174.177 0.300 . 1 . . . . 30 ASN C . 11331 1
292 . 1 1 30 30 ASN CA C 13 52.967 0.300 . 1 . . . . 30 ASN CA . 11331 1
293 . 1 1 30 30 ASN CB C 13 39.907 0.300 . 1 . . . . 30 ASN CB . 11331 1
294 . 1 1 30 30 ASN N N 15 120.051 0.300 . 1 . . . . 30 ASN N . 11331 1
295 . 1 1 30 30 ASN ND2 N 15 108.085 0.300 . 1 . . . . 30 ASN ND2 . 11331 1
296 . 1 1 31 31 MET H H 1 8.443 0.030 . 1 . . . . 31 MET H . 11331 1
297 . 1 1 31 31 MET HA H 1 4.834 0.030 . 1 . . . . 31 MET HA . 11331 1
298 . 1 1 31 31 MET HB2 H 1 1.910 0.030 . 2 . . . . 31 MET HB2 . 11331 1
299 . 1 1 31 31 MET HB3 H 1 1.781 0.030 . 2 . . . . 31 MET HB3 . 11331 1
300 . 1 1 31 31 MET HE1 H 1 1.948 0.030 . 1 . . . . 31 MET HE . 11331 1
301 . 1 1 31 31 MET HE2 H 1 1.948 0.030 . 1 . . . . 31 MET HE . 11331 1
302 . 1 1 31 31 MET HE3 H 1 1.948 0.030 . 1 . . . . 31 MET HE . 11331 1
303 . 1 1 31 31 MET HG2 H 1 2.361 0.030 . 1 . . . . 31 MET HG2 . 11331 1
304 . 1 1 31 31 MET HG3 H 1 2.361 0.030 . 1 . . . . 31 MET HG3 . 11331 1
305 . 1 1 31 31 MET C C 13 172.225 0.300 . 1 . . . . 31 MET C . 11331 1
306 . 1 1 31 31 MET CA C 13 54.973 0.300 . 1 . . . . 31 MET CA . 11331 1
307 . 1 1 31 31 MET CB C 13 38.230 0.300 . 1 . . . . 31 MET CB . 11331 1
308 . 1 1 31 31 MET CE C 13 17.638 0.300 . 1 . . . . 31 MET CE . 11331 1
309 . 1 1 31 31 MET CG C 13 32.552 0.300 . 1 . . . . 31 MET CG . 11331 1
310 . 1 1 31 31 MET N N 15 119.571 0.300 . 1 . . . . 31 MET N . 11331 1
311 . 1 1 32 32 TYR H H 1 9.067 0.030 . 1 . . . . 32 TYR H . 11331 1
312 . 1 1 32 32 TYR HA H 1 4.915 0.030 . 1 . . . . 32 TYR HA . 11331 1
313 . 1 1 32 32 TYR HB2 H 1 2.633 0.030 . 2 . . . . 32 TYR HB2 . 11331 1
314 . 1 1 32 32 TYR HB3 H 1 2.571 0.030 . 2 . . . . 32 TYR HB3 . 11331 1
315 . 1 1 32 32 TYR HD1 H 1 6.689 0.030 . 1 . . . . 32 TYR HD1 . 11331 1
316 . 1 1 32 32 TYR HD2 H 1 6.689 0.030 . 1 . . . . 32 TYR HD2 . 11331 1
317 . 1 1 32 32 TYR HE1 H 1 6.678 0.030 . 1 . . . . 32 TYR HE1 . 11331 1
318 . 1 1 32 32 TYR HE2 H 1 6.678 0.030 . 1 . . . . 32 TYR HE2 . 11331 1
319 . 1 1 32 32 TYR C C 13 173.265 0.300 . 1 . . . . 32 TYR C . 11331 1
320 . 1 1 32 32 TYR CA C 13 55.863 0.300 . 1 . . . . 32 TYR CA . 11331 1
321 . 1 1 32 32 TYR CB C 13 41.854 0.300 . 1 . . . . 32 TYR CB . 11331 1
322 . 1 1 32 32 TYR CD1 C 13 132.753 0.300 . 1 . . . . 32 TYR CD1 . 11331 1
323 . 1 1 32 32 TYR CD2 C 13 132.753 0.300 . 1 . . . . 32 TYR CD2 . 11331 1
324 . 1 1 32 32 TYR CE1 C 13 117.974 0.300 . 1 . . . . 32 TYR CE1 . 11331 1
325 . 1 1 32 32 TYR CE2 C 13 117.974 0.300 . 1 . . . . 32 TYR CE2 . 11331 1
326 . 1 1 32 32 TYR N N 15 121.192 0.300 . 1 . . . . 32 TYR N . 11331 1
327 . 1 1 33 33 CYS H H 1 9.140 0.030 . 1 . . . . 33 CYS H . 11331 1
328 . 1 1 33 33 CYS HA H 1 4.666 0.030 . 1 . . . . 33 CYS HA . 11331 1
329 . 1 1 33 33 CYS HB2 H 1 3.043 0.030 . 2 . . . . 33 CYS HB2 . 11331 1
330 . 1 1 33 33 CYS HB3 H 1 2.365 0.030 . 2 . . . . 33 CYS HB3 . 11331 1
331 . 1 1 33 33 CYS C C 13 175.294 0.300 . 1 . . . . 33 CYS C . 11331 1
332 . 1 1 33 33 CYS CA C 13 59.144 0.300 . 1 . . . . 33 CYS CA . 11331 1
333 . 1 1 33 33 CYS CB C 13 28.772 0.300 . 1 . . . . 33 CYS CB . 11331 1
334 . 1 1 33 33 CYS N N 15 129.096 0.300 . 1 . . . . 33 CYS N . 11331 1
335 . 1 1 34 34 VAL H H 1 8.876 0.030 . 1 . . . . 34 VAL H . 11331 1
336 . 1 1 34 34 VAL HA H 1 3.464 0.030 . 1 . . . . 34 VAL HA . 11331 1
337 . 1 1 34 34 VAL HB H 1 1.800 0.030 . 1 . . . . 34 VAL HB . 11331 1
338 . 1 1 34 34 VAL HG11 H 1 0.947 0.030 . 1 . . . . 34 VAL HG1 . 11331 1
339 . 1 1 34 34 VAL HG12 H 1 0.947 0.030 . 1 . . . . 34 VAL HG1 . 11331 1
340 . 1 1 34 34 VAL HG13 H 1 0.947 0.030 . 1 . . . . 34 VAL HG1 . 11331 1
341 . 1 1 34 34 VAL HG21 H 1 0.988 0.030 . 1 . . . . 34 VAL HG2 . 11331 1
342 . 1 1 34 34 VAL HG22 H 1 0.988 0.030 . 1 . . . . 34 VAL HG2 . 11331 1
343 . 1 1 34 34 VAL HG23 H 1 0.988 0.030 . 1 . . . . 34 VAL HG2 . 11331 1
344 . 1 1 34 34 VAL C C 13 178.462 0.300 . 1 . . . . 34 VAL C . 11331 1
345 . 1 1 34 34 VAL CA C 13 64.625 0.300 . 1 . . . . 34 VAL CA . 11331 1
346 . 1 1 34 34 VAL CB C 13 32.439 0.300 . 1 . . . . 34 VAL CB . 11331 1
347 . 1 1 34 34 VAL CG1 C 13 21.157 0.300 . 2 . . . . 34 VAL CG1 . 11331 1
348 . 1 1 34 34 VAL CG2 C 13 22.096 0.300 . 2 . . . . 34 VAL CG2 . 11331 1
349 . 1 1 34 34 VAL N N 15 130.438 0.300 . 1 . . . . 34 VAL N . 11331 1
350 . 1 1 35 35 SER H H 1 7.908 0.030 . 1 . . . . 35 SER H . 11331 1
351 . 1 1 35 35 SER HA H 1 4.135 0.030 . 1 . . . . 35 SER HA . 11331 1
352 . 1 1 35 35 SER HB2 H 1 3.580 0.030 . 2 . . . . 35 SER HB2 . 11331 1
353 . 1 1 35 35 SER HB3 H 1 3.378 0.030 . 2 . . . . 35 SER HB3 . 11331 1
354 . 1 1 35 35 SER C C 13 174.980 0.300 . 1 . . . . 35 SER C . 11331 1
355 . 1 1 35 35 SER CA C 13 62.258 0.300 . 1 . . . . 35 SER CA . 11331 1
356 . 1 1 35 35 SER CB C 13 62.690 0.300 . 1 . . . . 35 SER CB . 11331 1
357 . 1 1 35 35 SER N N 15 114.900 0.300 . 1 . . . . 35 SER N . 11331 1
358 . 1 1 36 36 ASP H H 1 7.828 0.030 . 1 . . . . 36 ASP H . 11331 1
359 . 1 1 36 36 ASP HA H 1 4.798 0.030 . 1 . . . . 36 ASP HA . 11331 1
360 . 1 1 36 36 ASP HB2 H 1 2.811 0.030 . 1 . . . . 36 ASP HB2 . 11331 1
361 . 1 1 36 36 ASP HB3 H 1 2.811 0.030 . 1 . . . . 36 ASP HB3 . 11331 1
362 . 1 1 36 36 ASP C C 13 174.641 0.300 . 1 . . . . 36 ASP C . 11331 1
363 . 1 1 36 36 ASP CA C 13 54.648 0.300 . 1 . . . . 36 ASP CA . 11331 1
364 . 1 1 36 36 ASP CB C 13 42.444 0.300 . 1 . . . . 36 ASP CB . 11331 1
365 . 1 1 36 36 ASP N N 15 116.833 0.300 . 1 . . . . 36 ASP N . 11331 1
366 . 1 1 37 37 ASP H H 1 7.975 0.030 . 1 . . . . 37 ASP H . 11331 1
367 . 1 1 37 37 ASP HA H 1 4.169 0.030 . 1 . . . . 37 ASP HA . 11331 1
368 . 1 1 37 37 ASP HB2 H 1 2.538 0.030 . 2 . . . . 37 ASP HB2 . 11331 1
369 . 1 1 37 37 ASP HB3 H 1 3.201 0.030 . 2 . . . . 37 ASP HB3 . 11331 1
370 . 1 1 37 37 ASP C C 13 174.063 0.300 . 1 . . . . 37 ASP C . 11331 1
371 . 1 1 37 37 ASP CA C 13 55.230 0.300 . 1 . . . . 37 ASP CA . 11331 1
372 . 1 1 37 37 ASP CB C 13 39.432 0.300 . 1 . . . . 37 ASP CB . 11331 1
