Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 52001
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name KRAS4a_GDP.str
_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.015
_Assigned_chem_shift_list.Chem_shift_13C_err 0.15
_Assigned_chem_shift_list.Chem_shift_15N_err 0.15
_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
;
The generic precision in measuring standard protein 3D experiments:
0.01-0.02 ppm for 1H and 0.1-0.2 ppm for 13C and 15N.
;
_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' . . . 52001 1
2 '3D CBCA(CO)NH' . . . 52001 1
3 '3D HNCACB' . . . 52001 1
4 '3D C(CO)NH' . . . 52001 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 $software_1 . . 52001 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 1 1 MET H H 1 8.719 0.01 . 1 . . . . . 1 MET H . 52001 1
2 . 1 . 1 1 1 MET C C 13 175.492 0.00 . 1 . . . . . 1 MET C . 52001 1
3 . 1 . 1 1 1 MET CA C 13 55.556 0.01 . 1 . . . . . 1 MET CA . 52001 1
4 . 1 . 1 1 1 MET CB C 13 34.119 0.00 . 1 . . . . . 1 MET CB . 52001 1
5 . 1 . 1 1 1 MET N N 15 122.797 0.02 . 1 . . . . . 1 MET N . 52001 1
6 . 1 . 1 2 2 THR H H 1 8.621 0.00 . 1 . . . . . 2 THR H . 52001 1
7 . 1 . 1 2 2 THR C C 13 172.226 0.00 . 1 . . . . . 2 THR C . 52001 1
8 . 1 . 1 2 2 THR CA C 13 63.166 0.00 . 1 . . . . . 2 THR CA . 52001 1
9 . 1 . 1 2 2 THR N N 15 122.203 0.02 . 1 . . . . . 2 THR N . 52001 1
10 . 1 . 1 3 3 GLU H H 1 8.338 0.01 . 1 . . . . . 3 GLU H . 52001 1
11 . 1 . 1 3 3 GLU C C 13 175.428 0.00 . 1 . . . . . 3 GLU C . 52001 1
12 . 1 . 1 3 3 GLU CA C 13 54.474 0.00 . 1 . . . . . 3 GLU CA . 52001 1
13 . 1 . 1 3 3 GLU N N 15 126.113 0.03 . 1 . . . . . 3 GLU N . 52001 1
14 . 1 . 1 4 4 TYR H H 1 8.667 0.00 . 1 . . . . . 4 TYR H . 52001 1
15 . 1 . 1 4 4 TYR C C 13 174.157 0.00 . 1 . . . . . 4 TYR C . 52001 1
16 . 1 . 1 4 4 TYR CA C 13 57.269 0.00 . 1 . . . . . 4 TYR CA . 52001 1
17 . 1 . 1 4 4 TYR N N 15 121.343 0.07 . 1 . . . . . 4 TYR N . 52001 1
18 . 1 . 1 5 5 LYS H H 1 9.139 0.00 . 1 . . . . . 5 LYS H . 52001 1
19 . 1 . 1 5 5 LYS C C 13 175.309 0.00 . 1 . . . . . 5 LYS C . 52001 1
20 . 1 . 1 5 5 LYS CA C 13 55.555 0.00 . 1 . . . . . 5 LYS CA . 52001 1
21 . 1 . 1 5 5 LYS N N 15 124.413 0.08 . 1 . . . . . 5 LYS N . 52001 1
22 . 1 . 1 6 6 LEU H H 1 9.423 0.00 . 1 . . . . . 6 LEU H . 52001 1
23 . 1 . 1 6 6 LEU C C 13 175.595 0.04 . 1 . . . . . 6 LEU C . 52001 1
24 . 1 . 1 6 6 LEU CA C 13 52.762 0.00 . 1 . . . . . 6 LEU CA . 52001 1
25 . 1 . 1 6 6 LEU N N 15 126.235 0.09 . 1 . . . . . 6 LEU N . 52001 1
26 . 1 . 1 7 7 VAL H H 1 7.958 0.02 . 1 . . . . . 7 VAL H . 52001 1
27 . 1 . 1 7 7 VAL C C 13 174.159 0.02 . 1 . . . . . 7 VAL C . 52001 1
28 . 1 . 1 7 7 VAL CA C 13 61.179 0.00 . 1 . . . . . 7 VAL CA . 52001 1
29 . 1 . 1 7 7 VAL N N 15 120.766 0.18 . 1 . . . . . 7 VAL N . 52001 1
30 . 1 . 1 8 8 VAL H H 1 8.904 0.00 . 1 . . . . . 8 VAL H . 52001 1
31 . 1 . 1 8 8 VAL C C 13 175.477 0.00 . 1 . . . . . 8 VAL C . 52001 1
32 . 1 . 1 8 8 VAL CA C 13 62.168 0.00 . 1 . . . . . 8 VAL CA . 52001 1
33 . 1 . 1 8 8 VAL N N 15 128.970 0.00 . 1 . . . . . 8 VAL N . 52001 1
34 . 1 . 1 9 9 VAL H H 1 9.167 0.00 . 1 . . . . . 9 VAL H . 52001 1
35 . 1 . 1 9 9 VAL C C 13 172.802 0.01 . 1 . . . . . 9 VAL C . 52001 1
36 . 1 . 1 9 9 VAL CA C 13 59.269 0.00 . 1 . . . . . 9 VAL CA . 52001 1
37 . 1 . 1 9 9 VAL N N 15 120.626 0.04 . 1 . . . . . 9 VAL N . 52001 1
38 . 1 . 1 10 10 GLY H H 1 7.160 0.03 . 1 . . . . . 10 GLY H . 52001 1
39 . 1 . 1 10 10 GLY C C 13 172.634 0.00 . 1 . . . . . 10 GLY C . 52001 1
40 . 1 . 1 10 10 GLY CA C 13 43.769 0.00 . 1 . . . . . 10 GLY CA . 52001 1
41 . 1 . 1 10 10 GLY N N 15 107.617 0.10 . 1 . . . . . 10 GLY N . 52001 1
42 . 1 . 1 11 11 ALA H H 1 9.222 0.00 . 1 . . . . . 11 ALA H . 52001 1
43 . 1 . 1 11 11 ALA C C 13 177.456 0.09 . 1 . . . . . 11 ALA C . 52001 1
44 . 1 . 1 11 11 ALA CA C 13 52.564 0.00 . 1 . . . . . 11 ALA CA . 52001 1
45 . 1 . 1 11 11 ALA N N 15 123.615 0.04 . 1 . . . . . 11 ALA N . 52001 1
46 . 1 . 1 12 12 GLY H H 1 8.625 0.01 . 1 . . . . . 12 GLY H . 52001 1
47 . 1 . 1 12 12 GLY C C 13 175.858 0.08 . 1 . . . . . 12 GLY C . 52001 1
48 . 1 . 1 12 12 GLY CA C 13 47.060 0.00 . 1 . . . . . 12 GLY CA . 52001 1
49 . 1 . 1 12 12 GLY N N 15 106.351 0.07 . 1 . . . . . 12 GLY N . 52001 1
50 . 1 . 1 13 13 GLY H H 1 10.459 0.00 . 1 . . . . . 13 GLY H . 52001 1
51 . 1 . 1 13 13 GLY C C 13 175.260 0.00 . 1 . . . . . 13 GLY C . 52001 1
52 . 1 . 1 13 13 GLY CA C 13 46.335 0.00 . 1 . . . . . 13 GLY CA . 52001 1
53 . 1 . 1 13 13 GLY N N 15 114.704 0.02 . 1 . . . . . 13 GLY N . 52001 1
54 . 1 . 1 14 14 VAL H H 1 7.676 0.00 . 1 . . . . . 14 VAL H . 52001 1
55 . 1 . 1 14 14 VAL C C 13 174.462 0.00 . 1 . . . . . 14 VAL C . 52001 1
56 . 1 . 1 14 14 VAL CA C 13 62.702 0.00 . 1 . . . . . 14 VAL CA . 52001 1
57 . 1 . 1 14 14 VAL N N 15 113.332 0.01 . 1 . . . . . 14 VAL N . 52001 1
58 . 1 . 1 15 15 GLY H H 1 8.604 0.00 . 1 . . . . . 15 GLY H . 52001 1
59 . 1 . 1 15 15 GLY C C 13 173.894 0.00 . 1 . . . . . 15 GLY C . 52001 1
60 . 1 . 1 15 15 GLY CA C 13 46.172 0.00 . 1 . . . . . 15 GLY CA . 52001 1
61 . 1 . 1 15 15 GLY N N 15 109.696 0.00 . 1 . . . . . 15 GLY N . 52001 1
62 . 1 . 1 16 16 LYS H H 1 10.602 0.00 . 1 . . . . . 16 LYS H . 52001 1
63 . 1 . 1 16 16 LYS C C 13 179.727 0.00 . 1 . . . . . 16 LYS C . 52001 1
64 . 1 . 1 16 16 LYS CA C 13 61.259 0.00 . 1 . . . . . 16 LYS CA . 52001 1
65 . 1 . 1 16 16 LYS N N 15 125.561 0.01 . 1 . . . . . 16 LYS N . 52001 1
66 . 1 . 1 17 17 SER H H 1 9.300 0.00 . 1 . . . . . 17 SER H . 52001 1
67 . 1 . 1 17 17 SER C C 13 175.739 0.00 . 1 . . . . . 17 SER C . 52001 1
68 . 1 . 1 17 17 SER CA C 13 61.425 0.00 . 1 . . . . . 17 SER CA . 52001 1
69 . 1 . 1 17 17 SER N N 15 120.077 0.00 . 1 . . . . . 17 SER N . 52001 1
70 . 1 . 1 18 18 ALA H H 1 9.066 0.00 . 1 . . . . . 18 ALA H . 52001 1
71 . 1 . 1 18 18 ALA C C 13 181.826 0.35 . 1 . . . . . 18 ALA C . 52001 1
72 . 1 . 1 18 18 ALA CA C 13 54.426 0.00 . 1 . . . . . 18 ALA CA . 52001 1
73 . 1 . 1 18 18 ALA N N 15 125.342 0.03 . 1 . . . . . 18 ALA N . 52001 1
74 . 1 . 1 19 19 LEU H H 1 8.878 0.00 . 1 . . . . . 19 LEU H . 52001 1
75 . 1 . 1 19 19 LEU C C 13 177.596 0.01 . 1 . . . . . 19 LEU C . 52001 1
76 . 1 . 1 19 19 LEU CA C 13 58.825 0.00 . 1 . . . . . 19 LEU CA . 52001 1
77 . 1 . 1 19 19 LEU N N 15 119.504 0.00 . 1 . . . . . 19 LEU N . 52001 1
78 . 1 . 1 20 20 THR H H 1 7.676 0.00 . 1 . . . . . 20 THR H . 52001 1
79 . 1 . 1 20 20 THR C C 13 175.878 0.00 . 1 . . . . . 20 THR C . 52001 1
80 . 1 . 1 20 20 THR CA C 13 68.144 0.00 . 1 . . . . . 20 THR CA . 52001 1
81 . 1 . 1 20 20 THR N N 15 116.416 0.03 . 1 . . . . . 20 THR N . 52001 1
82 . 1 . 1 21 21 ILE H H 1 8.849 0.01 . 1 . . . . . 21 ILE H . 52001 1
83 . 1 . 1 21 21 ILE C C 13 178.178 0.93 . 1 . . . . . 21 ILE C . 52001 1
