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 18479
_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' . . . 18479 1
2 '3D HNCO' . . . 18479 1
3 '3D HN(CA)CO' . . . 18479 1
4 '3D HNCA' . . . 18479 1
5 '3D HNCACB' . . . 18479 1
6 '3D HN(CO)CACB' . . . 18479 1
7 '3D HN(CO)CA' . . . 18479 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 1 1 MET C C 13 173.127 0.000 1 1 . . . . 1 M C . 18479 1
2 . 1 1 1 1 MET CA C 13 55.120 0.030 4 1 . . . . 1 M CA . 18479 1
3 . 1 1 1 1 MET CB C 13 33.928 0.041 2 1 . . . . 1 M CB . 18479 1
4 . 1 1 2 2 THR H H 1 8.886 0.002 13 1 . . . . 2 T H . 18479 1
5 . 1 1 2 2 THR C C 13 171.708 0.015 3 1 . . . . 2 T C . 18479 1
6 . 1 1 2 2 THR CA C 13 63.668 0.094 6 1 . . . . 2 T CA . 18479 1
7 . 1 1 2 2 THR CB C 13 69.400 0.034 3 1 . . . . 2 T CB . 18479 1
8 . 1 1 2 2 THR N N 15 127.581 0.018 13 1 . . . . 2 T N . 18479 1
9 . 1 1 3 3 GLU H H 1 8.317 0.001 14 1 . . . . 3 E H . 18479 1
10 . 1 1 3 3 GLU C C 13 174.960 0.003 2 1 . . . . 3 E C . 18479 1
11 . 1 1 3 3 GLU CA C 13 53.809 0.100 6 1 . . . . 3 E CA . 18479 1
12 . 1 1 3 3 GLU CB C 13 32.102 0.056 3 1 . . . . 3 E CB . 18479 1
13 . 1 1 3 3 GLU N N 15 129.657 0.012 14 1 . . . . 3 E N . 18479 1
14 . 1 1 4 4 TYR H H 1 8.703 0.003 13 1 . . . . 4 Y H . 18479 1
15 . 1 1 4 4 TYR C C 13 174.458 0.012 3 1 . . . . 4 Y C . 18479 1
16 . 1 1 4 4 TYR CA C 13 56.465 0.163 6 1 . . . . 4 Y CA . 18479 1
17 . 1 1 4 4 TYR CB C 13 41.436 0.158 3 1 . . . . 4 Y CB . 18479 1
18 . 1 1 4 4 TYR N N 15 124.639 0.011 13 1 . . . . 4 Y N . 18479 1
19 . 1 1 5 5 LYS H H 1 9.147 0.003 14 1 . . . . 5 K H . 18479 1
20 . 1 1 5 5 LYS C C 13 175.319 0.008 3 1 . . . . 5 K C . 18479 1
21 . 1 1 5 5 LYS CA C 13 55.326 0.052 6 1 . . . . 5 K CA . 18479 1
22 . 1 1 5 5 LYS CB C 13 32.807 0.076 3 1 . . . . 5 K CB . 18479 1
23 . 1 1 5 5 LYS N N 15 127.552 0.022 14 1 . . . . 5 K N . 18479 1
24 . 1 1 6 6 LEU H H 1 9.424 0.003 14 1 . . . . 6 L H . 18479 1
25 . 1 1 6 6 LEU C C 13 175.582 0.001 2 1 . . . . 6 L C . 18479 1
26 . 1 1 6 6 LEU CA C 13 52.397 0.046 6 1 . . . . 6 L CA . 18479 1
27 . 1 1 6 6 LEU CB C 13 43.939 0.024 3 1 . . . . 6 L CB . 18479 1
28 . 1 1 6 6 LEU N N 15 129.177 0.012 14 1 . . . . 6 L N . 18479 1
29 . 1 1 7 7 VAL H H 1 7.864 0.004 13 1 . . . . 7 V H . 18479 1
30 . 1 1 7 7 VAL C C 13 174.074 0.007 3 1 . . . . 7 V C . 18479 1
31 . 1 1 7 7 VAL CA C 13 61.217 0.065 6 1 . . . . 7 V CA . 18479 1
32 . 1 1 7 7 VAL CB C 13 34.199 0.043 3 1 . . . . 7 V CB . 18479 1
33 . 1 1 7 7 VAL N N 15 123.432 0.004 13 1 . . . . 7 V N . 18479 1
34 . 1 1 8 8 VAL H H 1 8.910 0.002 14 1 . . . . 8 V H . 18479 1
35 . 1 1 8 8 VAL C C 13 175.430 0.019 3 1 . . . . 8 V C . 18479 1
36 . 1 1 8 8 VAL CA C 13 62.173 0.043 6 1 . . . . 8 V CA . 18479 1
37 . 1 1 8 8 VAL CB C 13 32.462 0.035 3 1 . . . . 8 V CB . 18479 1
38 . 1 1 8 8 VAL N N 15 131.951 0.016 14 1 . . . . 8 V N . 18479 1
39 . 1 1 9 9 VAL H H 1 9.142 0.003 14 1 . . . . 9 V H . 18479 1
40 . 1 1 9 9 VAL C C 13 172.698 0.018 3 1 . . . . 9 V C . 18479 1
41 . 1 1 9 9 VAL CA C 13 59.305 0.090 6 1 . . . . 9 V CA . 18479 1
42 . 1 1 9 9 VAL CB C 13 35.390 0.093 3 1 . . . . 9 V CB . 18479 1
43 . 1 1 9 9 VAL N N 15 123.560 0.007 14 1 . . . . 9 V N . 18479 1
44 . 1 1 10 10 GLY H H 1 7.089 0.005 12 1 . . . . 10 G H . 18479 1
45 . 1 1 10 10 GLY C C 13 172.626 0.010 2 1 . . . . 10 G C . 18479 1
46 . 1 1 10 10 GLY CA C 13 43.633 0.035 6 1 . . . . 10 G CA . 18479 1
47 . 1 1 10 10 GLY N N 15 110.488 0.003 12 1 . . . . 10 G N . 18479 1
48 . 1 1 11 11 ALA H H 1 9.160 0.006 12 1 . . . . 11 A H . 18479 1
49 . 1 1 11 11 ALA C C 13 177.358 0.004 3 1 . . . . 11 A C . 18479 1
50 . 1 1 11 11 ALA CA C 13 52.572 0.029 6 1 . . . . 11 A CA . 18479 1
51 . 1 1 11 11 ALA CB C 13 19.375 0.018 3 1 . . . . 11 A CB . 18479 1
52 . 1 1 11 11 ALA N N 15 126.643 0.012 12 1 . . . . 11 A N . 18479 1
53 . 1 1 12 12 GLY H H 1 8.596 0.002 13 1 . . . . 12 G H . 18479 1
54 . 1 1 12 12 GLY C C 13 175.914 0.007 3 1 . . . . 12 G C . 18479 1
55 . 1 1 12 12 GLY CA C 13 47.019 0.080 5 1 . . . . 12 G CA . 18479 1
56 . 1 1 12 12 GLY N N 15 109.242 0.013 13 1 . . . . 12 G N . 18479 1
57 . 1 1 13 13 GLY H H 1 10.542 0.003 10 1 . . . . 13 G H . 18479 1
58 . 1 1 13 13 GLY C C 13 175.269 0.012 2 1 . . . . 13 G C . 18479 1
59 . 1 1 13 13 GLY CA C 13 46.327 0.157 6 1 . . . . 13 G CA . 18479 1
60 . 1 1 13 13 GLY N N 15 118.042 0.010 10 1 . . . . 13 G N . 18479 1
61 . 1 1 14 14 VAL H H 1 7.641 0.004 11 1 . . . . 14 V H . 18479 1
62 . 1 1 14 14 VAL C C 13 174.360 0.004 3 1 . . . . 14 V C . 18479 1
63 . 1 1 14 14 VAL CA C 13 62.722 0.064 5 1 . . . . 14 V CA . 18479 1
64 . 1 1 14 14 VAL CB C 13 31.900 0.077 3 1 . . . . 14 V CB . 18479 1
65 . 1 1 14 14 VAL N N 15 116.479 0.011 11 1 . . . . 14 V N . 18479 1
66 . 1 1 15 15 GLY H H 1 8.553 0.007 12 1 . . . . 15 G H . 18479 1
67 . 1 1 15 15 GLY C C 13 173.763 0.001 2 1 . . . . 15 G C . 18479 1
68 . 1 1 15 15 GLY CA C 13 46.092 0.047 6 1 . . . . 15 G CA . 18479 1
69 . 1 1 15 15 GLY N N 15 112.574 0.011 12 1 . . . . 15 G N . 18479 1
70 . 1 1 16 16 LYS H H 1 10.559 0.003 11 1 . . . . 16 K H . 18479 1
71 . 1 1 16 16 LYS C C 13 179.654 0.007 3 1 . . . . 16 K C . 18479 1
72 . 1 1 16 16 LYS CA C 13 61.238 0.041 5 1 . . . . 16 K CA . 18479 1
73 . 1 1 16 16 LYS CB C 13 29.365 0.040 3 1 . . . . 16 K CB . 18479 1
74 . 1 1 16 16 LYS N N 15 128.421 0.007 11 1 . . . . 16 K N . 18479 1
75 . 1 1 17 17 SER H H 1 9.313 0.003 10 1 . . . . 17 S H . 18479 1
76 . 1 1 17 17 SER C C 13 175.711 0.000 1 1 . . . . 17 S C . 18479 1
77 . 1 1 17 17 SER CA C 13 61.314 0.176 4 1 . . . . 17 S CA . 18479 1
78 . 1 1 17 17 SER N N 15 123.526 0.010 10 1 . . . . 17 S N . 18479 1
79 . 1 1 18 18 ALA H H 1 9.475 0.001 10 1 . . . . 18 A H . 18479 1
80 . 1 1 18 18 ALA C C 13 182.029 0.005 3 1 . . . . 18 A C . 18479 1
81 . 1 1 18 18 ALA CA C 13 54.430 0.049 6 1 . . . . 18 A CA . 18479 1
82 . 1 1 18 18 ALA CB C 13 18.674 0.079 3 1 . . . . 18 A CB . 18479 1
83 . 1 1 18 18 ALA N N 15 128.327 0.021 10 1 . . . . 18 A N . 18479 1
84 . 1 1 19 19 LEU H H 1 9.044 0.004 14 1 . . . . 19 L H . 18479 1
85 . 1 1 19 19 LEU C C 13 177.589 0.007 3 1 . . . . 19 L C . 18479 1
86 . 1 1 19 19 LEU CA C 13 58.921 0.083 6 1 . . . . 19 L CA . 18479 1
87 . 1 1 19 19 LEU CB C 13 43.337 0.168 3 1 . . . . 19 L CB . 18479 1
88 . 1 1 19 19 LEU N N 15 123.650 0.025 14 1 . . . . 19 L N . 18479 1
89 . 1 1 20 20 THR H H 1 7.663 0.005 12 1 . . . . 20 T H . 18479 1
90 . 1 1 20 20 THR C C 13 175.859 0.000 1 1 . . . . 20 T C . 18479 1
91 . 1 1 20 20 THR CA C 13 68.264 0.036 5 1 . . . . 20 T CA . 18479 1
92 . 1 1 20 20 THR N N 15 119.879 0.004 12 1 . . . . 20 T N . 18479 1
93 . 1 1 21 21 ILE H H 1 8.864 0.002 10 1 . . . . 21 I H . 18479 1
94 . 1 1 21 21 ILE C C 13 178.908 0.003 3 1 . . . . 21 I C . 18479 1
95 . 1 1 21 21 ILE CA C 13 64.866 0.065 6 1 . . . . 21 I CA . 18479 1
96 . 1 1 21 21 ILE CB C 13 36.342 0.045 3 1 . . . . 21 I CB . 18479 1
97 . 1 1 21 21 ILE N N 15 123.704 0.017 10 1 . . . . 21 I N . 18479 1
98 . 1 1 22 22 GLN H H 1 7.911 0.002 14 1 . . . . 22 Q H . 18479 1
99 . 1 1 22 22 GLN C C 13 179.252 0.025 3 1 . . . . 22 Q C . 18479 1
