Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25514
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 25514 1
2 '2D 1H-13C HSQC' . . . 25514 1
3 '2D 1H-13C HSQC aromatic' . . . 25514 1
4 '3D HNCA' . . . 25514 1
5 '3D HN(CO)CA' . . . 25514 1
6 '3D HNCACB' . . . 25514 1
7 '3D CBCA(CO)NH' . . . 25514 1
8 '3D HNCO' . . . 25514 1
9 '3D HCACO' . . . 25514 1
10 '3D HBHANH' . . . 25514 1
11 '3D HBHA(CO)NH' . . . 25514 1
12 '3D HCCH-TOCSY' . . . 25514 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 MET HA H 1 4.030 0.001 . . . . . A 1 MET HA . 25514 1
2 . 1 1 6 6 MET HB2 H 1 2.078 0.027 . . . . . A 1 MET HB2 . 25514 1
3 . 1 1 6 6 MET HB3 H 1 2.078 0.027 . . . . . A 1 MET HB3 . 25514 1
4 . 1 1 6 6 MET HG2 H 1 2.550 0.003 . . . . . A 1 MET HG2 . 25514 1
5 . 1 1 6 6 MET HG3 H 1 2.550 0.003 . . . . . A 1 MET HG3 . 25514 1
6 . 1 1 6 6 MET C C 13 172.238 0.000 . . . . . A 1 MET C . 25514 1
7 . 1 1 6 6 MET CA C 13 55.003 0.010 . . . . . A 1 MET CA . 25514 1
8 . 1 1 6 6 MET CB C 13 32.969 0.003 . . . . . A 1 MET CB . 25514 1
9 . 1 1 6 6 MET CG C 13 30.884 0.001 . . . . . A 1 MET CG . 25514 1
10 . 1 1 7 7 ALA H H 1 8.666 0.002 . . . . . A 2 ALA H . 25514 1
11 . 1 1 7 7 ALA HA H 1 4.299 0.001 . . . . . A 2 ALA HA . 25514 1
12 . 1 1 7 7 ALA HB1 H 1 1.314 0.001 . . . . . A 2 ALA HB1 . 25514 1
13 . 1 1 7 7 ALA HB2 H 1 1.314 0.001 . . . . . A 2 ALA HB2 . 25514 1
14 . 1 1 7 7 ALA HB3 H 1 1.314 0.001 . . . . . A 2 ALA HB3 . 25514 1
15 . 1 1 7 7 ALA C C 13 176.894 0.001 . . . . . A 2 ALA C . 25514 1
16 . 1 1 7 7 ALA CA C 13 52.535 0.008 . . . . . A 2 ALA CA . 25514 1
17 . 1 1 7 7 ALA CB C 13 19.138 0.013 . . . . . A 2 ALA CB . 25514 1
18 . 1 1 7 7 ALA N N 15 126.897 0.017 . . . . . A 2 ALA N . 25514 1
19 . 1 1 8 8 ASP H H 1 8.330 0.006 . . . . . A 3 ASP H . 25514 1
20 . 1 1 8 8 ASP HA H 1 4.468 0.004 . . . . . A 3 ASP HA . 25514 1
21 . 1 1 8 8 ASP HB2 H 1 2.620 0.014 . . . . . A 3 ASP HB2 . 25514 1
22 . 1 1 8 8 ASP HB3 H 1 2.590 0.001 . . . . . A 3 ASP HB3 . 25514 1
23 . 1 1 8 8 ASP C C 13 176.349 0.002 . . . . . A 3 ASP C . 25514 1
24 . 1 1 8 8 ASP CA C 13 54.251 0.006 . . . . . A 3 ASP CA . 25514 1
25 . 1 1 8 8 ASP CB C 13 41.147 0.028 . . . . . A 3 ASP CB . 25514 1
26 . 1 1 8 8 ASP N N 15 120.071 0.014 . . . . . A 3 ASP N . 25514 1
27 . 1 1 9 9 GLN H H 1 8.341 0.009 . . . . . A 4 GLN H . 25514 1
28 . 1 1 9 9 GLN HA H 1 4.230 0.009 . . . . . A 4 GLN HA . 25514 1
29 . 1 1 9 9 GLN HB2 H 1 2.057 0.015 . . . . . A 4 GLN HB2 . 25514 1
30 . 1 1 9 9 GLN HB3 H 1 1.903 0.022 . . . . . A 4 GLN HB3 . 25514 1
31 . 1 1 9 9 GLN HG2 H 1 2.276 0.026 . . . . . A 4 GLN HG2 . 25514 1
32 . 1 1 9 9 GLN HG3 H 1 2.276 0.026 . . . . . A 4 GLN HG3 . 25514 1
33 . 1 1 9 9 GLN HE21 H 1 7.466 0.020 . . . . . A 4 GLN HE21 . 25514 1
34 . 1 1 9 9 GLN HE22 H 1 6.831 0.048 . . . . . A 4 GLN HE22 . 25514 1
35 . 1 1 9 9 GLN C C 13 176.109 0.003 . . . . . A 4 GLN C . 25514 1
36 . 1 1 9 9 GLN CA C 13 56.053 0.035 . . . . . A 4 GLN CA . 25514 1
37 . 1 1 9 9 GLN CB C 13 29.217 0.025 . . . . . A 4 GLN CB . 25514 1
38 . 1 1 9 9 GLN CG C 13 33.769 0.010 . . . . . A 4 GLN CG . 25514 1
39 . 1 1 9 9 GLN N N 15 120.940 0.017 . . . . . A 4 GLN N . 25514 1
40 . 1 1 9 9 GLN NE2 N 15 112.588 0.004 . . . . . A 4 GLN NE2 . 25514 1
41 . 1 1 10 10 ARG H H 1 8.298 0.014 . . . . . A 5 ARG H . 25514 1
42 . 1 1 10 10 ARG HA H 1 4.199 0.016 . . . . . A 5 ARG HA . 25514 1
43 . 1 1 10 10 ARG HB2 H 1 1.754 0.001 . . . . . A 5 ARG HB2 . 25514 1
44 . 1 1 10 10 ARG HB3 H 1 1.729 0.010 . . . . . A 5 ARG HB3 . 25514 1
45 . 1 1 10 10 ARG HG2 H 1 1.538 0.005 . . . . . A 5 ARG HG2 . 25514 1
46 . 1 1 10 10 ARG HG3 H 1 1.538 0.005 . . . . . A 5 ARG HG3 . 25514 1
47 . 1 1 10 10 ARG HD2 H 1 3.088 0.005 . . . . . A 5 ARG HD2 . 25514 1
48 . 1 1 10 10 ARG HD3 H 1 3.088 0.005 . . . . . A 5 ARG HD3 . 25514 1
49 . 1 1 10 10 ARG C C 13 176.414 0.001 . . . . . A 5 ARG C . 25514 1
50 . 1 1 10 10 ARG CA C 13 56.460 0.010 . . . . . A 5 ARG CA . 25514 1
51 . 1 1 10 10 ARG CB C 13 30.536 0.028 . . . . . A 5 ARG CB . 25514 1
52 . 1 1 10 10 ARG CG C 13 26.893 0.046 . . . . . A 5 ARG CG . 25514 1
53 . 1 1 10 10 ARG CD C 13 43.232 0.057 . . . . . A 5 ARG CD . 25514 1
54 . 1 1 10 10 ARG N N 15 121.419 0.010 . . . . . A 5 ARG N . 25514 1
55 . 1 1 11 11 GLN H H 1 8.288 0.013 . . . . . A 6 GLN H . 25514 1
56 . 1 1 11 11 GLN HA H 1 4.142 0.015 . . . . . A 6 GLN HA . 25514 1
57 . 1 1 11 11 GLN HB2 H 1 1.947 0.048 . . . . . A 6 GLN HB2 . 25514 1
58 . 1 1 11 11 GLN HB3 H 1 1.905 0.032 . . . . . A 6 GLN HB3 . 25514 1
59 . 1 1 11 11 GLN HG2 H 1 2.218 0.003 . . . . . A 6 GLN HG2 . 25514 1
60 . 1 1 11 11 GLN HG3 H 1 2.218 0.003 . . . . . A 6 GLN HG3 . 25514 1
61 . 1 1 11 11 GLN HE21 H 1 7.445 0.029 . . . . . A 6 GLN HE21 . 25514 1
62 . 1 1 11 11 GLN HE22 H 1 6.709 0.049 . . . . . A 6 GLN HE22 . 25514 1
63 . 1 1 11 11 GLN C C 13 175.835 0.005 . . . . . A 6 GLN C . 25514 1
64 . 1 1 11 11 GLN CA C 13 56.027 0.025 . . . . . A 6 GLN CA . 25514 1
65 . 1 1 11 11 GLN CB C 13 28.991 0.014 . . . . . A 6 GLN CB . 25514 1
66 . 1 1 11 11 GLN CG C 13 33.695 0.013 . . . . . A 6 GLN CG . 25514 1
67 . 1 1 11 11 GLN N N 15 120.823 0.018 . . . . . A 6 GLN N . 25514 1
68 . 1 1 11 11 GLN NE2 N 15 112.185 0.001 . . . . . A 6 GLN NE2 . 25514 1
69 . 1 1 12 12 ARG H H 1 8.127 0.004 . . . . . A 7 ARG H . 25514 1
70 . 1 1 12 12 ARG HA H 1 4.239 0.006 . . . . . A 7 ARG HA . 25514 1
71 . 1 1 12 12 ARG HB2 H 1 1.760 0.020 . . . . . A 7 ARG HB2 . 25514 1
72 . 1 1 12 12 ARG HB3 H 1 1.724 0.021 . . . . . A 7 ARG HB3 . 25514 1
73 . 1 1 12 12 ARG HG2 H 1 1.537 0.006 . . . . . A 7 ARG HG2 . 25514 1
74 . 1 1 12 12 ARG HG3 H 1 1.537 0.006 . . . . . A 7 ARG HG3 . 25514 1
75 . 1 1 12 12 ARG HD2 H 1 3.087 0.007 . . . . . A 7 ARG HD2 . 25514 1
76 . 1 1 12 12 ARG HD3 H 1 3.087 0.007 . . . . . A 7 ARG HD3 . 25514 1
77 . 1 1 12 12 ARG C C 13 176.109 0.002 . . . . . A 7 ARG C . 25514 1
78 . 1 1 12 12 ARG CA C 13 56.075 0.027 . . . . . A 7 ARG CA . 25514 1
79 . 1 1 12 12 ARG CB C 13 30.913 0.032 . . . . . A 7 ARG CB . 25514 1
80 . 1 1 12 12 ARG CG C 13 26.894 0.048 . . . . . A 7 ARG CG . 25514 1
81 . 1 1 12 12 ARG CD C 13 43.227 0.057 . . . . . A 7 ARG CD . 25514 1
82 . 1 1 12 12 ARG N N 15 121.497 0.004 . . . . . A 7 ARG N . 25514 1
83 . 1 1 13 13 SER H H 1 8.701 0.005 . . . . . A 8 SER H . 25514 1
84 . 1 1 13 13 SER HA H 1 4.457 0.008 . . . . . A 8 SER HA . 25514 1
85 . 1 1 13 13 SER HB2 H 1 4.038 0.000 . . . . . A 8 SER HB2 . 25514 1
86 . 1 1 13 13 SER HB3 H 1 3.986 0.023 . . . . . A 8 SER HB3 . 25514 1
87 . 1 1 13 13 SER C C 13 173.743 0.004 . . . . . A 8 SER C . 25514 1
88 . 1 1 13 13 SER CA C 13 57.277 0.026 . . . . . A 8 SER CA . 25514 1
89 . 1 1 13 13 SER CB C 13 65.869 0.030 . . . . . A 8 SER CB . 25514 1
90 . 1 1 13 13 SER N N 15 117.424 0.011 . . . . . A 8 SER N . 25514 1
91 . 1 1 14 14 LEU H H 1 7.987 0.005 . . . . . A 9 LEU H . 25514 1
92 . 1 1 14 14 LEU HA H 1 4.513 0.011 . . . . . A 9 LEU HA . 25514 1
93 . 1 1 14 14 LEU HB2 H 1 1.594 0.020 . . . . . A 9 LEU HB2 . 25514 1
94 . 1 1 14 14 LEU HB3 H 1 1.104 0.003 . . . . . A 9 LEU HB3 . 25514 1
95 . 1 1 14 14 LEU HG H 1 1.505 0.024 . . . . . A 9 LEU HG . 25514 1
96 . 1 1 14 14 LEU HD11 H 1 0.587 0.004 . . . . . A 9 LEU HD11 . 25514 1
97 . 1 1 14 14 LEU HD12 H 1 0.587 0.004 . . . . . A 9 LEU HD12 . 25514 1
98 . 1 1 14 14 LEU HD13 H 1 0.587 0.004 . . . . . A 9 LEU HD13 . 25514 1
99 . 1 1 14 14 LEU HD21 H 1 0.748 0.009 . . . . . A 9 LEU HD21 . 25514 1
100 . 1 1 14 14 LEU HD22 H 1 0.748 0.009 . . . . . A 9 LEU HD22 . 25514 1
101 . 1 1 14 14 LEU HD23 H 1 0.748 0.009 . . . . . A 9 LEU HD23 . 25514 1
102 . 1 1 14 14 LEU C C 13 176.548 0.001 . . . . . A 9 LEU C . 25514 1
103 . 1 1 14 14 LEU CA C 13 54.082 0.015 . . . . . A 9 LEU CA . 25514 1
104 . 1 1 14 14 LEU CB C 13 43.349 0.019 . . . . . A 9 LEU CB . 25514 1
105 . 1 1 14 14 LEU CG C 13 26.496 0.040 . . . . . A 9 LEU CG . 25514 1
106 . 1 1 14 14 LEU CD1 C 13 26.434 0.012 . . . . . A 9 LEU CD1 . 25514 1
107 . 1 1 14 14 LEU CD2 C 13 23.315 0.061 . . . . . A 9 LEU CD2 . 25514 1
108 . 1 1 14 14 LEU N N 15 123.420 0.004 . . . . . A 9 LEU N . 25514 1
109 . 1 1 16 16 THR H H 1 8.482 0.017 . . . . . A 11 THR H . 25514 1
110 . 1 1 16 16 THR HA H 1 4.892 0.004 . . . . . A 11 THR HA . 25514 1
111 . 1 1 16 16 THR HB H 1 4.574 0.016 . . . . . A 11 THR HB . 25514 1
112 . 1 1 16 16 THR HG21 H 1 1.262 0.010 . . . . . A 11 THR HG21 . 25514 1
113 . 1 1 16 16 THR HG22 H 1 1.262 0.010 . . . . . A 11 THR HG22 . 25514 1
114 . 1 1 16 16 THR HG23 H 1 1.262 0.010 . . . . . A 11 THR HG23 . 25514 1
115 . 1 1 16 16 THR C C 13 174.925 0.006 . . . . . A 11 THR C . 25514 1
116 . 1 1 16 16 THR CA C 13 60.513 0.059 . . . . . A 11 THR CA . 25514 1
117 . 1 1 16 16 THR CB C 13 69.671 0.033 . . . . . A 11 THR CB . 25514 1
118 . 1 1 16 16 THR CG2 C 13 22.477 0.012 . . . . . A 11 THR CG2 . 25514 1
119 . 1 1 16 16 THR N N 15 106.395 0.021 . . . . . A 11 THR N . 25514 1
120 . 1 1 17 17 SER H H 1 8.114 0.003 . . . . . A 12 SER H . 25514 1
121 . 1 1 17 17 SER HA H 1 4.415 0.005 . . . . . A 12 SER HA . 25514 1
122 . 1 1 17 17 SER HB2 H 1 3.906 0.012 . . . . . A 12 SER HB2 . 25514 1
123 . 1 1 17 17 SER HB3 H 1 3.872 0.009 . . . . . A 12 SER HB3 . 25514 1
124 . 1 1 17 17 SER C C 13 175.451 0.002 . . . . . A 12 SER C . 25514 1
125 . 1 1 17 17 SER CA C 13 58.897 0.025 . . . . . A 12 SER CA . 25514 1
126 . 1 1 17 17 SER CB C 13 65.004 0.014 . . . . . A 12 SER CB . 25514 1
127 . 1 1 17 17 SER N N 15 118.043 0.006 . . . . . A 12 SER N . 25514 1
128 . 1 1 18 18 GLY H H 1 11.145 0.012 . . . . . A 13 GLY H . 25514 1
129 . 1 1 18 18 GLY HA2 H 1 3.266 0.010 . . . . . A 13 GLY HA2 . 25514 1
130 . 1 1 18 18 GLY HA3 H 1 2.728 0.008 . . . . . A 13 GLY HA3 . 25514 1
131 . 1 1 18 18 GLY C C 13 173.208 0.000 . . . . . A 13 GLY C . 25514 1
132 . 1 1 18 18 GLY CA C 13 47.220 0.036 . . . . . A 13 GLY CA . 25514 1
133 . 1 1 18 18 GLY N N 15 119.209 0.011 . . . . . A 13 GLY N . 25514 1
134 . 1 1 19 19 GLU H H 1 8.819 0.004 . . . . . A 14 GLU H . 25514 1
135 . 1 1 19 19 GLU HA H 1 4.706 0.016 . . . . . A 14 GLU HA . 25514 1
136 . 1 1 19 19 GLU HB2 H 1 1.720 0.031 . . . . . A 14 GLU HB2 . 25514 1
137 . 1 1 19 19 GLU HB3 H 1 1.683 0.014 . . . . . A 14 GLU HB3 . 25514 1
138 . 1 1 19 19 GLU HG2 H 1 2.149 0.018 . . . . . A 14 GLU HG2 . 25514 1
139 . 1 1 19 19 GLU HG3 H 1 2.015 0.011 . . . . . A 14 GLU HG3 . 25514 1
140 . 1 1 19 19 GLU C C 13 179.762 0.001 . . . . . A 14 GLU C . 25514 1
141 . 1 1 19 19 GLU CA C 13 56.887 0.000 . . . . . A 14 GLU CA . 25514 1
142 . 1 1 19 19 GLU CB C 13 33.808 0.022 . . . . . A 14 GLU CB . 25514 1
143 . 1 1 19 19 GLU CG C 13 36.640 0.034 . . . . . A 14 GLU CG . 25514 1