373 . 1 1 37 37 ASP N N 15 120.149 0.300 . 1 . . . . 37 ASP N . 11331 1
374 . 1 1 38 38 GLN H H 1 7.224 0.030 . 1 . . . . 38 GLN H . 11331 1
375 . 1 1 38 38 GLN HA H 1 4.664 0.030 . 1 . . . . 38 GLN HA . 11331 1
376 . 1 1 38 38 GLN HB2 H 1 2.307 0.030 . 2 . . . . 38 GLN HB2 . 11331 1
377 . 1 1 38 38 GLN HB3 H 1 1.727 0.030 . 2 . . . . 38 GLN HB3 . 11331 1
378 . 1 1 38 38 GLN HE21 H 1 6.863 0.030 . 2 . . . . 38 GLN HE21 . 11331 1
379 . 1 1 38 38 GLN HE22 H 1 7.320 0.030 . 2 . . . . 38 GLN HE22 . 11331 1
380 . 1 1 38 38 GLN HG2 H 1 2.298 0.030 . 1 . . . . 38 GLN HG2 . 11331 1
381 . 1 1 38 38 GLN HG3 H 1 2.298 0.030 . 1 . . . . 38 GLN HG3 . 11331 1
382 . 1 1 38 38 GLN C C 13 174.478 0.300 . 1 . . . . 38 GLN C . 11331 1
383 . 1 1 38 38 GLN CA C 13 54.181 0.300 . 1 . . . . 38 GLN CA . 11331 1
384 . 1 1 38 38 GLN CB C 13 33.511 0.300 . 1 . . . . 38 GLN CB . 11331 1
385 . 1 1 38 38 GLN CG C 13 33.478 0.300 . 1 . . . . 38 GLN CG . 11331 1
386 . 1 1 38 38 GLN N N 15 115.100 0.300 . 1 . . . . 38 GLN N . 11331 1
387 . 1 1 38 38 GLN NE2 N 15 111.058 0.300 . 1 . . . . 38 GLN NE2 . 11331 1
388 . 1 1 39 39 LEU H H 1 8.762 0.030 . 1 . . . . 39 LEU H . 11331 1
389 . 1 1 39 39 LEU HA H 1 4.881 0.030 . 1 . . . . 39 LEU HA . 11331 1
390 . 1 1 39 39 LEU HB2 H 1 1.915 0.030 . 2 . . . . 39 LEU HB2 . 11331 1
391 . 1 1 39 39 LEU HB3 H 1 1.329 0.030 . 2 . . . . 39 LEU HB3 . 11331 1
392 . 1 1 39 39 LEU HD11 H 1 0.974 0.030 . 1 . . . . 39 LEU HD1 . 11331 1
393 . 1 1 39 39 LEU HD12 H 1 0.974 0.030 . 1 . . . . 39 LEU HD1 . 11331 1
394 . 1 1 39 39 LEU HD13 H 1 0.974 0.030 . 1 . . . . 39 LEU HD1 . 11331 1
395 . 1 1 39 39 LEU HD21 H 1 0.908 0.030 . 1 . . . . 39 LEU HD2 . 11331 1
396 . 1 1 39 39 LEU HD22 H 1 0.908 0.030 . 1 . . . . 39 LEU HD2 . 11331 1
397 . 1 1 39 39 LEU HD23 H 1 0.908 0.030 . 1 . . . . 39 LEU HD2 . 11331 1
398 . 1 1 39 39 LEU HG H 1 1.865 0.030 . 1 . . . . 39 LEU HG . 11331 1
399 . 1 1 39 39 LEU C C 13 176.550 0.300 . 1 . . . . 39 LEU C . 11331 1
400 . 1 1 39 39 LEU CA C 13 55.021 0.300 . 1 . . . . 39 LEU CA . 11331 1
401 . 1 1 39 39 LEU CB C 13 41.767 0.300 . 1 . . . . 39 LEU CB . 11331 1
402 . 1 1 39 39 LEU CD1 C 13 26.088 0.300 . 2 . . . . 39 LEU CD1 . 11331 1
403 . 1 1 39 39 LEU CD2 C 13 24.133 0.300 . 2 . . . . 39 LEU CD2 . 11331 1
404 . 1 1 39 39 LEU CG C 13 27.343 0.300 . 1 . . . . 39 LEU CG . 11331 1
405 . 1 1 39 39 LEU N N 15 124.658 0.300 . 1 . . . . 39 LEU N . 11331 1
406 . 1 1 40 40 ILE H H 1 8.592 0.030 . 1 . . . . 40 ILE H . 11331 1
407 . 1 1 40 40 ILE HA H 1 4.892 0.030 . 1 . . . . 40 ILE HA . 11331 1
408 . 1 1 40 40 ILE HB H 1 2.010 0.030 . 1 . . . . 40 ILE HB . 11331 1
409 . 1 1 40 40 ILE HD11 H 1 0.538 0.030 . 1 . . . . 40 ILE HD1 . 11331 1
410 . 1 1 40 40 ILE HD12 H 1 0.538 0.030 . 1 . . . . 40 ILE HD1 . 11331 1
411 . 1 1 40 40 ILE HD13 H 1 0.538 0.030 . 1 . . . . 40 ILE HD1 . 11331 1
412 . 1 1 40 40 ILE HG12 H 1 1.164 0.030 . 2 . . . . 40 ILE HG12 . 11331 1
413 . 1 1 40 40 ILE HG13 H 1 0.542 0.030 . 2 . . . . 40 ILE HG13 . 11331 1
414 . 1 1 40 40 ILE HG21 H 1 -0.023 0.030 . 1 . . . . 40 ILE HG2 . 11331 1
415 . 1 1 40 40 ILE HG22 H 1 -0.023 0.030 . 1 . . . . 40 ILE HG2 . 11331 1
416 . 1 1 40 40 ILE HG23 H 1 -0.023 0.030 . 1 . . . . 40 ILE HG2 . 11331 1
417 . 1 1 40 40 ILE C C 13 173.717 0.300 . 1 . . . . 40 ILE C . 11331 1
418 . 1 1 40 40 ILE CA C 13 60.159 0.300 . 1 . . . . 40 ILE CA . 11331 1
419 . 1 1 40 40 ILE CB C 13 42.373 0.300 . 1 . . . . 40 ILE CB . 11331 1
420 . 1 1 40 40 ILE CD1 C 13 14.687 0.300 . 1 . . . . 40 ILE CD1 . 11331 1
421 . 1 1 40 40 ILE CG1 C 13 25.610 0.300 . 1 . . . . 40 ILE CG1 . 11331 1
422 . 1 1 40 40 ILE CG2 C 13 16.159 0.300 . 1 . . . . 40 ILE CG2 . 11331 1
423 . 1 1 40 40 ILE N N 15 115.602 0.300 . 1 . . . . 40 ILE N . 11331 1
424 . 1 1 41 41 CYS H H 1 8.101 0.030 . 1 . . . . 41 CYS H . 11331 1
425 . 1 1 41 41 CYS HA H 1 5.489 0.030 . 1 . . . . 41 CYS HA . 11331 1
426 . 1 1 41 41 CYS HB2 H 1 3.607 0.030 . 2 . . . . 41 CYS HB2 . 11331 1
427 . 1 1 41 41 CYS HB3 H 1 2.588 0.030 . 2 . . . . 41 CYS HB3 . 11331 1
428 . 1 1 41 41 CYS C C 13 175.957 0.300 . 1 . . . . 41 CYS C . 11331 1
429 . 1 1 41 41 CYS CA C 13 56.623 0.300 . 1 . . . . 41 CYS CA . 11331 1
430 . 1 1 41 41 CYS CB C 13 35.033 0.300 . 1 . . . . 41 CYS CB . 11331 1
431 . 1 1 41 41 CYS N N 15 119.004 0.300 . 1 . . . . 41 CYS N . 11331 1
432 . 1 1 42 42 ALA H H 1 8.661 0.030 . 1 . . . . 42 ALA H . 11331 1
433 . 1 1 42 42 ALA HA H 1 4.054 0.030 . 1 . . . . 42 ALA HA . 11331 1
434 . 1 1 42 42 ALA HB1 H 1 1.421 0.030 . 1 . . . . 42 ALA HB . 11331 1
435 . 1 1 42 42 ALA HB2 H 1 1.421 0.030 . 1 . . . . 42 ALA HB . 11331 1
436 . 1 1 42 42 ALA HB3 H 1 1.421 0.030 . 1 . . . . 42 ALA HB . 11331 1
437 . 1 1 42 42 ALA C C 13 181.314 0.300 . 1 . . . . 42 ALA C . 11331 1
438 . 1 1 42 42 ALA CA C 13 55.512 0.300 . 1 . . . . 42 ALA CA . 11331 1
439 . 1 1 42 42 ALA CB C 13 19.014 0.300 . 1 . . . . 42 ALA CB . 11331 1
440 . 1 1 42 42 ALA N N 15 119.446 0.300 . 1 . . . . 42 ALA N . 11331 1
441 . 1 1 43 43 LEU H H 1 8.701 0.030 . 1 . . . . 43 LEU H . 11331 1
442 . 1 1 43 43 LEU HA H 1 3.900 0.030 . 1 . . . . 43 LEU HA . 11331 1
443 . 1 1 43 43 LEU HB2 H 1 0.749 0.030 . 2 . . . . 43 LEU HB2 . 11331 1
444 . 1 1 43 43 LEU HB3 H 1 0.477 0.030 . 2 . . . . 43 LEU HB3 . 11331 1
445 . 1 1 43 43 LEU HD11 H 1 0.729 0.030 . 1 . . . . 43 LEU HD1 . 11331 1
446 . 1 1 43 43 LEU HD12 H 1 0.729 0.030 . 1 . . . . 43 LEU HD1 . 11331 1
447 . 1 1 43 43 LEU HD13 H 1 0.729 0.030 . 1 . . . . 43 LEU HD1 . 11331 1
448 . 1 1 43 43 LEU HD21 H 1 0.690 0.030 . 1 . . . . 43 LEU HD2 . 11331 1
449 . 1 1 43 43 LEU HD22 H 1 0.690 0.030 . 1 . . . . 43 LEU HD2 . 11331 1
450 . 1 1 43 43 LEU HD23 H 1 0.690 0.030 . 1 . . . . 43 LEU HD2 . 11331 1
451 . 1 1 43 43 LEU HG H 1 1.513 0.030 . 1 . . . . 43 LEU HG . 11331 1
452 . 1 1 43 43 LEU C C 13 179.670 0.300 . 1 . . . . 43 LEU C . 11331 1
453 . 1 1 43 43 LEU CA C 13 58.049 0.300 . 1 . . . . 43 LEU CA . 11331 1