84 . 1 . 1 21 21 ILE CA C 13 64.885 0.00 . 1 . . . . . 21 ILE CA . 52001 1
85 . 1 . 1 21 21 ILE N N 15 120.558 0.01 . 1 . . . . . 21 ILE N . 52001 1
86 . 1 . 1 22 22 GLN H H 1 7.807 0.00 . 1 . . . . . 22 GLN H . 52001 1
87 . 1 . 1 22 22 GLN C C 13 179.361 0.17 . 1 . . . . . 22 GLN C . 52001 1
88 . 1 . 1 22 22 GLN CA C 13 59.047 0.00 . 1 . . . . . 22 GLN CA . 52001 1
89 . 1 . 1 22 22 GLN CB C 13 29.547 0.00 . 1 . . . . . 22 GLN CB . 52001 1
90 . 1 . 1 22 22 GLN N N 15 120.684 0.04 . 1 . . . . . 22 GLN N . 52001 1
91 . 1 . 1 23 23 LEU H H 1 7.479 0.00 . 1 . . . . . 23 LEU H . 52001 1
92 . 1 . 1 23 23 LEU C C 13 178.257 0.00 . 1 . . . . . 23 LEU C . 52001 1
93 . 1 . 1 23 23 LEU CA C 13 58.020 0.08 . 1 . . . . . 23 LEU CA . 52001 1
94 . 1 . 1 23 23 LEU CB C 13 40.854 0.02 . 1 . . . . . 23 LEU CB . 52001 1
95 . 1 . 1 23 23 LEU N N 15 120.609 0.05 . 1 . . . . . 23 LEU N . 52001 1
96 . 1 . 1 24 24 ILE H H 1 7.963 0.00 . 1 . . . . . 24 ILE H . 52001 1
97 . 1 . 1 24 24 ILE C C 13 177.552 0.00 . 1 . . . . . 24 ILE C . 52001 1
98 . 1 . 1 24 24 ILE CA C 13 62.034 0.09 . 1 . . . . . 24 ILE CA . 52001 1
99 . 1 . 1 24 24 ILE CB C 13 37.157 0.04 . 1 . . . . . 24 ILE CB . 52001 1
100 . 1 . 1 24 24 ILE N N 15 114.311 0.13 . 1 . . . . . 24 ILE N . 52001 1
101 . 1 . 1 25 25 GLN H H 1 8.976 0.00 . 1 . . . . . 25 GLN H . 52001 1
102 . 1 . 1 25 25 GLN C C 13 176.305 0.00 . 1 . . . . . 25 GLN C . 52001 1
103 . 1 . 1 25 25 GLN CA C 13 55.295 0.00 . 1 . . . . . 25 GLN CA . 52001 1
104 . 1 . 1 25 25 GLN N N 15 115.981 0.04 . 1 . . . . . 25 GLN N . 52001 1
105 . 1 . 1 26 26 ASN H H 1 7.916 0.00 . 1 . . . . . 26 ASN H . 52001 1
106 . 1 . 1 26 26 ASN C C 13 174.056 0.00 . 1 . . . . . 26 ASN C . 52001 1
107 . 1 . 1 26 26 ASN CA C 13 54.492 0.00 . 1 . . . . . 26 ASN CA . 52001 1
108 . 1 . 1 26 26 ASN CB C 13 37.260 0.05 . 1 . . . . . 26 ASN CB . 52001 1
109 . 1 . 1 26 26 ASN N N 15 116.294 0.05 . 1 . . . . . 26 ASN N . 52001 1
110 . 1 . 1 27 27 HIS H H 1 6.768 0.00 . 1 . . . . . 27 HIS H . 52001 1
111 . 1 . 1 27 27 HIS CA C 13 54.640 0.02 . 1 . . . . . 27 HIS CA . 52001 1
112 . 1 . 1 27 27 HIS CB C 13 32.776 0.18 . 1 . . . . . 27 HIS CB . 52001 1
113 . 1 . 1 27 27 HIS N N 15 111.559 0.23 . 1 . . . . . 27 HIS N . 52001 1
114 . 1 . 1 28 28 PHE H H 1 8.551 0.10 . 1 . . . . . 28 PHE H . 52001 1
115 . 1 . 1 28 28 PHE C C 13 174.658 0.00 . 1 . . . . . 28 PHE C . 52001 1
116 . 1 . 1 28 28 PHE CA C 13 55.329 0.00 . 1 . . . . . 28 PHE CA . 52001 1
117 . 1 . 1 28 28 PHE CB C 13 40.046 0.00 . 1 . . . . . 28 PHE CB . 52001 1
118 . 1 . 1 28 28 PHE N N 15 122.113 0.18 . 1 . . . . . 28 PHE N . 52001 1
119 . 1 . 1 29 29 VAL H H 1 7.647 0.02 . 1 . . . . . 29 VAL H . 52001 1
120 . 1 . 1 29 29 VAL C C 13 173.473 0.00 . 1 . . . . . 29 VAL C . 52001 1
121 . 1 . 1 29 29 VAL CA C 13 60.065 0.00 . 1 . . . . . 29 VAL CA . 52001 1
122 . 1 . 1 29 29 VAL N N 15 125.638 0.05 . 1 . . . . . 29 VAL N . 52001 1
123 . 1 . 1 30 30 ASP H H 1 7.795 0.01 . 1 . . . . . 30 ASP H . 52001 1
124 . 1 . 1 30 30 ASP C C 13 176.219 0.00 . 1 . . . . . 30 ASP C . 52001 1
125 . 1 . 1 30 30 ASP CA C 13 54.657 0.00 . 1 . . . . . 30 ASP CA . 52001 1
126 . 1 . 1 30 30 ASP N N 15 122.418 0.05 . 1 . . . . . 30 ASP N . 52001 1
127 . 1 . 1 31 31 GLU H H 1 7.743 0.00 . 1 . . . . . 31 GLU H . 52001 1
128 . 1 . 1 31 31 GLU C C 13 174.420 0.00 . 1 . . . . . 31 GLU C . 52001 1
129 . 1 . 1 31 31 GLU CA C 13 55.593 0.00 . 1 . . . . . 31 GLU CA . 52001 1
130 . 1 . 1 31 31 GLU N N 15 119.304 0.03 . 1 . . . . . 31 GLU N . 52001 1
131 . 1 . 1 32 32 TYR H H 1 8.816 0.00 . 1 . . . . . 32 TYR H . 52001 1
132 . 1 . 1 32 32 TYR C C 13 175.340 0.00 . 1 . . . . . 32 TYR C . 52001 1
133 . 1 . 1 32 32 TYR CA C 13 58.814 0.00 . 1 . . . . . 32 TYR CA . 52001 1
134 . 1 . 1 32 32 TYR N N 15 125.680 0.04 . 1 . . . . . 32 TYR N . 52001 1
135 . 1 . 1 33 33 ASP H H 1 7.871 0.00 . 1 . . . . . 33 ASP H . 52001 1
136 . 1 . 1 33 33 ASP N N 15 128.876 0.01 . 1 . . . . . 33 ASP N . 52001 1
137 . 1 . 1 34 34 PRO C C 13 178.531 0.00 . 1 . . . . . 34 PRO C . 52001 1
138 . 1 . 1 34 34 PRO CA C 13 63.896 0.00 . 1 . . . . . 34 PRO CA . 52001 1
139 . 1 . 1 35 35 THR H H 1 8.989 0.01 . 1 . . . . . 35 THR H . 52001 1
140 . 1 . 1 35 35 THR C C 13 174.634 0.00 . 1 . . . . . 35 THR C . 52001 1
141 . 1 . 1 35 35 THR CA C 13 62.149 0.00 . 1 . . . . . 35 THR CA . 52001 1
142 . 1 . 1 35 35 THR N N 15 109.980 0.06 . 1 . . . . . 35 THR N . 52001 1
143 . 1 . 1 36 36 ILE H H 1 6.852 0.00 . 1 . . . . . 36 ILE H . 52001 1
144 . 1 . 1 36 36 ILE C C 13 174.838 0.00 . 1 . . . . . 36 ILE C . 52001 1
145 . 1 . 1 36 36 ILE CA C 13 62.081 0.00 . 1 . . . . . 36 ILE CA . 52001 1
146 . 1 . 1 36 36 ILE N N 15 120.976 0.01 . 1 . . . . . 36 ILE N . 52001 1
147 . 1 . 1 37 37 GLU H H 1 8.401 0.01 . 1 . . . . . 37 GLU H . 52001 1
148 . 1 . 1 37 37 GLU C C 13 174.291 0.00 . 1 . . . . . 37 GLU C . 52001 1
149 . 1 . 1 37 37 GLU CA C 13 54.575 0.00 . 1 . . . . . 37 GLU CA . 52001 1
150 . 1 . 1 37 37 GLU N N 15 131.627 0.04 . 1 . . . . . 37 GLU N . 52001 1
151 . 1 . 1 38 38 ASP H H 1 8.171 0.00 . 1 . . . . . 38 ASP H . 52001 1
152 . 1 . 1 38 38 ASP C C 13 173.395 0.00 . 1 . . . . . 38 ASP C . 52001 1
153 . 1 . 1 38 38 ASP CA C 13 52.605 0.00 . 1 . . . . . 38 ASP CA . 52001 1
154 . 1 . 1 38 38 ASP N N 15 124.275 0.02 . 1 . . . . . 38 ASP N . 52001 1
155 . 1 . 1 39 39 SER H H 1 8.374 0.00 . 1 . . . . . 39 SER H . 52001 1
156 . 1 . 1 39 39 SER C C 13 173.412 0.00 . 1 . . . . . 39 SER C . 52001 1
157 . 1 . 1 39 39 SER CA C 13 55.933 0.00 . 1 . . . . . 39 SER CA . 52001 1
158 . 1 . 1 39 39 SER CB C 13 65.930 0.00 . 1 . . . . . 39 SER CB . 52001 1
159 . 1 . 1 39 39 SER N N 15 113.934 0.00 . 1 . . . . . 39 SER N . 52001 1
160 . 1 . 1 40 40 TYR H H 1 9.113 0.00 . 1 . . . . . 40 TYR H . 52001 1
161 . 1 . 1 40 40 TYR C C 13 174.305 0.00 . 1 . . . . . 40 TYR C . 52001 1
162 . 1 . 1 40 40 TYR CA C 13 56.968 0.00 . 1 . . . . . 40 TYR CA . 52001 1
163 . 1 . 1 40 40 TYR CB C 13 43.242 0.02 . 1 . . . . . 40 TYR CB . 52001 1
164 . 1 . 1 40 40 TYR N N 15 121.551 0.04 . 1 . . . . . 40 TYR N . 52001 1
165 . 1 . 1 41 41 ARG H H 1 8.424 0.00 . 1 . . . . . 41 ARG H . 52001 1
166 . 1 . 1 41 41 ARG C C 13 176.291 0.00 . 1 . . . . . 41 ARG C . 52001 1
167 . 1 . 1 41 41 ARG CA C 13 54.233 0.01 . 1 . . . . . 41 ARG CA . 52001 1
168 . 1 . 1 41 41 ARG CB C 13 33.954 0.00 . 1 . . . . . 41 ARG CB . 52001 1
169 . 1 . 1 41 41 ARG N N 15 120.346 0.10 . 1 . . . . . 41 ARG N . 52001 1
170 . 1 . 1 42 42 LYS H H 1 8.659 0.02 . 1 . . . . . 42 LYS H . 52001 1
171 . 1 . 1 42 42 LYS C C 13 173.648 0.00 . 1 . . . . . 42 LYS C . 52001 1
172 . 1 . 1 42 42 LYS CA C 13 55.693 0.05 . 1 . . . . . 42 LYS CA . 52001 1
173 . 1 . 1 42 42 LYS CB C 13 38.130 0.02 . 1 . . . . . 42 LYS CB . 52001 1