100 . 1 1 22 22 GLN CA C 13 59.042 0.022 6 1 . . . . 22 Q CA . 18479 1
101 . 1 1 22 22 GLN CB C 13 29.754 0.043 3 1 . . . . 22 Q CB . 18479 1
102 . 1 1 22 22 GLN N N 15 123.760 0.010 14 1 . . . . 22 Q N . 18479 1
103 . 1 1 23 23 LEU H H 1 7.649 0.004 14 1 . . . . 23 L H . 18479 1
104 . 1 1 23 23 LEU C C 13 178.192 0.005 3 1 . . . . 23 L C . 18479 1
105 . 1 1 23 23 LEU CA C 13 58.149 0.062 6 1 . . . . 23 L CA . 18479 1
106 . 1 1 23 23 LEU CB C 13 40.567 0.072 3 1 . . . . 23 L CB . 18479 1
107 . 1 1 23 23 LEU N N 15 123.408 0.015 14 1 . . . . 23 L N . 18479 1
108 . 1 1 24 24 ILE H H 1 8.092 0.003 14 1 . . . . 24 I H . 18479 1
109 . 1 1 24 24 ILE C C 13 177.552 0.003 3 1 . . . . 24 I C . 18479 1
110 . 1 1 24 24 ILE CA C 13 62.200 0.058 6 1 . . . . 24 I CA . 18479 1
111 . 1 1 24 24 ILE CB C 13 37.048 0.043 3 1 . . . . 24 I CB . 18479 1
112 . 1 1 24 24 ILE N N 15 117.235 0.021 14 1 . . . . 24 I N . 18479 1
113 . 1 1 25 25 GLN H H 1 8.987 0.006 14 1 . . . . 25 Q H . 18479 1
114 . 1 1 25 25 GLN C C 13 176.222 0.016 3 1 . . . . 25 Q C . 18479 1
115 . 1 1 25 25 GLN CA C 13 55.315 0.054 6 1 . . . . 25 Q CA . 18479 1
116 . 1 1 25 25 GLN CB C 13 30.345 0.084 3 1 . . . . 25 Q CB . 18479 1
117 . 1 1 25 25 GLN N N 15 118.960 0.004 14 1 . . . . 25 Q N . 18479 1
118 . 1 1 26 26 ASN H H 1 7.917 0.003 14 1 . . . . 26 N H . 18479 1
119 . 1 1 26 26 ASN C C 13 173.968 0.007 3 1 . . . . 26 N C . 18479 1
120 . 1 1 26 26 ASN CA C 13 54.506 0.085 6 1 . . . . 26 N CA . 18479 1
121 . 1 1 26 26 ASN CB C 13 36.995 0.000 3 1 . . . . 26 N CB . 18479 1
122 . 1 1 26 26 ASN N N 15 119.368 0.009 14 1 . . . . 26 N N . 18479 1
123 . 1 1 27 27 HIS H H 1 6.716 0.007 14 1 . . . . 27 H H . 18479 1
124 . 1 1 27 27 HIS C C 13 172.622 0.007 3 1 . . . . 27 H C . 18479 1
125 . 1 1 27 27 HIS CA C 13 54.643 0.040 6 1 . . . . 27 H CA . 18479 1
126 . 1 1 27 27 HIS CB C 13 32.722 0.071 3 1 . . . . 27 H CB . 18479 1
127 . 1 1 27 27 HIS N N 15 114.397 0.005 14 1 . . . . 27 H N . 18479 1
128 . 1 1 28 28 PHE H H 1 8.460 0.003 14 1 . . . . 28 F H . 18479 1
129 . 1 1 28 28 PHE C C 13 174.523 0.025 3 1 . . . . 28 F C . 18479 1
130 . 1 1 28 28 PHE CA C 13 55.085 0.062 6 1 . . . . 28 F CA . 18479 1
131 . 1 1 28 28 PHE CB C 13 39.860 0.037 3 1 . . . . 28 F CB . 18479 1
132 . 1 1 28 28 PHE N N 15 125.256 0.011 14 1 . . . . 28 F N . 18479 1
133 . 1 1 29 29 VAL H H 1 7.702 0.003 14 1 . . . . 29 V H . 18479 1
134 . 1 1 29 29 VAL C C 13 173.418 0.009 3 1 . . . . 29 V C . 18479 1
135 . 1 1 29 29 VAL CA C 13 59.984 0.046 6 1 . . . . 29 V CA . 18479 1
136 . 1 1 29 29 VAL CB C 13 32.486 0.010 3 1 . . . . 29 V CB . 18479 1
137 . 1 1 29 29 VAL N N 15 128.908 0.006 14 1 . . . . 29 V N . 18479 1
138 . 1 1 30 30 ASP H H 1 7.743 0.002 14 1 . . . . 30 D H . 18479 1
139 . 1 1 30 30 ASP C C 13 176.152 0.008 2 1 . . . . 30 D C . 18479 1
140 . 1 1 30 30 ASP CA C 13 54.632 0.058 5 1 . . . . 30 D CA . 18479 1
141 . 1 1 30 30 ASP CB C 13 41.370 0.094 3 1 . . . . 30 D CB . 18479 1
142 . 1 1 30 30 ASP N N 15 125.281 0.011 14 1 . . . . 30 D N . 18479 1
143 . 1 1 31 31 GLU H H 1 7.664 0.004 12 1 . . . . 31 E H . 18479 1
144 . 1 1 31 31 GLU C C 13 174.273 0.008 3 1 . . . . 31 E C . 18479 1
145 . 1 1 31 31 GLU CA C 13 55.617 0.093 6 1 . . . . 31 E CA . 18479 1
146 . 1 1 31 31 GLU CB C 13 30.625 0.048 3 1 . . . . 31 E CB . 18479 1
147 . 1 1 31 31 GLU N N 15 122.118 0.016 12 1 . . . . 31 E N . 18479 1
148 . 1 1 32 32 TYR H H 1 8.790 0.001 14 1 . . . . 32 Y H . 18479 1
149 . 1 1 32 32 TYR C C 13 175.213 0.005 3 1 . . . . 32 Y C . 18479 1
150 . 1 1 32 32 TYR CA C 13 58.777 0.029 6 1 . . . . 32 Y CA . 18479 1
151 . 1 1 32 32 TYR CB C 13 39.827 0.008 3 1 . . . . 32 Y CB . 18479 1
152 . 1 1 32 32 TYR N N 15 128.666 0.014 14 1 . . . . 32 Y N . 18479 1
153 . 1 1 33 33 ASP H H 1 7.847 0.003 13 1 . . . . 33 D H . 18479 1
154 . 1 1 33 33 ASP CA C 13 52.553 0.013 2 1 . . . . 33 D CA . 18479 1
155 . 1 1 33 33 ASP CB C 13 41.528 0.000 1 1 . . . . 33 D CB . 18479 1
156 . 1 1 33 33 ASP N N 15 131.866 0.027 13 1 . . . . 33 D N . 18479 1
157 . 1 1 34 34 PRO C C 13 178.519 0.006 2 1 . . . . 34 P C . 18479 1
158 . 1 1 34 34 PRO CA C 13 63.882 0.042 4 1 . . . . 34 P CA . 18479 1
159 . 1 1 34 34 PRO CB C 13 33.211 0.066 2 1 . . . . 34 P CB . 18479 1
160 . 1 1 35 35 THR H H 1 8.963 0.003 14 1 . . . . 35 T H . 18479 1
161 . 1 1 35 35 THR C C 13 174.647 0.109 3 1 . . . . 35 T C . 18479 1
162 . 1 1 35 35 THR CA C 13 62.135 0.027 3 1 . . . . 35 T CA . 18479 1
163 . 1 1 35 35 THR CB C 13 70.099 0.000 1 1 . . . . 35 T CB . 18479 1
164 . 1 1 35 35 THR N N 15 112.919 0.014 14 1 . . . . 35 T N . 18479 1
165 . 1 1 36 36 ILE H H 1 6.802 0.001 5 1 . . . . 36 I H . 18479 1
166 . 1 1 36 36 ILE C C 13 174.798 0.000 1 1 . . . . 36 I C . 18479 1
167 . 1 1 36 36 ILE CA C 13 62.130 11.286 6 1 . . . . 36 I CA . 18479 1
168 . 1 1 36 36 ILE N N 15 123.873 0.003 5 1 . . . . 36 I N . 18479 1
169 . 1 1 37 37 GLU H H 1 8.397 0.004 13 1 . . . . 37 E H . 18479 1
170 . 1 1 37 37 GLU C C 13 174.159 0.003 2 1 . . . . 37 E C . 18479 1
171 . 1 1 37 37 GLU CA C 13 54.556 0.036 6 1 . . . . 37 E CA . 18479 1
172 . 1 1 37 37 GLU CB C 13 32.607 0.037 3 1 . . . . 37 E CB . 18479 1
173 . 1 1 37 37 GLU N N 15 135.015 0.021 13 1 . . . . 37 E N . 18479 1
174 . 1 1 38 38 ASP H H 1 8.132 0.002 13 1 . . . . 38 D H . 18479 1
175 . 1 1 38 38 ASP C C 13 173.260 0.013 2 1 . . . . 38 D C . 18479 1
176 . 1 1 38 38 ASP CA C 13 52.531 0.089 6 1 . . . . 38 D CA . 18479 1
177 . 1 1 38 38 ASP CB C 13 43.518 0.065 3 1 . . . . 38 D CB . 18479 1
178 . 1 1 38 38 ASP N N 15 127.524 0.017 13 1 . . . . 38 D N . 18479 1
179 . 1 1 39 39 SER H H 1 8.367 0.004 13 1 . . . . 39 S H . 18479 1
180 . 1 1 39 39 SER C C 13 173.408 0.000 1 1 . . . . 39 S C . 18479 1
181 . 1 1 39 39 SER CA C 13 55.872 0.088 6 1 . . . . 39 S CA . 18479 1
182 . 1 1 39 39 SER CB C 13 65.812 0.085 3 1 . . . . 39 S CB . 18479 1
183 . 1 1 39 39 SER N N 15 116.995 0.021 13 1 . . . . 39 S N . 18479 1
184 . 1 1 40 40 TYR H H 1 9.075 0.003 10 1 . . . . 40 Y H . 18479 1
185 . 1 1 40 40 TYR C C 13 174.235 0.008 3 1 . . . . 40 Y C . 18479 1
186 . 1 1 40 40 TYR CA C 13 56.884 0.031 6 1 . . . . 40 Y CA . 18479 1
187 . 1 1 40 40 TYR CB C 13 43.120 0.004 3 1 . . . . 40 Y CB . 18479 1
188 . 1 1 40 40 TYR N N 15 124.463 0.035 12 1 . . . . 40 Y N . 18479 1
189 . 1 1 41 41 ARG H H 1 8.367 0.003 14 1 . . . . 41 R H . 18479 1
190 . 1 1 41 41 ARG C C 13 176.432 0.001 2 1 . . . . 41 R C . 18479 1
191 . 1 1 41 41 ARG CA C 13 54.265 0.123 6 1 . . . . 41 R CA . 18479 1
192 . 1 1 41 41 ARG CB C 13 34.034 0.074 3 1 . . . . 41 R CB . 18479 1
193 . 1 1 41 41 ARG N N 15 123.133 0.020 14 1 . . . . 41 R N . 18479 1
194 . 1 1 42 42 LYS H H 1 8.637 0.002 13 1 . . . . 42 K H . 18479 1
195 . 1 1 42 42 LYS C C 13 173.736 0.000 1 1 . . . . 42 K C . 18479 1
196 . 1 1 42 42 LYS CA C 13 55.781 0.106 6 1 . . . . 42 K CA . 18479 1
197 . 1 1 42 42 LYS CB C 13 38.007 0.036 3 1 . . . . 42 K CB . 18479 1
198 . 1 1 42 42 LYS N N 15 124.950 0.028 13 1 . . . . 42 K N . 18479 1
199 . 1 1 43 43 GLN H H 1 8.840 0.004 8 1 . . . . 43 Q H . 18479 1