454 . 1 1 43 43 LEU CB C 13 39.953 0.300 . 1 . . . . 43 LEU CB . 11331 1
455 . 1 1 43 43 LEU CD1 C 13 25.412 0.300 . 2 . . . . 43 LEU CD1 . 11331 1
456 . 1 1 43 43 LEU CD2 C 13 22.359 0.300 . 2 . . . . 43 LEU CD2 . 11331 1
457 . 1 1 43 43 LEU CG C 13 27.095 0.300 . 1 . . . . 43 LEU CG . 11331 1
458 . 1 1 43 43 LEU N N 15 120.250 0.300 . 1 . . . . 43 LEU N . 11331 1
459 . 1 1 44 44 CYS H H 1 8.180 0.030 . 1 . . . . 44 CYS H . 11331 1
460 . 1 1 44 44 CYS HA H 1 4.030 0.030 . 1 . . . . 44 CYS HA . 11331 1
461 . 1 1 44 44 CYS HB2 H 1 2.644 0.030 . 2 . . . . 44 CYS HB2 . 11331 1
462 . 1 1 44 44 CYS HB3 H 1 3.895 0.030 . 2 . . . . 44 CYS HB3 . 11331 1
463 . 1 1 44 44 CYS C C 13 176.160 0.300 . 1 . . . . 44 CYS C . 11331 1
464 . 1 1 44 44 CYS CA C 13 66.208 0.300 . 1 . . . . 44 CYS CA . 11331 1
465 . 1 1 44 44 CYS CB C 13 31.335 0.300 . 1 . . . . 44 CYS CB . 11331 1
466 . 1 1 44 44 CYS N N 15 123.872 0.300 . 1 . . . . 44 CYS N . 11331 1
467 . 1 1 45 45 LYS H H 1 6.676 0.030 . 1 . . . . 45 LYS H . 11331 1
468 . 1 1 45 45 LYS HA H 1 3.994 0.030 . 1 . . . . 45 LYS HA . 11331 1
469 . 1 1 45 45 LYS HB2 H 1 1.538 0.030 . 2 . . . . 45 LYS HB2 . 11331 1
470 . 1 1 45 45 LYS HB3 H 1 1.888 0.030 . 2 . . . . 45 LYS HB3 . 11331 1
471 . 1 1 45 45 LYS HD2 H 1 1.492 0.030 . 2 . . . . 45 LYS HD2 . 11331 1
472 . 1 1 45 45 LYS HD3 H 1 2.101 0.030 . 2 . . . . 45 LYS HD3 . 11331 1
473 . 1 1 45 45 LYS HE2 H 1 3.077 0.030 . 2 . . . . 45 LYS HE2 . 11331 1
474 . 1 1 45 45 LYS HE3 H 1 2.971 0.030 . 2 . . . . 45 LYS HE3 . 11331 1
475 . 1 1 45 45 LYS HG2 H 1 1.402 0.030 . 1 . . . . 45 LYS HG2 . 11331 1
476 . 1 1 45 45 LYS HG3 H 1 1.402 0.030 . 1 . . . . 45 LYS HG3 . 11331 1
477 . 1 1 45 45 LYS C C 13 175.071 0.300 . 1 . . . . 45 LYS C . 11331 1
478 . 1 1 45 45 LYS CA C 13 55.463 0.300 . 1 . . . . 45 LYS CA . 11331 1
479 . 1 1 45 45 LYS CB C 13 33.820 0.300 . 1 . . . . 45 LYS CB . 11331 1
480 . 1 1 45 45 LYS CD C 13 28.829 0.300 . 1 . . . . 45 LYS CD . 11331 1
481 . 1 1 45 45 LYS CE C 13 42.696 0.300 . 1 . . . . 45 LYS CE . 11331 1
482 . 1 1 45 45 LYS CG C 13 24.867 0.300 . 1 . . . . 45 LYS CG . 11331 1
483 . 1 1 45 45 LYS N N 15 115.182 0.300 . 1 . . . . 45 LYS N . 11331 1
484 . 1 1 46 46 LEU H H 1 7.969 0.030 . 1 . . . . 46 LEU H . 11331 1
485 . 1 1 46 46 LEU HA H 1 4.241 0.030 . 1 . . . . 46 LEU HA . 11331 1
486 . 1 1 46 46 LEU HB2 H 1 1.651 0.030 . 2 . . . . 46 LEU HB2 . 11331 1
487 . 1 1 46 46 LEU HB3 H 1 1.582 0.030 . 2 . . . . 46 LEU HB3 . 11331 1
488 . 1 1 46 46 LEU HD11 H 1 0.857 0.030 . 1 . . . . 46 LEU HD1 . 11331 1
489 . 1 1 46 46 LEU HD12 H 1 0.857 0.030 . 1 . . . . 46 LEU HD1 . 11331 1
490 . 1 1 46 46 LEU HD13 H 1 0.857 0.030 . 1 . . . . 46 LEU HD1 . 11331 1
491 . 1 1 46 46 LEU HD21 H 1 0.851 0.030 . 1 . . . . 46 LEU HD2 . 11331 1
492 . 1 1 46 46 LEU HD22 H 1 0.851 0.030 . 1 . . . . 46 LEU HD2 . 11331 1
493 . 1 1 46 46 LEU HD23 H 1 0.851 0.030 . 1 . . . . 46 LEU HD2 . 11331 1
494 . 1 1 46 46 LEU HG H 1 1.586 0.030 . 1 . . . . 46 LEU HG . 11331 1
495 . 1 1 46 46 LEU C C 13 178.365 0.300 . 1 . . . . 46 LEU C . 11331 1
496 . 1 1 46 46 LEU CA C 13 57.763 0.300 . 1 . . . . 46 LEU CA . 11331 1
497 . 1 1 46 46 LEU CB C 13 44.331 0.300 . 1 . . . . 46 LEU CB . 11331 1
498 . 1 1 46 46 LEU CD1 C 13 23.629 0.300 . 2 . . . . 46 LEU CD1 . 11331 1
499 . 1 1 46 46 LEU CD2 C 13 24.371 0.300 . 2 . . . . 46 LEU CD2 . 11331 1
500 . 1 1 46 46 LEU CG C 13 26.988 0.300 . 1 . . . . 46 LEU CG . 11331 1
501 . 1 1 46 46 LEU N N 15 118.461 0.300 . 1 . . . . 46 LEU N . 11331 1
502 . 1 1 47 47 VAL H H 1 8.034 0.030 . 1 . . . . 47 VAL H . 11331 1
503 . 1 1 47 47 VAL HA H 1 4.627 0.030 . 1 . . . . 47 VAL HA . 11331 1
504 . 1 1 47 47 VAL HB H 1 2.344 0.030 . 1 . . . . 47 VAL HB . 11331 1
505 . 1 1 47 47 VAL HG11 H 1 0.861 0.030 . 1 . . . . 47 VAL HG1 . 11331 1
506 . 1 1 47 47 VAL HG12 H 1 0.861 0.030 . 1 . . . . 47 VAL HG1 . 11331 1
507 . 1 1 47 47 VAL HG13 H 1 0.861 0.030 . 1 . . . . 47 VAL HG1 . 11331 1
508 . 1 1 47 47 VAL HG21 H 1 0.768 0.030 . 1 . . . . 47 VAL HG2 . 11331 1
509 . 1 1 47 47 VAL HG22 H 1 0.768 0.030 . 1 . . . . 47 VAL HG2 . 11331 1
510 . 1 1 47 47 VAL HG23 H 1 0.768 0.030 . 1 . . . . 47 VAL HG2 . 11331 1
511 . 1 1 47 47 VAL C C 13 176.476 0.300 . 1 . . . . 47 VAL C . 11331 1
512 . 1 1 47 47 VAL CA C 13 60.483 0.300 . 1 . . . . 47 VAL CA . 11331 1
513 . 1 1 47 47 VAL CB C 13 34.906 0.300 . 1 . . . . 47 VAL CB . 11331 1
514 . 1 1 47 47 VAL CG1 C 13 21.895 0.300 . 2 . . . . 47 VAL CG1 . 11331 1
515 . 1 1 47 47 VAL CG2 C 13 18.938 0.300 . 2 . . . . 47 VAL CG2 . 11331 1
516 . 1 1 47 47 VAL N N 15 107.167 0.300 . 1 . . . . 47 VAL N . 11331 1
517 . 1 1 48 48 GLY H H 1 7.461 0.030 . 1 . . . . 48 GLY H . 11331 1
518 . 1 1 48 48 GLY HA2 H 1 3.987 0.030 . 2 . . . . 48 GLY HA2 . 11331 1
519 . 1 1 48 48 GLY HA3 H 1 4.635 0.030 . 2 . . . . 48 GLY HA3 . 11331 1
520 . 1 1 48 48 GLY C C 13 175.404 0.300 . 1 . . . . 48 GLY C . 11331 1
521 . 1 1 48 48 GLY CA C 13 44.939 0.300 . 1 . . . . 48 GLY CA . 11331 1
522 . 1 1 48 48 GLY N N 15 110.295 0.300 . 1 . . . . 48 GLY N . 11331 1
523 . 1 1 49 49 ARG H H 1 9.125 0.030 . 1 . . . . 49 ARG H . 11331 1
524 . 1 1 49 49 ARG HA H 1 4.119 0.030 . 1 . . . . 49 ARG HA . 11331 1
525 . 1 1 49 49 ARG HB2 H 1 1.632 0.030 . 1 . . . . 49 ARG HB2 . 11331 1
526 . 1 1 49 49 ARG HB3 H 1 1.632 0.030 . 1 . . . . 49 ARG HB3 . 11331 1
527 . 1 1 49 49 ARG HD2 H 1 3.112 0.030 . 1 . . . . 49 ARG HD2 . 11331 1
528 . 1 1 49 49 ARG HD3 H 1 3.112 0.030 . 1 . . . . 49 ARG HD3 . 11331 1
529 . 1 1 49 49 ARG HG2 H 1 1.058 0.030 . 2 . . . . 49 ARG HG2 . 11331 1
530 . 1 1 49 49 ARG HG3 H 1 1.495 0.030 . 2 . . . . 49 ARG HG3 . 11331 1
531 . 1 1 49 49 ARG C C 13 176.268 0.300 . 1 . . . . 49 ARG C . 11331 1
532 . 1 1 49 49 ARG CA C 13 57.553 0.300 . 1 . . . . 49 ARG CA . 11331 1
533 . 1 1 49 49 ARG CB C 13 29.819 0.300 . 1 . . . . 49 ARG CB . 11331 1
534 . 1 1 49 49 ARG CD C 13 43.525 0.300 . 1 . . . . 49 ARG CD . 11331 1
535 . 1 1 49 49 ARG CG C 13 27.309 0.300 . 1 . . . . 49 ARG CG . 11331 1
