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 51748
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'MERS Nsp9'
_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 .
_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 '1D 1H' . . . 51748 1
2 '2D 1H-15N HSQC' . . . 51748 1
3 '3D CBCA(CO)NH' . . . 51748 1
4 '3D HNCACB' . . . 51748 1
5 '3D HNCO' . . . 51748 1
6 '3D HN(CA)CO' . . . 51748 1
7 '3D 1H-15N NOESY' . . . 51748 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
2 $software_2 . . 51748 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 2 2 ASN HD21 H 1 7.606 0.001 . . . 5 . . . 2 N HD21 . 51748 1
2 . 1 . 1 2 2 ASN HD22 H 1 6.947 0.003 . . . 6 . . . 2 N HD22 . 51748 1
3 . 1 . 1 2 2 ASN C C 13 174.697 0.091 . . . 2 . . . 2 N C . 51748 1
4 . 1 . 1 2 2 ASN CA C 13 53.523 0.034 . . . 6 . . . 2 N CA . 51748 1
5 . 1 . 1 2 2 ASN CB C 13 38.646 0.031 . . . 5 . . . 2 N CB . 51748 1
6 . 1 . 1 2 2 ASN CG C 13 177.166 0.037 . . . 2 . . . 2 N CG . 51748 1
7 . 1 . 1 2 2 ASN ND2 N 15 112.495 0.214 . . . 11 . . . 2 N ND2 . 51748 1
8 . 1 . 1 3 3 GLU H H 1 8.448 0.001 . . . 10 . . . 3 E H . 51748 1
9 . 1 . 1 3 3 GLU C C 13 176.236 0.027 . . . 2 . . . 3 E C . 51748 1
10 . 1 . 1 3 3 GLU CA C 13 56.918 0.031 . . . 3 . . . 3 E CA . 51748 1
11 . 1 . 1 3 3 GLU CB C 13 30.311 0.020 . . . 3 . . . 3 E CB . 51748 1
12 . 1 . 1 3 3 GLU N N 15 121.169 0.055 . . . 10 . . . 3 E N . 51748 1
13 . 1 . 1 4 4 ILE H H 1 8.263 0.001 . . . 9 . . . 4 I H . 51748 1
14 . 1 . 1 4 4 ILE C C 13 176.034 0.047 . . . 2 . . . 4 I C . 51748 1
15 . 1 . 1 4 4 ILE CA C 13 60.999 0.068 . . . 2 . . . 4 I CA . 51748 1
16 . 1 . 1 4 4 ILE CB C 13 38.452 0.002 . . . 2 . . . 4 I CB . 51748 1
17 . 1 . 1 4 4 ILE N N 15 122.719 0.037 . . . 9 . . . 4 I N . 51748 1
18 . 1 . 1 5 5 LYS H H 1 8.449 0.002 . . . 7 . . . 5 K H . 51748 1
19 . 1 . 1 5 5 LYS C C 13 174.469 0.000 . . . 1 . . . 5 K C . 51748 1
20 . 1 . 1 5 5 LYS CA C 13 54.023 0.000 . . . 1 . . . 5 K CA . 51748 1
21 . 1 . 1 5 5 LYS CB C 13 32.511 0.000 . . . 1 . . . 5 K CB . 51748 1
22 . 1 . 1 5 5 LYS N N 15 127.457 0.065 . . . 7 . . . 5 K N . 51748 1
23 . 1 . 1 7 7 SER CA C 13 58.677 0.024 . . . 2 . . . 7 S CA . 51748 1
24 . 1 . 1 7 7 SER CB C 13 63.995 0.000 . . . 1 . . . 7 S CB . 51748 1
25 . 1 . 1 8 8 GLY H H 1 8.447 0.004 . . . 5 . . . 8 G H . 51748 1
26 . 1 . 1 8 8 GLY CA C 13 45.450 0.000 . . . 1 . . . 8 G CA . 51748 1
27 . 1 . 1 8 8 GLY N N 15 110.799 0.038 . . . 5 . . . 8 G N . 51748 1
28 . 1 . 1 12 12 MET C C 13 172.435 0.081 . . . 2 . . . 12 M C . 51748 1
29 . 1 . 1 12 12 MET CA C 13 54.806 0.043 . . . 2 . . . 12 M CA . 51748 1
30 . 1 . 1 12 12 MET CB C 13 35.015 0.067 . . . 2 . . . 12 M CB . 51748 1
31 . 1 . 1 13 13 VAL H H 1 8.471 0.007 . . . 9 . . . 13 V H . 51748 1