144 . 1 1 19 19 GLU N N 15 114.736 0.007 . . . . . A 14 GLU N . 25514 1
145 . 1 1 20 20 SER H H 1 9.877 0.004 . . . . . A 15 SER H . 25514 1
146 . 1 1 20 20 SER HA H 1 3.996 0.013 . . . . . A 15 SER HA . 25514 1
147 . 1 1 20 20 SER HB2 H 1 4.195 0.003 . . . . . A 15 SER HB2 . 25514 1
148 . 1 1 20 20 SER HB3 H 1 3.855 0.003 . . . . . A 15 SER HB3 . 25514 1
149 . 1 1 20 20 SER C C 13 177.835 0.000 . . . . . A 15 SER C . 25514 1
150 . 1 1 20 20 SER CA C 13 64.134 0.032 . . . . . A 15 SER CA . 25514 1
151 . 1 1 20 20 SER CB C 13 61.933 0.032 . . . . . A 15 SER CB . 25514 1
152 . 1 1 20 20 SER N N 15 121.815 0.010 . . . . . A 15 SER N . 25514 1
153 . 1 1 21 21 LEU H H 1 9.039 0.007 . . . . . A 16 LEU H . 25514 1
154 . 1 1 21 21 LEU HA H 1 3.918 0.008 . . . . . A 16 LEU HA . 25514 1
155 . 1 1 21 21 LEU HB2 H 1 1.034 0.003 . . . . . A 16 LEU HB2 . 25514 1
156 . 1 1 21 21 LEU HB3 H 1 0.681 0.025 . . . . . A 16 LEU HB3 . 25514 1
157 . 1 1 21 21 LEU HG H 1 1.377 0.036 . . . . . A 16 LEU HG . 25514 1
158 . 1 1 21 21 LEU HD11 H 1 0.477 0.012 . . . . . A 16 LEU HD11 . 25514 1
159 . 1 1 21 21 LEU HD12 H 1 0.477 0.012 . . . . . A 16 LEU HD12 . 25514 1
160 . 1 1 21 21 LEU HD13 H 1 0.477 0.012 . . . . . A 16 LEU HD13 . 25514 1
161 . 1 1 21 21 LEU HD21 H 1 -0.165 0.010 . . . . . A 16 LEU HD21 . 25514 1
162 . 1 1 21 21 LEU HD22 H 1 -0.165 0.010 . . . . . A 16 LEU HD22 . 25514 1
163 . 1 1 21 21 LEU HD23 H 1 -0.165 0.010 . . . . . A 16 LEU HD23 . 25514 1
164 . 1 1 21 21 LEU C C 13 178.520 0.006 . . . . . A 16 LEU C . 25514 1
165 . 1 1 21 21 LEU CA C 13 57.487 0.030 . . . . . A 16 LEU CA . 25514 1
166 . 1 1 21 21 LEU CB C 13 41.022 0.030 . . . . . A 16 LEU CB . 25514 1
167 . 1 1 21 21 LEU CG C 13 26.493 0.033 . . . . . A 16 LEU CG . 25514 1
168 . 1 1 21 21 LEU CD1 C 13 21.706 0.019 . . . . . A 16 LEU CD1 . 25514 1
169 . 1 1 21 21 LEU CD2 C 13 25.607 0.017 . . . . . A 16 LEU CD2 . 25514 1
170 . 1 1 21 21 LEU N N 15 122.781 0.014 . . . . . A 16 LEU N . 25514 1
171 . 1 1 22 22 TYR H H 1 6.659 0.022 . . . . . A 17 TYR H . 25514 1
172 . 1 1 22 22 TYR HA H 1 3.692 0.012 . . . . . A 17 TYR HA . 25514 1
173 . 1 1 22 22 TYR HB2 H 1 2.652 0.017 . . . . . A 17 TYR HB2 . 25514 1
174 . 1 1 22 22 TYR HB3 H 1 2.647 0.019 . . . . . A 17 TYR HB3 . 25514 1
175 . 1 1 22 22 TYR C C 13 179.459 0.001 . . . . . A 17 TYR C . 25514 1
176 . 1 1 22 22 TYR CA C 13 62.280 0.008 . . . . . A 17 TYR CA . 25514 1
177 . 1 1 22 22 TYR CB C 13 37.124 0.020 . . . . . A 17 TYR CB . 25514 1
178 . 1 1 22 22 TYR N N 15 113.879 0.007 . . . . . A 17 TYR N . 25514 1
179 . 1 1 23 23 HIS H H 1 7.925 0.009 . . . . . A 18 HIS H . 25514 1
180 . 1 1 23 23 HIS HA H 1 4.602 0.014 . . . . . A 18 HIS HA . 25514 1
181 . 1 1 23 23 HIS HB2 H 1 3.338 0.008 . . . . . A 18 HIS HB2 . 25514 1
182 . 1 1 23 23 HIS HB3 H 1 3.338 0.008 . . . . . A 18 HIS HB3 . 25514 1
183 . 1 1 23 23 HIS HD2 H 1 7.427 0.003 . . . . . A 18 HIS HD2 . 25514 1
184 . 1 1 23 23 HIS CA C 13 58.136 0.012 . . . . . A 18 HIS CA . 25514 1
185 . 1 1 23 23 HIS CB C 13 28.081 0.016 . . . . . A 18 HIS CB . 25514 1
186 . 1 1 23 23 HIS CD2 C 13 119.781 0.000 . . . . . A 18 HIS CD2 . 25514 1
187 . 1 1 23 23 HIS N N 15 117.389 0.010 . . . . . A 18 HIS N . 25514 1
188 . 1 1 24 24 VAL H H 1 7.872 0.009 . . . . . A 19 VAL H . 25514 1
189 . 1 1 24 24 VAL HA H 1 3.707 0.005 . . . . . A 19 VAL HA . 25514 1
190 . 1 1 24 24 VAL HB H 1 2.202 0.007 . . . . . A 19 VAL HB . 25514 1
191 . 1 1 24 24 VAL HG11 H 1 0.829 0.014 . . . . . A 19 VAL HG11 . 25514 1
192 . 1 1 24 24 VAL HG12 H 1 0.829 0.014 . . . . . A 19 VAL HG12 . 25514 1
193 . 1 1 24 24 VAL HG13 H 1 0.829 0.014 . . . . . A 19 VAL HG13 . 25514 1
194 . 1 1 24 24 VAL HG21 H 1 1.041 0.003 . . . . . A 19 VAL HG21 . 25514 1
195 . 1 1 24 24 VAL HG22 H 1 1.041 0.003 . . . . . A 19 VAL HG22 . 25514 1
196 . 1 1 24 24 VAL HG23 H 1 1.041 0.003 . . . . . A 19 VAL HG23 . 25514 1
197 . 1 1 24 24 VAL C C 13 176.333 0.002 . . . . . A 19 VAL C . 25514 1
198 . 1 1 24 24 VAL CA C 13 65.840 0.028 . . . . . A 19 VAL CA . 25514 1
199 . 1 1 24 24 VAL CB C 13 31.422 0.028 . . . . . A 19 VAL CB . 25514 1
200 . 1 1 24 24 VAL CG1 C 13 22.054 0.028 . . . . . A 19 VAL CG1 . 25514 1
201 . 1 1 24 24 VAL CG2 C 13 22.798 0.021 . . . . . A 19 VAL CG2 . 25514 1
202 . 1 1 24 24 VAL N N 15 121.341 0.010 . . . . . A 19 VAL N . 25514 1
203 . 1 1 25 25 LEU H H 1 6.604 0.024 . . . . . A 20 LEU H . 25514 1
204 . 1 1 25 25 LEU HA H 1 4.329 0.005 . . . . . A 20 LEU HA . 25514 1
205 . 1 1 25 25 LEU HB2 H 1 1.702 0.027 . . . . . A 20 LEU HB2 . 25514 1
206 . 1 1 25 25 LEU HB3 H 1 1.703 0.027 . . . . . A 20 LEU HB3 . 25514 1
207 . 1 1 25 25 LEU HG H 1 1.683 0.020 . . . . . A 20 LEU HG . 25514 1
208 . 1 1 25 25 LEU HD11 H 1 0.911 0.021 . . . . . A 20 LEU HD11 . 25514 1
209 . 1 1 25 25 LEU HD12 H 1 0.911 0.021 . . . . . A 20 LEU HD12 . 25514 1
210 . 1 1 25 25 LEU HD13 H 1 0.911 0.021 . . . . . A 20 LEU HD13 . 25514 1
211 . 1 1 25 25 LEU HD21 H 1 0.799 0.022 . . . . . A 20 LEU HD21 . 25514 1
212 . 1 1 25 25 LEU HD22 H 1 0.799 0.022 . . . . . A 20 LEU HD22 . 25514 1
213 . 1 1 25 25 LEU HD23 H 1 0.799 0.022 . . . . . A 20 LEU HD23 . 25514 1
214 . 1 1 25 25 LEU C C 13 176.081 0.010 . . . . . A 20 LEU C . 25514 1
215 . 1 1 25 25 LEU CA C 13 53.508 0.014 . . . . . A 20 LEU CA . 25514 1
216 . 1 1 25 25 LEU CB C 13 42.723 0.047 . . . . . A 20 LEU CB . 25514 1
217 . 1 1 25 25 LEU CG C 13 26.575 0.015 . . . . . A 20 LEU CG . 25514 1
218 . 1 1 25 25 LEU CD1 C 13 22.959 0.026 . . . . . A 20 LEU CD1 . 25514 1
219 . 1 1 25 25 LEU CD2 C 13 27.428 0.023 . . . . . A 20 LEU CD2 . 25514 1
220 . 1 1 25 25 LEU N N 15 114.766 0.010 . . . . . A 20 LEU N . 25514 1
221 . 1 1 26 26 GLY H H 1 7.941 0.019 . . . . . A 21 GLY H . 25514 1
222 . 1 1 26 26 GLY HA2 H 1 3.898 0.031 . . . . . A 21 GLY HA2 . 25514 1
223 . 1 1 26 26 GLY HA3 H 1 3.835 0.010 . . . . . A 21 GLY HA3 . 25514 1
224 . 1 1 26 26 GLY C C 13 174.358 0.015 . . . . . A 21 GLY C . 25514 1
225 . 1 1 26 26 GLY CA C 13 46.360 0.022 . . . . . A 21 GLY CA . 25514 1
226 . 1 1 26 26 GLY N N 15 109.076 0.007 . . . . . A 21 GLY N . 25514 1
227 . 1 1 27 27 LEU H H 1 7.821 0.009 . . . . . A 22 LEU H . 25514 1
228 . 1 1 27 27 LEU HA H 1 4.743 0.022 . . . . . A 22 LEU HA . 25514 1
229 . 1 1 27 27 LEU HB2 H 1 1.873 0.015 . . . . . A 22 LEU HB2 . 25514 1
230 . 1 1 27 27 LEU HB3 H 1 1.636 0.033 . . . . . A 22 LEU HB3 . 25514 1
231 . 1 1 27 27 LEU HG H 1 1.575 0.020 . . . . . A 22 LEU HG . 25514 1
232 . 1 1 27 27 LEU HD11 H 1 0.897 0.010 . . . . . A 22 LEU HD11 . 25514 1
233 . 1 1 27 27 LEU HD12 H 1 0.897 0.010 . . . . . A 22 LEU HD12 . 25514 1
234 . 1 1 27 27 LEU HD13 H 1 0.897 0.010 . . . . . A 22 LEU HD13 . 25514 1
235 . 1 1 27 27 LEU HD21 H 1 0.861 0.017 . . . . . A 22 LEU HD21 . 25514 1
236 . 1 1 27 27 LEU HD22 H 1 0.861 0.017 . . . . . A 22 LEU HD22 . 25514 1
237 . 1 1 27 27 LEU HD23 H 1 0.861 0.017 . . . . . A 22 LEU HD23 . 25514 1
238 . 1 1 27 27 LEU C C 13 174.915 0.001 . . . . . A 22 LEU C . 25514 1
239 . 1 1 27 27 LEU CA C 13 52.887 0.000 . . . . . A 22 LEU CA . 25514 1
240 . 1 1 27 27 LEU CB C 13 46.070 0.029 . . . . . A 22 LEU CB . 25514 1
241 . 1 1 27 27 LEU CG C 13 25.819 0.037 . . . . . A 22 LEU CG . 25514 1
242 . 1 1 27 27 LEU CD1 C 13 22.562 0.064 . . . . . A 22 LEU CD1 . 25514 1
243 . 1 1 27 27 LEU CD2 C 13 27.521 0.022 . . . . . A 22 LEU CD2 . 25514 1
244 . 1 1 27 27 LEU N N 15 119.508 0.006 . . . . . A 22 LEU N . 25514 1
245 . 1 1 28 28 ASP H H 1 8.015 0.004 . . . . . A 23 ASP H . 25514 1
246 . 1 1 28 28 ASP HA H 1 4.662 0.016 . . . . . A 23 ASP HA . 25514 1
247 . 1 1 28 28 ASP HB2 H 1 2.708 0.023 . . . . . A 23 ASP HB2 . 25514 1
248 . 1 1 28 28 ASP HB3 H 1 2.599 0.018 . . . . . A 23 ASP HB3 . 25514 1
249 . 1 1 28 28 ASP C C 13 175.124 0.000 . . . . . A 23 ASP C . 25514 1
250 . 1 1 28 28 ASP CA C 13 52.211 0.038 . . . . . A 23 ASP CA . 25514 1
251 . 1 1 28 28 ASP CB C 13 43.333 0.033 . . . . . A 23 ASP CB . 25514 1
252 . 1 1 28 28 ASP N N 15 118.798 0.005 . . . . . A 23 ASP N . 25514 1
253 . 1 1 29 29 LYS H H 1 7.852 0.006 . . . . . A 24 LYS H . 25514 1
254 . 1 1 29 29 LYS HA H 1 2.198 0.004 . . . . . A 24 LYS HA . 25514 1
255 . 1 1 29 29 LYS HB2 H 1 1.403 0.011 . . . . . A 24 LYS HB2 . 25514 1
256 . 1 1 29 29 LYS HB3 H 1 1.403 0.011 . . . . . A 24 LYS HB3 . 25514 1
257 . 1 1 29 29 LYS HG2 H 1 1.207 0.002 . . . . . A 24 LYS HG2 . 25514 1
258 . 1 1 29 29 LYS HG3 H 1 1.207 0.002 . . . . . A 24 LYS HG3 . 25514 1
259 . 1 1 29 29 LYS HD2 H 1 1.507 0.004 . . . . . A 24 LYS HD2 . 25514 1
260 . 1 1 29 29 LYS HD3 H 1 1.507 0.004 . . . . . A 24 LYS HD3 . 25514 1
261 . 1 1 29 29 LYS HE2 H 1 3.083 0.012 . . . . . A 24 LYS HE2 . 25514 1
262 . 1 1 29 29 LYS HE3 H 1 2.910 0.008 . . . . . A 24 LYS HE3 . 25514 1
263 . 1 1 29 29 LYS C C 13 175.965 0.004 . . . . . A 24 LYS C . 25514 1
264 . 1 1 29 29 LYS CA C 13 57.408 0.009 . . . . . A 24 LYS CA . 25514 1
265 . 1 1 29 29 LYS CB C 13 32.423 0.022 . . . . . A 24 LYS CB . 25514 1
266 . 1 1 29 29 LYS CG C 13 24.360 0.014 . . . . . A 24 LYS CG . 25514 1
267 . 1 1 29 29 LYS CD C 13 29.719 0.014 . . . . . A 24 LYS CD . 25514 1
268 . 1 1 29 29 LYS CE C 13 42.081 0.015 . . . . . A 24 LYS CE . 25514 1
269 . 1 1 29 29 LYS N N 15 116.031 0.010 . . . . . A 24 LYS N . 25514 1
270 . 1 1 30 30 ASN H H 1 7.591 0.011 . . . . . A 25 ASN H . 25514 1
271 . 1 1 30 30 ASN HA H 1 4.447 0.016 . . . . . A 25 ASN HA . 25514 1
272 . 1 1 30 30 ASN HB2 H 1 2.708 0.039 . . . . . A 25 ASN HB2 . 25514 1
273 . 1 1 30 30 ASN HB3 H 1 2.713 0.034 . . . . . A 25 ASN HB3 . 25514 1
274 . 1 1 30 30 ASN HD21 H 1 7.468 0.019 . . . . . A 25 ASN HD21 . 25514 1
275 . 1 1 30 30 ASN HD22 H 1 6.850 0.046 . . . . . A 25 ASN HD22 . 25514 1
276 . 1 1 30 30 ASN C C 13 175.173 0.002 . . . . . A 25 ASN C . 25514 1
277 . 1 1 30 30 ASN CA C 13 52.944 0.013 . . . . . A 25 ASN CA . 25514 1
278 . 1 1 30 30 ASN CB C 13 37.763 0.015 . . . . . A 25 ASN CB . 25514 1
279 . 1 1 30 30 ASN N N 15 114.282 0.004 . . . . . A 25 ASN N . 25514 1
280 . 1 1 30 30 ASN ND2 N 15 113.225 0.006 . . . . . A 25 ASN ND2 . 25514 1
281 . 1 1 31 31 ALA H H 1 7.565 0.011 . . . . . A 26 ALA H . 25514 1
282 . 1 1 31 31 ALA HA H 1 4.359 0.010 . . . . . A 26 ALA HA . 25514 1
283 . 1 1 31 31 ALA HB1 H 1 1.711 0.009 . . . . . A 26 ALA HB1 . 25514 1
284 . 1 1 31 31 ALA HB2 H 1 1.711 0.009 . . . . . A 26 ALA HB2 . 25514 1
285 . 1 1 31 31 ALA HB3 H 1 1.711 0.009 . . . . . A 26 ALA HB3 . 25514 1
286 . 1 1 31 31 ALA C C 13 177.963 0.001 . . . . . A 26 ALA C . 25514 1
287 . 1 1 31 31 ALA CA C 13 52.934 0.031 . . . . . A 26 ALA CA . 25514 1
288 . 1 1 31 31 ALA CB C 13 20.958 0.022 . . . . . A 26 ALA CB . 25514 1