174 . 1 . 1 42 42 LYS N N 15 122.351 0.08 . 1 . . . . . 42 LYS N . 52001 1
175 . 1 . 1 43 43 GLN H H 1 8.827 0.01 . 1 . . . . . 43 GLN H . 52001 1
176 . 1 . 1 43 43 GLN C C 13 175.254 0.00 . 1 . . . . . 43 GLN C . 52001 1
177 . 1 . 1 43 43 GLN CA C 13 55.343 0.00 . 1 . . . . . 43 GLN CA . 52001 1
178 . 1 . 1 43 43 GLN CB C 13 29.814 0.00 . 1 . . . . . 43 GLN CB . 52001 1
179 . 1 . 1 43 43 GLN N N 15 128.860 0.03 . 1 . . . . . 43 GLN N . 52001 1
180 . 1 . 1 44 44 VAL H H 1 9.109 0.00 . 1 . . . . . 44 VAL H . 52001 1
181 . 1 . 1 44 44 VAL C C 13 173.157 0.00 . 1 . . . . . 44 VAL C . 52001 1
182 . 1 . 1 44 44 VAL CA C 13 59.560 0.00 . 1 . . . . . 44 VAL CA . 52001 1
183 . 1 . 1 44 44 VAL CB C 13 36.119 0.00 . 1 . . . . . 44 VAL CB . 52001 1
184 . 1 . 1 44 44 VAL N N 15 121.619 0.05 . 1 . . . . . 44 VAL N . 52001 1
185 . 1 . 1 45 45 VAL H H 1 8.067 0.00 . 1 . . . . . 45 VAL H . 52001 1
186 . 1 . 1 45 45 VAL C C 13 175.723 0.00 . 1 . . . . . 45 VAL C . 52001 1
187 . 1 . 1 45 45 VAL CA C 13 61.636 0.00 . 1 . . . . . 45 VAL CA . 52001 1
188 . 1 . 1 45 45 VAL N N 15 121.883 0.01 . 1 . . . . . 45 VAL N . 52001 1
189 . 1 . 1 46 46 ILE H H 1 8.341 0.01 . 1 . . . . . 46 ILE H . 52001 1
190 . 1 . 1 46 46 ILE C C 13 176.600 0.00 . 1 . . . . . 46 ILE C . 52001 1
191 . 1 . 1 46 46 ILE CA C 13 60.377 0.00 . 1 . . . . . 46 ILE CA . 52001 1
192 . 1 . 1 46 46 ILE N N 15 126.082 0.03 . 1 . . . . . 46 ILE N . 52001 1
193 . 1 . 1 47 47 ASP H H 1 9.534 0.01 . 1 . . . . . 47 ASP H . 52001 1
194 . 1 . 1 47 47 ASP C C 13 176.194 0.00 . 1 . . . . . 47 ASP C . 52001 1
195 . 1 . 1 47 47 ASP CA C 13 55.294 0.00 . 1 . . . . . 47 ASP CA . 52001 1
196 . 1 . 1 47 47 ASP N N 15 130.189 0.03 . 1 . . . . . 47 ASP N . 52001 1
197 . 1 . 1 48 48 GLY H H 1 8.266 0.01 . 1 . . . . . 48 GLY H . 52001 1
198 . 1 . 1 48 48 GLY C C 13 173.090 0.00 . 1 . . . . . 48 GLY C . 52001 1
199 . 1 . 1 48 48 GLY CA C 13 45.366 0.00 . 1 . . . . . 48 GLY CA . 52001 1
200 . 1 . 1 48 48 GLY N N 15 103.435 0.05 . 1 . . . . . 48 GLY N . 52001 1
201 . 1 . 1 49 49 GLU H H 1 7.710 0.00 . 1 . . . . . 49 GLU H . 52001 1
202 . 1 . 1 49 49 GLU C C 13 175.527 0.00 . 1 . . . . . 49 GLU C . 52001 1
203 . 1 . 1 49 49 GLU CA C 13 54.749 0.00 . 1 . . . . . 49 GLU CA . 52001 1
204 . 1 . 1 49 49 GLU N N 15 122.860 0.02 . 1 . . . . . 49 GLU N . 52001 1
205 . 1 . 1 50 50 THR H H 1 8.962 0.01 . 1 . . . . . 50 THR H . 52001 1
206 . 1 . 1 50 50 THR C C 13 173.557 0.00 . 1 . . . . . 50 THR C . 52001 1
207 . 1 . 1 50 50 THR CA C 13 63.836 0.00 . 1 . . . . . 50 THR CA . 52001 1
208 . 1 . 1 50 50 THR N N 15 125.713 0.02 . 1 . . . . . 50 THR N . 52001 1
209 . 1 . 1 51 51 CYS H H 1 9.382 0.00 . 1 . . . . . 51 CYS H . 52001 1
210 . 1 . 1 51 51 CYS C C 13 171.461 0.00 . 1 . . . . . 51 CYS C . 52001 1
211 . 1 . 1 51 51 CYS CA C 13 56.538 0.00 . 1 . . . . . 51 CYS CA . 52001 1
212 . 1 . 1 51 51 CYS N N 15 124.879 0.03 . 1 . . . . . 51 CYS N . 52001 1
213 . 1 . 1 52 52 LEU H H 1 8.835 0.00 . 1 . . . . . 52 LEU H . 52001 1
214 . 1 . 1 52 52 LEU C C 13 175.194 0.00 . 1 . . . . . 52 LEU C . 52001 1
215 . 1 . 1 52 52 LEU CA C 13 53.460 0.00 . 1 . . . . . 52 LEU CA . 52001 1
216 . 1 . 1 52 52 LEU N N 15 122.727 0.02 . 1 . . . . . 52 LEU N . 52001 1
217 . 1 . 1 53 53 LEU H H 1 9.027 0.00 . 1 . . . . . 53 LEU H . 52001 1
218 . 1 . 1 53 53 LEU C C 13 174.457 0.00 . 1 . . . . . 53 LEU C . 52001 1
219 . 1 . 1 53 53 LEU CA C 13 53.598 0.00 . 1 . . . . . 53 LEU CA . 52001 1
220 . 1 . 1 53 53 LEU N N 15 124.011 0.04 . 1 . . . . . 53 LEU N . 52001 1
221 . 1 . 1 54 54 ASP H H 1 8.607 0.00 . 1 . . . . . 54 ASP H . 52001 1
222 . 1 . 1 54 54 ASP C C 13 174.999 0.00 . 1 . . . . . 54 ASP C . 52001 1
223 . 1 . 1 54 54 ASP CA C 13 53.073 0.00 . 1 . . . . . 54 ASP CA . 52001 1
224 . 1 . 1 54 54 ASP N N 15 125.322 0.03 . 1 . . . . . 54 ASP N . 52001 1
225 . 1 . 1 55 55 ILE H H 1 9.233 0.00 . 1 . . . . . 55 ILE H . 52001 1
226 . 1 . 1 55 55 ILE C C 13 174.819 0.00 . 1 . . . . . 55 ILE C . 52001 1
227 . 1 . 1 55 55 ILE CA C 13 60.248 0.00 . 1 . . . . . 55 ILE CA . 52001 1
228 . 1 . 1 55 55 ILE N N 15 123.799 0.06 . 1 . . . . . 55 ILE N . 52001 1
229 . 1 . 1 56 56 LEU H H 1 8.692 0.00 . 1 . . . . . 56 LEU H . 52001 1
230 . 1 . 1 56 56 LEU C C 13 173.701 0.00 . 1 . . . . . 56 LEU C . 52001 1
231 . 1 . 1 56 56 LEU CA C 13 54.089 0.00 . 1 . . . . . 56 LEU CA . 52001 1
232 . 1 . 1 56 56 LEU N N 15 127.820 0.04 . 1 . . . . . 56 LEU N . 52001 1
233 . 1 . 1 57 57 ASP H H 1 8.524 0.00 . 1 . . . . . 57 ASP H . 52001 1
234 . 1 . 1 57 57 ASP C C 13 175.498 0.00 . 1 . . . . . 57 ASP C . 52001 1
235 . 1 . 1 57 57 ASP CA C 13 53.229 0.00 . 1 . . . . . 57 ASP CA . 52001 1
236 . 1 . 1 57 57 ASP N N 15 129.120 0.04 . 1 . . . . . 57 ASP N . 52001 1
237 . 1 . 1 58 58 THR H H 1 6.802 0.00 . 1 . . . . . 58 THR H . 52001 1
238 . 1 . 1 58 58 THR C C 13 173.793 0.00 . 1 . . . . . 58 THR C . 52001 1
239 . 1 . 1 58 58 THR CA C 13 61.641 0.03 . 1 . . . . . 58 THR CA . 52001 1
240 . 1 . 1 58 58 THR N N 15 110.194 0.03 . 1 . . . . . 58 THR N . 52001 1
241 . 1 . 1 59 59 ALA H H 1 10.451 3.67 . 1 . . . . . 59 ALA H . 52001 1
242 . 1 . 1 59 59 ALA C C 13 178.264 0.12 . 1 . . . . . 59 ALA C . 52001 1
243 . 1 . 1 59 59 ALA CA C 13 51.723 0.01 . 1 . . . . . 59 ALA CA . 52001 1
244 . 1 . 1 59 59 ALA N N 15 121.503 0.03 . 1 . . . . . 59 ALA N . 52001 1
245 . 1 . 1 60 60 GLY H H 1 8.300 0.03 . 1 . . . . . 60 GLY H . 52001 1
246 . 1 . 1 60 60 GLY C C 13 174.978 0.00 . 1 . . . . . 60 GLY C . 52001 1
247 . 1 . 1 60 60 GLY CA C 13 46.204 0.00 . 1 . . . . . 60 GLY CA . 52001 1
248 . 1 . 1 60 60 GLY N N 15 108.028 0.07 . 1 . . . . . 60 GLY N . 52001 1
249 . 1 . 1 61 61 GLN H H 1 8.578 0.01 . 1 . . . . . 61 GLN H . 52001 1
250 . 1 . 1 61 61 GLN C C 13 176.375 0.01 . 1 . . . . . 61 GLN C . 52001 1
251 . 1 . 1 61 61 GLN CA C 13 56.188 0.00 . 1 . . . . . 61 GLN CA . 52001 1
252 . 1 . 1 61 61 GLN N N 15 119.154 0.02 . 1 . . . . . 61 GLN N . 52001 1
253 . 1 . 1 62 62 GLU H H 1 8.755 0.01 . 1 . . . . . 62 GLU H . 52001 1
254 . 1 . 1 62 62 GLU C C 13 176.806 0.00 . 1 . . . . . 62 GLU C . 52001 1
255 . 1 . 1 62 62 GLU CA C 13 57.721 0.02 . 1 . . . . . 62 GLU CA . 52001 1
256 . 1 . 1 62 62 GLU N N 15 120.708 0.06 . 1 . . . . . 62 GLU N . 52001 1
257 . 1 . 1 63 63 GLU H H 1 8.312 0.00 . 1 . . . . . 63 GLU H . 52001 1
258 . 1 . 1 63 63 GLU C C 13 175.941 0.00 . 1 . . . . . 63 GLU C . 52001 1
259 . 1 . 1 63 63 GLU CA C 13 56.736 0.00 . 1 . . . . . 63 GLU CA . 52001 1
260 . 1 . 1 63 63 GLU N N 15 120.124 0.02 . 1 . . . . . 63 GLU N . 52001 1
261 . 1 . 1 64 64 TYR H H 1 8.264 0.00 . 1 . . . . . 64 TYR H . 52001 1
262 . 1 . 1 64 64 TYR C C 13 175.668 0.00 . 1 . . . . . 64 TYR C . 52001 1
263 . 1 . 1 64 64 TYR CA C 13 58.183 0.00 . 1 . . . . . 64 TYR CA . 52001 1