32 . 1 . 1 13 13 VAL C C 13 176.616 0.082 . . . 2 . . . 13 V C . 51748 1
33 . 1 . 1 13 13 VAL CA C 13 62.328 0.075 . . . 3 . . . 13 V CA . 51748 1
34 . 1 . 1 13 13 VAL CB C 13 32.736 0.051 . . . 3 . . . 13 V CB . 51748 1
35 . 1 . 1 13 13 VAL N N 15 120.975 0.051 . . . 9 . . . 13 V N . 51748 1
36 . 1 . 1 14 14 VAL H H 1 8.918 0.003 . . . 10 . . . 14 V H . 51748 1
37 . 1 . 1 14 14 VAL C C 13 174.547 0.052 . . . 3 . . . 14 V C . 51748 1
38 . 1 . 1 14 14 VAL CA C 13 58.566 0.038 . . . 2 . . . 14 V CA . 51748 1
39 . 1 . 1 14 14 VAL CB C 13 35.228 0.035 . . . 3 . . . 14 V CB . 51748 1
40 . 1 . 1 14 14 VAL N N 15 120.674 0.047 . . . 10 . . . 14 V N . 51748 1
41 . 1 . 1 15 15 SER H H 1 8.344 0.002 . . . 9 . . . 15 S H . 51748 1
42 . 1 . 1 15 15 SER C C 13 172.555 0.043 . . . 2 . . . 15 S C . 51748 1
43 . 1 . 1 15 15 SER CA C 13 58.527 0.004 . . . 3 . . . 15 S CA . 51748 1
44 . 1 . 1 15 15 SER CB C 13 64.094 0.008 . . . 3 . . . 15 S CB . 51748 1
45 . 1 . 1 15 15 SER N N 15 117.628 0.033 . . . 9 . . . 15 S N . 51748 1
46 . 1 . 1 16 16 ALA H H 1 8.978 0.005 . . . 9 . . . 16 A H . 51748 1
47 . 1 . 1 16 16 ALA C C 13 175.449 0.065 . . . 3 . . . 16 A C . 51748 1
48 . 1 . 1 16 16 ALA CA C 13 50.869 0.033 . . . 3 . . . 16 A CA . 51748 1
49 . 1 . 1 16 16 ALA CB C 13 24.823 0.012 . . . 3 . . . 16 A CB . 51748 1
50 . 1 . 1 16 16 ALA N N 15 126.481 0.018 . . . 9 . . . 16 A N . 51748 1
51 . 1 . 1 17 17 GLY H H 1 8.875 0.002 . . . 8 . . . 17 G H . 51748 1
52 . 1 . 1 17 17 GLY C C 13 173.669 0.000 . . . 1 . . . 17 G C . 51748 1
53 . 1 . 1 17 17 GLY CA C 13 45.982 0.012 . . . 3 . . . 17 G CA . 51748 1
54 . 1 . 1 17 17 GLY N N 15 104.832 0.031 . . . 8 . . . 17 G N . 51748 1
55 . 1 . 1 18 18 GLN H H 1 9.295 0.002 . . . 8 . . . 18 Q H . 51748 1
56 . 1 . 1 18 18 GLN HE21 H 1 7.614 0.003 . . . 7 . . . 18 Q HE21 . 51748 1
57 . 1 . 1 18 18 GLN HE22 H 1 6.851 0.001 . . . 6 . . . 18 Q HE22 . 51748 1
58 . 1 . 1 18 18 GLN C C 13 174.832 0.024 . . . 3 . . . 18 Q C . 51748 1
59 . 1 . 1 18 18 GLN CA C 13 58.719 0.082 . . . 3 . . . 18 Q CA . 51748 1
60 . 1 . 1 18 18 GLN CB C 13 29.906 0.055 . . . 7 . . . 18 Q CB . 51748 1
61 . 1 . 1 18 18 GLN CG C 13 34.557 0.078 . . . 4 . . . 18 Q CG . 51748 1
62 . 1 . 1 18 18 GLN CD C 13 180.106 0.007 . . . 2 . . . 18 Q CD . 51748 1
63 . 1 . 1 18 18 GLN N N 15 122.448 0.033 . . . 7 . . . 18 Q N . 51748 1
64 . 1 . 1 18 18 GLN NE2 N 15 111.098 0.236 . . . 13 . . . 18 Q NE2 . 51748 1
65 . 1 . 1 19 19 GLU H H 1 7.892 0.001 . . . 10 . . . 19 E H . 51748 1
66 . 1 . 1 19 19 GLU C C 13 176.151 0.006 . . . 2 . . . 19 E C . 51748 1
67 . 1 . 1 19 19 GLU CA C 13 54.310 0.041 . . . 3 . . . 19 E CA . 51748 1
68 . 1 . 1 19 19 GLU CB C 13 33.005 0.107 . . . 3 . . . 19 E CB . 51748 1