289 . 1 1 31 31 ALA N N 15 122.946 0.006 . . . . . A 26 ALA N . 25514 1
290 . 1 1 32 32 THR H H 1 9.054 0.008 . . . . . A 27 THR H . 25514 1
291 . 1 1 32 32 THR HA H 1 4.588 0.002 . . . . . A 27 THR HA . 25514 1
292 . 1 1 32 32 THR HB H 1 4.741 0.016 . . . . . A 27 THR HB . 25514 1
293 . 1 1 32 32 THR HG21 H 1 1.374 0.003 . . . . . A 27 THR HG21 . 25514 1
294 . 1 1 32 32 THR HG22 H 1 1.374 0.003 . . . . . A 27 THR HG22 . 25514 1
295 . 1 1 32 32 THR HG23 H 1 1.374 0.003 . . . . . A 27 THR HG23 . 25514 1
296 . 1 1 32 32 THR C C 13 176.027 0.004 . . . . . A 27 THR C . 25514 1
297 . 1 1 32 32 THR CA C 13 60.422 0.023 . . . . . A 27 THR CA . 25514 1
298 . 1 1 32 32 THR CB C 13 71.773 0.044 . . . . . A 27 THR CB . 25514 1
299 . 1 1 32 32 THR CG2 C 13 21.815 0.009 . . . . . A 27 THR CG2 . 25514 1
300 . 1 1 32 32 THR N N 15 112.986 0.012 . . . . . A 27 THR N . 25514 1
301 . 1 1 33 33 SER H H 1 9.070 0.008 . . . . . A 28 SER H . 25514 1
302 . 1 1 33 33 SER HA H 1 3.914 0.007 . . . . . A 28 SER HA . 25514 1
303 . 1 1 33 33 SER HB2 H 1 4.057 0.002 . . . . . A 28 SER HB2 . 25514 1
304 . 1 1 33 33 SER HB3 H 1 4.057 0.002 . . . . . A 28 SER HB3 . 25514 1
305 . 1 1 33 33 SER C C 13 176.652 0.002 . . . . . A 28 SER C . 25514 1
306 . 1 1 33 33 SER CA C 13 62.453 0.020 . . . . . A 28 SER CA . 25514 1
307 . 1 1 33 33 SER CB C 13 62.412 0.046 . . . . . A 28 SER CB . 25514 1
308 . 1 1 33 33 SER N N 15 115.865 0.018 . . . . . A 28 SER N . 25514 1
309 . 1 1 34 34 ASP H H 1 8.135 0.006 . . . . . A 29 ASP H . 25514 1
310 . 1 1 34 34 ASP HA H 1 4.409 0.010 . . . . . A 29 ASP HA . 25514 1
311 . 1 1 34 34 ASP HB2 H 1 2.552 0.004 . . . . . A 29 ASP HB2 . 25514 1
312 . 1 1 34 34 ASP HB3 H 1 2.569 0.027 . . . . . A 29 ASP HB3 . 25514 1
313 . 1 1 34 34 ASP C C 13 178.081 0.002 . . . . . A 29 ASP C . 25514 1
314 . 1 1 34 34 ASP CA C 13 57.769 0.016 . . . . . A 29 ASP CA . 25514 1
315 . 1 1 34 34 ASP CB C 13 40.973 0.048 . . . . . A 29 ASP CB . 25514 1
316 . 1 1 34 34 ASP N N 15 120.040 0.010 . . . . . A 29 ASP N . 25514 1
317 . 1 1 35 35 ASP H H 1 7.831 0.004 . . . . . A 30 ASP H . 25514 1
318 . 1 1 35 35 ASP HA H 1 4.361 0.013 . . . . . A 30 ASP HA . 25514 1
319 . 1 1 35 35 ASP HB2 H 1 3.166 0.003 . . . . . A 30 ASP HB2 . 25514 1
320 . 1 1 35 35 ASP HB3 H 1 3.166 0.003 . . . . . A 30 ASP HB3 . 25514 1
321 . 1 1 35 35 ASP C C 13 179.367 0.001 . . . . . A 30 ASP C . 25514 1
322 . 1 1 35 35 ASP CA C 13 57.678 0.028 . . . . . A 30 ASP CA . 25514 1
323 . 1 1 35 35 ASP CB C 13 40.986 0.018 . . . . . A 30 ASP CB . 25514 1
324 . 1 1 35 35 ASP N N 15 120.930 0.008 . . . . . A 30 ASP N . 25514 1
325 . 1 1 36 36 ILE H H 1 8.155 0.007 . . . . . A 31 ILE H . 25514 1
326 . 1 1 36 36 ILE HA H 1 3.505 0.016 . . . . . A 31 ILE HA . 25514 1
327 . 1 1 36 36 ILE HB H 1 1.900 0.027 . . . . . A 31 ILE HB . 25514 1
328 . 1 1 36 36 ILE HG21 H 1 0.698 0.012 . . . . . A 31 ILE HG21 . 25514 1
329 . 1 1 36 36 ILE HG22 H 1 0.698 0.012 . . . . . A 31 ILE HG22 . 25514 1
330 . 1 1 36 36 ILE HG23 H 1 0.698 0.012 . . . . . A 31 ILE HG23 . 25514 1
331 . 1 1 36 36 ILE HD11 H 1 0.717 0.011 . . . . . A 31 ILE HD11 . 25514 1
332 . 1 1 36 36 ILE HD12 H 1 0.717 0.011 . . . . . A 31 ILE HD12 . 25514 1
333 . 1 1 36 36 ILE HD13 H 1 0.717 0.011 . . . . . A 31 ILE HD13 . 25514 1
334 . 1 1 36 36 ILE C C 13 177.197 0.004 . . . . . A 31 ILE C . 25514 1
335 . 1 1 36 36 ILE CA C 13 65.566 0.012 . . . . . A 31 ILE CA . 25514 1
336 . 1 1 36 36 ILE CB C 13 38.370 0.023 . . . . . A 31 ILE CB . 25514 1
337 . 1 1 36 36 ILE CG2 C 13 17.652 0.018 . . . . . A 31 ILE CG2 . 25514 1
338 . 1 1 36 36 ILE CD1 C 13 14.482 0.017 . . . . . A 31 ILE CD1 . 25514 1
339 . 1 1 36 36 ILE N N 15 121.829 0.007 . . . . . A 31 ILE N . 25514 1
340 . 1 1 37 37 LYS H H 1 8.134 0.010 . . . . . A 32 LYS H . 25514 1
341 . 1 1 37 37 LYS HA H 1 4.061 0.003 . . . . . A 32 LYS HA . 25514 1
342 . 1 1 37 37 LYS HB2 H 1 1.976 0.024 . . . . . A 32 LYS HB2 . 25514 1
343 . 1 1 37 37 LYS HB3 H 1 1.978 0.024 . . . . . A 32 LYS HB3 . 25514 1
344 . 1 1 37 37 LYS HG2 H 1 1.695 0.012 . . . . . A 32 LYS HG2 . 25514 1
345 . 1 1 37 37 LYS HG3 H 1 1.695 0.012 . . . . . A 32 LYS HG3 . 25514 1
346 . 1 1 37 37 LYS HD2 H 1 1.740 0.018 . . . . . A 32 LYS HD2 . 25514 1
347 . 1 1 37 37 LYS HD3 H 1 1.743 0.015 . . . . . A 32 LYS HD3 . 25514 1
348 . 1 1 37 37 LYS HE2 H 1 2.909 0.015 . . . . . A 32 LYS HE2 . 25514 1
349 . 1 1 37 37 LYS HE3 H 1 2.907 0.015 . . . . . A 32 LYS HE3 . 25514 1
350 . 1 1 37 37 LYS C C 13 178.954 0.005 . . . . . A 32 LYS C . 25514 1
351 . 1 1 37 37 LYS CA C 13 60.749 0.015 . . . . . A 32 LYS CA . 25514 1
352 . 1 1 37 37 LYS CB C 13 32.657 0.017 . . . . . A 32 LYS CB . 25514 1
353 . 1 1 37 37 LYS CG C 13 25.881 0.029 . . . . . A 32 LYS CG . 25514 1
354 . 1 1 37 37 LYS CD C 13 29.708 0.031 . . . . . A 32 LYS CD . 25514 1
355 . 1 1 37 37 LYS CE C 13 41.983 0.000 . . . . . A 32 LYS CE . 25514 1
356 . 1 1 37 37 LYS N N 15 119.499 0.016 . . . . . A 32 LYS N . 25514 1
357 . 1 1 38 38 LYS H H 1 8.327 0.007 . . . . . A 33 LYS H . 25514 1
358 . 1 1 38 38 LYS HA H 1 3.958 0.004 . . . . . A 33 LYS HA . 25514 1
359 . 1 1 38 38 LYS HB2 H 1 1.889 0.014 . . . . . A 33 LYS HB2 . 25514 1
360 . 1 1 38 38 LYS HB3 H 1 1.890 0.015 . . . . . A 33 LYS HB3 . 25514 1
361 . 1 1 38 38 LYS HG2 H 1 1.608 0.030 . . . . . A 33 LYS HG2 . 25514 1
362 . 1 1 38 38 LYS HG3 H 1 1.404 0.005 . . . . . A 33 LYS HG3 . 25514 1
363 . 1 1 38 38 LYS HD2 H 1 1.663 0.022 . . . . . A 33 LYS HD2 . 25514 1
364 . 1 1 38 38 LYS HD3 H 1 1.667 0.007 . . . . . A 33 LYS HD3 . 25514 1
365 . 1 1 38 38 LYS HE2 H 1 2.923 0.004 . . . . . A 33 LYS HE2 . 25514 1
366 . 1 1 38 38 LYS HE3 H 1 2.923 0.004 . . . . . A 33 LYS HE3 . 25514 1
367 . 1 1 38 38 LYS C C 13 179.631 0.002 . . . . . A 33 LYS C . 25514 1
368 . 1 1 38 38 LYS CA C 13 60.008 0.034 . . . . . A 33 LYS CA . 25514 1
369 . 1 1 38 38 LYS CB C 13 32.760 0.026 . . . . . A 33 LYS CB . 25514 1
370 . 1 1 38 38 LYS CG C 13 25.716 0.041 . . . . . A 33 LYS CG . 25514 1
371 . 1 1 38 38 LYS CD C 13 29.432 0.032 . . . . . A 33 LYS CD . 25514 1
372 . 1 1 38 38 LYS CE C 13 42.041 0.003 . . . . . A 33 LYS CE . 25514 1
373 . 1 1 38 38 LYS N N 15 118.935 0.009 . . . . . A 33 LYS N . 25514 1
374 . 1 1 39 39 SER H H 1 8.188 0.009 . . . . . A 34 SER H . 25514 1
375 . 1 1 39 39 SER HA H 1 4.251 0.009 . . . . . A 34 SER HA . 25514 1
376 . 1 1 39 39 SER HB2 H 1 4.104 0.019 . . . . . A 34 SER HB2 . 25514 1
377 . 1 1 39 39 SER HB3 H 1 4.078 0.009 . . . . . A 34 SER HB3 . 25514 1
378 . 1 1 39 39 SER C C 13 176.422 0.000 . . . . . A 34 SER C . 25514 1
379 . 1 1 39 39 SER CA C 13 61.804 0.045 . . . . . A 34 SER CA . 25514 1
380 . 1 1 39 39 SER CB C 13 63.023 0.023 . . . . . A 34 SER CB . 25514 1
381 . 1 1 39 39 SER N N 15 115.063 0.004 . . . . . A 34 SER N . 25514 1
382 . 1 1 40 40 TYR H H 1 8.477 0.006 . . . . . A 35 TYR H . 25514 1
383 . 1 1 40 40 TYR HA H 1 3.881 0.013 . . . . . A 35 TYR HA . 25514 1
384 . 1 1 40 40 TYR HB2 H 1 2.812 0.021 . . . . . A 35 TYR HB2 . 25514 1
385 . 1 1 40 40 TYR HB3 H 1 2.821 0.030 . . . . . A 35 TYR HB3 . 25514 1
386 . 1 1 40 40 TYR C C 13 175.618 0.005 . . . . . A 35 TYR C . 25514 1
387 . 1 1 40 40 TYR CA C 13 61.769 0.041 . . . . . A 35 TYR CA . 25514 1
388 . 1 1 40 40 TYR CB C 13 38.836 0.058 . . . . . A 35 TYR CB . 25514 1
389 . 1 1 40 40 TYR N N 15 119.277 0.005 . . . . . A 35 TYR N . 25514 1
390 . 1 1 41 41 ARG H H 1 7.958 0.003 . . . . . A 36 ARG H . 25514 1
391 . 1 1 41 41 ARG HA H 1 3.441 0.012 . . . . . A 36 ARG HA . 25514 1
392 . 1 1 41 41 ARG HB2 H 1 1.851 0.014 . . . . . A 36 ARG HB2 . 25514 1
393 . 1 1 41 41 ARG HB3 H 1 1.785 0.023 . . . . . A 36 ARG HB3 . 25514 1
394 . 1 1 41 41 ARG HG2 H 1 1.836 0.011 . . . . . A 36 ARG HG2 . 25514 1
395 . 1 1 41 41 ARG HG3 H 1 1.569 0.014 . . . . . A 36 ARG HG3 . 25514 1
396 . 1 1 41 41 ARG HD2 H 1 3.132 0.022 . . . . . A 36 ARG HD2 . 25514 1
397 . 1 1 41 41 ARG HD3 H 1 3.132 0.022 . . . . . A 36 ARG HD3 . 25514 1
398 . 1 1 41 41 ARG C C 13 178.782 0.003 . . . . . A 36 ARG C . 25514 1
399 . 1 1 41 41 ARG CA C 13 59.563 0.015 . . . . . A 36 ARG CA . 25514 1
400 . 1 1 41 41 ARG CB C 13 29.868 0.016 . . . . . A 36 ARG CB . 25514 1
401 . 1 1 41 41 ARG CG C 13 27.680 0.037 . . . . . A 36 ARG CG . 25514 1
402 . 1 1 41 41 ARG CD C 13 43.558 0.020 . . . . . A 36 ARG CD . 25514 1
403 . 1 1 41 41 ARG N N 15 116.689 0.003 . . . . . A 36 ARG N . 25514 1
404 . 1 1 42 42 LYS H H 1 7.326 0.005 . . . . . A 37 LYS H . 25514 1
405 . 1 1 42 42 LYS HA H 1 3.960 0.025 . . . . . A 37 LYS HA . 25514 1
406 . 1 1 42 42 LYS HB2 H 1 1.884 0.016 . . . . . A 37 LYS HB2 . 25514 1
407 . 1 1 42 42 LYS HB3 H 1 1.884 0.016 . . . . . A 37 LYS HB3 . 25514 1
408 . 1 1 42 42 LYS HG2 H 1 1.539 0.013 . . . . . A 37 LYS HG2 . 25514 1
409 . 1 1 42 42 LYS HG3 H 1 1.318 0.012 . . . . . A 37 LYS HG3 . 25514 1
410 . 1 1 42 42 LYS HE2 H 1 2.915 0.006 . . . . . A 37 LYS HE2 . 25514 1
411 . 1 1 42 42 LYS HE3 H 1 2.915 0.006 . . . . . A 37 LYS HE3 . 25514 1
412 . 1 1 42 42 LYS C C 13 179.533 0.001 . . . . . A 37 LYS C . 25514 1
413 . 1 1 42 42 LYS CA C 13 59.394 0.028 . . . . . A 37 LYS CA . 25514 1
414 . 1 1 42 42 LYS CB C 13 32.756 0.026 . . . . . A 37 LYS CB . 25514 1
415 . 1 1 42 42 LYS CG C 13 25.049 0.016 . . . . . A 37 LYS CG . 25514 1
416 . 1 1 42 42 LYS CE C 13 42.042 0.000 . . . . . A 37 LYS CE . 25514 1
417 . 1 1 42 42 LYS N N 15 116.988 0.007 . . . . . A 37 LYS N . 25514 1
418 . 1 1 43 43 LEU H H 1 8.283 0.013 . . . . . A 38 LEU H . 25514 1
419 . 1 1 43 43 LEU HA H 1 4.018 0.017 . . . . . A 38 LEU HA . 25514 1
420 . 1 1 43 43 LEU HB2 H 1 1.831 0.019 . . . . . A 38 LEU HB2 . 25514 1
421 . 1 1 43 43 LEU HB3 H 1 1.491 0.018 . . . . . A 38 LEU HB3 . 25514 1
422 . 1 1 43 43 LEU HD11 H 1 0.929 0.013 . . . . . A 38 LEU HD11 . 25514 1
423 . 1 1 43 43 LEU HD12 H 1 0.929 0.013 . . . . . A 38 LEU HD12 . 25514 1
424 . 1 1 43 43 LEU HD13 H 1 0.929 0.013 . . . . . A 38 LEU HD13 . 25514 1
425 . 1 1 43 43 LEU HD21 H 1 0.911 0.009 . . . . . A 38 LEU HD21 . 25514 1
426 . 1 1 43 43 LEU HD22 H 1 0.911 0.009 . . . . . A 38 LEU HD22 . 25514 1
427 . 1 1 43 43 LEU HD23 H 1 0.911 0.009 . . . . . A 38 LEU HD23 . 25514 1
428 . 1 1 43 43 LEU C C 13 178.418 0.018 . . . . . A 38 LEU C . 25514 1
429 . 1 1 43 43 LEU CA C 13 57.415 0.064 . . . . . A 38 LEU CA . 25514 1
430 . 1 1 43 43 LEU CB C 13 42.325 0.075 . . . . . A 38 LEU CB . 25514 1
431 . 1 1 43 43 LEU CD1 C 13 26.564 0.029 . . . . . A 38 LEU CD1 . 25514 1
432 . 1 1 43 43 LEU CD2 C 13 22.701 0.029 . . . . . A 38 LEU CD2 . 25514 1
433 . 1 1 43 43 LEU N N 15 120.813 0.015 . . . . . A 38 LEU N . 25514 1