200 . 1 1 43 43 GLN C C 13 173.134 0.011 2 1 . . . . 43 Q C . 18479 1
201 . 1 1 44 44 VAL H H 1 8.840 0.010 5 1 . . . . 44 V H . 18479 1
202 . 1 1 44 44 VAL C C 13 173.137 0.009 3 1 . . . . 44 V C . 18479 1
203 . 1 1 44 44 VAL CA C 13 59.474 0.064 4 1 . . . . 44 V CA . 18479 1
204 . 1 1 44 44 VAL CB C 13 36.024 0.011 2 1 . . . . 44 V CB . 18479 1
205 . 1 1 44 44 VAL N N 15 131.820 0.076 5 1 . . . . 44 V N . 18479 1
206 . 1 1 45 45 VAL H H 1 8.040 0.003 14 1 . . . . 45 V H . 18479 1
207 . 1 1 45 45 VAL C C 13 175.402 0.007 3 1 . . . . 45 V C . 18479 1
208 . 1 1 45 45 VAL CA C 13 61.788 0.043 6 1 . . . . 45 V CA . 18479 1
209 . 1 1 45 45 VAL CB C 13 32.285 0.104 3 1 . . . . 45 V CB . 18479 1
210 . 1 1 45 45 VAL N N 15 123.907 0.027 14 1 . . . . 45 V N . 18479 1
211 . 1 1 46 46 ILE H H 1 8.083 0.002 14 1 . . . . 46 I H . 18479 1
212 . 1 1 46 46 ILE C C 13 176.344 0.002 2 1 . . . . 46 I C . 18479 1
213 . 1 1 46 46 ILE CA C 13 60.223 0.069 6 1 . . . . 46 I CA . 18479 1
214 . 1 1 46 46 ILE CB C 13 39.906 0.033 3 1 . . . . 46 I CB . 18479 1
215 . 1 1 46 46 ILE N N 15 128.633 0.014 14 1 . . . . 46 I N . 18479 1
216 . 1 1 47 47 ASP H H 1 9.477 0.198 15 1 . . . . 47 D H . 18479 1
217 . 1 1 47 47 ASP C C 13 176.211 0.188 4 1 . . . . 47 D C . 18479 1
218 . 1 1 47 47 ASP CA C 13 55.292 0.043 6 1 . . . . 47 D CA . 18479 1
219 . 1 1 47 47 ASP CB C 13 39.040 0.053 3 1 . . . . 47 D CB . 18479 1
220 . 1 1 47 47 ASP N N 15 133.454 0.768 15 1 . . . . 47 D N . 18479 1
221 . 1 1 48 48 GLY H H 1 8.273 0.003 13 1 . . . . 48 G H . 18479 1
222 . 1 1 48 48 GLY C C 13 173.192 0.012 3 1 . . . . 48 G C . 18479 1
223 . 1 1 48 48 GLY CA C 13 45.263 0.038 6 1 . . . . 48 G CA . 18479 1
224 . 1 1 48 48 GLY N N 15 105.956 0.015 13 1 . . . . 48 G N . 18479 1
225 . 1 1 49 49 GLU H H 1 7.664 0.003 12 1 . . . . 49 E H . 18479 1
226 . 1 1 49 49 GLU C C 13 175.616 0.006 3 1 . . . . 49 E C . 18479 1
227 . 1 1 49 49 GLU CA C 13 54.674 0.054 5 1 . . . . 49 E CA . 18479 1
228 . 1 1 49 49 GLU CB C 13 31.821 0.000 1 1 . . . . 49 E CB . 18479 1
229 . 1 1 49 49 GLU N N 15 125.373 0.017 12 1 . . . . 49 E N . 18479 1
230 . 1 1 50 50 THR H H 1 8.872 0.003 13 1 . . . . 50 T H . 18479 1
231 . 1 1 50 50 THR C C 13 173.481 0.012 3 1 . . . . 50 T C . 18479 1
232 . 1 1 50 50 THR CA C 13 63.722 0.066 5 1 . . . . 50 T CA . 18479 1
233 . 1 1 50 50 THR CB C 13 68.455 0.116 3 1 . . . . 50 T CB . 18479 1
234 . 1 1 50 50 THR N N 15 129.051 0.030 13 1 . . . . 50 T N . 18479 1
235 . 1 1 51 51 CYS H H 1 9.424 0.003 13 1 . . . . 51 C H . 18479 1
236 . 1 1 51 51 CYS C C 13 170.834 0.007 3 1 . . . . 51 C C . 18479 1
237 . 1 1 51 51 CYS CA C 13 56.412 0.035 6 1 . . . . 51 C CA . 18479 1
238 . 1 1 51 51 CYS CB C 13 31.511 0.123 3 1 . . . . 51 C CB . 18479 1
239 . 1 1 51 51 CYS N N 15 126.937 0.019 13 1 . . . . 51 C N . 18479 1
240 . 1 1 52 52 LEU H H 1 8.706 0.004 15 1 . . . . 52 L H . 18479 1
241 . 1 1 52 52 LEU C C 13 174.972 0.009 4 1 . . . . 52 L C . 18479 1
242 . 1 1 52 52 LEU CA C 13 53.519 0.059 6 1 . . . . 52 L CA . 18479 1
243 . 1 1 52 52 LEU CB C 13 44.347 0.061 3 1 . . . . 52 L CB . 18479 1
244 . 1 1 52 52 LEU N N 15 124.888 0.081 15 1 . . . . 52 L N . 18479 1
245 . 1 1 53 53 LEU H H 1 8.967 0.004 11 1 . . . . 53 L H . 18479 1
246 . 1 1 53 53 LEU C C 13 174.237 0.001 2 1 . . . . 53 L C . 18479 1
247 . 1 1 53 53 LEU CA C 13 53.579 0.067 4 1 . . . . 53 L CA . 18479 1
248 . 1 1 53 53 LEU CB C 13 42.057 0.119 3 1 . . . . 53 L CB . 18479 1
249 . 1 1 53 53 LEU N N 15 126.443 0.022 11 1 . . . . 53 L N . 18479 1
250 . 1 1 54 54 ASP H H 1 8.709 0.002 11 1 . . . . 54 D H . 18479 1
251 . 1 1 54 54 ASP C C 13 174.922 0.016 2 1 . . . . 54 D C . 18479 1
252 . 1 1 54 54 ASP CA C 13 53.014 0.037 5 1 . . . . 54 D CA . 18479 1
253 . 1 1 54 54 ASP CB C 13 41.983 0.253 2 1 . . . . 54 D CB . 18479 1
254 . 1 1 54 54 ASP N N 15 128.601 0.014 11 1 . . . . 54 D N . 18479 1
255 . 1 1 55 55 ILE H H 1 9.179 0.006 12 1 . . . . 55 I H . 18479 1
256 . 1 1 55 55 ILE C C 13 171.149 0.000 0 1 . . . . 55 I C . 18479 1
257 . 1 1 55 55 ILE CA C 13 60.123 0.012 2 1 . . . . 55 I CA . 18479 1
258 . 1 1 55 55 ILE N N 15 126.686 0.032 12 1 . . . . 55 I N . 18479 1
259 . 1 1 57 57 ASP C C 13 175.436 0.000 1 1 . . . . 57 D C . 18479 1
260 . 1 1 57 57 ASP CA C 13 53.140 0.068 3 1 . . . . 57 D CA . 18479 1
261 . 1 1 57 57 ASP CB C 13 41.529 0.000 2 1 . . . . 57 D CB . 18479 1
262 . 1 1 58 58 THR H H 1 6.729 0.003 12 1 . . . . 58 T H . 18479 1
263 . 1 1 58 58 THR C C 13 173.625 0.200 4 1 . . . . 58 T C . 18479 1
264 . 1 1 58 58 THR CA C 13 61.694 0.061 6 1 . . . . 58 T CA . 18479 1
265 . 1 1 58 58 THR CB C 13 71.739 0.102 3 1 . . . . 58 T CB . 18479 1
266 . 1 1 58 58 THR N N 15 113.030 0.012 12 1 . . . . 58 T N . 18479 1
267 . 1 1 59 59 ALA H H 1 9.104 0.011 15 1 . . . . 59 A H . 18479 1
268 . 1 1 59 59 ALA C C 13 178.063 0.009 3 1 . . . . 59 A C . 18479 1
269 . 1 1 59 59 ALA CA C 13 51.622 0.042 6 1 . . . . 59 A CA . 18479 1
270 . 1 1 59 59 ALA CB C 13 20.740 0.019 3 1 . . . . 59 A CB . 18479 1
271 . 1 1 59 59 ALA N N 15 124.338 0.053 15 1 . . . . 59 A N . 18479 1
272 . 1 1 60 60 GLY H H 1 8.258 0.003 13 1 . . . . 60 G H . 18479 1
273 . 1 1 60 60 GLY C C 13 174.971 0.018 3 1 . . . . 60 G C . 18479 1
274 . 1 1 60 60 GLY CA C 13 46.156 0.070 7 1 . . . . 60 G CA . 18479 1
275 . 1 1 60 60 GLY N N 15 111.032 0.022 13 1 . . . . 60 G N . 18479 1
276 . 1 1 61 61 GLN H H 1 8.573 0.003 13 1 . . . . 61 Q H . 18479 1
277 . 1 1 61 61 GLN C C 13 176.352 0.002 3 1 . . . . 61 Q C . 18479 1
278 . 1 1 61 61 GLN CA C 13 56.146 0.115 6 1 . . . . 61 Q CA . 18479 1
279 . 1 1 61 61 GLN CB C 13 29.265 0.115 3 1 . . . . 61 Q CB . 18479 1
280 . 1 1 61 61 GLN N N 15 121.964 0.005 13 1 . . . . 61 Q N . 18479 1
281 . 1 1 62 62 GLU H H 1 8.737 0.002 13 1 . . . . 62 E H . 18479 1
282 . 1 1 62 62 GLU C C 13 176.791 0.008 3 1 . . . . 62 E C . 18479 1
283 . 1 1 62 62 GLU CA C 13 57.830 0.093 6 1 . . . . 62 E CA . 18479 1
284 . 1 1 62 62 GLU CB C 13 29.469 0.000 1 1 . . . . 62 E CB . 18479 1
285 . 1 1 62 62 GLU N N 15 123.624 0.016 13 1 . . . . 62 E N . 18479 1
286 . 1 1 63 63 GLU H H 1 8.287 0.004 14 1 . . . . 63 E H . 18479 1
287 . 1 1 63 63 GLU C C 13 175.877 0.013 3 1 . . . . 63 E C . 18479 1
288 . 1 1 63 63 GLU CA C 13 56.646 0.055 5 1 . . . . 63 E CA . 18479 1
289 . 1 1 63 63 GLU CB C 13 30.066 0.353 4 1 . . . . 63 E CB . 18479 1
290 . 1 1 63 63 GLU N N 15 123.051 0.005 14 1 . . . . 63 E N . 18479 1
291 . 1 1 64 64 TYR H H 1 8.259 0.004 13 1 . . . . 64 Y H . 18479 1
292 . 1 1 64 64 TYR C C 13 175.641 0.012 3 1 . . . . 64 Y C . 18479 1
293 . 1 1 64 64 TYR CA C 13 58.243 0.052 6 1 . . . . 64 Y CA . 18479 1
294 . 1 1 64 64 TYR CB C 13 38.395 0.074 3 1 . . . . 64 Y CB . 18479 1
295 . 1 1 64 64 TYR N N 15 124.136 0.020 13 1 . . . . 64 Y N . 18479 1
296 . 1 1 65 65 SER H H 1 7.881 0.003 14 1 . . . . 65 S H . 18479 1
297 . 1 1 65 65 SER C C 13 174.358 0.002 2 1 . . . . 65 S C . 18479 1
298 . 1 1 65 65 SER CA C 13 57.045 0.055 4 1 . . . . 65 S CA . 18479 1
299 . 1 1 65 65 SER CB C 13 63.838 0.048 2 1 . . . . 65 S CB . 18479 1