69 . 1 . 1 19 19 GLU N N 15 114.929 0.033 . . . 10 . . . 19 E N . 51748 1
70 . 1 . 1 20 20 GLN H H 1 8.411 0.002 . . . 9 . . . 20 Q H . 51748 1
71 . 1 . 1 20 20 GLN HE21 H 1 6.533 0.003 . . . 6 . . . 20 Q HE21 . 51748 1
72 . 1 . 1 20 20 GLN HE22 H 1 6.277 0.090 . . . 9 . . . 20 Q HE22 . 51748 1
73 . 1 . 1 20 20 GLN C C 13 176.391 0.096 . . . 3 . . . 20 Q C . 51748 1
74 . 1 . 1 20 20 GLN CA C 13 59.404 0.058 . . . 3 . . . 20 Q CA . 51748 1
75 . 1 . 1 20 20 GLN CB C 13 28.218 0.052 . . . 7 . . . 20 Q CB . 51748 1
76 . 1 . 1 20 20 GLN CG C 13 32.947 0.077 . . . 4 . . . 20 Q CG . 51748 1
77 . 1 . 1 20 20 GLN CD C 13 178.966 0.001 . . . 2 . . . 20 Q CD . 51748 1
78 . 1 . 1 20 20 GLN N N 15 121.949 0.058 . . . 9 . . . 20 Q N . 51748 1
79 . 1 . 1 20 20 GLN NE2 N 15 110.360 0.239 . . . 15 . . . 20 Q NE2 . 51748 1
80 . 1 . 1 21 21 THR H H 1 7.221 0.010 . . . 12 . . . 21 T H . 51748 1
81 . 1 . 1 21 21 THR C C 13 173.739 0.056 . . . 2 . . . 21 T C . 51748 1
82 . 1 . 1 21 21 THR CA C 13 61.072 0.074 . . . 3 . . . 21 T CA . 51748 1
83 . 1 . 1 21 21 THR CB C 13 69.008 0.023 . . . 3 . . . 21 T CB . 51748 1
84 . 1 . 1 21 21 THR N N 15 103.229 0.037 . . . 10 . . . 21 T N . 51748 1
85 . 1 . 1 22 22 ASN H H 1 7.431 0.004 . . . 11 . . . 22 N H . 51748 1
86 . 1 . 1 22 22 ASN HD21 H 1 7.552 0.002 . . . 5 . . . 22 N HD21 . 51748 1
87 . 1 . 1 22 22 ASN HD22 H 1 6.663 0.002 . . . 6 . . . 22 N HD22 . 51748 1
88 . 1 . 1 22 22 ASN C C 13 174.149 0.070 . . . 2 . . . 22 N C . 51748 1
89 . 1 . 1 22 22 ASN CA C 13 52.113 0.027 . . . 7 . . . 22 N CA . 51748 1
90 . 1 . 1 22 22 ASN CB C 13 38.657 0.030 . . . 5 . . . 22 N CB . 51748 1
91 . 1 . 1 22 22 ASN CG C 13 176.933 0.002 . . . 2 . . . 22 N CG . 51748 1
92 . 1 . 1 22 22 ASN N N 15 120.497 0.039 . . . 9 . . . 22 N N . 51748 1
93 . 1 . 1 22 22 ASN ND2 N 15 110.736 0.244 . . . 11 . . . 22 N ND2 . 51748 1
94 . 1 . 1 23 23 CYS H H 1 8.607 0.004 . . . 9 . . . 23 C H . 51748 1
95 . 1 . 1 23 23 CYS C C 13 173.765 0.015 . . . 3 . . . 23 C C . 51748 1
96 . 1 . 1 23 23 CYS CA C 13 59.446 0.062 . . . 3 . . . 23 C CA . 51748 1
97 . 1 . 1 23 23 CYS CB C 13 26.105 0.029 . . . 3 . . . 23 C CB . 51748 1
98 . 1 . 1 23 23 CYS N N 15 121.903 0.039 . . . 9 . . . 23 C N . 51748 1
99 . 1 . 1 24 24 ASN H H 1 8.035 0.002 . . . 10 . . . 24 N H . 51748 1
100 . 1 . 1 24 24 ASN HD21 H 1 7.490 0.001 . . . 6 . . . 24 N HD21 . 51748 1
101 . 1 . 1 24 24 ASN HD22 H 1 6.905 0.003 . . . 4 . . . 24 N HD22 . 51748 1
102 . 1 . 1 24 24 ASN C C 13 175.214 0.036 . . . 2 . . . 24 N C . 51748 1
103 . 1 . 1 24 24 ASN CA C 13 52.806 0.027 . . . 6 . . . 24 N CA . 51748 1
104 . 1 . 1 24 24 ASN CB C 13 39.530 0.058 . . . 6 . . . 24 N CB . 51748 1