434 . 1 1 44 44 ALA H H 1 9.004 0.008 . . . . . A 39 ALA H . 25514 1
435 . 1 1 44 44 ALA HA H 1 3.888 0.014 . . . . . A 39 ALA HA . 25514 1
436 . 1 1 44 44 ALA HB1 H 1 0.938 0.018 . . . . . A 39 ALA HB1 . 25514 1
437 . 1 1 44 44 ALA HB2 H 1 0.938 0.018 . . . . . A 39 ALA HB2 . 25514 1
438 . 1 1 44 44 ALA HB3 H 1 0.938 0.018 . . . . . A 39 ALA HB3 . 25514 1
439 . 1 1 44 44 ALA C C 13 179.307 0.003 . . . . . A 39 ALA C . 25514 1
440 . 1 1 44 44 ALA CA C 13 55.369 0.074 . . . . . A 39 ALA CA . 25514 1
441 . 1 1 44 44 ALA CB C 13 16.964 0.011 . . . . . A 39 ALA CB . 25514 1
442 . 1 1 44 44 ALA N N 15 122.663 0.013 . . . . . A 39 ALA N . 25514 1
443 . 1 1 45 45 LEU H H 1 6.909 0.007 . . . . . A 40 LEU H . 25514 1
444 . 1 1 45 45 LEU HA H 1 4.019 0.008 . . . . . A 40 LEU HA . 25514 1
445 . 1 1 45 45 LEU HB2 H 1 1.675 0.016 . . . . . A 40 LEU HB2 . 25514 1
446 . 1 1 45 45 LEU HB3 H 1 1.488 0.014 . . . . . A 40 LEU HB3 . 25514 1
447 . 1 1 45 45 LEU HG H 1 1.651 0.007 . . . . . A 40 LEU HG . 25514 1
448 . 1 1 45 45 LEU HD11 H 1 0.784 0.012 . . . . . A 40 LEU HD11 . 25514 1
449 . 1 1 45 45 LEU HD12 H 1 0.784 0.012 . . . . . A 40 LEU HD12 . 25514 1
450 . 1 1 45 45 LEU HD13 H 1 0.784 0.012 . . . . . A 40 LEU HD13 . 25514 1
451 . 1 1 45 45 LEU HD21 H 1 0.756 0.009 . . . . . A 40 LEU HD21 . 25514 1
452 . 1 1 45 45 LEU HD22 H 1 0.756 0.009 . . . . . A 40 LEU HD22 . 25514 1
453 . 1 1 45 45 LEU HD23 H 1 0.756 0.009 . . . . . A 40 LEU HD23 . 25514 1
454 . 1 1 45 45 LEU C C 13 178.908 0.004 . . . . . A 40 LEU C . 25514 1
455 . 1 1 45 45 LEU CA C 13 57.302 0.041 . . . . . A 40 LEU CA . 25514 1
456 . 1 1 45 45 LEU CB C 13 41.988 0.038 . . . . . A 40 LEU CB . 25514 1
457 . 1 1 45 45 LEU CG C 13 26.776 0.011 . . . . . A 40 LEU CG . 25514 1
458 . 1 1 45 45 LEU CD1 C 13 24.636 0.026 . . . . . A 40 LEU CD1 . 25514 1
459 . 1 1 45 45 LEU CD2 C 13 23.694 0.055 . . . . . A 40 LEU CD2 . 25514 1
460 . 1 1 45 45 LEU N N 15 114.589 0.006 . . . . . A 40 LEU N . 25514 1
461 . 1 1 46 46 LYS H H 1 7.172 0.012 . . . . . A 41 LYS H . 25514 1
462 . 1 1 46 46 LYS HA H 1 3.827 0.010 . . . . . A 41 LYS HA . 25514 1
463 . 1 1 46 46 LYS HB2 H 1 1.509 0.031 . . . . . A 41 LYS HB2 . 25514 1
464 . 1 1 46 46 LYS HB3 H 1 1.505 0.035 . . . . . A 41 LYS HB3 . 25514 1
465 . 1 1 46 46 LYS HG2 H 1 0.425 0.001 . . . . . A 41 LYS HG2 . 25514 1
466 . 1 1 46 46 LYS HG3 H 1 0.425 0.001 . . . . . A 41 LYS HG3 . 25514 1
467 . 1 1 46 46 LYS HD2 H 1 1.406 0.026 . . . . . A 41 LYS HD2 . 25514 1
468 . 1 1 46 46 LYS HD3 H 1 1.233 0.004 . . . . . A 41 LYS HD3 . 25514 1
469 . 1 1 46 46 LYS HE2 H 1 2.767 0.014 . . . . . A 41 LYS HE2 . 25514 1
470 . 1 1 46 46 LYS HE3 H 1 2.714 0.020 . . . . . A 41 LYS HE3 . 25514 1
471 . 1 1 46 46 LYS C C 13 178.253 0.002 . . . . . A 41 LYS C . 25514 1
472 . 1 1 46 46 LYS CA C 13 58.743 0.045 . . . . . A 41 LYS CA . 25514 1
473 . 1 1 46 46 LYS CB C 13 32.937 0.000 . . . . . A 41 LYS CB . 25514 1
474 . 1 1 46 46 LYS CG C 13 24.475 0.010 . . . . . A 41 LYS CG . 25514 1
475 . 1 1 46 46 LYS CD C 13 29.522 0.052 . . . . . A 41 LYS CD . 25514 1
476 . 1 1 46 46 LYS CE C 13 41.971 0.023 . . . . . A 41 LYS CE . 25514 1
477 . 1 1 46 46 LYS N N 15 118.184 0.008 . . . . . A 41 LYS N . 25514 1
478 . 1 1 47 47 TYR H H 1 7.749 0.004 . . . . . A 42 TYR H . 25514 1
479 . 1 1 47 47 TYR HA H 1 4.480 0.006 . . . . . A 42 TYR HA . 25514 1
480 . 1 1 47 47 TYR HB2 H 1 3.634 0.007 . . . . . A 42 TYR HB2 . 25514 1
481 . 1 1 47 47 TYR HB3 H 1 2.446 0.010 . . . . . A 42 TYR HB3 . 25514 1
482 . 1 1 47 47 TYR HD1 H 1 7.038 0.017 . . . . . A 42 TYR HD1 . 25514 1
483 . 1 1 47 47 TYR HD2 H 1 7.038 0.017 . . . . . A 42 TYR HD2 . 25514 1
484 . 1 1 47 47 TYR HE1 H 1 6.731 0.021 . . . . . A 42 TYR HE1 . 25514 1
485 . 1 1 47 47 TYR HE2 H 1 6.731 0.021 . . . . . A 42 TYR HE2 . 25514 1
486 . 1 1 47 47 TYR C C 13 173.188 0.001 . . . . . A 42 TYR C . 25514 1
487 . 1 1 47 47 TYR CA C 13 58.062 0.095 . . . . . A 42 TYR CA . 25514 1
488 . 1 1 47 47 TYR CB C 13 38.451 0.022 . . . . . A 42 TYR CB . 25514 1
489 . 1 1 47 47 TYR CD1 C 13 132.757 0.000 . . . . . A 42 TYR CD1 . 25514 1
490 . 1 1 47 47 TYR CD2 C 13 132.757 0.000 . . . . . A 42 TYR CD2 . 25514 1
491 . 1 1 47 47 TYR CE1 C 13 117.802 0.000 . . . . . A 42 TYR CE1 . 25514 1
492 . 1 1 47 47 TYR CE2 C 13 117.802 0.000 . . . . . A 42 TYR CE2 . 25514 1
493 . 1 1 47 47 TYR N N 15 113.982 0.005 . . . . . A 42 TYR N . 25514 1
494 . 1 1 48 48 HIS H H 1 7.181 0.015 . . . . . A 43 HIS H . 25514 1
495 . 1 1 48 48 HIS HA H 1 3.554 0.019 . . . . . A 43 HIS HA . 25514 1
496 . 1 1 48 48 HIS HB2 H 1 3.418 0.015 . . . . . A 43 HIS HB2 . 25514 1
497 . 1 1 48 48 HIS HB3 H 1 2.575 0.007 . . . . . A 43 HIS HB3 . 25514 1
498 . 1 1 48 48 HIS HD2 H 1 7.046 0.032 . . . . . A 43 HIS HD2 . 25514 1
499 . 1 1 48 48 HIS CA C 13 56.601 0.018 . . . . . A 43 HIS CA . 25514 1
500 . 1 1 48 48 HIS CB C 13 30.944 0.012 . . . . . A 43 HIS CB . 25514 1
501 . 1 1 48 48 HIS CD2 C 13 118.249 0.041 . . . . . A 43 HIS CD2 . 25514 1
502 . 1 1 48 48 HIS N N 15 120.738 0.006 . . . . . A 43 HIS N . 25514 1
503 . 1 1 49 49 PRO HA H 1 4.000 0.013 . . . . . A 44 PRO HA . 25514 1
504 . 1 1 49 49 PRO HB2 H 1 2.055 0.010 . . . . . A 44 PRO HB2 . 25514 1
505 . 1 1 49 49 PRO HB3 H 1 1.770 0.012 . . . . . A 44 PRO HB3 . 25514 1
506 . 1 1 49 49 PRO HG2 H 1 1.535 0.012 . . . . . A 44 PRO HG2 . 25514 1
507 . 1 1 49 49 PRO HG3 H 1 1.537 0.009 . . . . . A 44 PRO HG3 . 25514 1
508 . 1 1 49 49 PRO HD2 H 1 2.253 0.015 . . . . . A 44 PRO HD2 . 25514 1
509 . 1 1 49 49 PRO HD3 H 1 1.742 0.009 . . . . . A 44 PRO HD3 . 25514 1
510 . 1 1 49 49 PRO C C 13 178.984 0.000 . . . . . A 44 PRO C . 25514 1
511 . 1 1 49 49 PRO CA C 13 65.455 0.024 . . . . . A 44 PRO CA . 25514 1
512 . 1 1 49 49 PRO CB C 13 31.558 0.045 . . . . . A 44 PRO CB . 25514 1
513 . 1 1 49 49 PRO CG C 13 27.018 0.040 . . . . . A 44 PRO CG . 25514 1
514 . 1 1 49 49 PRO CD C 13 49.950 0.019 . . . . . A 44 PRO CD . 25514 1
515 . 1 1 50 50 ASP H H 1 10.495 0.006 . . . . . A 45 ASP H . 25514 1
516 . 1 1 50 50 ASP HA H 1 4.347 0.004 . . . . . A 45 ASP HA . 25514 1
517 . 1 1 50 50 ASP HB2 H 1 2.592 0.012 . . . . . A 45 ASP HB2 . 25514 1
518 . 1 1 50 50 ASP HB3 H 1 2.603 0.005 . . . . . A 45 ASP HB3 . 25514 1
519 . 1 1 50 50 ASP C C 13 177.804 0.005 . . . . . A 45 ASP C . 25514 1
520 . 1 1 50 50 ASP CA C 13 56.514 0.008 . . . . . A 45 ASP CA . 25514 1
521 . 1 1 50 50 ASP CB C 13 40.045 0.001 . . . . . A 45 ASP CB . 25514 1
522 . 1 1 50 50 ASP N N 15 121.038 0.011 . . . . . A 45 ASP N . 25514 1
523 . 1 1 51 51 LYS H H 1 7.495 0.005 . . . . . A 46 LYS H . 25514 1
524 . 1 1 51 51 LYS HA H 1 4.339 0.003 . . . . . A 46 LYS HA . 25514 1
525 . 1 1 51 51 LYS HB2 H 1 1.948 0.004 . . . . . A 46 LYS HB2 . 25514 1
526 . 1 1 51 51 LYS HB3 H 1 1.620 0.015 . . . . . A 46 LYS HB3 . 25514 1
527 . 1 1 51 51 LYS HG2 H 1 1.394 0.005 . . . . . A 46 LYS HG2 . 25514 1
528 . 1 1 51 51 LYS HG3 H 1 1.265 0.004 . . . . . A 46 LYS HG3 . 25514 1
529 . 1 1 51 51 LYS HD2 H 1 1.567 0.017 . . . . . A 46 LYS HD2 . 25514 1
530 . 1 1 51 51 LYS HD3 H 1 1.570 0.024 . . . . . A 46 LYS HD3 . 25514 1
531 . 1 1 51 51 LYS HE2 H 1 2.837 0.030 . . . . . A 46 LYS HE2 . 25514 1
532 . 1 1 51 51 LYS HE3 H 1 2.837 0.030 . . . . . A 46 LYS HE3 . 25514 1
533 . 1 1 51 51 LYS C C 13 175.542 0.005 . . . . . A 46 LYS C . 25514 1
534 . 1 1 51 51 LYS CA C 13 54.818 0.028 . . . . . A 46 LYS CA . 25514 1
535 . 1 1 51 51 LYS CB C 13 33.138 0.032 . . . . . A 46 LYS CB . 25514 1
536 . 1 1 51 51 LYS CG C 13 24.571 0.014 . . . . . A 46 LYS CG . 25514 1
537 . 1 1 51 51 LYS CD C 13 28.205 0.043 . . . . . A 46 LYS CD . 25514 1
538 . 1 1 51 51 LYS CE C 13 42.109 0.000 . . . . . A 46 LYS CE . 25514 1
539 . 1 1 51 51 LYS N N 15 116.137 0.014 . . . . . A 46 LYS N . 25514 1
540 . 1 1 52 52 ASN H H 1 7.472 0.009 . . . . . A 47 ASN H . 25514 1
541 . 1 1 52 52 ASN HA H 1 5.123 0.006 . . . . . A 47 ASN HA . 25514 1
542 . 1 1 52 52 ASN HB2 H 1 2.547 0.005 . . . . . A 47 ASN HB2 . 25514 1
543 . 1 1 52 52 ASN HB3 H 1 2.290 0.008 . . . . . A 47 ASN HB3 . 25514 1
544 . 1 1 52 52 ASN HD21 H 1 7.589 0.024 . . . . . A 47 ASN HD21 . 25514 1
545 . 1 1 52 52 ASN HD22 H 1 7.023 0.004 . . . . . A 47 ASN HD22 . 25514 1
546 . 1 1 52 52 ASN C C 13 171.456 0.000 . . . . . A 47 ASN C . 25514 1
547 . 1 1 52 52 ASN CA C 13 51.543 0.043 . . . . . A 47 ASN CA . 25514 1
548 . 1 1 52 52 ASN CB C 13 41.347 0.026 . . . . . A 47 ASN CB . 25514 1
549 . 1 1 52 52 ASN N N 15 117.774 0.006 . . . . . A 47 ASN N . 25514 1
550 . 1 1 52 52 ASN ND2 N 15 116.266 0.008 . . . . . A 47 ASN ND2 . 25514 1
551 . 1 1 53 53 PRO HA H 1 4.351 0.006 . . . . . A 48 PRO HA . 25514 1
552 . 1 1 53 53 PRO HB2 H 1 2.161 0.024 . . . . . A 48 PRO HB2 . 25514 1
553 . 1 1 53 53 PRO HB3 H 1 1.878 0.010 . . . . . A 48 PRO HB3 . 25514 1
554 . 1 1 53 53 PRO HG2 H 1 1.910 0.004 . . . . . A 48 PRO HG2 . 25514 1
555 . 1 1 53 53 PRO HG3 H 1 1.910 0.004 . . . . . A 48 PRO HG3 . 25514 1
556 . 1 1 53 53 PRO HD2 H 1 3.525 0.004 . . . . . A 48 PRO HD2 . 25514 1
557 . 1 1 53 53 PRO HD3 H 1 3.250 0.002 . . . . . A 48 PRO HD3 . 25514 1
558 . 1 1 53 53 PRO C C 13 177.232 0.000 . . . . . A 48 PRO C . 25514 1
559 . 1 1 53 53 PRO CA C 13 64.044 0.023 . . . . . A 48 PRO CA . 25514 1
560 . 1 1 53 53 PRO CB C 13 31.559 0.040 . . . . . A 48 PRO CB . 25514 1
561 . 1 1 53 53 PRO CG C 13 27.370 0.013 . . . . . A 48 PRO CG . 25514 1
562 . 1 1 53 53 PRO CD C 13 50.494 0.026 . . . . . A 48 PRO CD . 25514 1
563 . 1 1 54 54 ASP H H 1 8.648 0.006 . . . . . A 49 ASP H . 25514 1
564 . 1 1 54 54 ASP HA H 1 4.381 0.007 . . . . . A 49 ASP HA . 25514 1
565 . 1 1 54 54 ASP HB2 H 1 2.788 0.002 . . . . . A 49 ASP HB2 . 25514 1
566 . 1 1 54 54 ASP HB3 H 1 2.563 0.006 . . . . . A 49 ASP HB3 . 25514 1
567 . 1 1 54 54 ASP C C 13 174.704 0.000 . . . . . A 49 ASP C . 25514 1
568 . 1 1 54 54 ASP CA C 13 54.508 0.020 . . . . . A 49 ASP CA . 25514 1
569 . 1 1 54 54 ASP CB C 13 40.304 0.053 . . . . . A 49 ASP CB . 25514 1
570 . 1 1 54 54 ASP N N 15 117.650 0.012 . . . . . A 49 ASP N . 25514 1
571 . 1 1 55 55 ASN H H 1 7.358 0.010 . . . . . A 50 ASN H . 25514 1
572 . 1 1 55 55 ASN HA H 1 5.178 0.011 . . . . . A 50 ASN HA . 25514 1
573 . 1 1 55 55 ASN HB2 H 1 2.893 0.009 . . . . . A 50 ASN HB2 . 25514 1
574 . 1 1 55 55 ASN HB3 H 1 2.553 0.011 . . . . . A 50 ASN HB3 . 25514 1
575 . 1 1 55 55 ASN HD21 H 1 7.895 0.002 . . . . . A 50 ASN HD21 . 25514 1
576 . 1 1 55 55 ASN HD22 H 1 7.107 0.012 . . . . . A 50 ASN HD22 . 25514 1
577 . 1 1 55 55 ASN C C 13 173.754 0.000 . . . . . A 50 ASN C . 25514 1
578 . 1 1 55 55 ASN CA C 13 50.185 0.000 . . . . . A 50 ASN CA . 25514 1