264 . 1 . 1 64 64 TYR N N 15 121.035 0.03 . 1 . . . . . 64 TYR N . 52001 1
265 . 1 . 1 65 65 SER H H 1 7.896 0.01 . 1 . . . . . 65 SER H . 52001 1
266 . 1 . 1 65 65 SER C C 13 174.409 0.00 . 1 . . . . . 65 SER C . 52001 1
267 . 1 . 1 65 65 SER CA C 13 60.392 0.02 . 1 . . . . . 65 SER CA . 52001 1
268 . 1 . 1 65 65 SER CB C 13 64.127 0.00 . 1 . . . . . 65 SER CB . 52001 1
269 . 1 . 1 65 65 SER N N 15 119.648 0.02 . 1 . . . . . 65 SER N . 52001 1
270 . 1 . 1 66 66 ALA H H 1 8.765 0.01 . 1 . . . . . 66 ALA H . 52001 1
271 . 1 . 1 66 66 ALA C C 13 180.016 0.00 . 1 . . . . . 66 ALA C . 52001 1
272 . 1 . 1 66 66 ALA CA C 13 54.754 0.06 . 1 . . . . . 66 ALA CA . 52001 1
273 . 1 . 1 66 66 ALA CB C 13 18.279 0.02 . 1 . . . . . 66 ALA CB . 52001 1
274 . 1 . 1 66 66 ALA N N 15 128.716 0.04 . 1 . . . . . 66 ALA N . 52001 1
275 . 1 . 1 67 67 MET H H 1 8.221 0.00 . 1 . . . . . 67 MET H . 52001 1
276 . 1 . 1 67 67 MET C C 13 177.476 0.00 . 1 . . . . . 67 MET C . 52001 1
277 . 1 . 1 67 67 MET CA C 13 57.656 0.00 . 1 . . . . . 67 MET CA . 52001 1
278 . 1 . 1 67 67 MET CB C 13 32.582 0.06 . 1 . . . . . 67 MET CB . 52001 1
279 . 1 . 1 67 67 MET N N 15 117.566 0.09 . 1 . . . . . 67 MET N . 52001 1
280 . 1 . 1 68 68 ARG H H 1 7.853 0.00 . 1 . . . . . 68 ARG H . 52001 1
281 . 1 . 1 68 68 ARG C C 13 177.897 0.00 . 1 . . . . . 68 ARG C . 52001 1
282 . 1 . 1 68 68 ARG CA C 13 59.008 0.00 . 1 . . . . . 68 ARG CA . 52001 1
283 . 1 . 1 68 68 ARG CB C 13 29.795 0.01 . 1 . . . . . 68 ARG CB . 52001 1
284 . 1 . 1 68 68 ARG N N 15 120.886 0.02 . 1 . . . . . 68 ARG N . 52001 1
285 . 1 . 1 69 69 ASP H H 1 8.118 0.00 . 1 . . . . . 69 ASP H . 52001 1
286 . 1 . 1 69 69 ASP C C 13 177.997 0.00 . 1 . . . . . 69 ASP C . 52001 1
287 . 1 . 1 69 69 ASP CA C 13 57.580 0.00 . 1 . . . . . 69 ASP CA . 52001 1
288 . 1 . 1 69 69 ASP CB C 13 40.896 0.00 . 1 . . . . . 69 ASP CB . 52001 1
289 . 1 . 1 69 69 ASP N N 15 118.635 0.04 . 1 . . . . . 69 ASP N . 52001 1
290 . 1 . 1 70 70 GLN H H 1 7.839 0.00 . 1 . . . . . 70 GLN H . 52001 1
291 . 1 . 1 70 70 GLN C C 13 179.292 0.00 . 1 . . . . . 70 GLN C . 52001 1
292 . 1 . 1 70 70 GLN CA C 13 59.780 0.81 . 1 . . . . . 70 GLN CA . 52001 1
293 . 1 . 1 70 70 GLN CB C 13 28.238 0.03 . 1 . . . . . 70 GLN CB . 52001 1
294 . 1 . 1 70 70 GLN CG C 13 33.502 0.00 . 1 . . . . . 70 GLN CG . 52001 1
295 . 1 . 1 70 70 GLN N N 15 117.562 0.04 . 1 . . . . . 70 GLN N . 52001 1
296 . 1 . 1 71 71 TYR H H 1 8.206 0.01 . 1 . . . . . 71 TYR H . 52001 1
297 . 1 . 1 71 71 TYR C C 13 178.605 0.00 . 1 . . . . . 71 TYR C . 52001 1
298 . 1 . 1 71 71 TYR CA C 13 60.737 0.03 . 1 . . . . . 71 TYR CA . 52001 1
299 . 1 . 1 71 71 TYR CB C 13 37.971 0.01 . 1 . . . . . 71 TYR CB . 52001 1
300 . 1 . 1 71 71 TYR N N 15 119.599 0.04 . 1 . . . . . 71 TYR N . 52001 1
301 . 1 . 1 72 72 MET H H 1 8.294 0.02 . 1 . . . . . 72 MET H . 52001 1
302 . 1 . 1 72 72 MET C C 13 176.970 0.00 . 1 . . . . . 72 MET C . 52001 1
303 . 1 . 1 72 72 MET CA C 13 58.464 0.00 . 1 . . . . . 72 MET CA . 52001 1
304 . 1 . 1 72 72 MET N N 15 118.896 0.02 . 1 . . . . . 72 MET N . 52001 1
305 . 1 . 1 73 73 ARG H H 1 7.965 0.00 . 1 . . . . . 73 ARG H . 52001 1
306 . 1 . 1 73 73 ARG C C 13 178.637 0.20 . 1 . . . . . 73 ARG C . 52001 1
307 . 1 . 1 73 73 ARG CA C 13 59.612 0.00 . 1 . . . . . 73 ARG CA . 52001 1
308 . 1 . 1 73 73 ARG N N 15 115.766 0.05 . 1 . . . . . 73 ARG N . 52001 1
309 . 1 . 1 74 74 THR H H 1 7.811 0.01 . 1 . . . . . 74 THR H . 52001 1
310 . 1 . 1 74 74 THR C C 13 175.560 0.00 . 1 . . . . . 74 THR C . 52001 1
311 . 1 . 1 74 74 THR CA C 13 62.592 0.00 . 1 . . . . . 74 THR CA . 52001 1
312 . 1 . 1 74 74 THR N N 15 108.146 0.16 . 1 . . . . . 74 THR N . 52001 1
313 . 1 . 1 75 75 GLY H H 1 7.871 0.00 . 1 . . . . . 75 GLY H . 52001 1
314 . 1 . 1 75 75 GLY C C 13 172.486 0.00 . 1 . . . . . 75 GLY C . 52001 1
315 . 1 . 1 75 75 GLY CA C 13 46.259 0.00 . 1 . . . . . 75 GLY CA . 52001 1
316 . 1 . 1 75 75 GLY N N 15 109.428 0.13 . 1 . . . . . 75 GLY N . 52001 1
317 . 1 . 1 76 76 GLU H H 1 8.701 0.00 . 1 . . . . . 76 GLU H . 52001 1
318 . 1 . 1 76 76 GLU C C 13 176.247 0.00 . 1 . . . . . 76 GLU C . 52001 1
319 . 1 . 1 76 76 GLU CA C 13 56.588 0.00 . 1 . . . . . 76 GLU CA . 52001 1
320 . 1 . 1 76 76 GLU N N 15 121.888 0.02 . 1 . . . . . 76 GLU N . 52001 1
321 . 1 . 1 77 77 GLY H H 1 7.176 0.00 . 1 . . . . . 77 GLY H . 52001 1
322 . 1 . 1 77 77 GLY C C 13 170.805 0.00 . 1 . . . . . 77 GLY C . 52001 1
323 . 1 . 1 77 77 GLY CA C 13 45.544 0.00 . 1 . . . . . 77 GLY CA . 52001 1
324 . 1 . 1 77 77 GLY N N 15 100.899 0.07 . 1 . . . . . 77 GLY N . 52001 1
325 . 1 . 1 78 78 PHE H H 1 8.184 0.01 . 1 . . . . . 78 PHE H . 52001 1
326 . 1 . 1 78 78 PHE C C 13 173.516 0.00 . 1 . . . . . 78 PHE C . 52001 1
327 . 1 . 1 78 78 PHE CA C 13 56.897 0.00 . 1 . . . . . 78 PHE CA . 52001 1
328 . 1 . 1 78 78 PHE N N 15 121.261 0.03 . 1 . . . . . 78 PHE N . 52001 1
329 . 1 . 1 79 79 LEU H H 1 9.254 0.00 . 1 . . . . . 79 LEU H . 52001 1
330 . 1 . 1 79 79 LEU C C 13 174.688 0.00 . 1 . . . . . 79 LEU C . 52001 1
331 . 1 . 1 79 79 LEU CA C 13 53.826 0.01 . 1 . . . . . 79 LEU CA . 52001 1
332 . 1 . 1 79 79 LEU N N 15 127.405 0.04 . 1 . . . . . 79 LEU N . 52001 1
333 . 1 . 1 80 80 CYS H H 1 8.766 0.01 . 1 . . . . . 80 CYS H . 52001 1
334 . 1 . 1 80 80 CYS C C 13 172.793 0.00 . 1 . . . . . 80 CYS C . 52001 1
335 . 1 . 1 80 80 CYS CA C 13 57.802 0.00 . 1 . . . . . 80 CYS CA . 52001 1
336 . 1 . 1 80 80 CYS N N 15 125.000 0.01 . 1 . . . . . 80 CYS N . 52001 1
337 . 1 . 1 81 81 VAL H H 1 9.000 0.00 . 1 . . . . . 81 VAL H . 52001 1
338 . 1 . 1 81 81 VAL C C 13 174.992 0.00 . 1 . . . . . 81 VAL C . 52001 1
339 . 1 . 1 81 81 VAL CA C 13 61.324 0.00 . 1 . . . . . 81 VAL CA . 52001 1
340 . 1 . 1 81 81 VAL N N 15 126.229 0.02 . 1 . . . . . 81 VAL N . 52001 1
341 . 1 . 1 82 82 PHE H H 1 9.352 0.00 . 1 . . . . . 82 PHE H . 52001 1
342 . 1 . 1 82 82 PHE C C 13 171.304 0.00 . 1 . . . . . 82 PHE C . 52001 1
343 . 1 . 1 82 82 PHE CA C 13 55.278 0.00 . 1 . . . . . 82 PHE CA . 52001 1
344 . 1 . 1 82 82 PHE N N 15 123.721 0.02 . 1 . . . . . 82 PHE N . 52001 1
345 . 1 . 1 83 83 ALA H H 1 8.806 0.00 . 1 . . . . . 83 ALA H . 52001 1
346 . 1 . 1 83 83 ALA C C 13 179.298 0.00 . 1 . . . . . 83 ALA C . 52001 1
347 . 1 . 1 83 83 ALA CA C 13 49.834 0.00 . 1 . . . . . 83 ALA CA . 52001 1
348 . 1 . 1 83 83 ALA N N 15 121.513 0.01 . 1 . . . . . 83 ALA N . 52001 1
349 . 1 . 1 84 84 ILE H H 1 8.406 0.00 . 1 . . . . . 84 ILE H . 52001 1
350 . 1 . 1 84 84 ILE C C 13 174.057 0.00 . 1 . . . . . 84 ILE C . 52001 1
351 . 1 . 1 84 84 ILE CA C 13 63.615 0.00 . 1 . . . . . 84 ILE CA . 52001 1
352 . 1 . 1 84 84 ILE N N 15 113.419 0.07 . 1 . . . . . 84 ILE N . 52001 1
353 . 1 . 1 85 85 ASN H H 1 7.924 0.00 . 1 . . . . . 85 ASN H . 52001 1
354 . 1 . 1 85 85 ASN C C 13 174.549 0.00 . 1 . . . . . 85 ASN C . 52001 1