105 . 1 . 1 24 24 ASN CG C 13 177.723 0.015 . . . 2 . . . 24 N CG . 51748 1
106 . 1 . 1 24 24 ASN N N 15 121.231 0.043 . . . 10 . . . 24 N N . 51748 1
107 . 1 . 1 24 24 ASN ND2 N 15 111.961 0.223 . . . 10 . . . 24 N ND2 . 51748 1
108 . 1 . 1 25 25 THR H H 1 9.164 0.002 . . . 9 . . . 25 T H . 51748 1
109 . 1 . 1 25 25 THR C C 13 174.238 0.018 . . . 2 . . . 25 T C . 51748 1
110 . 1 . 1 25 25 THR CA C 13 62.056 0.052 . . . 3 . . . 25 T CA . 51748 1
111 . 1 . 1 25 25 THR CB C 13 70.245 0.011 . . . 3 . . . 25 T CB . 51748 1
112 . 1 . 1 25 25 THR N N 15 118.959 0.029 . . . 9 . . . 25 T N . 51748 1
113 . 1 . 1 26 26 SER H H 1 9.002 0.002 . . . 9 . . . 26 S H . 51748 1
114 . 1 . 1 26 26 SER C C 13 174.512 0.062 . . . 3 . . . 26 S C . 51748 1
115 . 1 . 1 26 26 SER CA C 13 59.126 0.046 . . . 3 . . . 26 S CA . 51748 1
116 . 1 . 1 26 26 SER CB C 13 63.766 0.037 . . . 3 . . . 26 S CB . 51748 1
117 . 1 . 1 26 26 SER N N 15 124.233 0.040 . . . 9 . . . 26 S N . 51748 1
118 . 1 . 1 27 27 SER H H 1 9.241 0.002 . . . 10 . . . 27 S H . 51748 1
119 . 1 . 1 27 27 SER C C 13 172.107 0.025 . . . 3 . . . 27 S C . 51748 1
120 . 1 . 1 27 27 SER CA C 13 57.823 0.032 . . . 3 . . . 27 S CA . 51748 1
121 . 1 . 1 27 27 SER CB C 13 67.011 0.021 . . . 3 . . . 27 S CB . 51748 1
122 . 1 . 1 27 27 SER N N 15 119.778 0.031 . . . 10 . . . 27 S N . 51748 1
123 . 1 . 1 28 28 LEU H H 1 8.222 0.002 . . . 10 . . . 28 L H . 51748 1
124 . 1 . 1 28 28 LEU C C 13 175.341 0.008 . . . 2 . . . 28 L C . 51748 1
125 . 1 . 1 28 28 LEU CA C 13 56.324 0.035 . . . 2 . . . 28 L CA . 51748 1
126 . 1 . 1 28 28 LEU CB C 13 43.051 0.065 . . . 2 . . . 28 L CB . 51748 1
127 . 1 . 1 28 28 LEU N N 15 128.058 0.074 . . . 10 . . . 28 L N . 51748 1
128 . 1 . 1 29 29 ALA H H 1 9.247 0.006 . . . 6 . . . 29 A H . 51748 1
129 . 1 . 1 29 29 ALA C C 13 175.334 0.023 . . . 2 . . . 29 A C . 51748 1
130 . 1 . 1 29 29 ALA CA C 13 50.395 0.047 . . . 3 . . . 29 A CA . 51748 1
131 . 1 . 1 29 29 ALA CB C 13 24.180 0.098 . . . 2 . . . 29 A CB . 51748 1
132 . 1 . 1 29 29 ALA N N 15 128.086 0.064 . . . 6 . . . 29 A N . 51748 1
133 . 1 . 1 30 30 TYR H H 1 8.935 0.006 . . . 8 . . . 30 Y H . 51748 1
134 . 1 . 1 30 30 TYR C C 13 175.789 0.126 . . . 2 . . . 30 Y C . 51748 1
135 . 1 . 1 30 30 TYR CA C 13 56.465 0.015 . . . 2 . . . 30 Y CA . 51748 1
136 . 1 . 1 30 30 TYR N N 15 117.351 0.019 . . . 8 . . . 30 Y N . 51748 1
137 . 1 . 1 31 31 TYR H H 1 9.358 0.002 . . . 6 . . . 31 Y H . 51748 1
138 . 1 . 1 31 31 TYR C C 13 170.750 0.017 . . . 2 . . . 31 Y C . 51748 1
139 . 1 . 1 31 31 TYR CA C 13 55.510 0.038 . . . 3 . . . 31 Y CA . 51748 1
140 . 1 . 1 31 31 TYR CB C 13 42.941 0.011 . . . 2 . . . 31 Y CB . 51748 1
141 . 1 . 1 31 31 TYR N N 15 121.322 0.025 . . . 6 . . . 31 Y N . 51748 1