579 . 1 1 55 55 ASN CB C 13 39.524 0.030 . . . . . A 50 ASN CB . 25514 1
580 . 1 1 55 55 ASN N N 15 114.697 0.008 . . . . . A 50 ASN N . 25514 1
581 . 1 1 55 55 ASN ND2 N 15 112.441 0.013 . . . . . A 50 ASN ND2 . 25514 1
582 . 1 1 56 56 PRO HA H 1 4.356 0.002 . . . . . A 51 PRO HA . 25514 1
583 . 1 1 56 56 PRO HB2 H 1 2.325 0.011 . . . . . A 51 PRO HB2 . 25514 1
584 . 1 1 56 56 PRO HB3 H 1 2.004 0.018 . . . . . A 51 PRO HB3 . 25514 1
585 . 1 1 56 56 PRO HG2 H 1 2.065 0.034 . . . . . A 51 PRO HG2 . 25514 1
586 . 1 1 56 56 PRO HG3 H 1 1.990 0.019 . . . . . A 51 PRO HG3 . 25514 1
587 . 1 1 56 56 PRO HD2 H 1 3.950 0.003 . . . . . A 51 PRO HD2 . 25514 1
588 . 1 1 56 56 PRO HD3 H 1 3.772 0.004 . . . . . A 51 PRO HD3 . 25514 1
589 . 1 1 56 56 PRO C C 13 178.252 0.000 . . . . . A 51 PRO C . 25514 1
590 . 1 1 56 56 PRO CA C 13 64.656 0.045 . . . . . A 51 PRO CA . 25514 1
591 . 1 1 56 56 PRO CB C 13 32.069 0.030 . . . . . A 51 PRO CB . 25514 1
592 . 1 1 56 56 PRO CG C 13 27.089 0.020 . . . . . A 51 PRO CG . 25514 1
593 . 1 1 56 56 PRO CD C 13 50.987 0.028 . . . . . A 51 PRO CD . 25514 1
594 . 1 1 57 57 GLU H H 1 8.047 0.005 . . . . . A 52 GLU H . 25514 1
595 . 1 1 57 57 GLU HA H 1 4.184 0.008 . . . . . A 52 GLU HA . 25514 1
596 . 1 1 57 57 GLU HB2 H 1 2.065 0.008 . . . . . A 52 GLU HB2 . 25514 1
597 . 1 1 57 57 GLU HB3 H 1 2.063 0.015 . . . . . A 52 GLU HB3 . 25514 1
598 . 1 1 57 57 GLU HG2 H 1 2.271 0.012 . . . . . A 52 GLU HG2 . 25514 1
599 . 1 1 57 57 GLU HG3 H 1 2.252 0.024 . . . . . A 52 GLU HG3 . 25514 1
600 . 1 1 57 57 GLU C C 13 178.703 0.003 . . . . . A 52 GLU C . 25514 1
601 . 1 1 57 57 GLU CA C 13 58.865 0.012 . . . . . A 52 GLU CA . 25514 1
602 . 1 1 57 57 GLU CB C 13 29.198 0.019 . . . . . A 52 GLU CB . 25514 1
603 . 1 1 57 57 GLU CG C 13 36.665 0.034 . . . . . A 52 GLU CG . 25514 1
604 . 1 1 57 57 GLU N N 15 118.533 0.006 . . . . . A 52 GLU N . 25514 1
605 . 1 1 58 58 ALA H H 1 7.611 0.004 . . . . . A 53 ALA H . 25514 1
606 . 1 1 58 58 ALA HA H 1 3.968 0.024 . . . . . A 53 ALA HA . 25514 1
607 . 1 1 58 58 ALA HB1 H 1 1.503 0.017 . . . . . A 53 ALA HB1 . 25514 1
608 . 1 1 58 58 ALA HB2 H 1 1.503 0.017 . . . . . A 53 ALA HB2 . 25514 1
609 . 1 1 58 58 ALA HB3 H 1 1.503 0.017 . . . . . A 53 ALA HB3 . 25514 1
610 . 1 1 58 58 ALA C C 13 178.536 0.006 . . . . . A 53 ALA C . 25514 1
611 . 1 1 58 58 ALA CA C 13 54.971 0.021 . . . . . A 53 ALA CA . 25514 1
612 . 1 1 58 58 ALA CB C 13 17.817 0.013 . . . . . A 53 ALA CB . 25514 1
613 . 1 1 58 58 ALA N N 15 122.127 0.006 . . . . . A 53 ALA N . 25514 1
614 . 1 1 59 59 ALA H H 1 7.687 0.041 . . . . . A 54 ALA H . 25514 1
615 . 1 1 59 59 ALA HA H 1 4.220 0.013 . . . . . A 54 ALA HA . 25514 1
616 . 1 1 59 59 ALA HB1 H 1 1.466 0.016 . . . . . A 54 ALA HB1 . 25514 1
617 . 1 1 59 59 ALA HB2 H 1 1.466 0.016 . . . . . A 54 ALA HB2 . 25514 1
618 . 1 1 59 59 ALA HB3 H 1 1.466 0.016 . . . . . A 54 ALA HB3 . 25514 1
619 . 1 1 59 59 ALA C C 13 180.836 0.003 . . . . . A 54 ALA C . 25514 1
620 . 1 1 59 59 ALA CA C 13 55.152 0.009 . . . . . A 54 ALA CA . 25514 1
621 . 1 1 59 59 ALA CB C 13 17.860 0.009 . . . . . A 54 ALA CB . 25514 1
622 . 1 1 59 59 ALA N N 15 119.528 0.019 . . . . . A 54 ALA N . 25514 1
623 . 1 1 60 60 ASP H H 1 7.984 0.014 . . . . . A 55 ASP H . 25514 1
624 . 1 1 60 60 ASP HA H 1 4.410 0.004 . . . . . A 55 ASP HA . 25514 1
625 . 1 1 60 60 ASP HB2 H 1 2.712 0.015 . . . . . A 55 ASP HB2 . 25514 1
626 . 1 1 60 60 ASP HB3 H 1 2.661 0.034 . . . . . A 55 ASP HB3 . 25514 1
627 . 1 1 60 60 ASP C C 13 178.919 0.003 . . . . . A 55 ASP C . 25514 1
628 . 1 1 60 60 ASP CA C 13 57.365 0.067 . . . . . A 55 ASP CA . 25514 1
629 . 1 1 60 60 ASP CB C 13 40.282 0.009 . . . . . A 55 ASP CB . 25514 1
630 . 1 1 60 60 ASP N N 15 120.085 0.009 . . . . . A 55 ASP N . 25514 1
631 . 1 1 61 61 LYS H H 1 7.774 0.024 . . . . . A 56 LYS H . 25514 1
632 . 1 1 61 61 LYS HA H 1 3.903 0.016 . . . . . A 56 LYS HA . 25514 1
633 . 1 1 61 61 LYS HB2 H 1 1.372 0.023 . . . . . A 56 LYS HB2 . 25514 1
634 . 1 1 61 61 LYS HB3 H 1 0.959 0.018 . . . . . A 56 LYS HB3 . 25514 1
635 . 1 1 61 61 LYS HG2 H 1 1.063 0.021 . . . . . A 56 LYS HG2 . 25514 1
636 . 1 1 61 61 LYS HG3 H 1 0.995 0.018 . . . . . A 56 LYS HG3 . 25514 1
637 . 1 1 61 61 LYS HD2 H 1 1.312 0.034 . . . . . A 56 LYS HD2 . 25514 1
638 . 1 1 61 61 LYS HD3 H 1 1.257 0.005 . . . . . A 56 LYS HD3 . 25514 1
639 . 1 1 61 61 LYS HE2 H 1 2.702 0.007 . . . . . A 56 LYS HE2 . 25514 1
640 . 1 1 61 61 LYS HE3 H 1 2.702 0.007 . . . . . A 56 LYS HE3 . 25514 1
641 . 1 1 61 61 LYS C C 13 178.810 0.006 . . . . . A 56 LYS C . 25514 1
642 . 1 1 61 61 LYS CA C 13 58.376 0.009 . . . . . A 56 LYS CA . 25514 1
643 . 1 1 61 61 LYS CB C 13 30.911 0.019 . . . . . A 56 LYS CB . 25514 1
644 . 1 1 61 61 LYS CG C 13 24.521 0.022 . . . . . A 56 LYS CG . 25514 1
645 . 1 1 61 61 LYS CD C 13 28.121 0.051 . . . . . A 56 LYS CD . 25514 1
646 . 1 1 61 61 LYS CE C 13 41.945 0.029 . . . . . A 56 LYS CE . 25514 1
647 . 1 1 61 61 LYS N N 15 120.921 0.006 . . . . . A 56 LYS N . 25514 1
648 . 1 1 62 62 PHE H H 1 8.834 0.003 . . . . . A 57 PHE H . 25514 1
649 . 1 1 62 62 PHE HA H 1 3.999 0.014 . . . . . A 57 PHE HA . 25514 1
650 . 1 1 62 62 PHE HB2 H 1 3.360 0.011 . . . . . A 57 PHE HB2 . 25514 1
651 . 1 1 62 62 PHE HB3 H 1 3.045 0.004 . . . . . A 57 PHE HB3 . 25514 1
652 . 1 1 62 62 PHE C C 13 177.531 0.005 . . . . . A 57 PHE C . 25514 1
653 . 1 1 62 62 PHE CA C 13 61.493 0.014 . . . . . A 57 PHE CA . 25514 1
654 . 1 1 62 62 PHE CB C 13 39.055 0.020 . . . . . A 57 PHE CB . 25514 1
655 . 1 1 62 62 PHE N N 15 120.024 0.007 . . . . . A 57 PHE N . 25514 1
656 . 1 1 63 63 LYS H H 1 7.857 0.019 . . . . . A 58 LYS H . 25514 1
657 . 1 1 63 63 LYS HA H 1 3.926 0.007 . . . . . A 58 LYS HA . 25514 1
658 . 1 1 63 63 LYS HB2 H 1 1.952 0.013 . . . . . A 58 LYS HB2 . 25514 1
659 . 1 1 63 63 LYS HB3 H 1 1.952 0.013 . . . . . A 58 LYS HB3 . 25514 1
660 . 1 1 63 63 LYS HG2 H 1 1.599 0.022 . . . . . A 58 LYS HG2 . 25514 1
661 . 1 1 63 63 LYS HG3 H 1 1.363 0.009 . . . . . A 58 LYS HG3 . 25514 1
662 . 1 1 63 63 LYS HD2 H 1 1.668 0.017 . . . . . A 58 LYS HD2 . 25514 1
663 . 1 1 63 63 LYS HD3 H 1 1.668 0.017 . . . . . A 58 LYS HD3 . 25514 1
664 . 1 1 63 63 LYS HE2 H 1 2.930 0.009 . . . . . A 58 LYS HE2 . 25514 1
665 . 1 1 63 63 LYS HE3 H 1 2.930 0.009 . . . . . A 58 LYS HE3 . 25514 1
666 . 1 1 63 63 LYS C C 13 179.141 0.006 . . . . . A 58 LYS C . 25514 1
667 . 1 1 63 63 LYS CA C 13 59.907 0.020 . . . . . A 58 LYS CA . 25514 1
668 . 1 1 63 63 LYS CB C 13 32.240 0.029 . . . . . A 58 LYS CB . 25514 1
669 . 1 1 63 63 LYS CG C 13 24.920 0.031 . . . . . A 58 LYS CG . 25514 1
670 . 1 1 63 63 LYS CD C 13 29.431 0.034 . . . . . A 58 LYS CD . 25514 1
671 . 1 1 63 63 LYS CE C 13 42.041 0.003 . . . . . A 58 LYS CE . 25514 1
672 . 1 1 63 63 LYS N N 15 119.344 0.015 . . . . . A 58 LYS N . 25514 1
673 . 1 1 64 64 GLU H H 1 7.724 0.008 . . . . . A 59 GLU H . 25514 1
674 . 1 1 64 64 GLU HA H 1 4.046 0.009 . . . . . A 59 GLU HA . 25514 1
675 . 1 1 64 64 GLU HB2 H 1 2.115 0.027 . . . . . A 59 GLU HB2 . 25514 1
676 . 1 1 64 64 GLU HB3 H 1 2.111 0.022 . . . . . A 59 GLU HB3 . 25514 1
677 . 1 1 64 64 GLU HG2 H 1 2.351 0.017 . . . . . A 59 GLU HG2 . 25514 1
678 . 1 1 64 64 GLU HG3 H 1 2.169 0.005 . . . . . A 59 GLU HG3 . 25514 1
679 . 1 1 64 64 GLU C C 13 180.089 0.001 . . . . . A 59 GLU C . 25514 1
680 . 1 1 64 64 GLU CA C 13 59.400 0.016 . . . . . A 59 GLU CA . 25514 1
681 . 1 1 64 64 GLU CB C 13 29.879 0.065 . . . . . A 59 GLU CB . 25514 1
682 . 1 1 64 64 GLU CG C 13 36.363 0.028 . . . . . A 59 GLU CG . 25514 1
683 . 1 1 64 64 GLU N N 15 119.706 0.015 . . . . . A 59 GLU N . 25514 1
684 . 1 1 65 65 ILE H H 1 8.378 0.003 . . . . . A 60 ILE H . 25514 1
685 . 1 1 65 65 ILE HA H 1 3.663 0.005 . . . . . A 60 ILE HA . 25514 1
686 . 1 1 65 65 ILE HB H 1 1.783 0.015 . . . . . A 60 ILE HB . 25514 1
687 . 1 1 65 65 ILE HG12 H 1 1.613 0.017 . . . . . A 60 ILE HG12 . 25514 1
688 . 1 1 65 65 ILE HG13 H 1 1.231 0.016 . . . . . A 60 ILE HG13 . 25514 1
689 . 1 1 65 65 ILE HG21 H 1 0.916 0.018 . . . . . A 60 ILE HG21 . 25514 1
690 . 1 1 65 65 ILE HG22 H 1 0.916 0.018 . . . . . A 60 ILE HG22 . 25514 1
691 . 1 1 65 65 ILE HG23 H 1 0.916 0.018 . . . . . A 60 ILE HG23 . 25514 1
692 . 1 1 65 65 ILE HD11 H 1 0.741 0.019 . . . . . A 60 ILE HD11 . 25514 1
693 . 1 1 65 65 ILE HD12 H 1 0.741 0.019 . . . . . A 60 ILE HD12 . 25514 1
694 . 1 1 65 65 ILE HD13 H 1 0.741 0.019 . . . . . A 60 ILE HD13 . 25514 1
695 . 1 1 65 65 ILE C C 13 177.556 0.005 . . . . . A 60 ILE C . 25514 1
696 . 1 1 65 65 ILE CA C 13 65.133 0.035 . . . . . A 60 ILE CA . 25514 1
697 . 1 1 65 65 ILE CB C 13 38.449 0.023 . . . . . A 60 ILE CB . 25514 1
698 . 1 1 65 65 ILE CG1 C 13 28.793 0.030 . . . . . A 60 ILE CG1 . 25514 1
699 . 1 1 65 65 ILE CG2 C 13 18.169 0.013 . . . . . A 60 ILE CG2 . 25514 1
700 . 1 1 65 65 ILE CD1 C 13 15.821 0.014 . . . . . A 60 ILE CD1 . 25514 1
701 . 1 1 65 65 ILE N N 15 119.339 0.009 . . . . . A 60 ILE N . 25514 1
702 . 1 1 66 66 ASN H H 1 8.050 0.003 . . . . . A 61 ASN H . 25514 1
703 . 1 1 66 66 ASN HA H 1 4.283 0.010 . . . . . A 61 ASN HA . 25514 1
704 . 1 1 66 66 ASN HB2 H 1 2.522 0.003 . . . . . A 61 ASN HB2 . 25514 1
705 . 1 1 66 66 ASN HB3 H 1 2.522 0.003 . . . . . A 61 ASN HB3 . 25514 1
706 . 1 1 66 66 ASN HD21 H 1 7.026 0.040 . . . . . A 61 ASN HD21 . 25514 1
707 . 1 1 66 66 ASN HD22 H 1 7.010 0.028 . . . . . A 61 ASN HD22 . 25514 1
708 . 1 1 66 66 ASN C C 13 177.775 0.004 . . . . . A 61 ASN C . 25514 1
709 . 1 1 66 66 ASN CA C 13 56.606 0.026 . . . . . A 61 ASN CA . 25514 1
710 . 1 1 66 66 ASN CB C 13 38.219 0.033 . . . . . A 61 ASN CB . 25514 1
711 . 1 1 66 66 ASN N N 15 119.914 0.014 . . . . . A 61 ASN N . 25514 1
712 . 1 1 66 66 ASN ND2 N 15 112.044 0.015 . . . . . A 61 ASN ND2 . 25514 1
713 . 1 1 67 67 ASN H H 1 8.041 0.013 . . . . . A 62 ASN H . 25514 1
714 . 1 1 67 67 ASN HA H 1 4.280 0.013 . . . . . A 62 ASN HA . 25514 1
715 . 1 1 67 67 ASN HB2 H 1 2.681 0.004 . . . . . A 62 ASN HB2 . 25514 1
716 . 1 1 67 67 ASN HB3 H 1 2.681 0.004 . . . . . A 62 ASN HB3 . 25514 1
717 . 1 1 67 67 ASN HD21 H 1 7.891 0.012 . . . . . A 62 ASN HD21 . 25514 1
718 . 1 1 67 67 ASN HD22 H 1 6.834 0.033 . . . . . A 62 ASN HD22 . 25514 1
719 . 1 1 67 67 ASN C C 13 175.797 0.011 . . . . . A 62 ASN C . 25514 1
720 . 1 1 67 67 ASN CA C 13 56.604 0.026 . . . . . A 62 ASN CA . 25514 1
721 . 1 1 67 67 ASN CB C 13 38.787 0.013 . . . . . A 62 ASN CB . 25514 1
722 . 1 1 67 67 ASN N N 15 119.459 0.031 . . . . . A 62 ASN N . 25514 1
723 . 1 1 67 67 ASN ND2 N 15 114.507 0.005 . . . . . A 62 ASN ND2 . 25514 1
724 . 1 1 68 68 ALA H H 1 7.879 0.004 . . . . . A 63 ALA H . 25514 1