300 . 1 1 65 65 SER N N 15 122.983 0.004 14 1 . . . . 65 S N . 18479 1
301 . 1 1 66 66 ALA H H 1 8.776 0.006 10 1 . . . . 66 A H . 18479 1
302 . 1 1 66 66 ALA C C 13 180.113 0.001 3 1 . . . . 66 A C . 18479 1
303 . 1 1 66 66 ALA CA C 13 54.761 0.076 6 1 . . . . 66 A CA . 18479 1
304 . 1 1 66 66 ALA CB C 13 18.131 0.016 3 1 . . . . 66 A CB . 18479 1
305 . 1 1 66 66 ALA N N 15 132.073 0.041 10 1 . . . . 66 A N . 18479 1
306 . 1 1 67 67 MET H H 1 8.213 0.003 14 1 . . . . 67 M H . 18479 1
307 . 1 1 67 67 MET C C 13 177.516 0.014 3 1 . . . . 67 M C . 18479 1
308 . 1 1 67 67 MET CA C 13 57.824 0.026 5 1 . . . . 67 M CA . 18479 1
309 . 1 1 67 67 MET CB C 13 32.528 0.113 2 1 . . . . 67 M CB . 18479 1
310 . 1 1 67 67 MET N N 15 120.699 0.001 14 1 . . . . 67 M N . 18479 1
311 . 1 1 68 68 ARG H H 1 7.821 0.006 12 1 . . . . 68 R H . 18479 1
312 . 1 1 68 68 ARG C C 13 177.902 0.014 3 1 . . . . 68 R C . 18479 1
313 . 1 1 68 68 ARG CA C 13 59.147 0.029 6 1 . . . . 68 R CA . 18479 1
314 . 1 1 68 68 ARG CB C 13 29.810 0.105 3 1 . . . . 68 R CB . 18479 1
315 . 1 1 68 68 ARG N N 15 123.879 0.011 12 1 . . . . 68 R N . 18479 1
316 . 1 1 69 69 ASP H H 1 8.067 0.003 13 1 . . . . 69 D H . 18479 1
317 . 1 1 69 69 ASP C C 13 177.954 0.005 4 1 . . . . 69 D C . 18479 1
318 . 1 1 69 69 ASP CA C 13 57.721 0.000 2 1 . . . . 69 D CA . 18479 1
319 . 1 1 69 69 ASP CB C 13 42.233 1.201 2 1 . . . . 69 D CB . 18479 1
320 . 1 1 69 69 ASP N N 15 121.347 0.029 13 1 . . . . 69 D N . 18479 1
321 . 1 1 70 70 GLN H H 1 7.789 0.004 9 1 . . . . 70 Q H . 18479 1
322 . 1 1 70 70 GLN CA C 13 59.487 0.000 1 1 . . . . 70 Q CA . 18479 1
323 . 1 1 70 70 GLN CB C 13 27.743 0.000 1 1 . . . . 70 Q CB . 18479 1
324 . 1 1 70 70 GLN N N 15 120.670 0.124 9 1 . . . . 70 Q N . 18479 1
325 . 1 1 71 71 TYR H H 1 8.380 0.000 1 1 . . . . 71 Y H . 18479 1
326 . 1 1 71 71 TYR C C 13 177.264 0.000 1 1 . . . . 71 Y C . 18479 1
327 . 1 1 71 71 TYR N N 15 117.604 0.000 1 1 . . . . 71 Y N . 18479 1
328 . 1 1 72 72 MET H H 1 8.354 0.000 3 1 . . . . 72 M H . 18479 1
329 . 1 1 72 72 MET C C 13 176.936 0.003 2 1 . . . . 72 M C . 18479 1
330 . 1 1 72 72 MET CA C 13 58.486 0.016 4 1 . . . . 72 M CA . 18479 1
331 . 1 1 72 72 MET CB C 13 31.194 0.367 2 1 . . . . 72 M CB . 18479 1
332 . 1 1 72 72 MET N N 15 125.545 0.000 3 1 . . . . 72 M N . 18479 1
333 . 1 1 73 73 ARG H H 1 7.934 0.002 14 1 . . . . 73 R H . 18479 1
334 . 1 1 73 73 ARG C C 13 178.990 0.006 3 1 . . . . 73 R C . 18479 1
335 . 1 1 73 73 ARG CA C 13 59.660 0.064 6 1 . . . . 73 R CA . 18479 1
336 . 1 1 73 73 ARG CB C 13 30.551 0.266 3 1 . . . . 73 R CB . 18479 1
337 . 1 1 73 73 ARG N N 15 118.479 0.025 14 1 . . . . 73 R N . 18479 1
338 . 1 1 74 74 THR H H 1 7.871 0.005 14 1 . . . . 74 T H . 18479 1
339 . 1 1 74 74 THR C C 13 175.489 0.010 2 1 . . . . 74 T C . 18479 1
340 . 1 1 74 74 THR CA C 13 62.363 0.044 5 1 . . . . 74 T CA . 18479 1
341 . 1 1 74 74 THR CB C 13 69.870 0.044 2 1 . . . . 74 T CB . 18479 1
342 . 1 1 74 74 THR N N 15 110.756 0.012 14 1 . . . . 74 T N . 18479 1
343 . 1 1 75 75 GLY H H 1 7.948 0.003 10 1 . . . . 75 G H . 18479 1
344 . 1 1 75 75 GLY C C 13 172.764 0.006 3 1 . . . . 75 G C . 18479 1
345 . 1 1 75 75 GLY CA C 13 46.276 0.057 6 1 . . . . 75 G CA . 18479 1
346 . 1 1 75 75 GLY N N 15 114.150 0.024 10 1 . . . . 75 G N . 18479 1
347 . 1 1 76 76 GLU H H 1 8.977 0.003 11 1 . . . . 76 E H . 18479 1
348 . 1 1 76 76 GLU C C 13 176.404 0.007 3 1 . . . . 76 E C . 18479 1
349 . 1 1 76 76 GLU CA C 13 56.760 0.064 5 1 . . . . 76 E CA . 18479 1
350 . 1 1 76 76 GLU CB C 13 32.288 0.161 3 1 . . . . 76 E CB . 18479 1
351 . 1 1 76 76 GLU N N 15 125.295 0.021 11 1 . . . . 76 E N . 18479 1
352 . 1 1 77 77 GLY H H 1 7.269 0.491 13 1 . . . . 77 G H . 18479 1
353 . 1 1 77 77 GLY C C 13 170.631 0.009 3 1 . . . . 77 G C . 18479 1
354 . 1 1 77 77 GLY CA C 13 45.552 0.033 6 1 . . . . 77 G CA . 18479 1
355 . 1 1 77 77 GLY N N 15 135.937 3.083 13 1 . . . . 77 G N . 18479 1
356 . 1 1 78 78 PHE H H 1 8.142 0.001 12 1 . . . . 78 F H . 18479 1
357 . 1 1 78 78 PHE C C 13 173.665 0.010 3 1 . . . . 78 F C . 18479 1
358 . 1 1 78 78 PHE CA C 13 56.717 0.069 6 1 . . . . 78 F CA . 18479 1
359 . 1 1 78 78 PHE CB C 13 43.047 0.190 5 1 . . . . 78 F CB . 18479 1
360 . 1 1 78 78 PHE N N 15 124.322 0.009 12 1 . . . . 78 F N . 18479 1
361 . 1 1 79 79 LEU H H 1 9.078 0.176 14 1 . . . . 79 L H . 18479 1
362 . 1 1 79 79 LEU C C 13 174.695 0.003 2 1 . . . . 79 L C . 18479 1
363 . 1 1 79 79 LEU CA C 13 54.024 0.044 6 1 . . . . 79 L CA . 18479 1
364 . 1 1 79 79 LEU N N 15 128.793 0.652 14 1 . . . . 79 L N . 18479 1
365 . 1 1 80 80 CYS H H 1 8.643 0.002 12 1 . . . . 80 C H . 18479 1
366 . 1 1 80 80 CYS C C 13 172.676 0.005 3 1 . . . . 80 C C . 18479 1
367 . 1 1 80 80 CYS CA C 13 57.770 0.070 6 1 . . . . 80 C CA . 18479 1
368 . 1 1 80 80 CYS CB C 13 27.593 0.025 3 1 . . . . 80 C CB . 18479 1
369 . 1 1 80 80 CYS N N 15 127.193 0.014 12 1 . . . . 80 C N . 18479 1
370 . 1 1 81 81 VAL H H 1 8.977 0.100 16 1 . . . . 81 V H . 18479 1
371 . 1 1 81 81 VAL C C 13 174.938 0.023 3 1 . . . . 81 V C . 18479 1
372 . 1 1 81 81 VAL CA C 13 61.308 0.023 6 1 . . . . 81 V CA . 18479 1
373 . 1 1 81 81 VAL CB C 13 33.298 0.020 3 1 . . . . 81 V CB . 18479 1
374 . 1 1 81 81 VAL N N 15 128.653 0.716 16 1 . . . . 81 V N . 18479 1
375 . 1 1 82 82 PHE H H 1 9.234 0.004 12 1 . . . . 82 F H . 18479 1
376 . 1 1 82 82 PHE C C 13 171.085 0.005 2 1 . . . . 82 F C . 18479 1
377 . 1 1 82 82 PHE CA C 13 55.410 0.026 6 1 . . . . 82 F CA . 18479 1
378 . 1 1 82 82 PHE CB C 13 40.453 0.155 3 1 . . . . 82 F CB . 18479 1
379 . 1 1 82 82 PHE N N 15 126.781 0.018 12 1 . . . . 82 F N . 18479 1
380 . 1 1 83 83 ALA H H 1 8.640 0.007 13 1 . . . . 83 A H . 18479 1
381 . 1 1 83 83 ALA C C 13 179.279 0.011 3 1 . . . . 83 A C . 18479 1
382 . 1 1 83 83 ALA CA C 13 49.711 0.125 6 1 . . . . 83 A CA . 18479 1
383 . 1 1 83 83 ALA CB C 13 21.700 0.029 3 1 . . . . 83 A CB . 18479 1
384 . 1 1 83 83 ALA N N 15 123.967 0.008 13 1 . . . . 83 A N . 18479 1
385 . 1 1 84 84 ILE H H 1 8.426 0.004 14 1 . . . . 84 I H . 18479 1
386 . 1 1 84 84 ILE C C 13 174.183 0.003 3 1 . . . . 84 I C . 18479 1
387 . 1 1 84 84 ILE CA C 13 63.587 0.161 6 1 . . . . 84 I CA . 18479 1
388 . 1 1 84 84 ILE CB C 13 38.088 0.092 3 1 . . . . 84 I CB . 18479 1
389 . 1 1 84 84 ILE N N 15 116.183 0.023 14 1 . . . . 84 I N . 18479 1
390 . 1 1 85 85 ASN H H 1 7.834 0.003 14 1 . . . . 85 N H . 18479 1
391 . 1 1 85 85 ASN C C 13 174.567 0.002 3 1 . . . . 85 N C . 18479 1
392 . 1 1 85 85 ASN CA C 13 52.216 0.140 6 1 . . . . 85 N CA . 18479 1
393 . 1 1 85 85 ASN CB C 13 37.988 0.190 3 1 . . . . 85 N CB . 18479 1
394 . 1 1 85 85 ASN N N 15 120.073 0.040 14 1 . . . . 85 N N . 18479 1
395 . 1 1 86 86 ASN H H 1 7.900 0.003 12 1 . . . . 86 N H . 18479 1
396 . 1 1 86 86 ASN C C 13 174.909 0.000 1 1 . . . . 86 N C . 18479 1
397 . 1 1 86 86 ASN CB C 13 39.489 0.000 1 1 . . . . 86 N CB . 18479 1
398 . 1 1 86 86 ASN N N 15 122.242 0.013 12 1 . . . . 86 N N . 18479 1
399 . 1 1 87 87 THR C C 13 175.956 0.016 2 1 . . . . 87 T C . 18479 1
400 . 1 1 87 87 THR CA C 13 66.827 0.047 3 1 . . . . 87 T CA . 18479 1