142 . 1 . 1 32 32 GLU H H 1 8.548 0.007 . . . 8 . . . 32 E H . 51748 1
143 . 1 . 1 32 32 GLU C C 13 173.474 0.000 . . . 1 . . . 32 E C . 51748 1
144 . 1 . 1 32 32 GLU CA C 13 52.467 0.000 . . . 1 . . . 32 E CA . 51748 1
145 . 1 . 1 32 32 GLU CB C 13 33.567 0.000 . . . 1 . . . 32 E CB . 51748 1
146 . 1 . 1 32 32 GLU N N 15 120.489 0.041 . . . 8 . . . 32 E N . 51748 1
147 . 1 . 1 33 33 PRO C C 13 176.443 0.000 . . . 1 . . . 33 P C . 51748 1
148 . 1 . 1 33 33 PRO CA C 13 61.988 0.000 . . . 1 . . . 33 P CA . 51748 1
149 . 1 . 1 33 33 PRO CB C 13 31.411 0.054 . . . 2 . . . 33 P CB . 51748 1
150 . 1 . 1 34 34 VAL H H 1 8.719 0.003 . . . 8 . . . 34 V H . 51748 1
151 . 1 . 1 34 34 VAL C C 13 175.789 0.167 . . . 2 . . . 34 V C . 51748 1
152 . 1 . 1 34 34 VAL CA C 13 61.921 0.014 . . . 3 . . . 34 V CA . 51748 1
153 . 1 . 1 34 34 VAL CB C 13 34.307 0.009 . . . 3 . . . 34 V CB . 51748 1
154 . 1 . 1 34 34 VAL N N 15 125.722 0.030 . . . 8 . . . 34 V N . 51748 1
155 . 1 . 1 35 35 GLN H H 1 9.319 0.003 . . . 9 . . . 35 Q H . 51748 1
156 . 1 . 1 35 35 GLN HE21 H 1 7.558 0.001 . . . 6 . . . 35 Q HE21 . 51748 1
157 . 1 . 1 35 35 GLN HE22 H 1 6.880 0.002 . . . 6 . . . 35 Q HE22 . 51748 1
158 . 1 . 1 35 35 GLN C C 13 175.958 0.015 . . . 3 . . . 35 Q C . 51748 1
159 . 1 . 1 35 35 GLN CA C 13 56.981 0.017 . . . 3 . . . 35 Q CA . 51748 1
160 . 1 . 1 35 35 GLN CB C 13 27.252 0.047 . . . 7 . . . 35 Q CB . 51748 1
161 . 1 . 1 35 35 GLN CG C 13 34.375 0.025 . . . 4 . . . 35 Q CG . 51748 1
162 . 1 . 1 35 35 GLN CD C 13 180.861 0.013 . . . 2 . . . 35 Q CD . 51748 1
163 . 1 . 1 35 35 GLN N N 15 125.573 0.047 . . . 9 . . . 35 Q N . 51748 1
164 . 1 . 1 35 35 GLN NE2 N 15 111.912 0.198 . . . 12 . . . 35 Q NE2 . 51748 1
165 . 1 . 1 36 36 GLY H H 1 8.600 0.002 . . . 9 . . . 36 G H . 51748 1
166 . 1 . 1 36 36 GLY C C 13 173.944 0.086 . . . 2 . . . 36 G C . 51748 1
167 . 1 . 1 36 36 GLY CA C 13 45.691 0.041 . . . 3 . . . 36 G CA . 51748 1
168 . 1 . 1 36 36 GLY N N 15 105.986 0.046 . . . 9 . . . 36 G N . 51748 1
169 . 1 . 1 37 37 ARG H H 1 8.098 0.001 . . . 7 . . . 37 R H . 51748 1
170 . 1 . 1 37 37 ARG C C 13 175.610 0.004 . . . 2 . . . 37 R C . 51748 1
171 . 1 . 1 37 37 ARG CA C 13 54.553 0.056 . . . 2 . . . 37 R CA . 51748 1
172 . 1 . 1 37 37 ARG CB C 13 32.362 0.068 . . . 2 . . . 37 R CB . 51748 1
173 . 1 . 1 37 37 ARG N N 15 120.540 0.052 . . . 7 . . . 37 R N . 51748 1
174 . 1 . 1 38 38 LYS H H 1 8.630 0.006 . . . 6 . . . 38 K H . 51748 1
175 . 1 . 1 38 38 LYS C C 13 174.867 0.000 . . . 1 . . . 38 K C . 51748 1
176 . 1 . 1 38 38 LYS CA C 13 56.732 0.123 . . . 3 . . . 38 K CA . 51748 1
177 . 1 . 1 38 38 LYS CB C 13 32.339 0.033 . . . 3 . . . 38 K CB . 51748 1