725 . 1 1 68 68 ALA HA H 1 3.666 0.007 . . . . . A 63 ALA HA . 25514 1
726 . 1 1 68 68 ALA HB1 H 1 1.307 0.012 . . . . . A 63 ALA HB1 . 25514 1
727 . 1 1 68 68 ALA HB2 H 1 1.307 0.012 . . . . . A 63 ALA HB2 . 25514 1
728 . 1 1 68 68 ALA HB3 H 1 1.307 0.012 . . . . . A 63 ALA HB3 . 25514 1
729 . 1 1 68 68 ALA C C 13 178.412 0.001 . . . . . A 63 ALA C . 25514 1
730 . 1 1 68 68 ALA CA C 13 55.469 0.038 . . . . . A 63 ALA CA . 25514 1
731 . 1 1 68 68 ALA CB C 13 18.577 0.054 . . . . . A 63 ALA CB . 25514 1
732 . 1 1 68 68 ALA N N 15 119.724 0.010 . . . . . A 63 ALA N . 25514 1
733 . 1 1 69 69 HIS H H 1 8.006 0.009 . . . . . A 64 HIS H . 25514 1
734 . 1 1 69 69 HIS HA H 1 3.516 0.010 . . . . . A 64 HIS HA . 25514 1
735 . 1 1 69 69 HIS HB2 H 1 2.552 0.017 . . . . . A 64 HIS HB2 . 25514 1
736 . 1 1 69 69 HIS HB3 H 1 2.552 0.017 . . . . . A 64 HIS HB3 . 25514 1
737 . 1 1 69 69 HIS CA C 13 60.180 0.012 . . . . . A 64 HIS CA . 25514 1
738 . 1 1 69 69 HIS CB C 13 29.842 0.030 . . . . . A 64 HIS CB . 25514 1
739 . 1 1 69 69 HIS N N 15 114.572 0.010 . . . . . A 64 HIS N . 25514 1
740 . 1 1 70 70 ALA H H 1 7.955 0.022 . . . . . A 65 ALA H . 25514 1
741 . 1 1 70 70 ALA HA H 1 3.478 0.018 . . . . . A 65 ALA HA . 25514 1
742 . 1 1 70 70 ALA HB1 H 1 1.338 0.012 . . . . . A 65 ALA HB1 . 25514 1
743 . 1 1 70 70 ALA HB2 H 1 1.338 0.012 . . . . . A 65 ALA HB2 . 25514 1
744 . 1 1 70 70 ALA HB3 H 1 1.338 0.012 . . . . . A 65 ALA HB3 . 25514 1
745 . 1 1 70 70 ALA C C 13 179.614 0.002 . . . . . A 65 ALA C . 25514 1
746 . 1 1 70 70 ALA CA C 13 54.927 0.016 . . . . . A 65 ALA CA . 25514 1
747 . 1 1 70 70 ALA CB C 13 18.014 0.019 . . . . . A 65 ALA CB . 25514 1
748 . 1 1 70 70 ALA N N 15 122.304 0.012 . . . . . A 65 ALA N . 25514 1
749 . 1 1 71 71 ILE H H 1 7.409 0.013 . . . . . A 66 ILE H . 25514 1
750 . 1 1 71 71 ILE HA H 1 3.415 0.008 . . . . . A 66 ILE HA . 25514 1
751 . 1 1 71 71 ILE HB H 1 1.363 0.011 . . . . . A 66 ILE HB . 25514 1
752 . 1 1 71 71 ILE HG12 H 1 1.336 0.014 . . . . . A 66 ILE HG12 . 25514 1
753 . 1 1 71 71 ILE HG13 H 1 1.026 0.005 . . . . . A 66 ILE HG13 . 25514 1
754 . 1 1 71 71 ILE HG21 H 1 0.217 0.009 . . . . . A 66 ILE HG21 . 25514 1
755 . 1 1 71 71 ILE HG22 H 1 0.217 0.009 . . . . . A 66 ILE HG22 . 25514 1
756 . 1 1 71 71 ILE HG23 H 1 0.217 0.009 . . . . . A 66 ILE HG23 . 25514 1
757 . 1 1 71 71 ILE HD11 H 1 0.546 0.015 . . . . . A 66 ILE HD11 . 25514 1
758 . 1 1 71 71 ILE HD12 H 1 0.546 0.015 . . . . . A 66 ILE HD12 . 25514 1
759 . 1 1 71 71 ILE HD13 H 1 0.546 0.015 . . . . . A 66 ILE HD13 . 25514 1
760 . 1 1 71 71 ILE C C 13 176.810 0.001 . . . . . A 66 ILE C . 25514 1
761 . 1 1 71 71 ILE CA C 13 63.632 0.021 . . . . . A 66 ILE CA . 25514 1
762 . 1 1 71 71 ILE CB C 13 37.688 0.012 . . . . . A 66 ILE CB . 25514 1
763 . 1 1 71 71 ILE CG1 C 13 28.693 0.013 . . . . . A 66 ILE CG1 . 25514 1
764 . 1 1 71 71 ILE CG2 C 13 17.364 0.024 . . . . . A 66 ILE CG2 . 25514 1
765 . 1 1 71 71 ILE CD1 C 13 12.700 0.007 . . . . . A 66 ILE CD1 . 25514 1
766 . 1 1 71 71 ILE N N 15 116.608 0.010 . . . . . A 66 ILE N . 25514 1
767 . 1 1 72 72 LEU H H 1 7.642 0.013 . . . . . A 67 LEU H . 25514 1
768 . 1 1 72 72 LEU HA H 1 3.654 0.007 . . . . . A 67 LEU HA . 25514 1
769 . 1 1 72 72 LEU HB2 H 1 1.384 0.015 . . . . . A 67 LEU HB2 . 25514 1
770 . 1 1 72 72 LEU HB3 H 1 1.183 0.009 . . . . . A 67 LEU HB3 . 25514 1
771 . 1 1 72 72 LEU HG H 1 1.318 0.033 . . . . . A 67 LEU HG . 25514 1
772 . 1 1 72 72 LEU HD11 H 1 -0.099 0.013 . . . . . A 67 LEU HD11 . 25514 1
773 . 1 1 72 72 LEU HD12 H 1 -0.099 0.013 . . . . . A 67 LEU HD12 . 25514 1
774 . 1 1 72 72 LEU HD13 H 1 -0.099 0.013 . . . . . A 67 LEU HD13 . 25514 1
775 . 1 1 72 72 LEU HD21 H 1 0.184 0.007 . . . . . A 67 LEU HD21 . 25514 1
776 . 1 1 72 72 LEU HD22 H 1 0.184 0.007 . . . . . A 67 LEU HD22 . 25514 1
777 . 1 1 72 72 LEU HD23 H 1 0.184 0.007 . . . . . A 67 LEU HD23 . 25514 1
778 . 1 1 72 72 LEU C C 13 177.460 0.002 . . . . . A 67 LEU C . 25514 1
779 . 1 1 72 72 LEU CA C 13 56.522 0.047 . . . . . A 67 LEU CA . 25514 1
780 . 1 1 72 72 LEU CB C 13 41.923 0.024 . . . . . A 67 LEU CB . 25514 1
781 . 1 1 72 72 LEU CG C 13 25.859 0.013 . . . . . A 67 LEU CG . 25514 1
782 . 1 1 72 72 LEU CD1 C 13 24.539 0.021 . . . . . A 67 LEU CD1 . 25514 1
783 . 1 1 72 72 LEU CD2 C 13 21.775 0.014 . . . . . A 67 LEU CD2 . 25514 1
784 . 1 1 72 72 LEU N N 15 111.695 0.011 . . . . . A 67 LEU N . 25514 1
785 . 1 1 73 73 THR H H 1 6.992 0.009 . . . . . A 68 THR H . 25514 1
786 . 1 1 73 73 THR HA H 1 4.052 0.004 . . . . . A 68 THR HA . 25514 1
787 . 1 1 73 73 THR HB H 1 4.101 0.045 . . . . . A 68 THR HB . 25514 1
788 . 1 1 73 73 THR HG21 H 1 0.774 0.025 . . . . . A 68 THR HG21 . 25514 1
789 . 1 1 73 73 THR HG22 H 1 0.774 0.025 . . . . . A 68 THR HG22 . 25514 1
790 . 1 1 73 73 THR HG23 H 1 0.774 0.025 . . . . . A 68 THR HG23 . 25514 1
791 . 1 1 73 73 THR C C 13 173.087 0.001 . . . . . A 68 THR C . 25514 1
792 . 1 1 73 73 THR CA C 13 61.460 0.015 . . . . . A 68 THR CA . 25514 1
793 . 1 1 73 73 THR CB C 13 69.003 0.017 . . . . . A 68 THR CB . 25514 1
794 . 1 1 73 73 THR CG2 C 13 21.505 0.013 . . . . . A 68 THR CG2 . 25514 1
795 . 1 1 73 73 THR N N 15 103.350 0.006 . . . . . A 68 THR N . 25514 1
796 . 1 1 74 74 ASP H H 1 7.134 0.002 . . . . . A 69 ASP H . 25514 1
797 . 1 1 74 74 ASP HA H 1 4.691 0.012 . . . . . A 69 ASP HA . 25514 1
798 . 1 1 74 74 ASP HB2 H 1 3.030 0.008 . . . . . A 69 ASP HB2 . 25514 1
799 . 1 1 74 74 ASP HB3 H 1 2.419 0.003 . . . . . A 69 ASP HB3 . 25514 1
800 . 1 1 74 74 ASP C C 13 174.971 0.003 . . . . . A 69 ASP C . 25514 1
801 . 1 1 74 74 ASP CA C 13 52.764 0.022 . . . . . A 69 ASP CA . 25514 1
802 . 1 1 74 74 ASP CB C 13 42.661 0.019 . . . . . A 69 ASP CB . 25514 1
803 . 1 1 74 74 ASP N N 15 125.209 0.006 . . . . . A 69 ASP N . 25514 1
804 . 1 1 75 75 ALA H H 1 8.750 0.007 . . . . . A 70 ALA H . 25514 1
805 . 1 1 75 75 ALA HA H 1 3.890 0.014 . . . . . A 70 ALA HA . 25514 1
806 . 1 1 75 75 ALA HB1 H 1 1.385 0.005 . . . . . A 70 ALA HB1 . 25514 1
807 . 1 1 75 75 ALA HB2 H 1 1.385 0.005 . . . . . A 70 ALA HB2 . 25514 1
808 . 1 1 75 75 ALA HB3 H 1 1.385 0.005 . . . . . A 70 ALA HB3 . 25514 1
809 . 1 1 75 75 ALA C C 13 179.960 0.002 . . . . . A 70 ALA C . 25514 1
810 . 1 1 75 75 ALA CA C 13 55.809 0.026 . . . . . A 70 ALA CA . 25514 1
811 . 1 1 75 75 ALA CB C 13 18.483 0.067 . . . . . A 70 ALA CB . 25514 1
812 . 1 1 75 75 ALA N N 15 128.317 0.005 . . . . . A 70 ALA N . 25514 1
813 . 1 1 76 76 THR H H 1 7.955 0.023 . . . . . A 71 THR H . 25514 1
814 . 1 1 76 76 THR HA H 1 3.966 0.019 . . . . . A 71 THR HA . 25514 1
815 . 1 1 76 76 THR HB H 1 4.222 0.005 . . . . . A 71 THR HB . 25514 1
816 . 1 1 76 76 THR HG21 H 1 1.147 0.013 . . . . . A 71 THR HG21 . 25514 1
817 . 1 1 76 76 THR HG22 H 1 1.147 0.013 . . . . . A 71 THR HG22 . 25514 1
818 . 1 1 76 76 THR HG23 H 1 1.147 0.013 . . . . . A 71 THR HG23 . 25514 1
819 . 1 1 76 76 THR C C 13 177.142 0.004 . . . . . A 71 THR C . 25514 1
820 . 1 1 76 76 THR CA C 13 66.023 0.040 . . . . . A 71 THR CA . 25514 1
821 . 1 1 76 76 THR CB C 13 68.397 0.022 . . . . . A 71 THR CB . 25514 1
822 . 1 1 76 76 THR CG2 C 13 21.714 0.017 . . . . . A 71 THR CG2 . 25514 1
823 . 1 1 76 76 THR N N 15 113.220 0.011 . . . . . A 71 THR N . 25514 1
824 . 1 1 77 77 LYS H H 1 8.253 0.010 . . . . . A 72 LYS H . 25514 1
825 . 1 1 77 77 LYS HA H 1 3.855 0.019 . . . . . A 72 LYS HA . 25514 1
826 . 1 1 77 77 LYS HB2 H 1 2.150 0.015 . . . . . A 72 LYS HB2 . 25514 1
827 . 1 1 77 77 LYS HB3 H 1 1.603 0.017 . . . . . A 72 LYS HB3 . 25514 1
828 . 1 1 77 77 LYS HG2 H 1 1.506 0.019 . . . . . A 72 LYS HG2 . 25514 1
829 . 1 1 77 77 LYS HG3 H 1 1.178 0.010 . . . . . A 72 LYS HG3 . 25514 1
830 . 1 1 77 77 LYS HD2 H 1 1.511 0.024 . . . . . A 72 LYS HD2 . 25514 1
831 . 1 1 77 77 LYS HD3 H 1 1.510 0.019 . . . . . A 72 LYS HD3 . 25514 1
832 . 1 1 77 77 LYS HE2 H 1 2.852 0.014 . . . . . A 72 LYS HE2 . 25514 1
833 . 1 1 77 77 LYS HE3 H 1 2.852 0.014 . . . . . A 72 LYS HE3 . 25514 1
834 . 1 1 77 77 LYS C C 13 178.334 0.001 . . . . . A 72 LYS C . 25514 1
835 . 1 1 77 77 LYS CA C 13 59.919 0.015 . . . . . A 72 LYS CA . 25514 1
836 . 1 1 77 77 LYS CB C 13 32.946 0.044 . . . . . A 72 LYS CB . 25514 1
837 . 1 1 77 77 LYS CG C 13 26.483 0.035 . . . . . A 72 LYS CG . 25514 1
838 . 1 1 77 77 LYS CD C 13 29.718 0.015 . . . . . A 72 LYS CD . 25514 1
839 . 1 1 77 77 LYS CE C 13 42.109 0.000 . . . . . A 72 LYS CE . 25514 1
840 . 1 1 77 77 LYS N N 15 122.037 0.005 . . . . . A 72 LYS N . 25514 1
841 . 1 1 78 78 ARG H H 1 9.232 0.004 . . . . . A 73 ARG H . 25514 1
842 . 1 1 78 78 ARG HA H 1 3.639 0.014 . . . . . A 73 ARG HA . 25514 1
843 . 1 1 78 78 ARG HB2 H 1 1.614 0.021 . . . . . A 73 ARG HB2 . 25514 1
844 . 1 1 78 78 ARG HB3 H 1 1.612 0.018 . . . . . A 73 ARG HB3 . 25514 1
845 . 1 1 78 78 ARG HD2 H 1 3.412 0.002 . . . . . A 73 ARG HD2 . 25514 1
846 . 1 1 78 78 ARG HD3 H 1 3.028 0.016 . . . . . A 73 ARG HD3 . 25514 1
847 . 1 1 78 78 ARG C C 13 177.355 0.007 . . . . . A 73 ARG C . 25514 1
848 . 1 1 78 78 ARG CA C 13 60.655 0.014 . . . . . A 73 ARG CA . 25514 1
849 . 1 1 78 78 ARG CB C 13 28.808 0.026 . . . . . A 73 ARG CB . 25514 1
850 . 1 1 78 78 ARG CD C 13 43.633 0.027 . . . . . A 73 ARG CD . 25514 1
851 . 1 1 78 78 ARG N N 15 120.463 0.010 . . . . . A 73 ARG N . 25514 1
852 . 1 1 79 79 ASN H H 1 7.537 0.007 . . . . . A 74 ASN H . 25514 1
853 . 1 1 79 79 ASN HA H 1 4.420 0.003 . . . . . A 74 ASN HA . 25514 1
854 . 1 1 79 79 ASN HB2 H 1 2.894 0.017 . . . . . A 74 ASN HB2 . 25514 1
855 . 1 1 79 79 ASN HB3 H 1 2.810 0.034 . . . . . A 74 ASN HB3 . 25514 1
856 . 1 1 79 79 ASN HD21 H 1 7.726 0.014 . . . . . A 74 ASN HD21 . 25514 1
857 . 1 1 79 79 ASN HD22 H 1 6.866 0.006 . . . . . A 74 ASN HD22 . 25514 1
858 . 1 1 79 79 ASN C C 13 177.960 0.002 . . . . . A 74 ASN C . 25514 1
859 . 1 1 79 79 ASN CA C 13 56.604 0.067 . . . . . A 74 ASN CA . 25514 1
860 . 1 1 79 79 ASN CB C 13 38.661 0.053 . . . . . A 74 ASN CB . 25514 1
861 . 1 1 79 79 ASN N N 15 114.968 0.009 . . . . . A 74 ASN N . 25514 1
862 . 1 1 79 79 ASN ND2 N 15 112.817 0.009 . . . . . A 74 ASN ND2 . 25514 1
863 . 1 1 80 80 ILE H H 1 7.287 0.009 . . . . . A 75 ILE H . 25514 1
864 . 1 1 80 80 ILE HA H 1 3.660 0.011 . . . . . A 75 ILE HA . 25514 1
865 . 1 1 80 80 ILE HB H 1 1.896 0.018 . . . . . A 75 ILE HB . 25514 1
866 . 1 1 80 80 ILE HG12 H 1 1.097 0.004 . . . . . A 75 ILE HG12 . 25514 1
867 . 1 1 80 80 ILE HG13 H 1 1.106 0.026 . . . . . A 75 ILE HG13 . 25514 1
868 . 1 1 80 80 ILE HG21 H 1 0.844 0.017 . . . . . A 75 ILE HG21 . 25514 1
869 . 1 1 80 80 ILE HG22 H 1 0.844 0.017 . . . . . A 75 ILE HG22 . 25514 1