536 . 1 1 49 49 ARG N N 15 118.207 0.300 . 1 . . . . 49 ARG N . 11331 1
537 . 1 1 50 50 HIS H H 1 7.493 0.030 . 1 . . . . 50 HIS H . 11331 1
538 . 1 1 50 50 HIS HA H 1 3.420 0.030 . 1 . . . . 50 HIS HA . 11331 1
539 . 1 1 50 50 HIS HB2 H 1 3.215 0.030 . 2 . . . . 50 HIS HB2 . 11331 1
540 . 1 1 50 50 HIS HB3 H 1 2.237 0.030 . 2 . . . . 50 HIS HB3 . 11331 1
541 . 1 1 50 50 HIS HD2 H 1 7.062 0.030 . 1 . . . . 50 HIS HD2 . 11331 1
542 . 1 1 50 50 HIS HE1 H 1 7.950 0.030 . 1 . . . . 50 HIS HE1 . 11331 1
543 . 1 1 50 50 HIS C C 13 175.212 0.300 . 1 . . . . 50 HIS C . 11331 1
544 . 1 1 50 50 HIS CA C 13 53.202 0.300 . 1 . . . . 50 HIS CA . 11331 1
545 . 1 1 50 50 HIS CB C 13 30.639 0.300 . 1 . . . . 50 HIS CB . 11331 1
546 . 1 1 50 50 HIS CD2 C 13 121.257 0.300 . 1 . . . . 50 HIS CD2 . 11331 1
547 . 1 1 50 50 HIS CE1 C 13 140.460 0.300 . 1 . . . . 50 HIS CE1 . 11331 1
548 . 1 1 50 50 HIS N N 15 115.850 0.300 . 1 . . . . 50 HIS N . 11331 1
549 . 1 1 51 51 ARG H H 1 7.046 0.030 . 1 . . . . 51 ARG H . 11331 1
550 . 1 1 51 51 ARG HA H 1 4.635 0.030 . 1 . . . . 51 ARG HA . 11331 1
551 . 1 1 51 51 ARG HB2 H 1 1.713 0.030 . 2 . . . . 51 ARG HB2 . 11331 1
552 . 1 1 51 51 ARG HB3 H 1 1.590 0.030 . 2 . . . . 51 ARG HB3 . 11331 1
553 . 1 1 51 51 ARG HD2 H 1 3.056 0.030 . 2 . . . . 51 ARG HD2 . 11331 1
554 . 1 1 51 51 ARG HD3 H 1 3.113 0.030 . 2 . . . . 51 ARG HD3 . 11331 1
555 . 1 1 51 51 ARG HG2 H 1 1.520 0.030 . 2 . . . . 51 ARG HG2 . 11331 1
556 . 1 1 51 51 ARG HG3 H 1 1.620 0.030 . 2 . . . . 51 ARG HG3 . 11331 1
557 . 1 1 51 51 ARG C C 13 177.771 0.300 . 1 . . . . 51 ARG C . 11331 1
558 . 1 1 51 51 ARG CA C 13 58.926 0.300 . 1 . . . . 51 ARG CA . 11331 1
559 . 1 1 51 51 ARG CB C 13 30.812 0.300 . 1 . . . . 51 ARG CB . 11331 1
560 . 1 1 51 51 ARG CD C 13 43.847 0.300 . 1 . . . . 51 ARG CD . 11331 1
561 . 1 1 51 51 ARG CG C 13 26.105 0.300 . 1 . . . . 51 ARG CG . 11331 1
562 . 1 1 51 51 ARG N N 15 121.020 0.300 . 1 . . . . 51 ARG N . 11331 1
563 . 1 1 52 52 ASP H H 1 8.628 0.030 . 1 . . . . 52 ASP H . 11331 1
564 . 1 1 52 52 ASP HA H 1 4.798 0.030 . 1 . . . . 52 ASP HA . 11331 1
565 . 1 1 52 52 ASP HB2 H 1 2.901 0.030 . 2 . . . . 52 ASP HB2 . 11331 1
566 . 1 1 52 52 ASP HB3 H 1 2.594 0.030 . 2 . . . . 52 ASP HB3 . 11331 1
567 . 1 1 52 52 ASP CA C 13 53.252 0.300 . 1 . . . . 52 ASP CA . 11331 1
568 . 1 1 52 52 ASP CB C 13 40.220 0.300 . 1 . . . . 52 ASP CB . 11331 1
569 . 1 1 52 52 ASP N N 15 117.480 0.300 . 1 . . . . 52 ASP N . 11331 1
570 . 1 1 53 53 HIS H H 1 7.493 0.030 . 1 . . . . 53 HIS H . 11331 1
571 . 1 1 53 53 HIS HA H 1 4.775 0.030 . 1 . . . . 53 HIS HA . 11331 1
572 . 1 1 53 53 HIS HB2 H 1 3.282 0.030 . 2 . . . . 53 HIS HB2 . 11331 1
573 . 1 1 53 53 HIS HB3 H 1 3.421 0.030 . 2 . . . . 53 HIS HB3 . 11331 1
574 . 1 1 53 53 HIS HD2 H 1 6.790 0.030 . 1 . . . . 53 HIS HD2 . 11331 1
575 . 1 1 53 53 HIS HE1 H 1 7.844 0.030 . 1 . . . . 53 HIS HE1 . 11331 1
576 . 1 1 53 53 HIS CA C 13 53.705 0.300 . 1 . . . . 53 HIS CA . 11331 1
577 . 1 1 53 53 HIS CB C 13 33.976 0.300 . 1 . . . . 53 HIS CB . 11331 1
578 . 1 1 53 53 HIS CD2 C 13 117.052 0.300 . 1 . . . . 53 HIS CD2 . 11331 1
579 . 1 1 53 53 HIS CE1 C 13 141.061 0.300 . 1 . . . . 53 HIS CE1 . 11331 1
580 . 1 1 53 53 HIS N N 15 119.223 0.300 . 1 . . . . 53 HIS N . 11331 1
581 . 1 1 54 54 GLN H H 1 8.196 0.030 . 1 . . . . 54 GLN H . 11331 1
582 . 1 1 54 54 GLN HA H 1 4.473 0.030 . 1 . . . . 54 GLN HA . 11331 1
583 . 1 1 54 54 GLN HB2 H 1 1.976 0.030 . 1 . . . . 54 GLN HB2 . 11331 1
584 . 1 1 54 54 GLN HB3 H 1 1.976 0.030 . 1 . . . . 54 GLN HB3 . 11331 1
585 . 1 1 54 54 GLN HE21 H 1 6.916 0.030 . 2 . . . . 54 GLN HE21 . 11331 1
586 . 1 1 54 54 GLN HE22 H 1 7.622 0.030 . 2 . . . . 54 GLN HE22 . 11331 1
587 . 1 1 54 54 GLN HG2 H 1 2.462 0.030 . 2 . . . . 54 GLN HG2 . 11331 1
588 . 1 1 54 54 GLN HG3 H 1 2.242 0.030 . 2 . . . . 54 GLN HG3 . 11331 1
589 . 1 1 54 54 GLN C C 13 174.612 0.300 . 1 . . . . 54 GLN C . 11331 1
590 . 1 1 54 54 GLN CA C 13 55.509 0.300 . 1 . . . . 54 GLN CA . 11331 1
591 . 1 1 54 54 GLN CB C 13 28.730 0.300 . 1 . . . . 54 GLN CB . 11331 1
592 . 1 1 54 54 GLN CG C 13 33.512 0.300 . 1 . . . . 54 GLN CG . 11331 1
593 . 1 1 54 54 GLN N N 15 121.891 0.300 . 1 . . . . 54 GLN N . 11331 1
594 . 1 1 54 54 GLN NE2 N 15 111.935 0.300 . 1 . . . . 54 GLN NE2 . 11331 1
595 . 1 1 55 55 VAL H H 1 8.467 0.030 . 1 . . . . 55 VAL H . 11331 1
596 . 1 1 55 55 VAL HA H 1 5.453 0.030 . 1 . . . . 55 VAL HA . 11331 1
597 . 1 1 55 55 VAL HB H 1 2.028 0.030 . 1 . . . . 55 VAL HB . 11331 1
598 . 1 1 55 55 VAL HG11 H 1 0.924 0.030 . 1 . . . . 55 VAL HG1 . 11331 1
599 . 1 1 55 55 VAL HG12 H 1 0.924 0.030 . 1 . . . . 55 VAL HG1 . 11331 1
600 . 1 1 55 55 VAL HG13 H 1 0.924 0.030 . 1 . . . . 55 VAL HG1 . 11331 1
601 . 1 1 55 55 VAL HG21 H 1 0.884 0.030 . 1 . . . . 55 VAL HG2 . 11331 1
602 . 1 1 55 55 VAL HG22 H 1 0.884 0.030 . 1 . . . . 55 VAL HG2 . 11331 1
603 . 1 1 55 55 VAL HG23 H 1 0.884 0.030 . 1 . . . . 55 VAL HG2 . 11331 1
604 . 1 1 55 55 VAL C C 13 174.947 0.300 . 1 . . . . 55 VAL C . 11331 1
605 . 1 1 55 55 VAL CA C 13 59.300 0.300 . 1 . . . . 55 VAL CA . 11331 1
606 . 1 1 55 55 VAL CB C 13 35.765 0.300 . 1 . . . . 55 VAL CB . 11331 1
607 . 1 1 55 55 VAL CG1 C 13 22.641 0.300 . 2 . . . . 55 VAL CG1 . 11331 1
608 . 1 1 55 55 VAL CG2 C 13 19.365 0.300 . 2 . . . . 55 VAL CG2 . 11331 1
609 . 1 1 55 55 VAL N N 15 118.534 0.300 . 1 . . . . 55 VAL N . 11331 1
610 . 1 1 56 56 ALA H H 1 9.424 0.030 . 1 . . . . 56 ALA H . 11331 1
611 . 1 1 56 56 ALA HA H 1 4.818 0.030 . 1 . . . . 56 ALA HA . 11331 1
612 . 1 1 56 56 ALA HB1 H 1 1.488 0.030 . 1 . . . . 56 ALA HB . 11331 1
613 . 1 1 56 56 ALA HB2 H 1 1.488 0.030 . 1 . . . . 56 ALA HB . 11331 1
614 . 1 1 56 56 ALA HB3 H 1 1.488 0.030 . 1 . . . . 56 ALA HB . 11331 1
615 . 1 1 56 56 ALA C C 13 176.257 0.300 . 1 . . . . 56 ALA C . 11331 1
616 . 1 1 56 56 ALA CA C 13 50.413 0.300 . 1 . . . . 56 ALA CA . 11331 1