401 . 1 1 87 87 THR CB C 13 68.589 0.000 2 1 . . . . 87 T CB . 18479 1
402 . 1 1 88 88 LYS H H 1 8.411 0.008 14 1 . . . . 88 K H . 18479 1
403 . 1 1 88 88 LYS C C 13 177.986 0.012 5 1 . . . . 88 K C . 18479 1
404 . 1 1 88 88 LYS CA C 13 59.511 0.119 6 1 . . . . 88 K CA . 18479 1
405 . 1 1 88 88 LYS CB C 13 31.265 0.043 3 1 . . . . 88 K CB . 18479 1
406 . 1 1 88 88 LYS N N 15 127.014 0.100 14 1 . . . . 88 K N . 18479 1
407 . 1 1 89 89 SER H H 1 8.031 0.006 15 1 . . . . 89 S H . 18479 1
408 . 1 1 89 89 SER C C 13 175.754 0.007 2 1 . . . . 89 S C . 18479 1
409 . 1 1 89 89 SER CA C 13 61.788 0.029 5 1 . . . . 89 S CA . 18479 1
410 . 1 1 89 89 SER CB C 13 63.603 0.041 3 1 . . . . 89 S CB . 18479 1
411 . 1 1 89 89 SER N N 15 117.366 0.071 15 1 . . . . 89 S N . 18479 1
412 . 1 1 90 90 PHE H H 1 7.363 0.002 13 1 . . . . 90 F H . 18479 1
413 . 1 1 90 90 PHE C C 13 177.274 0.002 2 1 . . . . 90 F C . 18479 1
414 . 1 1 90 90 PHE CA C 13 59.916 0.194 6 1 . . . . 90 F CA . 18479 1
415 . 1 1 90 90 PHE CB C 13 40.144 0.079 3 1 . . . . 90 F CB . 18479 1
416 . 1 1 90 90 PHE N N 15 127.578 0.012 13 1 . . . . 90 F N . 18479 1
417 . 1 1 91 91 GLU H H 1 8.429 0.003 12 1 . . . . 91 E H . 18479 1
418 . 1 1 91 91 GLU C C 13 179.619 0.000 2 1 . . . . 91 E C . 18479 1
419 . 1 1 91 91 GLU CA C 13 59.170 0.067 6 1 . . . . 91 E CA . 18479 1
420 . 1 1 91 91 GLU CB C 13 29.058 0.111 3 1 . . . . 91 E CB . 18479 1
421 . 1 1 91 91 GLU N N 15 124.649 0.011 12 1 . . . . 91 E N . 18479 1
422 . 1 1 92 92 ASP H H 1 8.429 0.004 14 1 . . . . 92 D H . 18479 1
423 . 1 1 92 92 ASP C C 13 177.486 0.005 2 1 . . . . 92 D C . 18479 1
424 . 1 1 92 92 ASP CA C 13 56.135 0.066 5 1 . . . . 92 D CA . 18479 1
425 . 1 1 92 92 ASP CB C 13 41.166 0.064 3 1 . . . . 92 D CB . 18479 1
426 . 1 1 92 92 ASP N N 15 120.302 0.014 14 1 . . . . 92 D N . 18479 1
427 . 1 1 93 93 ILE H H 1 7.529 0.003 12 1 . . . . 93 I H . 18479 1
428 . 1 1 93 93 ILE C C 13 177.297 0.001 3 1 . . . . 93 I C . 18479 1
429 . 1 1 93 93 ILE CA C 13 62.401 0.074 6 1 . . . . 93 I CA . 18479 1
430 . 1 1 93 93 ILE CB C 13 34.406 0.133 3 1 . . . . 93 I CB . 18479 1
431 . 1 1 93 93 ILE N N 15 123.432 0.009 12 1 . . . . 93 I N . 18479 1
432 . 1 1 94 94 HIS H H 1 7.714 0.003 13 1 . . . . 94 H H . 18479 1
433 . 1 1 94 94 HIS C C 13 177.359 0.001 2 1 . . . . 94 H C . 18479 1
434 . 1 1 94 94 HIS CA C 13 60.094 0.065 6 1 . . . . 94 H CA . 18479 1
435 . 1 1 94 94 HIS CB C 13 30.555 0.000 3 1 . . . . 94 H CB . 18479 1
436 . 1 1 94 94 HIS N N 15 119.984 0.007 13 1 . . . . 94 H N . 18479 1
437 . 1 1 95 95 GLN H H 1 7.429 0.005 14 1 . . . . 95 Q H . 18479 1
438 . 1 1 95 95 GLN C C 13 179.119 0.001 3 1 . . . . 95 Q C . 18479 1
439 . 1 1 95 95 GLN CA C 13 58.325 0.097 6 1 . . . . 95 Q CA . 18479 1
440 . 1 1 95 95 GLN CB C 13 27.880 0.134 3 1 . . . . 95 Q CB . 18479 1
441 . 1 1 95 95 GLN N N 15 119.424 0.009 14 1 . . . . 95 Q N . 18479 1
442 . 1 1 96 96 TYR H H 1 7.503 0.003 14 1 . . . . 96 Y H . 18479 1
443 . 1 1 96 96 TYR C C 13 177.781 0.001 2 1 . . . . 96 Y C . 18479 1
444 . 1 1 96 96 TYR CA C 13 62.869 0.064 6 1 . . . . 96 Y CA . 18479 1
445 . 1 1 96 96 TYR CB C 13 37.651 0.050 3 1 . . . . 96 Y CB . 18479 1
446 . 1 1 96 96 TYR N N 15 122.195 0.011 14 1 . . . . 96 Y N . 18479 1
447 . 1 1 97 97 ARG H H 1 8.352 0.003 13 1 . . . . 97 R H . 18479 1
448 . 1 1 97 97 ARG C C 13 177.759 0.135 4 1 . . . . 97 R C . 18479 1
449 . 1 1 97 97 ARG CA C 13 60.023 0.078 6 1 . . . . 97 R CA . 18479 1
450 . 1 1 97 97 ARG CB C 13 28.908 0.189 3 1 . . . . 97 R CB . 18479 1
451 . 1 1 97 97 ARG N N 15 121.817 0.023 13 1 . . . . 97 R N . 18479 1
452 . 1 1 98 98 GLU H H 1 7.972 0.004 15 1 . . . . 98 E H . 18479 1
453 . 1 1 98 98 GLU C C 13 178.858 0.011 3 1 . . . . 98 E C . 18479 1
454 . 1 1 98 98 GLU CA C 13 58.916 0.178 6 1 . . . . 98 E CA . 18479 1
455 . 1 1 98 98 GLU CB C 13 29.074 0.081 4 1 . . . . 98 E CB . 18479 1
456 . 1 1 98 98 GLU N N 15 120.433 0.006 15 1 . . . . 98 E N . 18479 1
457 . 1 1 99 99 GLN H H 1 7.806 0.002 15 1 . . . . 99 Q H . 18479 1
458 . 1 1 99 99 GLN C C 13 177.868 0.006 3 1 . . . . 99 Q C . 18479 1
459 . 1 1 99 99 GLN CA C 13 59.136 0.080 6 1 . . . . 99 Q CA . 18479 1
460 . 1 1 99 99 GLN CB C 13 27.977 0.082 3 1 . . . . 99 Q CB . 18479 1
461 . 1 1 99 99 GLN N N 15 122.737 0.006 15 1 . . . . 99 Q N . 18479 1
462 . 1 1 100 100 ILE H H 1 7.730 0.003 14 1 . . . . 100 I H . 18479 1
463 . 1 1 100 100 ILE C C 13 177.094 0.017 3 1 . . . . 100 I C . 18479 1
464 . 1 1 100 100 ILE CA C 13 63.469 3.338 8 1 . . . . 100 I CA . 18479 1
465 . 1 1 100 100 ILE CB C 13 37.858 0.040 3 1 . . . . 100 I CB . 18479 1
466 . 1 1 100 100 ILE N N 15 122.964 0.012 14 1 . . . . 100 I N . 18479 1
467 . 1 1 101 101 LYS H H 1 7.803 0.011 17 1 . . . . 101 K H . 18479 1
468 . 1 1 101 101 LYS C C 13 179.447 0.046 3 1 . . . . 101 K C . 18479 1
469 . 1 1 101 101 LYS CA C 13 59.658 0.101 7 1 . . . . 101 K CA . 18479 1
470 . 1 1 101 101 LYS CB C 13 32.170 0.020 3 1 . . . . 101 K CB . 18479 1
471 . 1 1 101 101 LYS N N 15 120.472 0.100 17 1 . . . . 101 K N . 18479 1
472 . 1 1 102 102 ARG H H 1 7.749 0.003 14 1 . . . . 102 R H . 18479 1
473 . 1 1 102 102 ARG C C 13 179.358 0.003 3 1 . . . . 102 R C . 18479 1
474 . 1 1 102 102 ARG CA C 13 58.820 0.083 6 1 . . . . 102 R CA . 18479 1
475 . 1 1 102 102 ARG CB C 13 29.680 0.170 3 1 . . . . 102 R CB . 18479 1
476 . 1 1 102 102 ARG N N 15 120.610 0.026 14 1 . . . . 102 R N . 18479 1
477 . 1 1 103 103 VAL H H 1 8.043 0.006 14 1 . . . . 103 V H . 18479 1
478 . 1 1 103 103 VAL C C 13 177.745 0.012 3 1 . . . . 103 V C . 18479 1
479 . 1 1 103 103 VAL CA C 13 65.364 0.095 6 1 . . . . 103 V CA . 18479 1
480 . 1 1 103 103 VAL CB C 13 31.746 0.126 5 1 . . . . 103 V CB . 18479 1
481 . 1 1 103 103 VAL N N 15 121.242 0.013 14 1 . . . . 103 V N . 18479 1
482 . 1 1 104 104 LYS H H 1 8.021 0.004 14 1 . . . . 104 K H . 18479 1
483 . 1 1 104 104 LYS C C 13 175.998 0.009 3 1 . . . . 104 K C . 18479 1
484 . 1 1 104 104 LYS CA C 13 55.053 0.048 6 1 . . . . 104 K CA . 18479 1
485 . 1 1 104 104 LYS CB C 13 31.077 0.068 3 1 . . . . 104 K CB . 18479 1
486 . 1 1 104 104 LYS N N 15 119.585 0.018 14 1 . . . . 104 K N . 18479 1
487 . 1 1 105 105 ASP H H 1 7.955 0.004 14 1 . . . . 105 D H . 18479 1
488 . 1 1 105 105 ASP C C 13 174.509 0.018 3 1 . . . . 105 D C . 18479 1
489 . 1 1 105 105 ASP CA C 13 54.560 0.041 6 1 . . . . 105 D CA . 18479 1
490 . 1 1 105 105 ASP CB C 13 39.743 0.093 3 1 . . . . 105 D CB . 18479 1
491 . 1 1 105 105 ASP N N 15 123.590 0.004 14 1 . . . . 105 D N . 18479 1
492 . 1 1 106 106 SER H H 1 7.447 0.003 14 1 . . . . 106 S H . 18479 1
493 . 1 1 106 106 SER C C 13 172.959 0.020 3 1 . . . . 106 S C . 18479 1
494 . 1 1 106 106 SER CA C 13 56.882 0.122 6 1 . . . . 106 S CA . 18479 1
495 . 1 1 106 106 SER CB C 13 65.039 0.028 3 1 . . . . 106 S CB . 18479 1
496 . 1 1 106 106 SER N N 15 111.976 0.001 14 1 . . . . 106 S N . 18479 1
497 . 1 1 107 107 ASP H H 1 8.316 0.005 13 1 . . . . 107 D H . 18479 1
498 . 1 1 107 107 ASP C C 13 176.013 0.000 1 1 . . . . 107 D C . 18479 1