870 . 1 1 80 80 ILE HG23 H 1 0.844 0.017 . . . . . A 75 ILE HG23 . 25514 1
871 . 1 1 80 80 ILE HD11 H 1 0.822 0.022 . . . . . A 75 ILE HD11 . 25514 1
872 . 1 1 80 80 ILE HD12 H 1 0.822 0.022 . . . . . A 75 ILE HD12 . 25514 1
873 . 1 1 80 80 ILE HD13 H 1 0.822 0.022 . . . . . A 75 ILE HD13 . 25514 1
874 . 1 1 80 80 ILE C C 13 177.160 0.015 . . . . . A 75 ILE C . 25514 1
875 . 1 1 80 80 ILE CA C 13 65.134 0.046 . . . . . A 75 ILE CA . 25514 1
876 . 1 1 80 80 ILE CB C 13 38.671 0.047 . . . . . A 75 ILE CB . 25514 1
877 . 1 1 80 80 ILE CG1 C 13 28.840 0.020 . . . . . A 75 ILE CG1 . 25514 1
878 . 1 1 80 80 ILE CG2 C 13 17.241 0.012 . . . . . A 75 ILE CG2 . 25514 1
879 . 1 1 80 80 ILE CD1 C 13 13.618 0.015 . . . . . A 75 ILE CD1 . 25514 1
880 . 1 1 80 80 ILE N N 15 118.531 0.010 . . . . . A 75 ILE N . 25514 1
881 . 1 1 81 81 TYR H H 1 8.933 0.004 . . . . . A 76 TYR H . 25514 1
882 . 1 1 81 81 TYR HA H 1 3.885 0.017 . . . . . A 76 TYR HA . 25514 1
883 . 1 1 81 81 TYR HB2 H 1 2.851 0.008 . . . . . A 76 TYR HB2 . 25514 1
884 . 1 1 81 81 TYR HB3 H 1 2.851 0.008 . . . . . A 76 TYR HB3 . 25514 1
885 . 1 1 81 81 TYR C C 13 177.613 0.009 . . . . . A 76 TYR C . 25514 1
886 . 1 1 81 81 TYR CA C 13 61.717 0.046 . . . . . A 76 TYR CA . 25514 1
887 . 1 1 81 81 TYR CB C 13 39.310 0.008 . . . . . A 76 TYR CB . 25514 1
888 . 1 1 81 81 TYR N N 15 122.674 0.016 . . . . . A 76 TYR N . 25514 1
889 . 1 1 82 82 ASP H H 1 9.003 0.022 . . . . . A 77 ASP H . 25514 1
890 . 1 1 82 82 ASP HA H 1 4.420 0.003 . . . . . A 77 ASP HA . 25514 1
891 . 1 1 82 82 ASP HB2 H 1 2.593 0.035 . . . . . A 77 ASP HB2 . 25514 1
892 . 1 1 82 82 ASP HB3 H 1 2.593 0.035 . . . . . A 77 ASP HB3 . 25514 1
893 . 1 1 82 82 ASP C C 13 177.863 0.000 . . . . . A 77 ASP C . 25514 1
894 . 1 1 82 82 ASP CA C 13 56.621 0.062 . . . . . A 77 ASP CA . 25514 1
895 . 1 1 82 82 ASP CB C 13 39.726 0.009 . . . . . A 77 ASP CB . 25514 1
896 . 1 1 82 82 ASP N N 15 116.921 0.009 . . . . . A 77 ASP N . 25514 1
897 . 1 1 83 83 LYS H H 1 7.036 0.019 . . . . . A 78 LYS H . 25514 1
898 . 1 1 83 83 LYS HA H 1 3.933 0.018 . . . . . A 78 LYS HA . 25514 1
899 . 1 1 83 83 LYS HB2 H 1 1.205 0.009 . . . . . A 78 LYS HB2 . 25514 1
900 . 1 1 83 83 LYS HB3 H 1 0.759 0.017 . . . . . A 78 LYS HB3 . 25514 1
901 . 1 1 83 83 LYS HG2 H 1 0.919 0.018 . . . . . A 78 LYS HG2 . 25514 1
902 . 1 1 83 83 LYS HG3 H 1 0.544 0.009 . . . . . A 78 LYS HG3 . 25514 1
903 . 1 1 83 83 LYS HD2 H 1 1.332 0.016 . . . . . A 78 LYS HD2 . 25514 1
904 . 1 1 83 83 LYS HD3 H 1 1.332 0.016 . . . . . A 78 LYS HD3 . 25514 1
905 . 1 1 83 83 LYS HE2 H 1 2.737 0.019 . . . . . A 78 LYS HE2 . 25514 1
906 . 1 1 83 83 LYS HE3 H 1 2.737 0.019 . . . . . A 78 LYS HE3 . 25514 1
907 . 1 1 83 83 LYS C C 13 177.446 0.002 . . . . . A 78 LYS C . 25514 1
908 . 1 1 83 83 LYS CA C 13 58.137 0.013 . . . . . A 78 LYS CA . 25514 1
909 . 1 1 83 83 LYS CB C 13 33.982 0.024 . . . . . A 78 LYS CB . 25514 1
910 . 1 1 83 83 LYS CG C 13 24.830 0.014 . . . . . A 78 LYS CG . 25514 1
911 . 1 1 83 83 LYS CD C 13 29.066 0.054 . . . . . A 78 LYS CD . 25514 1
912 . 1 1 83 83 LYS CE C 13 41.949 0.016 . . . . . A 78 LYS CE . 25514 1
913 . 1 1 83 83 LYS N N 15 117.429 0.006 . . . . . A 78 LYS N . 25514 1
914 . 1 1 84 84 TYR H H 1 8.381 0.006 . . . . . A 79 TYR H . 25514 1
915 . 1 1 84 84 TYR HA H 1 4.659 0.029 . . . . . A 79 TYR HA . 25514 1
916 . 1 1 84 84 TYR HB2 H 1 2.852 0.003 . . . . . A 79 TYR HB2 . 25514 1
917 . 1 1 84 84 TYR HB3 H 1 2.852 0.003 . . . . . A 79 TYR HB3 . 25514 1
918 . 1 1 84 84 TYR C C 13 175.863 0.001 . . . . . A 79 TYR C . 25514 1
919 . 1 1 84 84 TYR CA C 13 56.617 0.022 . . . . . A 79 TYR CA . 25514 1
920 . 1 1 84 84 TYR CB C 13 42.109 0.000 . . . . . A 79 TYR CB . 25514 1
921 . 1 1 84 84 TYR N N 15 115.750 0.006 . . . . . A 79 TYR N . 25514 1
922 . 1 1 85 85 GLY H H 1 8.256 0.013 . . . . . A 80 GLY H . 25514 1
923 . 1 1 85 85 GLY HA2 H 1 3.758 0.004 . . . . . A 80 GLY HA2 . 25514 1
924 . 1 1 85 85 GLY HA3 H 1 3.097 0.010 . . . . . A 80 GLY HA3 . 25514 1
925 . 1 1 85 85 GLY C C 13 174.776 0.003 . . . . . A 80 GLY C . 25514 1
926 . 1 1 85 85 GLY CA C 13 45.309 0.035 . . . . . A 80 GLY CA . 25514 1
927 . 1 1 85 85 GLY N N 15 110.036 0.009 . . . . . A 80 GLY N . 25514 1
928 . 1 1 86 86 SER H H 1 9.624 0.004 . . . . . A 81 SER H . 25514 1
929 . 1 1 86 86 SER HA H 1 4.238 0.003 . . . . . A 81 SER HA . 25514 1
930 . 1 1 86 86 SER HB2 H 1 4.522 0.009 . . . . . A 81 SER HB2 . 25514 1
931 . 1 1 86 86 SER HB3 H 1 3.794 0.014 . . . . . A 81 SER HB3 . 25514 1
932 . 1 1 86 86 SER C C 13 178.239 0.000 . . . . . A 81 SER C . 25514 1
933 . 1 1 86 86 SER CA C 13 65.413 0.017 . . . . . A 81 SER CA . 25514 1
934 . 1 1 86 86 SER CB C 13 63.134 0.042 . . . . . A 81 SER CB . 25514 1
935 . 1 1 86 86 SER N N 15 123.218 0.009 . . . . . A 81 SER N . 25514 1
936 . 1 1 87 87 LEU H H 1 9.236 0.003 . . . . . A 82 LEU H . 25514 1
937 . 1 1 87 87 LEU HA H 1 4.237 0.003 . . . . . A 82 LEU HA . 25514 1
938 . 1 1 87 87 LEU HB2 H 1 1.903 0.022 . . . . . A 82 LEU HB2 . 25514 1
939 . 1 1 87 87 LEU HB3 H 1 1.418 0.016 . . . . . A 82 LEU HB3 . 25514 1
940 . 1 1 87 87 LEU HG H 1 1.698 0.011 . . . . . A 82 LEU HG . 25514 1
941 . 1 1 87 87 LEU HD11 H 1 1.001 0.011 . . . . . A 82 LEU HD11 . 25514 1
942 . 1 1 87 87 LEU HD12 H 1 1.001 0.011 . . . . . A 82 LEU HD12 . 25514 1
943 . 1 1 87 87 LEU HD13 H 1 1.001 0.011 . . . . . A 82 LEU HD13 . 25514 1
944 . 1 1 87 87 LEU HD21 H 1 1.038 0.016 . . . . . A 82 LEU HD21 . 25514 1
945 . 1 1 87 87 LEU HD22 H 1 1.038 0.016 . . . . . A 82 LEU HD22 . 25514 1
946 . 1 1 87 87 LEU HD23 H 1 1.038 0.016 . . . . . A 82 LEU HD23 . 25514 1
947 . 1 1 87 87 LEU C C 13 178.015 0.007 . . . . . A 82 LEU C . 25514 1
948 . 1 1 87 87 LEU CA C 13 58.128 0.029 . . . . . A 82 LEU CA . 25514 1
949 . 1 1 87 87 LEU CB C 13 41.623 0.028 . . . . . A 82 LEU CB . 25514 1
950 . 1 1 87 87 LEU CG C 13 27.723 0.025 . . . . . A 82 LEU CG . 25514 1
951 . 1 1 87 87 LEU CD1 C 13 23.279 0.039 . . . . . A 82 LEU CD1 . 25514 1
952 . 1 1 87 87 LEU CD2 C 13 26.117 0.018 . . . . . A 82 LEU CD2 . 25514 1
953 . 1 1 87 87 LEU N N 15 123.646 0.014 . . . . . A 82 LEU N . 25514 1
954 . 1 1 88 88 GLY H H 1 7.515 0.005 . . . . . A 83 GLY H . 25514 1
955 . 1 1 88 88 GLY HA2 H 1 3.635 0.024 . . . . . A 83 GLY HA2 . 25514 1
956 . 1 1 88 88 GLY HA3 H 1 3.550 0.022 . . . . . A 83 GLY HA3 . 25514 1
957 . 1 1 88 88 GLY C C 13 174.858 0.000 . . . . . A 83 GLY C . 25514 1
958 . 1 1 88 88 GLY CA C 13 47.774 0.038 . . . . . A 83 GLY CA . 25514 1
959 . 1 1 88 88 GLY N N 15 105.974 0.011 . . . . . A 83 GLY N . 25514 1
960 . 1 1 89 89 LEU H H 1 7.778 0.010 . . . . . A 84 LEU H . 25514 1
961 . 1 1 89 89 LEU HA H 1 4.069 0.012 . . . . . A 84 LEU HA . 25514 1
962 . 1 1 89 89 LEU HB2 H 1 2.033 0.007 . . . . . A 84 LEU HB2 . 25514 1
963 . 1 1 89 89 LEU HB3 H 1 1.623 0.027 . . . . . A 84 LEU HB3 . 25514 1
964 . 1 1 89 89 LEU HD11 H 1 0.903 0.025 . . . . . A 84 LEU HD11 . 25514 1
965 . 1 1 89 89 LEU HD12 H 1 0.903 0.025 . . . . . A 84 LEU HD12 . 25514 1
966 . 1 1 89 89 LEU HD13 H 1 0.903 0.025 . . . . . A 84 LEU HD13 . 25514 1
967 . 1 1 89 89 LEU HD21 H 1 0.902 0.034 . . . . . A 84 LEU HD21 . 25514 1
968 . 1 1 89 89 LEU HD22 H 1 0.902 0.034 . . . . . A 84 LEU HD22 . 25514 1
969 . 1 1 89 89 LEU HD23 H 1 0.902 0.034 . . . . . A 84 LEU HD23 . 25514 1
970 . 1 1 89 89 LEU C C 13 179.079 0.010 . . . . . A 84 LEU C . 25514 1
971 . 1 1 89 89 LEU CA C 13 57.585 0.015 . . . . . A 84 LEU CA . 25514 1
972 . 1 1 89 89 LEU CB C 13 41.471 0.027 . . . . . A 84 LEU CB . 25514 1
973 . 1 1 89 89 LEU CD1 C 13 27.129 0.016 . . . . . A 84 LEU CD1 . 25514 1
974 . 1 1 89 89 LEU CD2 C 13 22.596 0.086 . . . . . A 84 LEU CD2 . 25514 1
975 . 1 1 89 89 LEU N N 15 119.433 0.013 . . . . . A 84 LEU N . 25514 1
976 . 1 1 90 90 TYR H H 1 7.896 0.012 . . . . . A 85 TYR H . 25514 1
977 . 1 1 90 90 TYR HA H 1 4.232 0.003 . . . . . A 85 TYR HA . 25514 1
978 . 1 1 90 90 TYR HB2 H 1 3.219 0.008 . . . . . A 85 TYR HB2 . 25514 1
979 . 1 1 90 90 TYR HB3 H 1 3.100 0.002 . . . . . A 85 TYR HB3 . 25514 1
980 . 1 1 90 90 TYR HD1 H 1 7.026 0.031 . . . . . A 85 TYR HD1 . 25514 1
981 . 1 1 90 90 TYR HD2 H 1 7.026 0.031 . . . . . A 85 TYR HD2 . 25514 1
982 . 1 1 90 90 TYR HE1 H 1 6.652 0.014 . . . . . A 85 TYR HE1 . 25514 1
983 . 1 1 90 90 TYR HE2 H 1 6.652 0.014 . . . . . A 85 TYR HE2 . 25514 1
984 . 1 1 90 90 TYR C C 13 177.459 0.005 . . . . . A 85 TYR C . 25514 1
985 . 1 1 90 90 TYR CA C 13 61.132 0.018 . . . . . A 85 TYR CA . 25514 1
986 . 1 1 90 90 TYR CB C 13 38.557 0.026 . . . . . A 85 TYR CB . 25514 1
987 . 1 1 90 90 TYR CD1 C 13 133.171 0.027 . . . . . A 85 TYR CD1 . 25514 1
988 . 1 1 90 90 TYR CD2 C 13 133.171 0.027 . . . . . A 85 TYR CD2 . 25514 1
989 . 1 1 90 90 TYR CE1 C 13 117.874 0.032 . . . . . A 85 TYR CE1 . 25514 1
990 . 1 1 90 90 TYR CE2 C 13 117.874 0.032 . . . . . A 85 TYR CE2 . 25514 1
991 . 1 1 90 90 TYR N N 15 121.542 0.006 . . . . . A 85 TYR N . 25514 1
992 . 1 1 91 91 VAL H H 1 8.490 0.004 . . . . . A 86 VAL H . 25514 1
993 . 1 1 91 91 VAL HA H 1 3.227 0.004 . . . . . A 86 VAL HA . 25514 1
994 . 1 1 91 91 VAL HB H 1 2.036 0.018 . . . . . A 86 VAL HB . 25514 1
995 . 1 1 91 91 VAL HG11 H 1 0.695 0.018 . . . . . A 86 VAL HG11 . 25514 1
996 . 1 1 91 91 VAL HG12 H 1 0.695 0.018 . . . . . A 86 VAL HG12 . 25514 1
997 . 1 1 91 91 VAL HG13 H 1 0.695 0.018 . . . . . A 86 VAL HG13 . 25514 1
998 . 1 1 91 91 VAL HG21 H 1 0.614 0.016 . . . . . A 86 VAL HG21 . 25514 1
999 . 1 1 91 91 VAL HG22 H 1 0.614 0.016 . . . . . A 86 VAL HG22 . 25514 1
1000 . 1 1 91 91 VAL HG23 H 1 0.614 0.016 . . . . . A 86 VAL HG23 . 25514 1
1001 . 1 1 91 91 VAL C C 13 178.004 0.014 . . . . . A 86 VAL C . 25514 1
1002 . 1 1 91 91 VAL CA C 13 66.465 0.021 . . . . . A 86 VAL CA . 25514 1
1003 . 1 1 91 91 VAL CB C 13 31.405 0.039 . . . . . A 86 VAL CB . 25514 1
1004 . 1 1 91 91 VAL CG1 C 13 22.376 0.015 . . . . . A 86 VAL CG1 . 25514 1
1005 . 1 1 91 91 VAL CG2 C 13 21.943 0.017 . . . . . A 86 VAL CG2 . 25514 1
1006 . 1 1 91 91 VAL N N 15 120.172 0.017 . . . . . A 86 VAL N . 25514 1
1007 . 1 1 92 92 ALA H H 1 8.338 0.014 . . . . . A 87 ALA H . 25514 1
1008 . 1 1 92 92 ALA HA H 1 3.691 0.016 . . . . . A 87 ALA HA . 25514 1
1009 . 1 1 92 92 ALA HB1 H 1 1.381 0.005 . . . . . A 87 ALA HB1 . 25514 1
1010 . 1 1 92 92 ALA HB2 H 1 1.381 0.005 . . . . . A 87 ALA HB2 . 25514 1
1011 . 1 1 92 92 ALA HB3 H 1 1.381 0.005 . . . . . A 87 ALA HB3 . 25514 1
1012 . 1 1 92 92 ALA C C 13 179.885 0.004 . . . . . A 87 ALA C . 25514 1
1013 . 1 1 92 92 ALA CA C 13 54.528 0.012 . . . . . A 87 ALA CA . 25514 1
1014 . 1 1 92 92 ALA CB C 13 18.190 0.043 . . . . . A 87 ALA CB . 25514 1