617 . 1 1 56 56 ALA CB C 13 23.006 0.300 . 1 . . . . 56 ALA CB . 11331 1
618 . 1 1 56 56 ALA N N 15 125.331 0.300 . 1 . . . . 56 ALA N . 11331 1
619 . 1 1 57 57 SER H H 1 8.815 0.030 . 1 . . . . 57 SER H . 11331 1
620 . 1 1 57 57 SER HA H 1 4.623 0.030 . 1 . . . . 57 SER HA . 11331 1
621 . 1 1 57 57 SER HB2 H 1 4.104 0.030 . 2 . . . . 57 SER HB2 . 11331 1
622 . 1 1 57 57 SER HB3 H 1 3.958 0.030 . 2 . . . . 57 SER HB3 . 11331 1
623 . 1 1 57 57 SER C C 13 175.093 0.300 . 1 . . . . 57 SER C . 11331 1
624 . 1 1 57 57 SER CA C 13 58.568 0.300 . 1 . . . . 57 SER CA . 11331 1
625 . 1 1 57 57 SER CB C 13 63.992 0.300 . 1 . . . . 57 SER CB . 11331 1
626 . 1 1 57 57 SER N N 15 115.942 0.300 . 1 . . . . 57 SER N . 11331 1
627 . 1 1 58 58 LEU H H 1 8.351 0.030 . 1 . . . . 58 LEU H . 11331 1
628 . 1 1 58 58 LEU HA H 1 4.114 0.030 . 1 . . . . 58 LEU HA . 11331 1
629 . 1 1 58 58 LEU HB2 H 1 1.417 0.030 . 2 . . . . 58 LEU HB2 . 11331 1
630 . 1 1 58 58 LEU HB3 H 1 1.547 0.030 . 2 . . . . 58 LEU HB3 . 11331 1
631 . 1 1 58 58 LEU HD11 H 1 0.745 0.030 . 1 . . . . 58 LEU HD1 . 11331 1
632 . 1 1 58 58 LEU HD12 H 1 0.745 0.030 . 1 . . . . 58 LEU HD1 . 11331 1
633 . 1 1 58 58 LEU HD13 H 1 0.745 0.030 . 1 . . . . 58 LEU HD1 . 11331 1
634 . 1 1 58 58 LEU HD21 H 1 0.673 0.030 . 1 . . . . 58 LEU HD2 . 11331 1
635 . 1 1 58 58 LEU HD22 H 1 0.673 0.030 . 1 . . . . 58 LEU HD2 . 11331 1
636 . 1 1 58 58 LEU HD23 H 1 0.673 0.030 . 1 . . . . 58 LEU HD2 . 11331 1
637 . 1 1 58 58 LEU HG H 1 1.416 0.030 . 1 . . . . 58 LEU HG . 11331 1
638 . 1 1 58 58 LEU C C 13 177.737 0.300 . 1 . . . . 58 LEU C . 11331 1
639 . 1 1 58 58 LEU CA C 13 56.417 0.300 . 1 . . . . 58 LEU CA . 11331 1
640 . 1 1 58 58 LEU CB C 13 41.540 0.300 . 1 . . . . 58 LEU CB . 11331 1
641 . 1 1 58 58 LEU CD1 C 13 25.459 0.300 . 2 . . . . 58 LEU CD1 . 11331 1
642 . 1 1 58 58 LEU CD2 C 13 23.607 0.300 . 2 . . . . 58 LEU CD2 . 11331 1
643 . 1 1 58 58 LEU CG C 13 27.032 0.300 . 1 . . . . 58 LEU CG . 11331 1
644 . 1 1 58 58 LEU N N 15 122.117 0.300 . 1 . . . . 58 LEU N . 11331 1
645 . 1 1 59 59 ASN H H 1 8.285 0.030 . 1 . . . . 59 ASN H . 11331 1
646 . 1 1 59 59 ASN HA H 1 4.533 0.030 . 1 . . . . 59 ASN HA . 11331 1
647 . 1 1 59 59 ASN HB2 H 1 2.799 0.030 . 1 . . . . 59 ASN HB2 . 11331 1
648 . 1 1 59 59 ASN HB3 H 1 2.799 0.030 . 1 . . . . 59 ASN HB3 . 11331 1
649 . 1 1 59 59 ASN HD21 H 1 7.675 0.030 . 2 . . . . 59 ASN HD21 . 11331 1
650 . 1 1 59 59 ASN HD22 H 1 6.958 0.030 . 2 . . . . 59 ASN HD22 . 11331 1
651 . 1 1 59 59 ASN C C 13 175.912 0.300 . 1 . . . . 59 ASN C . 11331 1
652 . 1 1 59 59 ASN CA C 13 54.391 0.300 . 1 . . . . 59 ASN CA . 11331 1
653 . 1 1 59 59 ASN CB C 13 38.734 0.300 . 1 . . . . 59 ASN CB . 11331 1
654 . 1 1 59 59 ASN N N 15 116.885 0.300 . 1 . . . . 59 ASN N . 11331 1
655 . 1 1 59 59 ASN ND2 N 15 113.012 0.300 . 1 . . . . 59 ASN ND2 . 11331 1
656 . 1 1 60 60 ASP H H 1 7.996 0.030 . 1 . . . . 60 ASP H . 11331 1
657 . 1 1 60 60 ASP HA H 1 4.503 0.030 . 1 . . . . 60 ASP HA . 11331 1
658 . 1 1 60 60 ASP HB2 H 1 2.708 0.030 . 1 . . . . 60 ASP HB2 . 11331 1
659 . 1 1 60 60 ASP HB3 H 1 2.708 0.030 . 1 . . . . 60 ASP HB3 . 11331 1
660 . 1 1 60 60 ASP C C 13 177.054 0.300 . 1 . . . . 60 ASP C . 11331 1
661 . 1 1 60 60 ASP CA C 13 55.744 0.300 . 1 . . . . 60 ASP CA . 11331 1
662 . 1 1 60 60 ASP CB C 13 40.962 0.300 . 1 . . . . 60 ASP CB . 11331 1
663 . 1 1 60 60 ASP N N 15 119.356 0.300 . 1 . . . . 60 ASP N . 11331 1
664 . 1 1 61 61 ARG H H 1 7.810 0.030 . 1 . . . . 61 ARG H . 11331 1
665 . 1 1 61 61 ARG HA H 1 4.011 0.030 . 1 . . . . 61 ARG HA . 11331 1
666 . 1 1 61 61 ARG HB2 H 1 1.591 0.030 . 2 . . . . 61 ARG HB2 . 11331 1
667 . 1 1 61 61 ARG HB3 H 1 1.477 0.030 . 2 . . . . 61 ARG HB3 . 11331 1
668 . 1 1 61 61 ARG HD2 H 1 2.738 0.030 . 2 . . . . 61 ARG HD2 . 11331 1
669 . 1 1 61 61 ARG HD3 H 1 2.838 0.030 . 2 . . . . 61 ARG HD3 . 11331 1
670 . 1 1 61 61 ARG HG2 H 1 1.184 0.030 . 1 . . . . 61 ARG HG2 . 11331 1
671 . 1 1 61 61 ARG HG3 H 1 1.184 0.030 . 1 . . . . 61 ARG HG3 . 11331 1
672 . 1 1 61 61 ARG C C 13 176.761 0.300 . 1 . . . . 61 ARG C . 11331 1
673 . 1 1 61 61 ARG CA C 13 56.918 0.300 . 1 . . . . 61 ARG CA . 11331 1
674 . 1 1 61 61 ARG CB C 13 29.841 0.300 . 1 . . . . 61 ARG CB . 11331 1
675 . 1 1 61 61 ARG CD C 13 42.933 0.300 . 1 . . . . 61 ARG CD . 11331 1
676 . 1 1 61 61 ARG CG C 13 26.600 0.300 . 1 . . . . 61 ARG CG . 11331 1
677 . 1 1 61 61 ARG N N 15 119.339 0.300 . 1 . . . . 61 ARG N . 11331 1
678 . 1 1 62 62 PHE H H 1 8.018 0.030 . 1 . . . . 62 PHE H . 11331 1
679 . 1 1 62 62 PHE HA H 1 4.379 0.030 . 1 . . . . 62 PHE HA . 11331 1
680 . 1 1 62 62 PHE HB2 H 1 3.171 0.030 . 2 . . . . 62 PHE HB2 . 11331 1
681 . 1 1 62 62 PHE HB3 H 1 3.028 0.030 . 2 . . . . 62 PHE HB3 . 11331 1
682 . 1 1 62 62 PHE HD1 H 1 7.158 0.030 . 1 . . . . 62 PHE HD1 . 11331 1
683 . 1 1 62 62 PHE HD2 H 1 7.158 0.030 . 1 . . . . 62 PHE HD2 . 11331 1
684 . 1 1 62 62 PHE HE1 H 1 7.203 0.030 . 1 . . . . 62 PHE HE1 . 11331 1
685 . 1 1 62 62 PHE HE2 H 1 7.203 0.030 . 1 . . . . 62 PHE HE2 . 11331 1
686 . 1 1 62 62 PHE HZ H 1 7.150 0.030 . 1 . . . . 62 PHE HZ . 11331 1
687 . 1 1 62 62 PHE C C 13 176.558 0.300 . 1 . . . . 62 PHE C . 11331 1
688 . 1 1 62 62 PHE CA C 13 59.192 0.300 . 1 . . . . 62 PHE CA . 11331 1
689 . 1 1 62 62 PHE CB C 13 38.981 0.300 . 1 . . . . 62 PHE CB . 11331 1
690 . 1 1 62 62 PHE CD1 C 13 131.593 0.300 . 1 . . . . 62 PHE CD1 . 11331 1
691 . 1 1 62 62 PHE CD2 C 13 131.593 0.300 . 1 . . . . 62 PHE CD2 . 11331 1
692 . 1 1 62 62 PHE CE1 C 13 131.440 0.300 . 1 . . . . 62 PHE CE1 . 11331 1
693 . 1 1 62 62 PHE CE2 C 13 131.440 0.300 . 1 . . . . 62 PHE CE2 . 11331 1
694 . 1 1 62 62 PHE CZ C 13 129.623 0.300 . 1 . . . . 62 PHE CZ . 11331 1
695 . 1 1 62 62 PHE N N 15 118.824 0.300 . 1 . . . . 62 PHE N . 11331 1
696 . 1 1 63 63 GLU H H 1 8.246 0.030 . 1 . . . . 63 GLU H . 11331 1
697 . 1 1 63 63 GLU HA H 1 4.045 0.030 . 1 . . . . 63 GLU HA . 11331 1
698 . 1 1 63 63 GLU HB2 H 1 2.026 0.030 . 1 . . . . 63 GLU HB2 . 11331 1