178 . 1 . 1 38 38 LYS N N 15 121.957 0.043 . . . 6 . . . 38 K N . 51748 1
179 . 1 . 1 39 39 MET H H 1 8.531 0.002 . . . 9 . . . 39 M H . 51748 1
180 . 1 . 1 39 39 MET C C 13 174.927 0.010 . . . 2 . . . 39 M C . 51748 1
181 . 1 . 1 39 39 MET CA C 13 53.976 0.033 . . . 2 . . . 39 M CA . 51748 1
182 . 1 . 1 39 39 MET CB C 13 31.469 0.088 . . . 2 . . . 39 M CB . 51748 1
183 . 1 . 1 39 39 MET N N 15 124.338 0.054 . . . 9 . . . 39 M N . 51748 1
184 . 1 . 1 40 40 LEU H H 1 8.675 0.004 . . . 7 . . . 40 L H . 51748 1
185 . 1 . 1 40 40 LEU C C 13 175.695 0.000 . . . 2 . . . 40 L C . 51748 1
186 . 1 . 1 40 40 LEU CA C 13 56.572 0.094 . . . 2 . . . 40 L CA . 51748 1
187 . 1 . 1 40 40 LEU CB C 13 42.692 0.054 . . . 3 . . . 40 L CB . 51748 1
188 . 1 . 1 40 40 LEU N N 15 129.145 0.045 . . . 7 . . . 40 L N . 51748 1
189 . 1 . 1 41 41 MET H H 1 8.972 0.003 . . . 7 . . . 41 M H . 51748 1
190 . 1 . 1 41 41 MET C C 13 175.267 0.000 . . . 1 . . . 41 M C . 51748 1
191 . 1 . 1 41 41 MET CA C 13 56.720 0.046 . . . 3 . . . 41 M CA . 51748 1
192 . 1 . 1 41 41 MET CB C 13 36.799 0.053 . . . 2 . . . 41 M CB . 51748 1
193 . 1 . 1 41 41 MET N N 15 120.389 0.059 . . . 7 . . . 41 M N . 51748 1
194 . 1 . 1 42 42 ALA H H 1 7.708 0.003 . . . 8 . . . 42 A H . 51748 1
195 . 1 . 1 42 42 ALA C C 13 174.905 0.003 . . . 2 . . . 42 A C . 51748 1
196 . 1 . 1 42 42 ALA CA C 13 51.345 0.044 . . . 3 . . . 42 A CA . 51748 1
197 . 1 . 1 42 42 ALA CB C 13 24.610 0.022 . . . 3 . . . 42 A CB . 51748 1
198 . 1 . 1 42 42 ALA N N 15 116.384 0.033 . . . 8 . . . 42 A N . 51748 1
199 . 1 . 1 43 43 LEU H H 1 9.276 0.003 . . . 9 . . . 43 L H . 51748 1
200 . 1 . 1 43 43 LEU C C 13 174.829 0.021 . . . 2 . . . 43 L C . 51748 1
201 . 1 . 1 43 43 LEU CA C 13 54.666 0.047 . . . 2 . . . 43 L CA . 51748 1
202 . 1 . 1 43 43 LEU CB C 13 46.063 0.039 . . . 2 . . . 43 L CB . 51748 1
203 . 1 . 1 43 43 LEU N N 15 120.226 0.064 . . . 9 . . . 43 L N . 51748 1
204 . 1 . 1 44 44 LEU H H 1 8.641 0.006 . . . 7 . . . 44 L H . 51748 1
205 . 1 . 1 44 44 LEU C C 13 175.265 0.130 . . . 2 . . . 44 L C . 51748 1
206 . 1 . 1 44 44 LEU CA C 13 54.004 0.086 . . . 3 . . . 44 L CA . 51748 1
207 . 1 . 1 44 44 LEU CB C 13 46.228 0.027 . . . 3 . . . 44 L CB . 51748 1
208 . 1 . 1 44 44 LEU N N 15 123.602 0.059 . . . 7 . . . 44 L N . 51748 1
209 . 1 . 1 45 45 SER H H 1 9.190 0.003 . . . 9 . . . 45 S H . 51748 1
210 . 1 . 1 45 45 SER C C 13 173.151 0.000 . . . 1 . . . 45 S C . 51748 1
211 . 1 . 1 45 45 SER CA C 13 56.653 0.000 . . . 1 . . . 45 S CA . 51748 1
212 . 1 . 1 45 45 SER CB C 13 66.050 0.000 . . . 1 . . . 45 S CB . 51748 1
213 . 1 . 1 45 45 SER N N 15 118.108 0.022 . . . 9 . . . 45 S N . 51748 1
214 . 1 . 1 46 46 ASP C C 13 174.823 0.000 . . . 1 . . . 46 D C . 51748 1