499 . 1 1 107 107 ASP CA C 13 54.381 0.109 6 1 . . . . 107 D CA . 18479 1
500 . 1 1 107 107 ASP CB C 13 41.469 0.122 3 1 . . . . 107 D CB . 18479 1
501 . 1 1 107 107 ASP N N 15 124.987 0.033 13 1 . . . . 107 D N . 18479 1
502 . 1 1 108 108 ASP H H 1 8.382 0.004 11 1 . . . . 108 D H . 18479 1
503 . 1 1 108 108 ASP C C 13 174.386 0.000 1 1 . . . . 108 D C . 18479 1
504 . 1 1 108 108 ASP CA C 13 53.033 0.105 6 1 . . . . 108 D CA . 18479 1
505 . 1 1 108 108 ASP CB C 13 40.985 0.011 2 1 . . . . 108 D CB . 18479 1
506 . 1 1 108 108 ASP N N 15 124.102 0.003 11 1 . . . . 108 D N . 18479 1
507 . 1 1 109 109 VAL H H 1 7.585 0.002 13 1 . . . . 109 V H . 18479 1
508 . 1 1 109 109 VAL C C 13 173.965 0.000 1 1 . . . . 109 V C . 18479 1
509 . 1 1 109 109 VAL CA C 13 59.117 0.016 2 1 . . . . 109 V CA . 18479 1
510 . 1 1 109 109 VAL CB C 13 34.738 0.000 1 1 . . . . 109 V CB . 18479 1
511 . 1 1 109 109 VAL N N 15 125.394 0.019 13 1 . . . . 109 V N . 18479 1
512 . 1 1 110 110 PRO C C 13 175.808 0.000 2 1 . . . . 110 P C . 18479 1
513 . 1 1 110 110 PRO CA C 13 64.000 0.063 4 1 . . . . 110 P CA . 18479 1
514 . 1 1 110 110 PRO CB C 13 32.099 0.000 2 1 . . . . 110 P CB . 18479 1
515 . 1 1 111 111 MET H H 1 8.129 0.004 13 1 . . . . 111 M H . 18479 1
516 . 1 1 111 111 MET C C 13 173.847 0.007 3 1 . . . . 111 M C . 18479 1
517 . 1 1 111 111 MET CA C 13 54.997 0.075 6 1 . . . . 111 M CA . 18479 1
518 . 1 1 111 111 MET CB C 13 37.859 0.007 3 1 . . . . 111 M CB . 18479 1
519 . 1 1 111 111 MET N N 15 125.805 0.011 13 1 . . . . 111 M N . 18479 1
520 . 1 1 112 112 VAL H H 1 8.001 0.003 14 1 . . . . 112 V H . 18479 1
521 . 1 1 112 112 VAL C C 13 174.096 1.014 4 1 . . . . 112 V C . 18479 1
522 . 1 1 112 112 VAL CA C 13 60.455 1.568 7 1 . . . . 112 V CA . 18479 1
523 . 1 1 112 112 VAL CB C 13 37.231 0.564 3 1 . . . . 112 V CB . 18479 1
524 . 1 1 112 112 VAL N N 15 120.825 0.023 14 1 . . . . 112 V N . 18479 1
525 . 1 1 113 113 LEU H H 1 8.640 0.365 17 1 . . . . 113 L H . 18479 1
526 . 1 1 113 113 LEU C C 13 173.406 0.000 2 1 . . . . 113 L C . 18479 1
527 . 1 1 113 113 LEU CA C 13 53.833 0.144 8 1 . . . . 113 L CA . 18479 1
528 . 1 1 113 113 LEU CB C 13 43.748 0.010 3 1 . . . . 113 L CB . 18479 1
529 . 1 1 113 113 LEU N N 15 131.991 0.315 17 1 . . . . 113 L N . 18479 1
530 . 1 1 114 114 VAL H H 1 9.148 0.002 14 1 . . . . 114 V H . 18479 1
531 . 1 1 114 114 VAL C C 13 173.642 0.004 3 1 . . . . 114 V C . 18479 1
532 . 1 1 114 114 VAL CA C 13 60.096 0.039 7 1 . . . . 114 V CA . 18479 1
533 . 1 1 114 114 VAL CB C 13 35.059 0.151 4 1 . . . . 114 V CB . 18479 1
534 . 1 1 114 114 VAL N N 15 131.201 0.010 14 1 . . . . 114 V N . 18479 1
535 . 1 1 115 115 GLY H H 1 8.010 0.004 17 1 . . . . 115 G H . 18479 1
536 . 1 1 115 115 GLY C C 13 171.597 0.009 3 1 . . . . 115 G C . 18479 1
537 . 1 1 115 115 GLY CA C 13 45.270 0.063 8 1 . . . . 115 G CA . 18479 1
538 . 1 1 115 115 GLY N N 15 117.383 0.066 17 1 . . . . 115 G N . 18479 1
539 . 1 1 116 116 ASN H H 1 8.699 0.003 12 1 . . . . 116 N H . 18479 1
540 . 1 1 116 116 ASN C C 13 174.691 0.007 3 1 . . . . 116 N C . 18479 1
541 . 1 1 116 116 ASN CA C 13 51.516 0.035 6 1 . . . . 116 N CA . 18479 1
542 . 1 1 116 116 ASN CB C 13 41.027 0.038 3 1 . . . . 116 N CB . 18479 1
543 . 1 1 116 116 ASN N N 15 124.144 0.018 12 1 . . . . 116 N N . 18479 1
544 . 1 1 117 117 LYS H H 1 7.304 0.005 14 1 . . . . 117 K H . 18479 1
545 . 1 1 117 117 LYS C C 13 177.300 0.002 3 1 . . . . 117 K C . 18479 1
546 . 1 1 117 117 LYS CA C 13 57.276 0.085 5 1 . . . . 117 K CA . 18479 1
547 . 1 1 117 117 LYS CB C 13 29.849 0.119 3 1 . . . . 117 K CB . 18479 1
548 . 1 1 117 117 LYS N N 15 115.035 0.002 14 1 . . . . 117 K N . 18479 1
549 . 1 1 118 118 CYS H H 1 8.744 0.002 13 1 . . . . 118 C H . 18479 1
550 . 1 1 118 118 CYS C C 13 173.328 0.006 3 1 . . . . 118 C C . 18479 1
551 . 1 1 118 118 CYS CA C 13 60.651 0.047 6 1 . . . . 118 C CA . 18479 1
552 . 1 1 118 118 CYS CB C 13 26.178 0.095 3 1 . . . . 118 C CB . 18479 1
553 . 1 1 118 118 CYS N N 15 117.230 0.020 13 1 . . . . 118 C N . 18479 1
554 . 1 1 119 119 ASP H H 1 8.580 0.002 14 1 . . . . 119 D H . 18479 1
555 . 1 1 119 119 ASP C C 13 175.466 0.007 2 1 . . . . 119 D C . 18479 1
556 . 1 1 119 119 ASP CA C 13 54.289 0.309 6 1 . . . . 119 D CA . 18479 1
557 . 1 1 119 119 ASP CB C 13 41.240 0.076 3 1 . . . . 119 D CB . 18479 1
558 . 1 1 119 119 ASP N N 15 120.400 0.009 14 1 . . . . 119 D N . 18479 1
559 . 1 1 120 120 LEU H H 1 7.762 0.002 13 1 . . . . 120 L H . 18479 1
560 . 1 1 120 120 LEU C C 13 176.379 0.030 3 1 . . . . 120 L C . 18479 1
561 . 1 1 120 120 LEU CA C 13 54.756 0.076 6 1 . . . . 120 L CA . 18479 1
562 . 1 1 120 120 LEU CB C 13 41.946 0.123 3 1 . . . . 120 L CB . 18479 1
563 . 1 1 120 120 LEU N N 15 123.847 0.009 13 1 . . . . 120 L N . 18479 1
564 . 1 1 121 121 ALA H H 1 8.101 0.002 14 1 . . . . 121 A H . 18479 1
565 . 1 1 121 121 ALA C C 13 178.596 0.002 3 1 . . . . 121 A C . 18479 1
566 . 1 1 121 121 ALA CA C 13 53.011 0.091 6 1 . . . . 121 A CA . 18479 1
567 . 1 1 121 121 ALA CB C 13 19.129 0.096 3 1 . . . . 121 A CB . 18479 1
568 . 1 1 121 121 ALA N N 15 125.654 0.023 14 1 . . . . 121 A N . 18479 1
569 . 1 1 122 122 ALA H H 1 7.643 0.005 14 1 . . . . 122 A H . 18479 1
570 . 1 1 122 122 ALA C C 13 175.221 0.008 3 1 . . . . 122 A C . 18479 1
571 . 1 1 122 122 ALA CA C 13 51.224 0.109 6 1 . . . . 122 A CA . 18479 1
572 . 1 1 122 122 ALA CB C 13 17.701 0.023 3 1 . . . . 122 A CB . 18479 1
573 . 1 1 122 122 ALA N N 15 124.584 0.003 14 1 . . . . 122 A N . 18479 1
574 . 1 1 123 123 ARG H H 1 7.976 0.003 14 1 . . . . 123 R H . 18479 1
575 . 1 1 123 123 ARG C C 13 176.120 0.018 3 1 . . . . 123 R C . 18479 1
576 . 1 1 123 123 ARG CA C 13 55.636 0.074 6 1 . . . . 123 R CA . 18479 1
577 . 1 1 123 123 ARG CB C 13 32.761 0.107 3 1 . . . . 123 R CB . 18479 1
578 . 1 1 123 123 ARG N N 15 123.006 0.004 14 1 . . . . 123 R N . 18479 1
579 . 1 1 124 124 THR H H 1 9.066 0.004 13 1 . . . . 124 T H . 18479 1
580 . 1 1 124 124 THR C C 13 174.077 0.000 1 1 . . . . 124 T C . 18479 1
581 . 1 1 124 124 THR CA C 13 61.765 0.125 6 1 . . . . 124 T CA . 18479 1
582 . 1 1 124 124 THR CB C 13 69.032 0.079 3 1 . . . . 124 T CB . 18479 1
583 . 1 1 124 124 THR N N 15 116.900 0.010 13 1 . . . . 124 T N . 18479 1
584 . 1 1 125 125 VAL H H 1 7.589 0.001 13 1 . . . . 125 V H . 18479 1
585 . 1 1 125 125 VAL C C 13 175.706 0.008 3 1 . . . . 125 V C . 18479 1
586 . 1 1 125 125 VAL CA C 13 61.411 0.040 6 1 . . . . 125 V CA . 18479 1
587 . 1 1 125 125 VAL CB C 13 33.092 0.011 3 1 . . . . 125 V CB . 18479 1
588 . 1 1 125 125 VAL N N 15 127.507 0.016 13 1 . . . . 125 V N . 18479 1
589 . 1 1 126 126 GLU H H 1 8.696 0.001 14 1 . . . . 126 E H . 18479 1
590 . 1 1 126 126 GLU C C 13 177.955 0.005 3 1 . . . . 126 E C . 18479 1
591 . 1 1 126 126 GLU CA C 13 56.235 0.049 6 1 . . . . 126 E CA . 18479 1
592 . 1 1 126 126 GLU CB C 13 30.049 0.025 3 1 . . . . 126 E CB . 18479 1
593 . 1 1 126 126 GLU N N 15 130.128 0.013 14 1 . . . . 126 E N . 18479 1
594 . 1 1 127 127 SER H H 1 9.389 0.002 12 1 . . . . 127 S H . 18479 1