699 . 1 1 63 63 GLU HB3 H 1 2.026 0.030 . 1 . . . . 63 GLU HB3 . 11331 1
700 . 1 1 63 63 GLU HG2 H 1 2.290 0.030 . 1 . . . . 63 GLU HG2 . 11331 1
701 . 1 1 63 63 GLU HG3 H 1 2.290 0.030 . 1 . . . . 63 GLU HG3 . 11331 1
702 . 1 1 63 63 GLU C C 13 177.772 0.300 . 1 . . . . 63 GLU C . 11331 1
703 . 1 1 63 63 GLU CA C 13 58.229 0.300 . 1 . . . . 63 GLU CA . 11331 1
704 . 1 1 63 63 GLU CB C 13 29.819 0.300 . 1 . . . . 63 GLU CB . 11331 1
705 . 1 1 63 63 GLU CG C 13 36.158 0.300 . 1 . . . . 63 GLU CG . 11331 1
706 . 1 1 63 63 GLU N N 15 120.449 0.300 . 1 . . . . 63 GLU N . 11331 1
707 . 1 1 64 64 LYS H H 1 8.036 0.030 . 1 . . . . 64 LYS H . 11331 1
708 . 1 1 64 64 LYS HA H 1 4.156 0.030 . 1 . . . . 64 LYS HA . 11331 1
709 . 1 1 64 64 LYS HB2 H 1 1.805 0.030 . 1 . . . . 64 LYS HB2 . 11331 1
710 . 1 1 64 64 LYS HB3 H 1 1.805 0.030 . 1 . . . . 64 LYS HB3 . 11331 1
711 . 1 1 64 64 LYS HD2 H 1 1.637 0.030 . 1 . . . . 64 LYS HD2 . 11331 1
712 . 1 1 64 64 LYS HD3 H 1 1.637 0.030 . 1 . . . . 64 LYS HD3 . 11331 1
713 . 1 1 64 64 LYS HE2 H 1 2.952 0.030 . 1 . . . . 64 LYS HE2 . 11331 1
714 . 1 1 64 64 LYS HE3 H 1 2.952 0.030 . 1 . . . . 64 LYS HE3 . 11331 1
715 . 1 1 64 64 LYS HG2 H 1 1.416 0.030 . 1 . . . . 64 LYS HG2 . 11331 1
716 . 1 1 64 64 LYS HG3 H 1 1.416 0.030 . 1 . . . . 64 LYS HG3 . 11331 1
717 . 1 1 64 64 LYS C C 13 178.051 0.300 . 1 . . . . 64 LYS C . 11331 1
718 . 1 1 64 64 LYS CA C 13 57.508 0.300 . 1 . . . . 64 LYS CA . 11331 1
719 . 1 1 64 64 LYS CB C 13 32.402 0.300 . 1 . . . . 64 LYS CB . 11331 1
720 . 1 1 64 64 LYS CD C 13 29.013 0.300 . 1 . . . . 64 LYS CD . 11331 1
721 . 1 1 64 64 LYS CE C 13 42.165 0.300 . 1 . . . . 64 LYS CE . 11331 1
722 . 1 1 64 64 LYS CG C 13 25.114 0.300 . 1 . . . . 64 LYS CG . 11331 1
723 . 1 1 64 64 LYS N N 15 119.737 0.300 . 1 . . . . 64 LYS N . 11331 1
724 . 1 1 65 65 LEU H H 1 7.918 0.030 . 1 . . . . 65 LEU H . 11331 1
725 . 1 1 65 65 LEU HA H 1 4.162 0.030 . 1 . . . . 65 LEU HA . 11331 1
726 . 1 1 65 65 LEU HB2 H 1 1.628 0.030 . 2 . . . . 65 LEU HB2 . 11331 1
727 . 1 1 65 65 LEU HB3 H 1 1.570 0.030 . 2 . . . . 65 LEU HB3 . 11331 1
728 . 1 1 65 65 LEU HD11 H 1 0.837 0.030 . 1 . . . . 65 LEU HD1 . 11331 1
729 . 1 1 65 65 LEU HD12 H 1 0.837 0.030 . 1 . . . . 65 LEU HD1 . 11331 1
730 . 1 1 65 65 LEU HD13 H 1 0.837 0.030 . 1 . . . . 65 LEU HD1 . 11331 1
731 . 1 1 65 65 LEU HD21 H 1 0.820 0.030 . 1 . . . . 65 LEU HD2 . 11331 1
732 . 1 1 65 65 LEU HD22 H 1 0.820 0.030 . 1 . . . . 65 LEU HD2 . 11331 1
733 . 1 1 65 65 LEU HD23 H 1 0.820 0.030 . 1 . . . . 65 LEU HD2 . 11331 1
734 . 1 1 65 65 LEU HG H 1 1.583 0.030 . 1 . . . . 65 LEU HG . 11331 1
735 . 1 1 65 65 LEU C C 13 178.048 0.300 . 1 . . . . 65 LEU C . 11331 1
736 . 1 1 65 65 LEU CA C 13 56.663 0.300 . 1 . . . . 65 LEU CA . 11331 1
737 . 1 1 65 65 LEU CB C 13 41.964 0.300 . 1 . . . . 65 LEU CB . 11331 1
738 . 1 1 65 65 LEU CD1 C 13 24.867 0.300 . 2 . . . . 65 LEU CD1 . 11331 1
739 . 1 1 65 65 LEU CD2 C 13 23.876 0.300 . 2 . . . . 65 LEU CD2 . 11331 1
740 . 1 1 65 65 LEU CG C 13 27.015 0.300 . 1 . . . . 65 LEU CG . 11331 1
741 . 1 1 65 65 LEU N N 15 121.429 0.300 . 1 . . . . 65 LEU N . 11331 1
742 . 1 1 66 66 LYS H H 1 8.078 0.030 . 1 . . . . 66 LYS H . 11331 1
743 . 1 1 66 66 LYS HA H 1 4.013 0.030 . 1 . . . . 66 LYS HA . 11331 1
744 . 1 1 66 66 LYS HB2 H 1 1.816 0.030 . 2 . . . . 66 LYS HB2 . 11331 1
745 . 1 1 66 66 LYS HB3 H 1 1.727 0.030 . 2 . . . . 66 LYS HB3 . 11331 1
746 . 1 1 66 66 LYS HD2 H 1 1.657 0.030 . 1 . . . . 66 LYS HD2 . 11331 1
747 . 1 1 66 66 LYS HD3 H 1 1.657 0.030 . 1 . . . . 66 LYS HD3 . 11331 1
748 . 1 1 66 66 LYS HE2 H 1 2.969 0.030 . 2 . . . . 66 LYS HE2 . 11331 1
749 . 1 1 66 66 LYS HE3 H 1 2.928 0.030 . 2 . . . . 66 LYS HE3 . 11331 1
750 . 1 1 66 66 LYS HG2 H 1 1.344 0.030 . 1 . . . . 66 LYS HG2 . 11331 1
751 . 1 1 66 66 LYS HG3 H 1 1.344 0.030 . 1 . . . . 66 LYS HG3 . 11331 1
752 . 1 1 66 66 LYS C C 13 177.444 0.300 . 1 . . . . 66 LYS C . 11331 1
753 . 1 1 66 66 LYS CA C 13 58.296 0.300 . 1 . . . . 66 LYS CA . 11331 1
754 . 1 1 66 66 LYS CB C 13 32.421 0.300 . 1 . . . . 66 LYS CB . 11331 1
755 . 1 1 66 66 LYS CD C 13 29.087 0.300 . 1 . . . . 66 LYS CD . 11331 1
756 . 1 1 66 66 LYS CE C 13 42.191 0.300 . 1 . . . . 66 LYS CE . 11331 1
757 . 1 1 66 66 LYS CG C 13 24.805 0.300 . 1 . . . . 66 LYS CG . 11331 1
758 . 1 1 66 66 LYS N N 15 120.433 0.300 . 1 . . . . 66 LYS N . 11331 1
759 . 1 1 67 67 GLN H H 1 8.108 0.030 . 1 . . . . 67 GLN H . 11331 1
760 . 1 1 67 67 GLN HA H 1 4.258 0.030 . 1 . . . . 67 GLN HA . 11331 1
761 . 1 1 67 67 GLN HB2 H 1 2.130 0.030 . 2 . . . . 67 GLN HB2 . 11331 1
762 . 1 1 67 67 GLN HB3 H 1 2.087 0.030 . 2 . . . . 67 GLN HB3 . 11331 1
763 . 1 1 67 67 GLN HE21 H 1 7.561 0.030 . 2 . . . . 67 GLN HE21 . 11331 1
764 . 1 1 67 67 GLN HE22 H 1 6.849 0.030 . 2 . . . . 67 GLN HE22 . 11331 1
765 . 1 1 67 67 GLN HG2 H 1 2.461 0.030 . 2 . . . . 67 GLN HG2 . 11331 1
766 . 1 1 67 67 GLN HG3 H 1 2.383 0.030 . 2 . . . . 67 GLN HG3 . 11331 1
767 . 1 1 67 67 GLN C C 13 177.230 0.300 . 1 . . . . 67 GLN C . 11331 1
768 . 1 1 67 67 GLN CA C 13 57.270 0.300 . 1 . . . . 67 GLN CA . 11331 1
769 . 1 1 67 67 GLN CB C 13 29.012 0.300 . 1 . . . . 67 GLN CB . 11331 1
770 . 1 1 67 67 GLN CG C 13 33.944 0.300 . 1 . . . . 67 GLN CG . 11331 1
771 . 1 1 67 67 GLN N N 15 119.006 0.300 . 1 . . . . 67 GLN N . 11331 1
772 . 1 1 67 67 GLN NE2 N 15 112.005 0.300 . 1 . . . . 67 GLN NE2 . 11331 1
773 . 1 1 68 68 THR H H 1 8.055 0.030 . 1 . . . . 68 THR H . 11331 1
774 . 1 1 68 68 THR HA H 1 4.195 0.030 . 1 . . . . 68 THR HA . 11331 1
775 . 1 1 68 68 THR HB H 1 4.270 0.030 . 1 . . . . 68 THR HB . 11331 1
776 . 1 1 68 68 THR HG21 H 1 1.224 0.030 . 1 . . . . 68 THR HG2 . 11331 1
777 . 1 1 68 68 THR HG22 H 1 1.224 0.030 . 1 . . . . 68 THR HG2 . 11331 1
778 . 1 1 68 68 THR HG23 H 1 1.224 0.030 . 1 . . . . 68 THR HG2 . 11331 1
779 . 1 1 68 68 THR C C 13 175.254 0.300 . 1 . . . . 68 THR C . 11331 1