215 . 1 . 1 46 46 ASP CA C 13 54.260 0.000 . . . 1 . . . 46 D CA . 51748 1
216 . 1 . 1 46 46 ASP CB C 13 40.195 0.000 . . . 1 . . . 46 D CB . 51748 1
217 . 1 . 1 47 47 ASN H H 1 9.208 0.002 . . . 7 . . . 47 N H . 51748 1
218 . 1 . 1 47 47 ASN C C 13 175.824 0.092 . . . 3 . . . 47 N C . 51748 1
219 . 1 . 1 47 47 ASN CA C 13 53.293 0.067 . . . 2 . . . 47 N CA . 51748 1
220 . 1 . 1 47 47 ASN CB C 13 40.951 0.047 . . . 3 . . . 47 N CB . 51748 1
221 . 1 . 1 47 47 ASN N N 15 122.514 0.017 . . . 7 . . . 47 N N . 51748 1
222 . 1 . 1 48 48 ALA H H 1 8.288 0.003 . . . 9 . . . 48 A H . 51748 1
223 . 1 . 1 48 48 ALA C C 13 177.845 0.078 . . . 3 . . . 48 A C . 51748 1
224 . 1 . 1 48 48 ALA CA C 13 53.200 0.015 . . . 2 . . . 48 A CA . 51748 1
225 . 1 . 1 48 48 ALA CB C 13 19.302 0.001 . . . 2 . . . 48 A CB . 51748 1
226 . 1 . 1 48 48 ALA N N 15 129.477 0.106 . . . 9 . . . 48 A N . 51748 1
227 . 1 . 1 49 49 TYR H H 1 8.329 0.003 . . . 8 . . . 49 Y H . 51748 1
228 . 1 . 1 49 49 TYR C C 13 175.684 0.019 . . . 2 . . . 49 Y C . 51748 1
229 . 1 . 1 49 49 TYR CA C 13 57.814 0.050 . . . 2 . . . 49 Y CA . 51748 1
230 . 1 . 1 49 49 TYR CB C 13 38.648 0.008 . . . 2 . . . 49 Y CB . 51748 1
231 . 1 . 1 49 49 TYR N N 15 116.801 0.064 . . . 8 . . . 49 Y N . 51748 1
232 . 1 . 1 50 50 LEU H H 1 7.682 0.002 . . . 7 . . . 50 L H . 51748 1
233 . 1 . 1 50 50 LEU C C 13 176.623 0.015 . . . 3 . . . 50 L C . 51748 1
234 . 1 . 1 50 50 LEU CA C 13 55.625 0.022 . . . 3 . . . 50 L CA . 51748 1
235 . 1 . 1 50 50 LEU CB C 13 41.297 0.058 . . . 3 . . . 50 L CB . 51748 1
236 . 1 . 1 50 50 LEU N N 15 117.765 0.050 . . . 7 . . . 50 L N . 51748 1
237 . 1 . 1 51 51 LYS H H 1 8.288 0.003 . . . 11 . . . 51 K H . 51748 1
238 . 1 . 1 51 51 LYS C C 13 173.544 0.072 . . . 3 . . . 51 K C . 51748 1
239 . 1 . 1 51 51 LYS CA C 13 56.995 0.047 . . . 3 . . . 51 K CA . 51748 1
240 . 1 . 1 51 51 LYS CB C 13 37.694 0.053 . . . 3 . . . 51 K CB . 51748 1
241 . 1 . 1 51 51 LYS N N 15 118.107 0.047 . . . 11 . . . 51 K N . 51748 1
242 . 1 . 1 52 52 TRP H H 1 7.966 0.003 . . . 9 . . . 52 W H . 51748 1
243 . 1 . 1 52 52 TRP C C 13 173.933 0.070 . . . 2 . . . 52 W C . 51748 1
244 . 1 . 1 52 52 TRP CA C 13 55.654 0.055 . . . 3 . . . 52 W CA . 51748 1
245 . 1 . 1 52 52 TRP CB C 13 34.542 0.016 . . . 3 . . . 52 W CB . 51748 1
246 . 1 . 1 52 52 TRP N N 15 117.884 0.039 . . . 9 . . . 52 W N . 51748 1
247 . 1 . 1 53 53 ALA H H 1 9.324 0.002 . . . 9 . . . 53 A H . 51748 1
248 . 1 . 1 53 53 ALA C C 13 175.548 0.015 . . . 2 . . . 53 A C . 51748 1
249 . 1 . 1 53 53 ALA CA C 13 50.348 0.048 . . . 3 . . . 53 A CA . 51748 1
250 . 1 . 1 53 53 ALA CB C 13 23.270 0.018 . . . 3 . . . 53 A CB . 51748 1
251 . 1 . 1 53 53 ALA N N 15 120.717 0.035 . . . 9 . . . 53 A N . 51748 1