595 . 1 1 127 127 SER C C 13 176.583 0.000 1 1 . . . . 127 S C . 18479 1
596 . 1 1 127 127 SER CA C 13 62.797 0.001 2 1 . . . . 127 S CA . 18479 1
597 . 1 1 127 127 SER CB C 13 62.626 0.134 4 1 . . . . 127 S CB . 18479 1
598 . 1 1 127 127 SER N N 15 124.693 0.020 12 1 . . . . 127 S N . 18479 1
599 . 1 1 128 128 ARG H H 1 8.617 0.002 11 1 . . . . 128 R H . 18479 1
600 . 1 1 128 128 ARG C C 13 177.688 0.001 3 1 . . . . 128 R C . 18479 1
601 . 1 1 128 128 ARG CA C 13 58.802 0.163 7 1 . . . . 128 R CA . 18479 1
602 . 1 1 128 128 ARG CB C 13 29.671 0.068 2 1 . . . . 128 R CB . 18479 1
603 . 1 1 128 128 ARG N N 15 120.827 0.025 11 1 . . . . 128 R N . 18479 1
604 . 1 1 129 129 GLN H H 1 6.737 0.003 19 1 . . . . 129 Q H . 18479 1
605 . 1 1 129 129 GLN C C 13 178.982 0.011 3 1 . . . . 129 Q C . 18479 1
606 . 1 1 129 129 GLN CA C 13 52.087 9.931 9 1 . . . . 129 Q CA . 18479 1
607 . 1 1 129 129 GLN CB C 13 28.813 0.554 5 1 . . . . 129 Q CB . 18479 1
608 . 1 1 129 129 GLN N N 15 119.873 0.123 19 1 . . . . 129 Q N . 18479 1
609 . 1 1 130 130 ALA H H 1 6.975 0.006 14 1 . . . . 130 A H . 18479 1
610 . 1 1 130 130 ALA C C 13 178.122 0.005 3 1 . . . . 130 A C . 18479 1
611 . 1 1 130 130 ALA CA C 13 54.887 0.057 6 1 . . . . 130 A CA . 18479 1
612 . 1 1 130 130 ALA CB C 13 18.501 0.039 3 1 . . . . 130 A CB . 18479 1
613 . 1 1 130 130 ALA N N 15 126.430 0.022 14 1 . . . . 130 A N . 18479 1
614 . 1 1 131 131 GLN H H 1 8.556 0.003 14 1 . . . . 131 Q H . 18479 1
615 . 1 1 131 131 GLN C C 13 179.374 0.016 3 1 . . . . 131 Q C . 18479 1
616 . 1 1 131 131 GLN CA C 13 58.917 0.047 6 1 . . . . 131 Q CA . 18479 1
617 . 1 1 131 131 GLN CB C 13 28.546 0.042 3 1 . . . . 131 Q CB . 18479 1
618 . 1 1 131 131 GLN N N 15 120.894 0.013 14 1 . . . . 131 Q N . 18479 1
619 . 1 1 132 132 ASP H H 1 8.161 0.004 14 1 . . . . 132 D H . 18479 1
620 . 1 1 132 132 ASP C C 13 178.861 0.045 3 1 . . . . 132 D C . 18479 1
621 . 1 1 132 132 ASP CA C 13 57.285 0.053 6 1 . . . . 132 D CA . 18479 1
622 . 1 1 132 132 ASP CB C 13 39.727 0.049 3 1 . . . . 132 D CB . 18479 1
623 . 1 1 132 132 ASP N N 15 123.042 0.004 14 1 . . . . 132 D N . 18479 1
624 . 1 1 133 133 LEU H H 1 7.434 0.004 13 1 . . . . 133 L H . 18479 1
625 . 1 1 133 133 LEU C C 13 178.928 0.011 2 1 . . . . 133 L C . 18479 1
626 . 1 1 133 133 LEU CA C 13 57.885 0.093 6 1 . . . . 133 L CA . 18479 1
627 . 1 1 133 133 LEU CB C 13 41.478 0.007 3 1 . . . . 133 L CB . 18479 1
628 . 1 1 133 133 LEU N N 15 126.543 0.014 13 1 . . . . 133 L N . 18479 1
629 . 1 1 134 134 ALA H H 1 8.374 0.004 14 1 . . . . 134 A H . 18479 1
630 . 1 1 134 134 ALA C C 13 179.854 0.001 2 1 . . . . 134 A C . 18479 1
631 . 1 1 134 134 ALA CA C 13 55.957 0.061 6 1 . . . . 134 A CA . 18479 1
632 . 1 1 134 134 ALA CB C 13 18.101 0.012 3 1 . . . . 134 A CB . 18479 1
633 . 1 1 134 134 ALA N N 15 124.752 0.028 14 1 . . . . 134 A N . 18479 1
634 . 1 1 135 135 ARG H H 1 8.418 0.002 13 1 . . . . 135 R H . 18479 1
635 . 1 1 135 135 ARG C C 13 179.986 0.029 3 1 . . . . 135 R C . 18479 1
636 . 1 1 135 135 ARG CA C 13 59.504 0.061 6 1 . . . . 135 R CA . 18479 1
637 . 1 1 135 135 ARG CB C 13 29.605 0.003 3 1 . . . . 135 R CB . 18479 1
638 . 1 1 135 135 ARG N N 15 121.250 0.012 13 1 . . . . 135 R N . 18479 1
639 . 1 1 136 136 SER H H 1 7.889 0.002 14 1 . . . . 136 S H . 18479 1
640 . 1 1 136 136 SER C C 13 176.087 0.007 2 1 . . . . 136 S C . 18479 1
641 . 1 1 136 136 SER CA C 13 61.471 0.086 5 1 . . . . 136 S CA . 18479 1
642 . 1 1 136 136 SER CB C 13 62.489 0.039 3 1 . . . . 136 S CB . 18479 1
643 . 1 1 136 136 SER N N 15 120.739 0.026 14 1 . . . . 136 S N . 18479 1
644 . 1 1 137 137 TYR H H 1 7.570 0.003 12 1 . . . . 137 Y H . 18479 1
645 . 1 1 137 137 TYR C C 13 176.221 0.001 3 1 . . . . 137 Y C . 18479 1
646 . 1 1 137 137 TYR CA C 13 54.743 0.076 6 1 . . . . 137 Y CA . 18479 1
647 . 1 1 137 137 TYR CB C 13 38.631 0.067 3 1 . . . . 137 Y CB . 18479 1
648 . 1 1 137 137 TYR N N 15 123.014 0.004 12 1 . . . . 137 Y N . 18479 1
649 . 1 1 138 138 GLY H H 1 8.269 0.004 13 1 . . . . 138 G H . 18479 1
650 . 1 1 138 138 GLY C C 13 175.069 0.016 3 1 . . . . 138 G C . 18479 1
651 . 1 1 138 138 GLY CA C 13 46.462 0.068 6 1 . . . . 138 G CA . 18479 1
652 . 1 1 138 138 GLY N N 15 113.874 0.017 13 1 . . . . 138 G N . 18479 1
653 . 1 1 139 139 ILE H H 1 8.025 0.003 12 1 . . . . 139 I H . 18479 1
654 . 1 1 139 139 ILE C C 13 172.805 0.000 1 1 . . . . 139 I C . 18479 1
655 . 1 1 139 139 ILE CA C 13 58.576 0.004 2 1 . . . . 139 I CA . 18479 1
656 . 1 1 139 139 ILE CB C 13 38.536 0.000 1 1 . . . . 139 I CB . 18479 1
657 . 1 1 139 139 ILE N N 15 116.204 0.017 12 1 . . . . 139 I N . 18479 1
658 . 1 1 140 140 PRO C C 13 179.373 0.000 1 1 . . . . 140 P C . 18479 1
659 . 1 1 140 140 PRO CA C 13 62.535 0.000 0 1 . . . . 140 P CA . 18479 1
660 . 1 1 141 141 TYR H H 1 8.213 0.005 7 1 . . . . 141 Y H . 18479 1
661 . 1 1 141 141 TYR C C 13 174.484 0.015 3 1 . . . . 141 Y C . 18479 1
662 . 1 1 141 141 TYR CA C 13 54.951 0.083 6 1 . . . . 141 Y CA . 18479 1
663 . 1 1 141 141 TYR CB C 13 41.097 0.082 3 1 . . . . 141 Y CB . 18479 1
664 . 1 1 141 141 TYR N N 15 122.832 0.006 7 1 . . . . 141 Y N . 18479 1
665 . 1 1 142 142 ILE H H 1 8.452 0.004 14 1 . . . . 142 I H . 18479 1
666 . 1 1 142 142 ILE C C 13 172.836 0.022 3 1 . . . . 142 I C . 18479 1
667 . 1 1 142 142 ILE CA C 13 59.468 0.069 6 1 . . . . 142 I CA . 18479 1
668 . 1 1 142 142 ILE CB C 13 42.186 0.032 3 1 . . . . 142 I CB . 18479 1
669 . 1 1 142 142 ILE N N 15 133.089 0.007 14 1 . . . . 142 I N . 18479 1
670 . 1 1 143 143 GLU H H 1 7.777 0.004 14 1 . . . . 143 E H . 18479 1
671 . 1 1 143 143 GLU C C 13 176.053 0.002 2 1 . . . . 143 E C . 18479 1
672 . 1 1 143 143 GLU CA C 13 55.762 0.152 6 1 . . . . 143 E CA . 18479 1
673 . 1 1 143 143 GLU CB C 13 29.576 0.054 3 1 . . . . 143 E CB . 18479 1
674 . 1 1 143 143 GLU N N 15 127.569 0.044 14 1 . . . . 143 E N . 18479 1
675 . 1 1 144 144 THR H H 1 8.713 0.004 13 1 . . . . 144 T H . 18479 1
676 . 1 1 144 144 THR C C 13 176.121 0.025 3 1 . . . . 144 T C . 18479 1
677 . 1 1 144 144 THR CA C 13 59.566 0.089 6 1 . . . . 144 T CA . 18479 1
678 . 1 1 144 144 THR CB C 13 73.430 0.047 3 1 . . . . 144 T CB . 18479 1
679 . 1 1 144 144 THR N N 15 115.215 0.019 13 1 . . . . 144 T N . 18479 1
680 . 1 1 145 145 SER H H 1 8.806 0.003 14 1 . . . . 145 S H . 18479 1
681 . 1 1 145 145 SER C C 13 175.703 0.012 3 1 . . . . 145 S C . 18479 1
682 . 1 1 145 145 SER CA C 13 57.282 0.130 6 1 . . . . 145 S CA . 18479 1
683 . 1 1 145 145 SER CB C 13 64.263 0.022 3 1 . . . . 145 S CB . 18479 1
684 . 1 1 145 145 SER N N 15 115.576 0.002 14 1 . . . . 145 S N . 18479 1
685 . 1 1 146 146 ALA H H 1 9.081 0.002 13 1 . . . . 146 A H . 18479 1
686 . 1 1 146 146 ALA C C 13 175.726 0.010 2 1 . . . . 146 A C . 18479 1
687 . 1 1 146 146 ALA CA C 13 54.655 0.047 6 1 . . . . 146 A CA . 18479 1
688 . 1 1 146 146 ALA CB C 13 18.535 0.033 3 1 . . . . 146 A CB . 18479 1
689 . 1 1 146 146 ALA N N 15 135.380 0.009 13 1 . . . . 146 A N . 18479 1
690 . 1 1 147 147 LYS H H 1 6.949 0.003 14 1 . . . . 147 K H . 18479 1
691 . 1 1 147 147 LYS C C 13 177.047 0.012 3 1 . . . . 147 K C . 18479 1