780 . 1 1 68 68 THR CA C 13 63.763 0.300 . 1 . . . . 68 THR CA . 11331 1
781 . 1 1 68 68 THR CB C 13 69.539 0.300 . 1 . . . . 68 THR CB . 11331 1
782 . 1 1 68 68 THR CG2 C 13 21.761 0.300 . 1 . . . . 68 THR CG2 . 11331 1
783 . 1 1 68 68 THR N N 15 115.291 0.300 . 1 . . . . 68 THR N . 11331 1
784 . 1 1 69 69 LEU H H 1 8.169 0.030 . 1 . . . . 69 LEU H . 11331 1
785 . 1 1 69 69 LEU HA H 1 4.229 0.030 . 1 . . . . 69 LEU HA . 11331 1
786 . 1 1 69 69 LEU HB2 H 1 1.591 0.030 . 1 . . . . 69 LEU HB2 . 11331 1
787 . 1 1 69 69 LEU HB3 H 1 1.591 0.030 . 1 . . . . 69 LEU HB3 . 11331 1
788 . 1 1 69 69 LEU HD11 H 1 0.858 0.030 . 1 . . . . 69 LEU HD1 . 11331 1
789 . 1 1 69 69 LEU HD12 H 1 0.858 0.030 . 1 . . . . 69 LEU HD1 . 11331 1
790 . 1 1 69 69 LEU HD13 H 1 0.858 0.030 . 1 . . . . 69 LEU HD1 . 11331 1
791 . 1 1 69 69 LEU HD21 H 1 0.855 0.030 . 1 . . . . 69 LEU HD2 . 11331 1
792 . 1 1 69 69 LEU HD22 H 1 0.855 0.030 . 1 . . . . 69 LEU HD2 . 11331 1
793 . 1 1 69 69 LEU HD23 H 1 0.855 0.030 . 1 . . . . 69 LEU HD2 . 11331 1
794 . 1 1 69 69 LEU HG H 1 1.670 0.030 . 1 . . . . 69 LEU HG . 11331 1
795 . 1 1 69 69 LEU C C 13 178.071 0.300 . 1 . . . . 69 LEU C . 11331 1
796 . 1 1 69 69 LEU CA C 13 56.407 0.300 . 1 . . . . 69 LEU CA . 11331 1
797 . 1 1 69 69 LEU CB C 13 41.953 0.300 . 1 . . . . 69 LEU CB . 11331 1
798 . 1 1 69 69 LEU CD1 C 13 23.531 0.300 . 1 . . . . 69 LEU CD1 . 11331 1
799 . 1 1 69 69 LEU CD2 C 13 23.531 0.300 . 1 . . . . 69 LEU CD2 . 11331 1
800 . 1 1 69 69 LEU CG C 13 26.848 0.300 . 1 . . . . 69 LEU CG . 11331 1
801 . 1 1 69 69 LEU N N 15 123.274 0.300 . 1 . . . . 69 LEU N . 11331 1
802 . 1 1 70 70 GLU H H 1 8.234 0.030 . 1 . . . . 70 GLU H . 11331 1
803 . 1 1 70 70 GLU HA H 1 4.159 0.030 . 1 . . . . 70 GLU HA . 11331 1
804 . 1 1 70 70 GLU HB2 H 1 2.028 0.030 . 1 . . . . 70 GLU HB2 . 11331 1
805 . 1 1 70 70 GLU HB3 H 1 2.028 0.030 . 1 . . . . 70 GLU HB3 . 11331 1
806 . 1 1 70 70 GLU HG2 H 1 2.322 0.030 . 2 . . . . 70 GLU HG2 . 11331 1
807 . 1 1 70 70 GLU HG3 H 1 2.235 0.030 . 2 . . . . 70 GLU HG3 . 11331 1
808 . 1 1 70 70 GLU C C 13 177.307 0.300 . 1 . . . . 70 GLU C . 11331 1
809 . 1 1 70 70 GLU CA C 13 57.443 0.300 . 1 . . . . 70 GLU CA . 11331 1
810 . 1 1 70 70 GLU CB C 13 29.799 0.300 . 1 . . . . 70 GLU CB . 11331 1
811 . 1 1 70 70 GLU CG C 13 36.534 0.300 . 1 . . . . 70 GLU CG . 11331 1
812 . 1 1 70 70 GLU N N 15 119.969 0.300 . 1 . . . . 70 GLU N . 11331 1
813 . 1 1 71 71 MET H H 1 8.121 0.030 . 1 . . . . 71 MET H . 11331 1
814 . 1 1 71 71 MET HA H 1 4.379 0.030 . 1 . . . . 71 MET HA . 11331 1
815 . 1 1 71 71 MET HB2 H 1 2.087 0.030 . 1 . . . . 71 MET HB2 . 11331 1
816 . 1 1 71 71 MET HB3 H 1 2.087 0.030 . 1 . . . . 71 MET HB3 . 11331 1
817 . 1 1 71 71 MET HE1 H 1 2.090 0.030 . 1 . . . . 71 MET HE . 11331 1
818 . 1 1 71 71 MET HE2 H 1 2.090 0.030 . 1 . . . . 71 MET HE . 11331 1
819 . 1 1 71 71 MET HE3 H 1 2.090 0.030 . 1 . . . . 71 MET HE . 11331 1
820 . 1 1 71 71 MET HG2 H 1 2.630 0.030 . 2 . . . . 71 MET HG2 . 11331 1
821 . 1 1 71 71 MET HG3 H 1 2.543 0.030 . 2 . . . . 71 MET HG3 . 11331 1
822 . 1 1 71 71 MET C C 13 176.355 0.300 . 1 . . . . 71 MET C . 11331 1
823 . 1 1 71 71 MET CA C 13 56.375 0.300 . 1 . . . . 71 MET CA . 11331 1
824 . 1 1 71 71 MET CB C 13 32.670 0.300 . 1 . . . . 71 MET CB . 11331 1
825 . 1 1 71 71 MET CE C 13 16.989 0.300 . 1 . . . . 71 MET CE . 11331 1
826 . 1 1 71 71 MET CG C 13 32.257 0.300 . 1 . . . . 71 MET CG . 11331 1
827 . 1 1 71 71 MET N N 15 119.935 0.300 . 1 . . . . 71 MET N . 11331 1
828 . 1 1 72 72 ASN H H 1 8.316 0.030 . 1 . . . . 72 ASN H . 11331 1
829 . 1 1 72 72 ASN HA H 1 4.681 0.030 . 1 . . . . 72 ASN HA . 11331 1
830 . 1 1 72 72 ASN HB2 H 1 2.802 0.030 . 1 . . . . 72 ASN HB2 . 11331 1
831 . 1 1 72 72 ASN HB3 H 1 2.802 0.030 . 1 . . . . 72 ASN HB3 . 11331 1
832 . 1 1 72 72 ASN HD21 H 1 6.963 0.030 . 2 . . . . 72 ASN HD21 . 11331 1
833 . 1 1 72 72 ASN HD22 H 1 7.619 0.030 . 2 . . . . 72 ASN HD22 . 11331 1
834 . 1 1 72 72 ASN C C 13 175.669 0.300 . 1 . . . . 72 ASN C . 11331 1
835 . 1 1 72 72 ASN CA C 13 53.622 0.300 . 1 . . . . 72 ASN CA . 11331 1
836 . 1 1 72 72 ASN CB C 13 38.712 0.300 . 1 . . . . 72 ASN CB . 11331 1
837 . 1 1 72 72 ASN N N 15 118.923 0.300 . 1 . . . . 72 ASN N . 11331 1
838 . 1 1 72 72 ASN ND2 N 15 112.700 0.300 . 1 . . . . 72 ASN ND2 . 11331 1
839 . 1 1 73 73 LEU H H 1 8.190 0.030 . 1 . . . . 73 LEU H . 11331 1
840 . 1 1 73 73 LEU HA H 1 4.338 0.030 . 1 . . . . 73 LEU HA . 11331 1
841 . 1 1 73 73 LEU HB2 H 1 1.740 0.030 . 1 . . . . 73 LEU HB2 . 11331 1
842 . 1 1 73 73 LEU HB3 H 1 1.740 0.030 . 1 . . . . 73 LEU HB3 . 11331 1
843 . 1 1 73 73 LEU HD11 H 1 0.861 0.030 . 1 . . . . 73 LEU HD1 . 11331 1
844 . 1 1 73 73 LEU HD12 H 1 0.861 0.030 . 1 . . . . 73 LEU HD1 . 11331 1
845 . 1 1 73 73 LEU HD13 H 1 0.861 0.030 . 1 . . . . 73 LEU HD1 . 11331 1
846 . 1 1 73 73 LEU HD21 H 1 0.919 0.030 . 1 . . . . 73 LEU HD2 . 11331 1
847 . 1 1 73 73 LEU HD22 H 1 0.919 0.030 . 1 . . . . 73 LEU HD2 . 11331 1
848 . 1 1 73 73 LEU HD23 H 1 0.919 0.030 . 1 . . . . 73 LEU HD2 . 11331 1
849 . 1 1 73 73 LEU HG H 1 1.674 0.030 . 1 . . . . 73 LEU HG . 11331 1
850 . 1 1 73 73 LEU C C 13 178.029 0.300 . 1 . . . . 73 LEU C . 11331 1
851 . 1 1 73 73 LEU CA C 13 55.902 0.300 . 1 . . . . 73 LEU CA . 11331 1
852 . 1 1 73 73 LEU CB C 13 42.170 0.300 . 1 . . . . 73 LEU CB . 11331 1
853 . 1 1 73 73 LEU CD1 C 13 23.396 0.300 . 2 . . . . 73 LEU CD1 . 11331 1
854 . 1 1 73 73 LEU CD2 C 13 25.151 0.300 . 2 . . . . 73 LEU CD2 . 11331 1
855 . 1 1 73 73 LEU CG C 13 26.888 0.300 . 1 . . . . 73 LEU CG . 11331 1
856 . 1 1 73 73 LEU N N 15 121.786 0.300 . 1 . . . . 73 LEU N . 11331 1
857 . 1 1 74 74 THR H H 1 8.049 0.030 . 1 . . . . 74 THR H . 11331 1
858 . 1 1 74 74 THR HA H 1 4.243 0.030 . 1 . . . . 74 THR HA . 11331 1
859 . 1 1 74 74 THR HB H 1 4.263 0.030 . 1 . . . . 74 THR HB . 11331 1
860 . 1 1 74 74 THR HG21 H 1 1.219 0.030 . 1 . . . . 74 THR HG2 . 11331 1
861 . 1 1 74 74 THR HG22 H 1 1.219 0.030 . 1 . . . . 74 THR HG2 . 11331 1