355 . 1 . 1 85 85 ASN CA C 13 52.245 0.01 . 1 . . . . . 85 ASN CA . 52001 1
356 . 1 . 1 85 85 ASN N N 15 117.181 0.01 . 1 . . . . . 85 ASN N . 52001 1
357 . 1 . 1 86 86 ASN H H 1 7.882 0.01 . 1 . . . . . 86 ASN H . 52001 1
358 . 1 . 1 86 86 ASN N N 15 119.173 0.02 . 1 . . . . . 86 ASN N . 52001 1
359 . 1 . 1 87 87 THR C C 13 176.083 0.00 . 1 . . . . . 87 THR C . 52001 1
360 . 1 . 1 87 87 THR CA C 13 66.818 0.00 . 1 . . . . . 87 THR CA . 52001 1
361 . 1 . 1 88 88 LYS H H 1 8.456 0.01 . 1 . . . . . 88 LYS H . 52001 1
362 . 1 . 1 88 88 LYS C C 13 178.102 0.00 . 1 . . . . . 88 LYS C . 52001 1
363 . 1 . 1 88 88 LYS CA C 13 59.546 0.03 . 1 . . . . . 88 LYS CA . 52001 1
364 . 1 . 1 88 88 LYS CB C 13 31.393 0.00 . 1 . . . . . 88 LYS CB . 52001 1
365 . 1 . 1 88 88 LYS N N 15 124.157 0.05 . 1 . . . . . 88 LYS N . 52001 1
366 . 1 . 1 89 89 SER H H 1 8.108 0.00 . 1 . . . . . 89 SER H . 52001 1
367 . 1 . 1 89 89 SER C C 13 175.781 0.00 . 1 . . . . . 89 SER C . 52001 1
368 . 1 . 1 89 89 SER CA C 13 61.835 0.00 . 1 . . . . . 89 SER CA . 52001 1
369 . 1 . 1 89 89 SER CB C 13 63.772 0.04 . 1 . . . . . 89 SER CB . 52001 1
370 . 1 . 1 89 89 SER N N 15 114.282 0.03 . 1 . . . . . 89 SER N . 52001 1
371 . 1 . 1 90 90 PHE H H 1 7.429 0.00 . 1 . . . . . 90 PHE H . 52001 1
372 . 1 . 1 90 90 PHE C C 13 177.295 0.00 . 1 . . . . . 90 PHE C . 52001 1
373 . 1 . 1 90 90 PHE CA C 13 59.859 0.00 . 1 . . . . . 90 PHE CA . 52001 1
374 . 1 . 1 90 90 PHE CB C 13 40.242 0.00 . 1 . . . . . 90 PHE CB . 52001 1
375 . 1 . 1 90 90 PHE N N 15 124.589 0.02 . 1 . . . . . 90 PHE N . 52001 1
376 . 1 . 1 91 91 GLU H H 1 8.470 0.01 . 1 . . . . . 91 GLU H . 52001 1
377 . 1 . 1 91 91 GLU C C 13 179.499 0.00 . 1 . . . . . 91 GLU C . 52001 1
378 . 1 . 1 91 91 GLU CA C 13 59.132 0.00 . 1 . . . . . 91 GLU CA . 52001 1
379 . 1 . 1 91 91 GLU N N 15 121.918 0.01 . 1 . . . . . 91 GLU N . 52001 1
380 . 1 . 1 92 92 ASP H H 1 8.482 0.01 . 1 . . . . . 92 ASP H . 52001 1
381 . 1 . 1 92 92 ASP C C 13 177.695 0.00 . 1 . . . . . 92 ASP C . 52001 1
382 . 1 . 1 92 92 ASP CA C 13 56.118 0.00 . 1 . . . . . 92 ASP CA . 52001 1
383 . 1 . 1 92 92 ASP CB C 13 41.271 0.00 . 1 . . . . . 92 ASP CB . 52001 1
384 . 1 . 1 92 92 ASP N N 15 116.874 0.08 . 1 . . . . . 92 ASP N . 52001 1
385 . 1 . 1 93 93 ILE H H 1 7.616 0.00 . 1 . . . . . 93 ILE H . 52001 1
386 . 1 . 1 93 93 ILE C C 13 177.410 0.00 . 1 . . . . . 93 ILE C . 52001 1
387 . 1 . 1 93 93 ILE CA C 13 62.643 0.02 . 1 . . . . . 93 ILE CA . 52001 1
388 . 1 . 1 93 93 ILE N N 15 120.661 0.04 . 1 . . . . . 93 ILE N . 52001 1
389 . 1 . 1 94 94 HIS H H 1 7.690 0.03 . 1 . . . . . 94 HIS H . 52001 1
390 . 1 . 1 94 94 HIS C C 13 177.071 0.00 . 1 . . . . . 94 HIS C . 52001 1
391 . 1 . 1 94 94 HIS CA C 13 60.062 0.00 . 1 . . . . . 94 HIS CA . 52001 1
392 . 1 . 1 94 94 HIS N N 15 116.951 0.06 . 1 . . . . . 94 HIS N . 52001 1
393 . 1 . 1 95 95 HIS H H 1 7.208 0.00 . 1 . . . . . 95 HIS H . 52001 1
394 . 1 . 1 95 95 HIS C C 13 178.350 0.00 . 1 . . . . . 95 HIS C . 52001 1
395 . 1 . 1 95 95 HIS CA C 13 58.781 0.00 . 1 . . . . . 95 HIS CA . 52001 1
396 . 1 . 1 95 95 HIS CB C 13 29.477 0.11 . 1 . . . . . 95 HIS CB . 52001 1
397 . 1 . 1 95 95 HIS N N 15 117.147 0.07 . 1 . . . . . 95 HIS N . 52001 1
398 . 1 . 1 96 96 TYR H H 1 7.684 0.01 . 1 . . . . . 96 TYR H . 52001 1
399 . 1 . 1 96 96 TYR C C 13 177.705 0.00 . 1 . . . . . 96 TYR C . 52001 1
400 . 1 . 1 96 96 TYR CA C 13 63.119 0.01 . 1 . . . . . 96 TYR CA . 52001 1
401 . 1 . 1 96 96 TYR CB C 13 37.811 0.00 . 1 . . . . . 96 TYR CB . 52001 1
402 . 1 . 1 96 96 TYR N N 15 118.699 0.03 . 1 . . . . . 96 TYR N . 52001 1
403 . 1 . 1 97 97 ARG H H 1 8.506 0.01 . 1 . . . . . 97 ARG H . 52001 1
404 . 1 . 1 97 97 ARG C C 13 177.513 0.00 . 1 . . . . . 97 ARG C . 52001 1
405 . 1 . 1 97 97 ARG CA C 13 60.022 0.00 . 1 . . . . . 97 ARG CA . 52001 1
406 . 1 . 1 97 97 ARG CB C 13 28.840 0.04 . 1 . . . . . 97 ARG CB . 52001 1
407 . 1 . 1 97 97 ARG N N 15 118.789 0.05 . 1 . . . . . 97 ARG N . 52001 1
408 . 1 . 1 98 98 GLU H H 1 7.939 0.01 . 1 . . . . . 98 GLU H . 52001 1
409 . 1 . 1 98 98 GLU C C 13 178.911 0.00 . 1 . . . . . 98 GLU C . 52001 1
410 . 1 . 1 98 98 GLU CA C 13 59.114 0.07 . 1 . . . . . 98 GLU CA . 52001 1
411 . 1 . 1 98 98 GLU CB C 13 29.180 0.00 . 1 . . . . . 98 GLU CB . 52001 1
412 . 1 . 1 98 98 GLU N N 15 117.532 0.05 . 1 . . . . . 98 GLU N . 52001 1
413 . 1 . 1 99 99 GLN H H 1 7.829 0.00 . 1 . . . . . 99 GLN H . 52001 1
414 . 1 . 1 99 99 GLN C C 13 177.844 0.00 . 1 . . . . . 99 GLN C . 52001 1
415 . 1 . 1 99 99 GLN CA C 13 58.985 0.00 . 1 . . . . . 99 GLN CA . 52001 1
416 . 1 . 1 99 99 GLN CB C 13 28.376 0.01 . 1 . . . . . 99 GLN CB . 52001 1
417 . 1 . 1 99 99 GLN N N 15 119.483 0.04 . 1 . . . . . 99 GLN N . 52001 1
418 . 1 . 1 100 100 ILE H H 1 7.800 0.00 . 1 . . . . . 100 ILE H . 52001 1
419 . 1 . 1 100 100 ILE C C 13 177.168 0.00 . 1 . . . . . 100 ILE C . 52001 1
420 . 1 . 1 100 100 ILE CA C 13 65.383 0.00 . 1 . . . . . 100 ILE CA . 52001 1
421 . 1 . 1 100 100 ILE CB C 13 37.941 0.02 . 1 . . . . . 100 ILE CB . 52001 1
422 . 1 . 1 100 100 ILE N N 15 119.961 0.03 . 1 . . . . . 100 ILE N . 52001 1
423 . 1 . 1 101 101 LYS H H 1 7.824 0.01 . 1 . . . . . 101 LYS H . 52001 1
424 . 1 . 1 101 101 LYS C C 13 179.331 0.00 . 1 . . . . . 101 LYS C . 52001 1
425 . 1 . 1 101 101 LYS CA C 13 59.861 0.10 . 1 . . . . . 101 LYS CA . 52001 1
426 . 1 . 1 101 101 LYS CB C 13 32.275 0.01 . 1 . . . . . 101 LYS CB . 52001 1
427 . 1 . 1 101 101 LYS N N 15 117.388 0.03 . 1 . . . . . 101 LYS N . 52001 1
428 . 1 . 1 102 102 ARG H H 1 7.740 0.00 . 1 . . . . . 102 ARG H . 52001 1
429 . 1 . 1 102 102 ARG C C 13 179.441 0.00 . 1 . . . . . 102 ARG C . 52001 1
430 . 1 . 1 102 102 ARG CA C 13 59.048 0.02 . 1 . . . . . 102 ARG CA . 52001 1
431 . 1 . 1 102 102 ARG CB C 13 30.073 0.00 . 1 . . . . . 102 ARG CB . 52001 1
432 . 1 . 1 102 102 ARG N N 15 117.682 0.04 . 1 . . . . . 102 ARG N . 52001 1
433 . 1 . 1 103 103 VAL H H 1 8.054 0.02 . 1 . . . . . 103 VAL H . 52001 1
434 . 1 . 1 103 103 VAL C C 13 177.702 0.00 . 1 . . . . . 103 VAL C . 52001 1
435 . 1 . 1 103 103 VAL CA C 13 65.211 0.02 . 1 . . . . . 103 VAL CA . 52001 1
436 . 1 . 1 103 103 VAL CB C 13 31.821 0.00 . 1 . . . . . 103 VAL CB . 52001 1
437 . 1 . 1 103 103 VAL N N 15 118.238 0.04 . 1 . . . . . 103 VAL N . 52001 1
438 . 1 . 1 104 104 LYS H H 1 8.038 0.01 . 1 . . . . . 104 LYS H . 52001 1
439 . 1 . 1 104 104 LYS C C 13 176.109 0.00 . 1 . . . . . 104 LYS C . 52001 1
440 . 1 . 1 104 104 LYS CA C 13 54.946 0.02 . 1 . . . . . 104 LYS CA . 52001 1
441 . 1 . 1 104 104 LYS CB C 13 30.980 0.07 . 1 . . . . . 104 LYS CB . 52001 1
442 . 1 . 1 104 104 LYS N N 15 116.661 0.05 . 1 . . . . . 104 LYS N . 52001 1
443 . 1 . 1 105 105 ASP H H 1 7.979 0.00 . 1 . . . . . 105 ASP H . 52001 1