692 . 1 1 147 147 LYS CA C 13 58.253 0.065 6 1 . . . . 147 K CA . 18479 1
693 . 1 1 147 147 LYS CB C 13 33.859 0.038 3 1 . . . . 147 K CB . 18479 1
694 . 1 1 147 147 LYS N N 15 118.976 0.002 14 1 . . . . 147 K N . 18479 1
695 . 1 1 148 148 THR H H 1 7.674 0.002 14 1 . . . . 148 T H . 18479 1
696 . 1 1 148 148 THR C C 13 175.927 0.003 2 1 . . . . 148 T C . 18479 1
697 . 1 1 148 148 THR CA C 13 61.564 0.111 6 1 . . . . 148 T CA . 18479 1
698 . 1 1 148 148 THR CB C 13 69.601 0.133 3 1 . . . . 148 T CB . 18479 1
699 . 1 1 148 148 THR N N 15 109.299 0.021 14 1 . . . . 148 T N . 18479 1
700 . 1 1 149 149 ARG H H 1 7.788 0.003 13 1 . . . . 149 R H . 18479 1
701 . 1 1 149 149 ARG C C 13 175.496 0.003 3 1 . . . . 149 R C . 18479 1
702 . 1 1 149 149 ARG CA C 13 59.746 0.113 6 1 . . . . 149 R CA . 18479 1
703 . 1 1 149 149 ARG CB C 13 30.471 0.038 3 1 . . . . 149 R CB . 18479 1
704 . 1 1 149 149 ARG N N 15 121.428 0.010 13 1 . . . . 149 R N . 18479 1
705 . 1 1 150 150 GLN H H 1 7.792 0.003 14 1 . . . . 150 Q H . 18479 1
706 . 1 1 150 150 GLN C C 13 176.958 0.012 3 1 . . . . 150 Q C . 18479 1
707 . 1 1 150 150 GLN CA C 13 57.516 0.094 6 1 . . . . 150 Q CA . 18479 1
708 . 1 1 150 150 GLN CB C 13 28.443 0.082 3 1 . . . . 150 Q CB . 18479 1
709 . 1 1 150 150 GLN N N 15 127.204 0.032 14 1 . . . . 150 Q N . 18479 1
710 . 1 1 151 151 GLY H H 1 8.888 0.004 13 1 . . . . 151 G H . 18479 1
711 . 1 1 151 151 GLY C C 13 173.530 0.002 3 1 . . . . 151 G C . 18479 1
712 . 1 1 151 151 GLY CA C 13 46.978 0.077 6 1 . . . . 151 G CA . 18479 1
713 . 1 1 151 151 GLY N N 15 118.162 0.001 13 1 . . . . 151 G N . 18479 1
714 . 1 1 152 152 VAL H H 1 7.032 0.002 12 1 . . . . 152 V H . 18479 1
715 . 1 1 152 152 VAL C C 13 176.995 0.006 3 1 . . . . 152 V C . 18479 1
716 . 1 1 152 152 VAL CA C 13 68.349 0.083 6 1 . . . . 152 V CA . 18479 1
717 . 1 1 152 152 VAL CB C 13 31.336 0.050 3 1 . . . . 152 V CB . 18479 1
718 . 1 1 152 152 VAL N N 15 123.503 0.003 12 1 . . . . 152 V N . 18479 1
719 . 1 1 153 153 GLU H H 1 8.198 0.005 14 1 . . . . 153 E H . 18479 1
720 . 1 1 153 153 GLU C C 13 177.173 0.005 3 1 . . . . 153 E C . 18479 1
721 . 1 1 153 153 GLU CA C 13 60.384 0.029 6 1 . . . . 153 E CA . 18479 1
722 . 1 1 153 153 GLU CB C 13 28.688 0.039 3 1 . . . . 153 E CB . 18479 1
723 . 1 1 153 153 GLU N N 15 119.588 0.015 14 1 . . . . 153 E N . 18479 1
724 . 1 1 154 154 ASP H H 1 8.096 0.002 14 1 . . . . 154 D H . 18479 1
725 . 1 1 154 154 ASP C C 13 179.304 0.004 2 1 . . . . 154 D C . 18479 1
726 . 1 1 154 154 ASP CA C 13 57.382 0.097 5 1 . . . . 154 D CA . 18479 1
727 . 1 1 154 154 ASP CB C 13 39.839 0.055 3 1 . . . . 154 D CB . 18479 1
728 . 1 1 154 154 ASP N N 15 119.375 0.012 14 1 . . . . 154 D N . 18479 1
729 . 1 1 155 155 ALA H H 1 8.551 0.002 11 1 . . . . 155 A H . 18479 1
730 . 1 1 155 155 ALA C C 13 177.605 0.004 3 1 . . . . 155 A C . 18479 1
731 . 1 1 155 155 ALA CA C 13 56.291 0.034 6 1 . . . . 155 A CA . 18479 1
732 . 1 1 155 155 ALA CB C 13 17.508 0.002 2 1 . . . . 155 A CB . 18479 1
733 . 1 1 155 155 ALA N N 15 127.086 0.014 11 1 . . . . 155 A N . 18479 1
734 . 1 1 156 156 PHE H H 1 7.154 0.004 14 1 . . . . 156 F H . 18479 1
735 . 1 1 156 156 PHE C C 13 177.951 0.018 3 1 . . . . 156 F C . 18479 1
736 . 1 1 156 156 PHE CA C 13 62.924 0.056 6 1 . . . . 156 F CA . 18479 1
737 . 1 1 156 156 PHE CB C 13 39.575 0.031 3 1 . . . . 156 F CB . 18479 1
738 . 1 1 156 156 PHE N N 15 115.398 0.013 14 1 . . . . 156 F N . 18479 1
739 . 1 1 157 157 TYR H H 1 9.573 0.003 14 1 . . . . 157 Y H . 18479 1
740 . 1 1 157 157 TYR C C 13 179.041 0.003 3 1 . . . . 157 Y C . 18479 1
741 . 1 1 157 157 TYR CA C 13 58.487 0.058 6 1 . . . . 157 Y CA . 18479 1
742 . 1 1 157 157 TYR CB C 13 34.852 0.043 3 1 . . . . 157 Y CB . 18479 1
743 . 1 1 157 157 TYR N N 15 122.184 0.039 14 1 . . . . 157 Y N . 18479 1
744 . 1 1 158 158 THR H H 1 8.483 0.006 13 1 . . . . 158 T H . 18479 1
745 . 1 1 158 158 THR C C 13 175.624 0.001 2 1 . . . . 158 T C . 18479 1
746 . 1 1 158 158 THR CA C 13 67.650 0.050 5 1 . . . . 158 T CA . 18479 1
747 . 1 1 158 158 THR N N 15 119.969 0.019 13 1 . . . . 158 T N . 18479 1
748 . 1 1 159 159 LEU H H 1 7.150 0.004 10 1 . . . . 159 L H . 18479 1
749 . 1 1 159 159 LEU C C 13 177.431 0.001 2 1 . . . . 159 L C . 18479 1
750 . 1 1 159 159 LEU CA C 13 58.033 0.048 5 1 . . . . 159 L CA . 18479 1
751 . 1 1 159 159 LEU CB C 13 40.171 0.066 3 1 . . . . 159 L CB . 18479 1
752 . 1 1 159 159 LEU N N 15 124.469 0.016 10 1 . . . . 159 L N . 18479 1
753 . 1 1 160 160 VAL H H 1 7.470 0.003 12 1 . . . . 160 V H . 18479 1
754 . 1 1 160 160 VAL C C 13 177.439 0.016 3 1 . . . . 160 V C . 18479 1
755 . 1 1 160 160 VAL CA C 13 67.346 0.053 6 1 . . . . 160 V CA . 18479 1
756 . 1 1 160 160 VAL CB C 13 30.724 0.088 3 1 . . . . 160 V CB . 18479 1
757 . 1 1 160 160 VAL N N 15 121.810 0.030 12 1 . . . . 160 V N . 18479 1
758 . 1 1 161 161 ARG H H 1 8.092 0.004 14 1 . . . . 161 R H . 18479 1
759 . 1 1 161 161 ARG C C 13 179.003 0.004 3 1 . . . . 161 R C . 18479 1
760 . 1 1 161 161 ARG CA C 13 60.949 0.082 6 1 . . . . 161 R CA . 18479 1
761 . 1 1 161 161 ARG CB C 13 29.423 0.258 3 1 . . . . 161 R CB . 18479 1
762 . 1 1 161 161 ARG N N 15 122.173 0.012 14 1 . . . . 161 R N . 18479 1
763 . 1 1 162 162 GLU H H 1 8.119 0.004 14 1 . . . . 162 E H . 18479 1
764 . 1 1 162 162 GLU C C 13 179.713 0.008 3 1 . . . . 162 E C . 18479 1
765 . 1 1 162 162 GLU CA C 13 58.841 0.144 6 1 . . . . 162 E CA . 18479 1
766 . 1 1 162 162 GLU CB C 13 30.455 0.270 3 1 . . . . 162 E CB . 18479 1
767 . 1 1 162 162 GLU N N 15 121.189 0.017 14 1 . . . . 162 E N . 18479 1
768 . 1 1 163 163 ILE H H 1 8.078 0.007 14 1 . . . . 163 I H . 18479 1
769 . 1 1 163 163 ILE C C 13 178.842 0.009 3 1 . . . . 163 I C . 18479 1
770 . 1 1 163 163 ILE CA C 13 65.855 0.093 6 1 . . . . 163 I CA . 18479 1
771 . 1 1 163 163 ILE CB C 13 38.197 0.081 3 1 . . . . 163 I CB . 18479 1
772 . 1 1 163 163 ILE N N 15 124.907 0.029 14 1 . . . . 163 I N . 18479 1
773 . 1 1 164 164 ARG H H 1 8.312 0.004 14 1 . . . . 164 R H . 18479 1
774 . 1 1 164 164 ARG C C 13 177.495 0.007 3 1 . . . . 164 R C . 18479 1
775 . 1 1 164 164 ARG CA C 13 58.981 0.056 6 1 . . . . 164 R CA . 18479 1
776 . 1 1 164 164 ARG CB C 13 31.137 0.059 3 1 . . . . 164 R CB . 18479 1
777 . 1 1 164 164 ARG N N 15 121.437 0.010 14 1 . . . . 164 R N . 18479 1
778 . 1 1 165 165 GLN H H 1 7.601 0.003 14 1 . . . . 165 Q H . 18479 1
779 . 1 1 165 165 GLN C C 13 175.133 0.010 3 1 . . . . 165 Q C . 18479 1
780 . 1 1 165 165 GLN CA C 13 56.021 0.071 6 1 . . . . 165 Q CA . 18479 1
781 . 1 1 165 165 GLN CB C 13 29.310 0.208 3 1 . . . . 165 Q CB . 18479 1
782 . 1 1 165 165 GLN N N 15 118.619 0.004 14 1 . . . . 165 Q N . 18479 1
783 . 1 1 166 166 HIS H H 1 7.651 0.003 13 1 . . . . 166 H H . 18479 1
784 . 1 1 166 166 HIS CA C 13 58.168 0.028 2 1 . . . . 166 H CA . 18479 1
785 . 1 1 166 166 HIS CB C 13 43.382 0.000 1 1 . . . . 166 H CB . 18479 1
786 . 1 1 166 166 HIS N N 15 128.013 0.021 13 1 . . . . 166 H N . 18479 1
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