1015 . 1 1 92 92 ALA N N 15 121.524 0.009 . . . . . A 87 ALA N . 25514 1
1016 . 1 1 93 93 GLU H H 1 7.794 0.018 . . . . . A 88 GLU H . 25514 1
1017 . 1 1 93 93 GLU HA H 1 3.859 0.019 . . . . . A 88 GLU HA . 25514 1
1018 . 1 1 93 93 GLU HB2 H 1 2.026 0.026 . . . . . A 88 GLU HB2 . 25514 1
1019 . 1 1 93 93 GLU HB3 H 1 1.894 0.038 . . . . . A 88 GLU HB3 . 25514 1
1020 . 1 1 93 93 GLU HG2 H 1 2.250 0.014 . . . . . A 88 GLU HG2 . 25514 1
1021 . 1 1 93 93 GLU HG3 H 1 2.060 0.016 . . . . . A 88 GLU HG3 . 25514 1
1022 . 1 1 93 93 GLU C C 13 178.059 0.001 . . . . . A 88 GLU C . 25514 1
1023 . 1 1 93 93 GLU CA C 13 58.750 0.016 . . . . . A 88 GLU CA . 25514 1
1024 . 1 1 93 93 GLU CB C 13 29.509 0.015 . . . . . A 88 GLU CB . 25514 1
1025 . 1 1 93 93 GLU CG C 13 36.098 0.020 . . . . . A 88 GLU CG . 25514 1
1026 . 1 1 93 93 GLU N N 15 117.850 0.005 . . . . . A 88 GLU N . 25514 1
1027 . 1 1 94 94 GLN H H 1 7.708 0.028 . . . . . A 89 GLN H . 25514 1
1028 . 1 1 94 94 GLN HA H 1 3.661 0.004 . . . . . A 89 GLN HA . 25514 1
1029 . 1 1 94 94 GLN HB2 H 1 1.016 0.015 . . . . . A 89 GLN HB2 . 25514 1
1030 . 1 1 94 94 GLN HB3 H 1 1.022 0.013 . . . . . A 89 GLN HB3 . 25514 1
1031 . 1 1 94 94 GLN HG2 H 1 1.511 0.013 . . . . . A 89 GLN HG2 . 25514 1
1032 . 1 1 94 94 GLN HG3 H 1 1.361 0.012 . . . . . A 89 GLN HG3 . 25514 1
1033 . 1 1 94 94 GLN HE21 H 1 6.530 0.048 . . . . . A 89 GLN HE21 . 25514 1
1034 . 1 1 94 94 GLN HE22 H 1 6.501 0.038 . . . . . A 89 GLN HE22 . 25514 1
1035 . 1 1 94 94 GLN C C 13 177.587 0.004 . . . . . A 89 GLN C . 25514 1
1036 . 1 1 94 94 GLN CA C 13 57.104 0.045 . . . . . A 89 GLN CA . 25514 1
1037 . 1 1 94 94 GLN CB C 13 28.684 0.010 . . . . . A 89 GLN CB . 25514 1
1038 . 1 1 94 94 GLN CG C 13 32.910 0.026 . . . . . A 89 GLN CG . 25514 1
1039 . 1 1 94 94 GLN N N 15 116.020 0.009 . . . . . A 89 GLN N . 25514 1
1040 . 1 1 94 94 GLN NE2 N 15 112.515 0.003 . . . . . A 89 GLN NE2 . 25514 1
1041 . 1 1 95 95 PHE H H 1 8.227 0.004 . . . . . A 90 PHE H . 25514 1
1042 . 1 1 95 95 PHE HA H 1 4.703 0.011 . . . . . A 90 PHE HA . 25514 1
1043 . 1 1 95 95 PHE HB2 H 1 3.263 0.009 . . . . . A 90 PHE HB2 . 25514 1
1044 . 1 1 95 95 PHE HB3 H 1 2.584 0.020 . . . . . A 90 PHE HB3 . 25514 1
1045 . 1 1 95 95 PHE C C 13 176.259 0.004 . . . . . A 90 PHE C . 25514 1
1046 . 1 1 95 95 PHE CA C 13 57.368 0.011 . . . . . A 90 PHE CA . 25514 1
1047 . 1 1 95 95 PHE CB C 13 40.165 0.025 . . . . . A 90 PHE CB . 25514 1
1048 . 1 1 95 95 PHE N N 15 114.406 0.009 . . . . . A 90 PHE N . 25514 1
1049 . 1 1 96 96 GLY H H 1 7.630 0.015 . . . . . A 91 GLY H . 25514 1
1050 . 1 1 96 96 GLY HA2 H 1 4.444 0.006 . . . . . A 91 GLY HA2 . 25514 1
1051 . 1 1 96 96 GLY HA3 H 1 3.761 0.023 . . . . . A 91 GLY HA3 . 25514 1
1052 . 1 1 96 96 GLY C C 13 175.285 0.005 . . . . . A 91 GLY C . 25514 1
1053 . 1 1 96 96 GLY CA C 13 45.021 0.034 . . . . . A 91 GLY CA . 25514 1
1054 . 1 1 96 96 GLY N N 15 111.190 0.008 . . . . . A 91 GLY N . 25514 1
1055 . 1 1 97 97 GLU H H 1 8.799 0.003 . . . . . A 92 GLU H . 25514 1
1056 . 1 1 97 97 GLU HA H 1 3.807 0.008 . . . . . A 92 GLU HA . 25514 1
1057 . 1 1 97 97 GLU HB2 H 1 1.962 0.038 . . . . . A 92 GLU HB2 . 25514 1
1058 . 1 1 97 97 GLU HB3 H 1 1.948 0.035 . . . . . A 92 GLU HB3 . 25514 1
1059 . 1 1 97 97 GLU HG2 H 1 2.193 0.015 . . . . . A 92 GLU HG2 . 25514 1
1060 . 1 1 97 97 GLU HG3 H 1 2.193 0.015 . . . . . A 92 GLU HG3 . 25514 1
1061 . 1 1 97 97 GLU C C 13 177.916 0.001 . . . . . A 92 GLU C . 25514 1
1062 . 1 1 97 97 GLU CA C 13 59.398 0.026 . . . . . A 92 GLU CA . 25514 1
1063 . 1 1 97 97 GLU CB C 13 29.534 0.022 . . . . . A 92 GLU CB . 25514 1
1064 . 1 1 97 97 GLU CG C 13 36.376 0.013 . . . . . A 92 GLU CG . 25514 1
1065 . 1 1 97 97 GLU N N 15 123.544 0.010 . . . . . A 92 GLU N . 25514 1
1066 . 1 1 98 98 GLU H H 1 9.413 0.005 . . . . . A 93 GLU H . 25514 1
1067 . 1 1 98 98 GLU HA H 1 4.185 0.006 . . . . . A 93 GLU HA . 25514 1
1068 . 1 1 98 98 GLU HB2 H 1 1.995 0.021 . . . . . A 93 GLU HB2 . 25514 1
1069 . 1 1 98 98 GLU HB3 H 1 1.962 0.016 . . . . . A 93 GLU HB3 . 25514 1
1070 . 1 1 98 98 GLU HG2 H 1 2.230 0.045 . . . . . A 93 GLU HG2 . 25514 1
1071 . 1 1 98 98 GLU HG3 H 1 2.186 0.003 . . . . . A 93 GLU HG3 . 25514 1
1072 . 1 1 98 98 GLU C C 13 176.779 0.012 . . . . . A 93 GLU C . 25514 1
1073 . 1 1 98 98 GLU CA C 13 57.821 0.015 . . . . . A 93 GLU CA . 25514 1
1074 . 1 1 98 98 GLU CB C 13 28.796 0.033 . . . . . A 93 GLU CB . 25514 1
1075 . 1 1 98 98 GLU CG C 13 35.846 0.034 . . . . . A 93 GLU CG . 25514 1
1076 . 1 1 98 98 GLU N N 15 118.412 0.011 . . . . . A 93 GLU N . 25514 1
1077 . 1 1 99 99 ASN H H 1 7.826 0.005 . . . . . A 94 ASN H . 25514 1
1078 . 1 1 99 99 ASN HA H 1 4.915 0.003 . . . . . A 94 ASN HA . 25514 1
1079 . 1 1 99 99 ASN HB2 H 1 2.834 0.012 . . . . . A 94 ASN HB2 . 25514 1
1080 . 1 1 99 99 ASN HB3 H 1 2.478 0.015 . . . . . A 94 ASN HB3 . 25514 1
1081 . 1 1 99 99 ASN HD21 H 1 7.809 0.008 . . . . . A 94 ASN HD21 . 25514 1
1082 . 1 1 99 99 ASN HD22 H 1 7.023 0.024 . . . . . A 94 ASN HD22 . 25514 1
1083 . 1 1 99 99 ASN C C 13 175.691 0.006 . . . . . A 94 ASN C . 25514 1
1084 . 1 1 99 99 ASN CA C 13 53.301 0.022 . . . . . A 94 ASN CA . 25514 1
1085 . 1 1 99 99 ASN CB C 13 39.786 0.025 . . . . . A 94 ASN CB . 25514 1
1086 . 1 1 99 99 ASN N N 15 116.594 0.009 . . . . . A 94 ASN N . 25514 1
1087 . 1 1 99 99 ASN ND2 N 15 115.099 0.006 . . . . . A 94 ASN ND2 . 25514 1
1088 . 1 1 100 100 VAL H H 1 7.375 0.008 . . . . . A 95 VAL H . 25514 1
1089 . 1 1 100 100 VAL HA H 1 3.681 0.004 . . . . . A 95 VAL HA . 25514 1
1090 . 1 1 100 100 VAL HB H 1 1.997 0.019 . . . . . A 95 VAL HB . 25514 1
1091 . 1 1 100 100 VAL HG11 H 1 0.992 0.006 . . . . . A 95 VAL HG11 . 25514 1
1092 . 1 1 100 100 VAL HG12 H 1 0.992 0.006 . . . . . A 95 VAL HG12 . 25514 1
1093 . 1 1 100 100 VAL HG13 H 1 0.992 0.006 . . . . . A 95 VAL HG13 . 25514 1
1094 . 1 1 100 100 VAL HG21 H 1 0.820 0.011 . . . . . A 95 VAL HG21 . 25514 1
1095 . 1 1 100 100 VAL HG22 H 1 0.820 0.011 . . . . . A 95 VAL HG22 . 25514 1
1096 . 1 1 100 100 VAL HG23 H 1 0.820 0.011 . . . . . A 95 VAL HG23 . 25514 1
1097 . 1 1 100 100 VAL C C 13 176.290 0.002 . . . . . A 95 VAL C . 25514 1
1098 . 1 1 100 100 VAL CA C 13 65.581 0.000 . . . . . A 95 VAL CA . 25514 1
1099 . 1 1 100 100 VAL CB C 13 32.012 0.035 . . . . . A 95 VAL CB . 25514 1
1100 . 1 1 100 100 VAL CG1 C 13 22.505 0.015 . . . . . A 95 VAL CG1 . 25514 1
1101 . 1 1 100 100 VAL CG2 C 13 21.642 0.028 . . . . . A 95 VAL CG2 . 25514 1
1102 . 1 1 100 100 VAL N N 15 120.021 0.008 . . . . . A 95 VAL N . 25514 1
1103 . 1 1 101 101 ASN H H 1 8.336 0.004 . . . . . A 96 ASN H . 25514 1
1104 . 1 1 101 101 ASN HA H 1 4.437 0.012 . . . . . A 96 ASN HA . 25514 1
1105 . 1 1 101 101 ASN HB2 H 1 2.798 0.017 . . . . . A 96 ASN HB2 . 25514 1
1106 . 1 1 101 101 ASN HB3 H 1 2.796 0.015 . . . . . A 96 ASN HB3 . 25514 1
1107 . 1 1 101 101 ASN HD21 H 1 7.620 0.024 . . . . . A 96 ASN HD21 . 25514 1
1108 . 1 1 101 101 ASN HD22 H 1 6.925 0.045 . . . . . A 96 ASN HD22 . 25514 1
1109 . 1 1 101 101 ASN C C 13 176.755 0.007 . . . . . A 96 ASN C . 25514 1
1110 . 1 1 101 101 ASN CA C 13 55.782 0.044 . . . . . A 96 ASN CA . 25514 1
1111 . 1 1 101 101 ASN CB C 13 38.094 0.053 . . . . . A 96 ASN CB . 25514 1
1112 . 1 1 101 101 ASN N N 15 116.386 0.012 . . . . . A 96 ASN N . 25514 1
1113 . 1 1 101 101 ASN ND2 N 15 113.548 0.011 . . . . . A 96 ASN ND2 . 25514 1
1114 . 1 1 102 102 THR H H 1 7.561 0.014 . . . . . A 97 THR H . 25514 1
1115 . 1 1 102 102 THR HA H 1 3.978 0.002 . . . . . A 97 THR HA . 25514 1
1116 . 1 1 102 102 THR HB H 1 4.022 0.021 . . . . . A 97 THR HB . 25514 1
1117 . 1 1 102 102 THR HG21 H 1 0.991 0.003 . . . . . A 97 THR HG21 . 25514 1
1118 . 1 1 102 102 THR HG22 H 1 0.991 0.003 . . . . . A 97 THR HG22 . 25514 1
1119 . 1 1 102 102 THR HG23 H 1 0.991 0.003 . . . . . A 97 THR HG23 . 25514 1
1120 . 1 1 102 102 THR C C 13 174.623 0.002 . . . . . A 97 THR C . 25514 1
1121 . 1 1 102 102 THR CA C 13 63.526 0.027 . . . . . A 97 THR CA . 25514 1
1122 . 1 1 102 102 THR CB C 13 69.072 0.024 . . . . . A 97 THR CB . 25514 1
1123 . 1 1 102 102 THR CG2 C 13 21.798 0.037 . . . . . A 97 THR CG2 . 25514 1
1124 . 1 1 102 102 THR N N 15 111.167 0.005 . . . . . A 97 THR N . 25514 1
1125 . 1 1 103 103 TYR H H 1 7.493 0.023 . . . . . A 98 TYR H . 25514 1
1126 . 1 1 103 103 TYR HA H 1 3.959 0.007 . . . . . A 98 TYR HA . 25514 1
1127 . 1 1 103 103 TYR HB2 H 1 2.578 0.013 . . . . . A 98 TYR HB2 . 25514 1
1128 . 1 1 103 103 TYR HB3 H 1 2.547 0.008 . . . . . A 98 TYR HB3 . 25514 1
1129 . 1 1 103 103 TYR C C 13 175.446 0.003 . . . . . A 98 TYR C . 25514 1
1130 . 1 1 103 103 TYR CA C 13 59.747 0.005 . . . . . A 98 TYR CA . 25514 1
1131 . 1 1 103 103 TYR CB C 13 39.033 0.024 . . . . . A 98 TYR CB . 25514 1
1132 . 1 1 103 103 TYR N N 15 120.595 0.008 . . . . . A 98 TYR N . 25514 1
1133 . 1 1 104 104 PHE H H 1 7.391 0.019 . . . . . A 99 PHE H . 25514 1
1134 . 1 1 104 104 PHE HA H 1 4.467 0.014 . . . . . A 99 PHE HA . 25514 1
1135 . 1 1 104 104 PHE HB2 H 1 3.250 0.009 . . . . . A 99 PHE HB2 . 25514 1
1136 . 1 1 104 104 PHE HB3 H 1 2.568 0.007 . . . . . A 99 PHE HB3 . 25514 1
1137 . 1 1 104 104 PHE C C 13 174.617 0.004 . . . . . A 99 PHE C . 25514 1
1138 . 1 1 104 104 PHE CA C 13 58.158 0.025 . . . . . A 99 PHE CA . 25514 1
1139 . 1 1 104 104 PHE CB C 13 40.378 0.033 . . . . . A 99 PHE CB . 25514 1
1140 . 1 1 104 104 PHE N N 15 117.597 0.007 . . . . . A 99 PHE N . 25514 1
1141 . 1 1 105 105 VAL H H 1 7.324 0.011 . . . . . A 100 VAL H . 25514 1
1142 . 1 1 105 105 VAL HA H 1 3.972 0.001 . . . . . A 100 VAL HA . 25514 1
1143 . 1 1 105 105 VAL HB H 1 2.025 0.001 . . . . . A 100 VAL HB . 25514 1
1144 . 1 1 105 105 VAL HG11 H 1 0.831 0.004 . . . . . A 100 VAL HG11 . 25514 1
1145 . 1 1 105 105 VAL HG12 H 1 0.831 0.004 . . . . . A 100 VAL HG12 . 25514 1
1146 . 1 1 105 105 VAL HG13 H 1 0.831 0.004 . . . . . A 100 VAL HG13 . 25514 1
1147 . 1 1 105 105 VAL HG21 H 1 0.845 0.006 . . . . . A 100 VAL HG21 . 25514 1
1148 . 1 1 105 105 VAL HG22 H 1 0.845 0.006 . . . . . A 100 VAL HG22 . 25514 1
1149 . 1 1 105 105 VAL HG23 H 1 0.845 0.006 . . . . . A 100 VAL HG23 . 25514 1
1150 . 1 1 105 105 VAL C C 13 180.959 0.000 . . . . . A 100 VAL C . 25514 1
1151 . 1 1 105 105 VAL CA C 13 63.897 0.033 . . . . . A 100 VAL CA . 25514 1
1152 . 1 1 105 105 VAL CB C 13 32.901 0.011 . . . . . A 100 VAL CB . 25514 1
1153 . 1 1 105 105 VAL CG1 C 13 20.327 0.016 . . . . . A 100 VAL CG1 . 25514 1
1154 . 1 1 105 105 VAL CG2 C 13 21.539 0.013 . . . . . A 100 VAL CG2 . 25514 1
1155 . 1 1 105 105 VAL N N 15 123.860 0.003 . . . . . A 100 VAL N . 25514 1
stop_
save_