444 . 1 . 1 105 105 ASP C C 13 174.707 0.00 . 1 . . . . . 105 ASP C . 52001 1
445 . 1 . 1 105 105 ASP CA C 13 54.809 0.03 . 1 . . . . . 105 ASP CA . 52001 1
446 . 1 . 1 105 105 ASP CB C 13 39.918 0.00 . 1 . . . . . 105 ASP CB . 52001 1
447 . 1 . 1 105 105 ASP N N 15 120.717 0.02 . 1 . . . . . 105 ASP N . 52001 1
448 . 1 . 1 106 106 SER H H 1 7.637 0.01 . 1 . . . . . 106 SER H . 52001 1
449 . 1 . 1 106 106 SER C C 13 173.399 0.00 . 1 . . . . . 106 SER C . 52001 1
450 . 1 . 1 106 106 SER CA C 13 57.337 0.00 . 1 . . . . . 106 SER CA . 52001 1
451 . 1 . 1 106 106 SER N N 15 109.222 0.03 . 1 . . . . . 106 SER N . 52001 1
452 . 1 . 1 107 107 GLU H H 1 8.413 0.00 . 1 . . . . . 107 GLU H . 52001 1
453 . 1 . 1 107 107 GLU C C 13 176.112 0.00 . 1 . . . . . 107 GLU C . 52001 1
454 . 1 . 1 107 107 GLU CA C 13 56.617 0.00 . 1 . . . . . 107 GLU CA . 52001 1
455 . 1 . 1 107 107 GLU N N 15 121.384 0.06 . 1 . . . . . 107 GLU N . 52001 1
456 . 1 . 1 108 108 ASP H H 1 8.317 0.01 . 1 . . . . . 108 ASP H . 52001 1
457 . 1 . 1 108 108 ASP C C 13 174.270 0.00 . 1 . . . . . 108 ASP C . 52001 1
458 . 1 . 1 108 108 ASP CA C 13 53.310 0.00 . 1 . . . . . 108 ASP CA . 52001 1
459 . 1 . 1 108 108 ASP N N 15 120.150 0.01 . 1 . . . . . 108 ASP N . 52001 1
460 . 1 . 1 109 109 VAL H H 1 7.476 0.00 . 1 . . . . . 109 VAL H . 52001 1
461 . 1 . 1 109 109 VAL N N 15 120.621 0.02 . 1 . . . . . 109 VAL N . 52001 1
462 . 1 . 1 110 110 PRO C C 13 175.975 0.00 . 1 . . . . . 110 PRO C . 52001 1
463 . 1 . 1 110 110 PRO CA C 13 64.059 0.00 . 1 . . . . . 110 PRO CA . 52001 1
464 . 1 . 1 111 111 MET H H 1 8.104 0.01 . 1 . . . . . 111 MET H . 52001 1
465 . 1 . 1 111 111 MET C C 13 173.919 0.00 . 1 . . . . . 111 MET C . 52001 1
466 . 1 . 1 111 111 MET CA C 13 55.011 0.00 . 1 . . . . . 111 MET CA . 52001 1
467 . 1 . 1 111 111 MET N N 15 122.260 0.01 . 1 . . . . . 111 MET N . 52001 1
468 . 1 . 1 112 112 VAL H H 1 8.097 0.01 . 1 . . . . . 112 VAL H . 52001 1
469 . 1 . 1 112 112 VAL C C 13 173.156 0.00 . 1 . . . . . 112 VAL C . 52001 1
470 . 1 . 1 112 112 VAL CA C 13 61.189 0.00 . 1 . . . . . 112 VAL CA . 52001 1
471 . 1 . 1 112 112 VAL N N 15 118.668 0.03 . 1 . . . . . 112 VAL N . 52001 1
472 . 1 . 1 113 113 LEU H H 1 8.966 0.00 . 1 . . . . . 113 LEU H . 52001 1
473 . 1 . 1 113 113 LEU C C 13 173.702 0.00 . 1 . . . . . 113 LEU C . 52001 1
474 . 1 . 1 113 113 LEU CA C 13 53.874 0.00 . 1 . . . . . 113 LEU CA . 52001 1
475 . 1 . 1 113 113 LEU N N 15 129.052 0.01 . 1 . . . . . 113 LEU N . 52001 1
476 . 1 . 1 114 114 VAL H H 1 9.271 0.00 . 1 . . . . . 114 VAL H . 52001 1
477 . 1 . 1 114 114 VAL C C 13 173.946 0.00 . 1 . . . . . 114 VAL C . 52001 1
478 . 1 . 1 114 114 VAL CA C 13 60.089 0.01 . 1 . . . . . 114 VAL CA . 52001 1
479 . 1 . 1 114 114 VAL N N 15 128.157 0.01 . 1 . . . . . 114 VAL N . 52001 1
480 . 1 . 1 115 115 GLY H H 1 8.406 0.00 . 1 . . . . . 115 GLY H . 52001 1
481 . 1 . 1 115 115 GLY C C 13 171.340 0.00 . 1 . . . . . 115 GLY C . 52001 1
482 . 1 . 1 115 115 GLY CA C 13 45.588 0.03 . 1 . . . . . 115 GLY CA . 52001 1
483 . 1 . 1 115 115 GLY N N 15 113.469 0.03 . 1 . . . . . 115 GLY N . 52001 1
484 . 1 . 1 116 116 ASN H H 1 8.890 0.00 . 1 . . . . . 116 ASN H . 52001 1
485 . 1 . 1 116 116 ASN C C 13 174.513 0.00 . 1 . . . . . 116 ASN C . 52001 1
486 . 1 . 1 116 116 ASN CA C 13 51.558 0.00 . 1 . . . . . 116 ASN CA . 52001 1
487 . 1 . 1 116 116 ASN N N 15 121.543 0.01 . 1 . . . . . 116 ASN N . 52001 1
488 . 1 . 1 117 117 LYS H H 1 7.317 0.00 . 1 . . . . . 117 LYS H . 52001 1
489 . 1 . 1 117 117 LYS C C 13 177.247 0.00 . 1 . . . . . 117 LYS C . 52001 1
490 . 1 . 1 117 117 LYS CA C 13 57.340 0.00 . 1 . . . . . 117 LYS CA . 52001 1
491 . 1 . 1 117 117 LYS N N 15 111.883 0.05 . 1 . . . . . 117 LYS N . 52001 1
492 . 1 . 1 118 118 CYS H H 1 8.756 0.00 . 1 . . . . . 118 CYS H . 52001 1
493 . 1 . 1 118 118 CYS C C 13 173.175 0.00 . 1 . . . . . 118 CYS C . 52001 1
494 . 1 . 1 118 118 CYS CA C 13 60.519 0.00 . 1 . . . . . 118 CYS CA . 52001 1
495 . 1 . 1 118 118 CYS N N 15 114.296 0.04 . 1 . . . . . 118 CYS N . 52001 1
496 . 1 . 1 119 119 ASP H H 1 8.672 0.03 . 1 . . . . . 119 ASP H . 52001 1
497 . 1 . 1 119 119 ASP C C 13 175.656 0.00 . 1 . . . . . 119 ASP C . 52001 1
498 . 1 . 1 119 119 ASP CA C 13 54.008 0.00 . 1 . . . . . 119 ASP CA . 52001 1
499 . 1 . 1 119 119 ASP N N 15 117.748 0.03 . 1 . . . . . 119 ASP N . 52001 1
500 . 1 . 1 120 120 LEU H H 1 7.793 0.00 . 1 . . . . . 120 LEU H . 52001 1
501 . 1 . 1 120 120 LEU N N 15 121.468 0.01 . 1 . . . . . 120 LEU N . 52001 1
502 . 1 . 1 121 121 PRO C C 13 177.015 0.00 . 1 . . . . . 121 PRO C . 52001 1
503 . 1 . 1 121 121 PRO CA C 13 63.409 0.00 . 1 . . . . . 121 PRO CA . 52001 1
504 . 1 . 1 122 122 SER H H 1 7.229 0.00 . 1 . . . . . 122 SER H . 52001 1
505 . 1 . 1 122 122 SER C C 13 172.532 0.00 . 1 . . . . . 122 SER C . 52001 1
506 . 1 . 1 122 122 SER CA C 13 56.400 0.00 . 1 . . . . . 122 SER CA . 52001 1
507 . 1 . 1 122 122 SER CB C 13 62.684 0.00 . 1 . . . . . 122 SER CB . 52001 1
508 . 1 . 1 122 122 SER N N 15 113.307 0.01 . 1 . . . . . 122 SER N . 52001 1
509 . 1 . 1 123 123 ARG H H 1 7.835 0.00 . 1 . . . . . 123 ARG H . 52001 1
510 . 1 . 1 123 123 ARG C C 13 175.819 0.00 . 1 . . . . . 123 ARG C . 52001 1
511 . 1 . 1 123 123 ARG CA C 13 55.854 0.00 . 1 . . . . . 123 ARG CA . 52001 1
512 . 1 . 1 123 123 ARG CB C 13 32.843 0.00 . 1 . . . . . 123 ARG CB . 52001 1
513 . 1 . 1 123 123 ARG N N 15 119.778 0.02 . 1 . . . . . 123 ARG N . 52001 1
514 . 1 . 1 124 124 THR H H 1 9.058 0.00 . 1 . . . . . 124 THR H . 52001 1
515 . 1 . 1 124 124 THR C C 13 174.326 0.00 . 1 . . . . . 124 THR C . 52001 1
516 . 1 . 1 124 124 THR CA C 13 61.799 0.00 . 1 . . . . . 124 THR CA . 52001 1
517 . 1 . 1 124 124 THR N N 15 113.661 0.02 . 1 . . . . . 124 THR N . 52001 1
518 . 1 . 1 125 125 VAL H H 1 7.566 0.00 . 1 . . . . . 125 VAL H . 52001 1
519 . 1 . 1 125 125 VAL C C 13 175.177 0.00 . 1 . . . . . 125 VAL C . 52001 1
520 . 1 . 1 125 125 VAL CA C 13 61.414 0.00 . 1 . . . . . 125 VAL CA . 52001 1
521 . 1 . 1 125 125 VAL N N 15 124.271 0.01 . 1 . . . . . 125 VAL N . 52001 1
522 . 1 . 1 126 126 ASP H H 1 8.640 0.00 . 1 . . . . . 126 ASP H . 52001 1
523 . 1 . 1 126 126 ASP C C 13 176.583 0.00 . 1 . . . . . 126 ASP C . 52001 1
524 . 1 . 1 126 126 ASP CA C 13 54.370 0.00 . 1 . . . . . 126 ASP CA . 52001 1
525 . 1 . 1 126 126 ASP N N 15 128.749 0.01 . 1 . . . . . 126 ASP N . 52001 1
526 . 1 . 1 127 127 THR H H 1 8.767 0.00 . 1 . . . . . 127 THR H . 52001 1
527 . 1 . 1 127 127 THR C C 13 175.710 0.00 . 1 . . . . . 127 THR C . 52001 1
528 . 1 . 1 127 127 THR CA C 13 67.394 0.00 . 1 . . . . . 127 THR CA . 52001 1
529 . 1 . 1 127 127 THR CB C 13 69.274 0.00 . 1 . . . . . 127 THR CB . 52001 1