862 . 1 1 74 74 THR HG23 H 1 1.219 0.030 . 1 . . . . 74 THR HG2 . 11331 1
863 . 1 1 74 74 THR C C 13 174.597 0.300 . 1 . . . . 74 THR C . 11331 1
864 . 1 1 74 74 THR CA C 13 62.960 0.300 . 1 . . . . 74 THR CA . 11331 1
865 . 1 1 74 74 THR CB C 13 69.517 0.300 . 1 . . . . 74 THR CB . 11331 1
866 . 1 1 74 74 THR CG2 C 13 21.705 0.300 . 1 . . . . 74 THR CG2 . 11331 1
867 . 1 1 74 74 THR N N 15 113.345 0.300 . 1 . . . . 74 THR N . 11331 1
868 . 1 1 75 75 ASN H H 1 8.251 0.030 . 1 . . . . 75 ASN H . 11331 1
869 . 1 1 75 75 ASN HA H 1 4.677 0.030 . 1 . . . . 75 ASN HA . 11331 1
870 . 1 1 75 75 ASN HB2 H 1 2.830 0.030 . 2 . . . . 75 ASN HB2 . 11331 1
871 . 1 1 75 75 ASN HB3 H 1 2.748 0.030 . 2 . . . . 75 ASN HB3 . 11331 1
872 . 1 1 75 75 ASN HD21 H 1 6.898 0.030 . 2 . . . . 75 ASN HD21 . 11331 1
873 . 1 1 75 75 ASN HD22 H 1 7.607 0.030 . 2 . . . . 75 ASN HD22 . 11331 1
874 . 1 1 75 75 ASN C C 13 175.127 0.300 . 1 . . . . 75 ASN C . 11331 1
875 . 1 1 75 75 ASN CA C 13 53.435 0.300 . 1 . . . . 75 ASN CA . 11331 1
876 . 1 1 75 75 ASN CB C 13 38.646 0.300 . 1 . . . . 75 ASN CB . 11331 1
877 . 1 1 75 75 ASN N N 15 120.029 0.300 . 1 . . . . 75 ASN N . 11331 1
878 . 1 1 75 75 ASN ND2 N 15 112.600 0.300 . 1 . . . . 75 ASN ND2 . 11331 1
879 . 1 1 76 76 LEU H H 1 8.029 0.030 . 1 . . . . 76 LEU H . 11331 1
880 . 1 1 76 76 LEU HA H 1 4.321 0.030 . 1 . . . . 76 LEU HA . 11331 1
881 . 1 1 76 76 LEU HB2 H 1 1.667 0.030 . 2 . . . . 76 LEU HB2 . 11331 1
882 . 1 1 76 76 LEU HB3 H 1 1.598 0.030 . 2 . . . . 76 LEU HB3 . 11331 1
883 . 1 1 76 76 LEU HD11 H 1 0.857 0.030 . 1 . . . . 76 LEU HD1 . 11331 1
884 . 1 1 76 76 LEU HD12 H 1 0.857 0.030 . 1 . . . . 76 LEU HD1 . 11331 1
885 . 1 1 76 76 LEU HD13 H 1 0.857 0.030 . 1 . . . . 76 LEU HD1 . 11331 1
886 . 1 1 76 76 LEU HD21 H 1 0.901 0.030 . 1 . . . . 76 LEU HD2 . 11331 1
887 . 1 1 76 76 LEU HD22 H 1 0.901 0.030 . 1 . . . . 76 LEU HD2 . 11331 1
888 . 1 1 76 76 LEU HD23 H 1 0.901 0.030 . 1 . . . . 76 LEU HD2 . 11331 1
889 . 1 1 76 76 LEU HG H 1 1.671 0.030 . 1 . . . . 76 LEU HG . 11331 1
890 . 1 1 76 76 LEU C C 13 177.357 0.300 . 1 . . . . 76 LEU C . 11331 1
891 . 1 1 76 76 LEU CA C 13 55.630 0.300 . 1 . . . . 76 LEU CA . 11331 1
892 . 1 1 76 76 LEU CB C 13 42.341 0.300 . 1 . . . . 76 LEU CB . 11331 1
893 . 1 1 76 76 LEU CD1 C 13 23.540 0.300 . 2 . . . . 76 LEU CD1 . 11331 1
894 . 1 1 76 76 LEU CD2 C 13 24.978 0.300 . 2 . . . . 76 LEU CD2 . 11331 1
895 . 1 1 76 76 LEU CG C 13 27.095 0.300 . 1 . . . . 76 LEU CG . 11331 1
896 . 1 1 76 76 LEU N N 15 121.967 0.300 . 1 . . . . 76 LEU N . 11331 1
897 . 1 1 77 77 VAL H H 1 8.020 0.030 . 1 . . . . 77 VAL H . 11331 1
898 . 1 1 77 77 VAL HA H 1 4.060 0.030 . 1 . . . . 77 VAL HA . 11331 1
899 . 1 1 77 77 VAL HB H 1 2.059 0.030 . 1 . . . . 77 VAL HB . 11331 1
900 . 1 1 77 77 VAL HG11 H 1 0.946 0.030 . 1 . . . . 77 VAL HG1 . 11331 1
901 . 1 1 77 77 VAL HG12 H 1 0.946 0.030 . 1 . . . . 77 VAL HG1 . 11331 1
902 . 1 1 77 77 VAL HG13 H 1 0.946 0.030 . 1 . . . . 77 VAL HG1 . 11331 1
903 . 1 1 77 77 VAL HG21 H 1 0.916 0.030 . 1 . . . . 77 VAL HG2 . 11331 1
904 . 1 1 77 77 VAL HG22 H 1 0.916 0.030 . 1 . . . . 77 VAL HG2 . 11331 1
905 . 1 1 77 77 VAL HG23 H 1 0.916 0.030 . 1 . . . . 77 VAL HG2 . 11331 1
906 . 1 1 77 77 VAL C C 13 176.166 0.300 . 1 . . . . 77 VAL C . 11331 1
907 . 1 1 77 77 VAL CA C 13 62.520 0.300 . 1 . . . . 77 VAL CA . 11331 1
908 . 1 1 77 77 VAL CB C 13 32.567 0.300 . 1 . . . . 77 VAL CB . 11331 1
909 . 1 1 77 77 VAL CG1 C 13 20.907 0.300 . 2 . . . . 77 VAL CG1 . 11331 1
910 . 1 1 77 77 VAL CG2 C 13 21.040 0.300 . 2 . . . . 77 VAL CG2 . 11331 1
911 . 1 1 77 77 VAL N N 15 120.909 0.300 . 1 . . . . 77 VAL N . 11331 1
912 . 1 1 78 78 LYS H H 1 8.367 0.030 . 1 . . . . 78 LYS H . 11331 1
913 . 1 1 78 78 LYS HA H 1 4.379 0.030 . 1 . . . . 78 LYS HA . 11331 1
914 . 1 1 78 78 LYS HB2 H 1 1.765 0.030 . 1 . . . . 78 LYS HB2 . 11331 1
915 . 1 1 78 78 LYS HB3 H 1 1.765 0.030 . 1 . . . . 78 LYS HB3 . 11331 1
916 . 1 1 78 78 LYS HD2 H 1 1.693 0.030 . 1 . . . . 78 LYS HD2 . 11331 1
917 . 1 1 78 78 LYS HD3 H 1 1.693 0.030 . 1 . . . . 78 LYS HD3 . 11331 1
918 . 1 1 78 78 LYS HE2 H 1 2.975 0.030 . 1 . . . . 78 LYS HE2 . 11331 1
919 . 1 1 78 78 LYS HE3 H 1 2.975 0.030 . 1 . . . . 78 LYS HE3 . 11331 1
920 . 1 1 78 78 LYS HG2 H 1 1.414 0.030 . 1 . . . . 78 LYS HG2 . 11331 1
921 . 1 1 78 78 LYS HG3 H 1 1.414 0.030 . 1 . . . . 78 LYS HG3 . 11331 1
922 . 1 1 78 78 LYS C C 13 176.430 0.300 . 1 . . . . 78 LYS C . 11331 1
923 . 1 1 78 78 LYS CA C 13 56.183 0.300 . 1 . . . . 78 LYS CA . 11331 1
924 . 1 1 78 78 LYS CB C 13 32.991 0.300 . 1 . . . . 78 LYS CB . 11331 1
925 . 1 1 78 78 LYS CD C 13 29.049 0.300 . 1 . . . . 78 LYS CD . 11331 1
926 . 1 1 78 78 LYS CE C 13 42.209 0.300 . 1 . . . . 78 LYS CE . 11331 1
927 . 1 1 78 78 LYS CG C 13 24.772 0.300 . 1 . . . . 78 LYS CG . 11331 1
928 . 1 1 78 78 LYS N N 15 125.432 0.300 . 1 . . . . 78 LYS N . 11331 1
929 . 1 1 79 79 SER H H 1 8.321 0.030 . 1 . . . . 79 SER H . 11331 1
930 . 1 1 79 79 SER HA H 1 4.488 0.030 . 1 . . . . 79 SER HA . 11331 1
931 . 1 1 79 79 SER HB2 H 1 3.901 0.030 . 1 . . . . 79 SER HB2 . 11331 1
932 . 1 1 79 79 SER HB3 H 1 3.901 0.030 . 1 . . . . 79 SER HB3 . 11331 1
933 . 1 1 79 79 SER C C 13 174.490 0.300 . 1 . . . . 79 SER C . 11331 1
934 . 1 1 79 79 SER CA C 13 58.185 0.300 . 1 . . . . 79 SER CA . 11331 1
935 . 1 1 79 79 SER CB C 13 63.973 0.300 . 1 . . . . 79 SER CB . 11331 1
936 . 1 1 79 79 SER N N 15 117.371 0.300 . 1 . . . . 79 SER N . 11331 1
937 . 1 1 80 80 GLY H H 1 8.268 0.030 . 1 . . . . 80 GLY H . 11331 1
938 . 1 1 80 80 GLY HA2 H 1 4.120 0.030 . 1 . . . . 80 GLY HA2 . 11331 1
939 . 1 1 80 80 GLY HA3 H 1 4.120 0.030 . 1 . . . . 80 GLY HA3 . 11331 1
940 . 1 1 80 80 GLY C C 13 171.778 0.300 . 1 . . . . 80 GLY C . 11331 1
941 . 1 1 80 80 GLY CA C 13 44.657 0.300 . 1 . . . . 80 GLY CA . 11331 1
942 . 1 1 80 80 GLY N N 15 110.713 0.300 . 1 . . . . 80 GLY N . 11331 1
stop_
save_