530 . 1 . 1 127 127 THR N N 15 121.975 0.02 . 1 . . . . . 127 THR N . 52001 1
531 . 1 . 1 128 128 LYS H H 1 8.423 0.00 . 1 . . . . . 128 LYS H . 52001 1
532 . 1 . 1 128 128 LYS C C 13 178.277 0.00 . 1 . . . . . 128 LYS C . 52001 1
533 . 1 . 1 128 128 LYS CA C 13 59.493 0.00 . 1 . . . . . 128 LYS CA . 52001 1
534 . 1 . 1 128 128 LYS N N 15 120.148 0.04 . 1 . . . . . 128 LYS N . 52001 1
535 . 1 . 1 129 129 GLN H H 1 7.262 0.00 . 1 . . . . . 129 GLN H . 52001 1
536 . 1 . 1 129 129 GLN C C 13 179.275 0.00 . 1 . . . . . 129 GLN C . 52001 1
537 . 1 . 1 129 129 GLN CA C 13 58.608 0.00 . 1 . . . . . 129 GLN CA . 52001 1
538 . 1 . 1 129 129 GLN N N 15 117.437 0.06 . 1 . . . . . 129 GLN N . 52001 1
539 . 1 . 1 130 130 ALA H H 1 7.092 0.00 . 1 . . . . . 130 ALA H . 52001 1
540 . 1 . 1 130 130 ALA C C 13 177.977 0.00 . 1 . . . . . 130 ALA C . 52001 1
541 . 1 . 1 130 130 ALA CA C 13 54.855 0.00 . 1 . . . . . 130 ALA CA . 52001 1
542 . 1 . 1 130 130 ALA N N 15 122.531 0.03 . 1 . . . . . 130 ALA N . 52001 1
543 . 1 . 1 131 131 GLN H H 1 8.473 0.00 . 1 . . . . . 131 GLN H . 52001 1
544 . 1 . 1 131 131 GLN C C 13 179.418 0.00 . 1 . . . . . 131 GLN C . 52001 1
545 . 1 . 1 131 131 GLN CA C 13 58.990 0.00 . 1 . . . . . 131 GLN CA . 52001 1
546 . 1 . 1 131 131 GLN N N 15 118.116 0.05 . 1 . . . . . 131 GLN N . 52001 1
547 . 1 . 1 132 132 ASP H H 1 8.500 0.00 . 1 . . . . . 132 ASP H . 52001 1
548 . 1 . 1 132 132 ASP C C 13 178.932 0.00 . 1 . . . . . 132 ASP C . 52001 1
549 . 1 . 1 132 132 ASP CA C 13 57.290 0.00 . 1 . . . . . 132 ASP CA . 52001 1
550 . 1 . 1 132 132 ASP N N 15 120.398 0.01 . 1 . . . . . 132 ASP N . 52001 1
551 . 1 . 1 133 133 LEU H H 1 7.512 0.00 . 1 . . . . . 133 LEU H . 52001 1
552 . 1 . 1 133 133 LEU C C 13 178.958 0.00 . 1 . . . . . 133 LEU C . 52001 1
553 . 1 . 1 133 133 LEU CA C 13 57.854 0.00 . 1 . . . . . 133 LEU CA . 52001 1
554 . 1 . 1 133 133 LEU N N 15 123.535 0.05 . 1 . . . . . 133 LEU N . 52001 1
555 . 1 . 1 134 134 ALA H H 1 8.266 0.00 . 1 . . . . . 134 ALA H . 52001 1
556 . 1 . 1 134 134 ALA C C 13 179.893 0.00 . 1 . . . . . 134 ALA C . 52001 1
557 . 1 . 1 134 134 ALA CA C 13 55.843 0.00 . 1 . . . . . 134 ALA CA . 52001 1
558 . 1 . 1 134 134 ALA N N 15 121.538 0.03 . 1 . . . . . 134 ALA N . 52001 1
559 . 1 . 1 135 135 ARG H H 1 8.487 0.00 . 1 . . . . . 135 ARG H . 52001 1
560 . 1 . 1 135 135 ARG C C 13 179.935 0.00 . 1 . . . . . 135 ARG C . 52001 1
561 . 1 . 1 135 135 ARG CA C 13 59.386 0.00 . 1 . . . . . 135 ARG CA . 52001 1
562 . 1 . 1 135 135 ARG CB C 13 29.800 0.00 . 1 . . . . . 135 ARG CB . 52001 1
563 . 1 . 1 135 135 ARG N N 15 118.279 0.03 . 1 . . . . . 135 ARG N . 52001 1
564 . 1 . 1 136 136 SER H H 1 7.931 0.00 . 1 . . . . . 136 SER H . 52001 1
565 . 1 . 1 136 136 SER C C 13 176.177 0.00 . 1 . . . . . 136 SER C . 52001 1
566 . 1 . 1 136 136 SER CA C 13 61.514 0.04 . 1 . . . . . 136 SER CA . 52001 1
567 . 1 . 1 136 136 SER CB C 13 62.575 0.03 . 1 . . . . . 136 SER CB . 52001 1
568 . 1 . 1 136 136 SER N N 15 117.608 0.03 . 1 . . . . . 136 SER N . 52001 1
569 . 1 . 1 137 137 TYR H H 1 7.605 0.00 . 1 . . . . . 137 TYR H . 52001 1
570 . 1 . 1 137 137 TYR C C 13 176.256 0.00 . 1 . . . . . 137 TYR C . 52001 1
571 . 1 . 1 137 137 TYR CA C 13 54.924 0.02 . 1 . . . . . 137 TYR CA . 52001 1
572 . 1 . 1 137 137 TYR CB C 13 38.867 0.00 . 1 . . . . . 137 TYR CB . 52001 1
573 . 1 . 1 137 137 TYR N N 15 119.796 0.04 . 1 . . . . . 137 TYR N . 52001 1
574 . 1 . 1 138 138 GLY H H 1 8.308 0.00 . 1 . . . . . 138 GLY H . 52001 1
575 . 1 . 1 138 138 GLY C C 13 175.108 0.00 . 1 . . . . . 138 GLY C . 52001 1
576 . 1 . 1 138 138 GLY CA C 13 46.501 0.00 . 1 . . . . . 138 GLY CA . 52001 1
577 . 1 . 1 138 138 GLY N N 15 110.955 0.02 . 1 . . . . . 138 GLY N . 52001 1
578 . 1 . 1 139 139 ILE H H 1 8.009 0.00 . 1 . . . . . 139 ILE H . 52001 1
579 . 1 . 1 139 139 ILE N N 15 112.659 0.03 . 1 . . . . . 139 ILE N . 52001 1
580 . 1 . 1 140 140 PRO C C 13 174.626 0.00 . 1 . . . . . 140 PRO C . 52001 1
581 . 1 . 1 140 140 PRO CA C 13 62.426 0.00 . 1 . . . . . 140 PRO CA . 52001 1
582 . 1 . 1 141 141 PHE H H 1 8.307 0.01 . 1 . . . . . 141 PHE H . 52001 1
583 . 1 . 1 141 141 PHE C C 13 173.849 0.00 . 1 . . . . . 141 PHE C . 52001 1
584 . 1 . 1 141 141 PHE CA C 13 54.710 0.00 . 1 . . . . . 141 PHE CA . 52001 1
585 . 1 . 1 141 141 PHE N N 15 120.155 0.02 . 1 . . . . . 141 PHE N . 52001 1
586 . 1 . 1 142 142 ILE H H 1 8.440 0.00 . 1 . . . . . 142 ILE H . 52001 1
587 . 1 . 1 142 142 ILE C C 13 172.471 0.00 . 1 . . . . . 142 ILE C . 52001 1
588 . 1 . 1 142 142 ILE CA C 13 59.618 0.00 . 1 . . . . . 142 ILE CA . 52001 1
589 . 1 . 1 142 142 ILE N N 15 130.283 0.01 . 1 . . . . . 142 ILE N . 52001 1
590 . 1 . 1 143 143 GLU H H 1 7.968 0.01 . 1 . . . . . 143 GLU H . 52001 1
591 . 1 . 1 143 143 GLU C C 13 176.324 0.00 . 1 . . . . . 143 GLU C . 52001 1
592 . 1 . 1 143 143 GLU CA C 13 55.195 0.00 . 1 . . . . . 143 GLU CA . 52001 1
593 . 1 . 1 143 143 GLU N N 15 125.536 0.01 . 1 . . . . . 143 GLU N . 52001 1
594 . 1 . 1 144 144 THR H H 1 8.656 0.00 . 1 . . . . . 144 THR H . 52001 1
595 . 1 . 1 144 144 THR C C 13 176.511 0.00 . 1 . . . . . 144 THR C . 52001 1
596 . 1 . 1 144 144 THR CA C 13 59.797 0.00 . 1 . . . . . 144 THR CA . 52001 1
597 . 1 . 1 144 144 THR N N 15 112.300 0.01 . 1 . . . . . 144 THR N . 52001 1
598 . 1 . 1 145 145 SER H H 1 8.342 0.00 . 1 . . . . . 145 SER H . 52001 1
599 . 1 . 1 145 145 SER C C 13 175.778 0.00 . 1 . . . . . 145 SER C . 52001 1
600 . 1 . 1 145 145 SER CA C 13 57.553 0.00 . 1 . . . . . 145 SER CA . 52001 1
601 . 1 . 1 145 145 SER N N 15 111.733 0.00 . 1 . . . . . 145 SER N . 52001 1
602 . 1 . 1 146 146 ALA H H 1 9.140 0.01 . 1 . . . . . 146 ALA H . 52001 1
603 . 1 . 1 146 146 ALA C C 13 176.540 0.35 . 1 . . . . . 146 ALA C . 52001 1
604 . 1 . 1 146 146 ALA CA C 13 54.818 0.00 . 1 . . . . . 146 ALA CA . 52001 1
605 . 1 . 1 146 146 ALA N N 15 132.595 0.03 . 1 . . . . . 146 ALA N . 52001 1
606 . 1 . 1 147 147 LYS H H 1 7.064 0.06 . 1 . . . . . 147 LYS H . 52001 1
607 . 1 . 1 147 147 LYS C C 13 176.937 0.00 . 1 . . . . . 147 LYS C . 52001 1
608 . 1 . 1 147 147 LYS CA C 13 58.308 0.00 . 1 . . . . . 147 LYS CA . 52001 1
609 . 1 . 1 147 147 LYS N N 15 116.286 0.07 . 1 . . . . . 147 LYS N . 52001 1
610 . 1 . 1 148 148 THR H H 1 7.736 0.02 . 1 . . . . . 148 THR H . 52001 1
611 . 1 . 1 148 148 THR C C 13 175.178 0.00 . 1 . . . . . 148 THR C . 52001 1
612 . 1 . 1 148 148 THR CA C 13 60.951 0.00 . 1 . . . . . 148 THR CA . 52001 1
613 . 1 . 1 148 148 THR N N 15 106.073 0.04 . 1 . . . . . 148 THR N . 52001 1
614 . 1 . 1 149 149 ARG H H 1 7.522 0.00 . 1 . . . . . 149 ARG H . 52001 1
615 . 1 . 1 149 149 ARG C C 13 175.168 0.00 . 1 . . . . . 149 ARG C . 52001 1
616 . 1 . 1 149 149 ARG CA C 13 58.820 0.00 . 1 . . . . . 149 ARG CA . 52001 1
617 . 1 . 1 149 149 ARG N N 15 120.273 0.04 . 1 . . . . . 149 ARG N . 52001 1
618 . 1 . 1 150 150 GLN H H 1 7.941 0.00 . 1 . . . . . 150 GLN H . 52001 1
619 . 1 . 1 150 150 GLN C C 13 175.111 0.00 . 1 . . . . . 150 GLN C . 52001 1
620 . 1 . 1 150 150 GLN CA C 13 57.241 0.00 . 1 . . . . . 150 GLN CA . 52001 1
621 . 1 . 1 150 150 GLN N N 15 122.746 0.02 . 1 . . . . . 150 GLN N . 52001 1
622 . 1 . 1 151 151 ARG H H 1 9.143 0.00 . 1 . . . . . 151 ARG H . 52001 1
623 . 1 . 1 151 151 ARG C C 13 174.310 0.02 . 1 . . . . . 151 ARG C . 52001 1
624 . 1 . 1 151 151 ARG CA C 13 58.509 0.00 . 1 . . . . . 151 ARG CA . 52001 1
625 . 1 . 1 151 151 ARG N N 15 119.474 0.03 . 1 . . . . . 151 ARG N . 52001 1
626 . 1 . 1 152 152 VAL H H 1 7.366 0.02 . 1 . . . . . 152 VAL H . 52001 1
627 . 1 . 1 152 152 VAL C C 13 177.616 0.00 . 1 . . . . . 152 VAL C . 52001 1
628 . 1 . 1 152 152 VAL CA C 13 67.874 0.00 . 1 . . . . . 152 VAL CA . 52001 1
629 . 1 . 1 152 152 VAL N N 15 119.800 0.07 . 1 . . . . . 152 VAL N . 52001 1
630 . 1 . 1 153 153 GLU H H 1 8.232 0.00 . 1 . . . . . 153 GLU H . 52001 1
631 . 1 . 1 153 153 GLU C C 13 177.386 0.00 . 1 . . . . . 153 GLU C . 52001 1
632 . 1 . 1 153 153 GLU CA C 13 60.523 0.00 . 1 . . . . . 153 GLU CA . 52001 1
633 . 1 . 1 153 153 GLU N N 15 117.120 0.02 . 1 . . . . . 153 GLU N . 52001 1
634 . 1 . 1 154 154 ASP H H 1 7.801 0.00 . 1 . . . . . 154 ASP H . 52001 1
635 . 1 . 1 154 154 ASP C C 13 179.139 0.00 . 1 . . . . . 154 ASP C . 52001 1
636 . 1 . 1 154 154 ASP CA C 13 57.131 0.00 . 1 . . . . . 154 ASP CA . 52001 1
637 . 1 . 1 154 154 ASP N N 15 114.925 0.03 . 1 . . . . . 154 ASP N . 52001 1
638 . 1 . 1 155 155 ALA H H 1 8.058 0.00 . 1 . . . . . 155 ALA H . 52001 1
639 . 1 . 1 155 155 ALA C C 13 177.546 0.00 . 1 . . . . . 155 ALA C . 52001 1
640 . 1 . 1 155 155 ALA CA C 13 56.335 0.00 . 1 . . . . . 155 ALA CA . 52001 1
641 . 1 . 1 155 155 ALA N N 15 123.543 0.04 . 1 . . . . . 155 ALA N . 52001 1
642 . 1 . 1 156 156 PHE H H 1 7.155 0.00 . 1 . . . . . 156 PHE H . 52001 1
643 . 1 . 1 156 156 PHE C C 13 178.147 0.00 . 1 . . . . . 156 PHE C . 52001 1
644 . 1 . 1 156 156 PHE CA C 13 62.879 0.00 . 1 . . . . . 156 PHE CA . 52001 1
645 . 1 . 1 156 156 PHE N N 15 112.813 0.04 . 1 . . . . . 156 PHE N . 52001 1
646 . 1 . 1 157 157 TYR H H 1 9.680 0.00 . 1 . . . . . 157 TYR H . 52001 1
647 . 1 . 1 157 157 TYR C C 13 178.934 0.00 . 1 . . . . . 157 TYR C . 52001 1
648 . 1 . 1 157 157 TYR CA C 13 58.218 0.00 . 1 . . . . . 157 TYR CA . 52001 1
649 . 1 . 1 157 157 TYR N N 15 119.540 0.02 . 1 . . . . . 157 TYR N . 52001 1
650 . 1 . 1 158 158 THR H H 1 8.416 0.00 . 1 . . . . . 158 THR H . 52001 1
651 . 1 . 1 158 158 THR C C 13 175.663 0.00 . 1 . . . . . 158 THR C . 52001 1
652 . 1 . 1 158 158 THR CA C 13 68.023 0.00 . 1 . . . . . 158 THR CA . 52001 1
653 . 1 . 1 158 158 THR N N 15 117.125 0.01 . 1 . . . . . 158 THR N . 52001 1
654 . 1 . 1 159 159 LEU H H 1 7.136 0.01 . 1 . . . . . 159 LEU H . 52001 1
655 . 1 . 1 159 159 LEU C C 13 177.544 0.00 . 1 . . . . . 159 LEU C . 52001 1
656 . 1 . 1 159 159 LEU CA C 13 58.036 0.00 . 1 . . . . . 159 LEU CA . 52001 1
657 . 1 . 1 159 159 LEU CB C 13 40.365 0.00 . 1 . . . . . 159 LEU CB . 52001 1
658 . 1 . 1 159 159 LEU N N 15 121.709 0.05 . 1 . . . . . 159 LEU N . 52001 1
659 . 1 . 1 160 160 VAL H H 1 7.690 0.00 . 1 . . . . . 160 VAL H . 52001 1
660 . 1 . 1 160 160 VAL C C 13 177.211 0.00 . 1 . . . . . 160 VAL C . 52001 1
661 . 1 . 1 160 160 VAL CA C 13 67.583 0.00 . 1 . . . . . 160 VAL CA . 52001 1
662 . 1 . 1 160 160 VAL CB C 13 30.794 0.01 . 1 . . . . . 160 VAL CB . 52001 1
663 . 1 . 1 160 160 VAL N N 15 119.546 0.03 . 1 . . . . . 160 VAL N . 52001 1
664 . 1 . 1 161 161 ARG H H 1 8.118 0.01 . 1 . . . . . 161 ARG H . 52001 1
665 . 1 . 1 161 161 ARG C C 13 179.503 0.00 . 1 . . . . . 161 ARG C . 52001 1
666 . 1 . 1 161 161 ARG CA C 13 61.025 0.03 . 1 . . . . . 161 ARG CA . 52001 1
667 . 1 . 1 161 161 ARG CB C 13 29.493 0.13 . 1 . . . . . 161 ARG CB . 52001 1
668 . 1 . 1 161 161 ARG N N 15 118.675 0.03 . 1 . . . . . 161 ARG N . 52001 1
669 . 1 . 1 162 162 GLU H H 1 8.187 0.01 . 1 . . . . . 162 GLU H . 52001 1
670 . 1 . 1 162 162 GLU C C 13 179.622 0.00 . 1 . . . . . 162 GLU C . 52001 1
671 . 1 . 1 162 162 GLU CA C 13 59.081 0.02 . 1 . . . . . 162 GLU CA . 52001 1
672 . 1 . 1 162 162 GLU CB C 13 30.397 0.01 . 1 . . . . . 162 GLU CB . 52001 1
673 . 1 . 1 162 162 GLU N N 15 119.599 0.05 . 1 . . . . . 162 GLU N . 52001 1
674 . 1 . 1 163 163 ILE H H 1 8.318 0.01 . 1 . . . . . 163 ILE H . 52001 1
675 . 1 . 1 163 163 ILE C C 13 178.005 0.00 . 1 . . . . . 163 ILE C . 52001 1
676 . 1 . 1 163 163 ILE CA C 13 66.185 0.00 . 1 . . . . . 163 ILE CA . 52001 1
677 . 1 . 1 163 163 ILE N N 15 122.075 0.07 . 1 . . . . . 163 ILE N . 52001 1
678 . 1 . 1 164 164 ARG H H 1 8.803 0.01 . 1 . . . . . 164 ARG H . 52001 1
679 . 1 . 1 164 164 ARG C C 13 179.168 0.00 . 1 . . . . . 164 ARG C . 52001 1
680 . 1 . 1 164 164 ARG CA C 13 60.330 0.00 . 1 . . . . . 164 ARG CA . 52001 1
681 . 1 . 1 164 164 ARG N N 15 119.313 0.01 . 1 . . . . . 164 ARG N . 52001 1
682 . 1 . 1 165 165 GLN H H 1 7.799 0.00 . 1 . . . . . 165 GLN H . 52001 1
683 . 1 . 1 165 165 GLN C C 13 178.645 0.00 . 1 . . . . . 165 GLN C . 52001 1
684 . 1 . 1 165 165 GLN CA C 13 58.332 0.00 . 1 . . . . . 165 GLN CA . 52001 1
685 . 1 . 1 165 165 GLN N N 15 115.793 0.01 . 1 . . . . . 165 GLN N . 52001 1
686 . 1 . 1 166 166 TYR H H 1 8.202 0.00 . 1 . . . . . 166 TYR H . 52001 1
687 . 1 . 1 166 166 TYR C C 13 178.082 0.00 . 1 . . . . . 166 TYR C . 52001 1
688 . 1 . 1 166 166 TYR CA C 13 61.348 0.00 . 1 . . . . . 166 TYR CA . 52001 1
689 . 1 . 1 166 166 TYR CB C 13 39.101 0.00 . 1 . . . . . 166 TYR CB . 52001 1
690 . 1 . 1 166 166 TYR N N 15 122.384 0.04 . 1 . . . . . 166 TYR N . 52001 1
691 . 1 . 1 167 167 ARG H H 1 8.210 0.00 . 1 . . . . . 167 ARG H . 52001 1
692 . 1 . 1 167 167 ARG C C 13 177.060 0.00 . 1 . . . . . 167 ARG C . 52001 1
693 . 1 . 1 167 167 ARG CA C 13 58.214 0.01 . 1 . . . . . 167 ARG CA . 52001 1
694 . 1 . 1 167 167 ARG CB C 13 31.138 0.00 . 1 . . . . . 167 ARG CB . 52001 1
695 . 1 . 1 167 167 ARG N N 15 117.435 0.05 . 1 . . . . . 167 ARG N . 52001 1
696 . 1 . 1 168 168 LEU H H 1 7.409 0.00 . 1 . . . . . 168 LEU H . 52001 1
697 . 1 . 1 168 168 LEU C C 13 176.689 0.00 . 1 . . . . . 168 LEU C . 52001 1
698 . 1 . 1 168 168 LEU CA C 13 55.049 0.00 . 1 . . . . . 168 LEU CA . 52001 1
699 . 1 . 1 168 168 LEU N N 15 119.021 0.01 . 1 . . . . . 168 LEU N . 52001 1
700 . 1 . 1 169 169 LYS H H 1 7.340 0.00 . 1 . . . . . 169 LYS H . 52001 1
701 . 1 . 1 169 169 LYS CA C 13 58.770 0.00 . 1 . . . . . 169 LYS CA . 52001 1
702 . 1 . 1 169 169 LYS N N 15 125.931 0.02 . 1 . . . . . 169 LYS N . 52001 1
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