252 . 1 . 1 54 54 ARG H H 1 8.524 0.001 . . . 9 . . . 54 R H . 51748 1
253 . 1 . 1 54 54 ARG C C 13 174.961 0.047 . . . 2 . . . 54 R C . 51748 1
254 . 1 . 1 54 54 ARG CA C 13 55.107 0.052 . . . 3 . . . 54 R CA . 51748 1
255 . 1 . 1 54 54 ARG CB C 13 32.720 0.039 . . . 3 . . . 54 R CB . 51748 1
256 . 1 . 1 54 54 ARG N N 15 121.932 0.053 . . . 9 . . . 54 R N . 51748 1
257 . 1 . 1 55 55 VAL H H 1 9.014 0.002 . . . 9 . . . 55 V H . 51748 1
258 . 1 . 1 55 55 VAL C C 13 174.666 0.076 . . . 3 . . . 55 V C . 51748 1
259 . 1 . 1 55 55 VAL CA C 13 60.303 0.039 . . . 3 . . . 55 V CA . 51748 1
260 . 1 . 1 55 55 VAL CB C 13 35.162 0.002 . . . 3 . . . 55 V CB . 51748 1
261 . 1 . 1 55 55 VAL N N 15 122.696 0.036 . . . 9 . . . 55 V N . 51748 1
262 . 1 . 1 56 56 GLU H H 1 8.939 0.001 . . . 10 . . . 56 E H . 51748 1
263 . 1 . 1 56 56 GLU C C 13 176.125 0.029 . . . 3 . . . 56 E C . 51748 1
264 . 1 . 1 56 56 GLU CA C 13 57.402 0.045 . . . 3 . . . 56 E CA . 51748 1
265 . 1 . 1 56 56 GLU CB C 13 30.203 0.010 . . . 3 . . . 56 E CB . 51748 1
266 . 1 . 1 56 56 GLU N N 15 127.058 0.049 . . . 10 . . . 56 E N . 51748 1
267 . 1 . 1 57 57 GLY H H 1 8.055 0.001 . . . 8 . . . 57 G H . 51748 1
268 . 1 . 1 57 57 GLY CA C 13 44.324 0.037 . . . 3 . . . 57 G CA . 51748 1
269 . 1 . 1 57 57 GLY N N 15 113.854 0.036 . . . 8 . . . 57 G N . 51748 1
270 . 1 . 1 58 58 LYS H H 1 8.624 0.009 . . . 5 . . . 58 K H . 51748 1
271 . 1 . 1 58 58 LYS C C 13 177.084 0.062 . . . 3 . . . 58 K C . 51748 1
272 . 1 . 1 58 58 LYS CA C 13 58.881 0.043 . . . 3 . . . 58 K CA . 51748 1
273 . 1 . 1 58 58 LYS CB C 13 32.410 0.049 . . . 2 . . . 58 K CB . 51748 1
274 . 1 . 1 58 58 LYS N N 15 121.961 0.051 . . . 5 . . . 58 K N . 51748 1
275 . 1 . 1 59 59 ASP H H 1 8.429 0.001 . . . 10 . . . 59 D H . 51748 1
276 . 1 . 1 59 59 ASP C C 13 175.037 0.056 . . . 3 . . . 59 D C . 51748 1
277 . 1 . 1 59 59 ASP CA C 13 53.761 0.058 . . . 3 . . . 59 D CA . 51748 1
278 . 1 . 1 59 59 ASP CB C 13 41.316 0.019 . . . 3 . . . 59 D CB . 51748 1
279 . 1 . 1 59 59 ASP N N 15 116.970 0.034 . . . 10 . . . 59 D N . 51748 1
280 . 1 . 1 60 60 GLY H H 1 7.433 0.001 . . . 9 . . . 60 G H . 51748 1
281 . 1 . 1 60 60 GLY C C 13 173.312 0.023 . . . 2 . . . 60 G C . 51748 1
282 . 1 . 1 60 60 GLY CA C 13 44.590 0.007 . . . 3 . . . 60 G CA . 51748 1
283 . 1 . 1 60 60 GLY N N 15 107.935 0.028 . . . 9 . . . 60 G N . 51748 1
284 . 1 . 1 61 61 PHE H H 1 8.557 0.001 . . . 7 . . . 61 F H . 51748 1
285 . 1 . 1 61 61 PHE C C 13 175.989 0.041 . . . 3 . . . 61 F C . 51748 1
286 . 1 . 1 61 61 PHE CA C 13 58.261 0.056 . . . 3 . . . 61 F CA . 51748 1
287 . 1 . 1 61 61 PHE CB C 13 41.168 0.031 . . . 3 . . . 61 F CB . 51748 1
288 . 1 . 1 61 61 PHE N N 15 119.420 0.051 . . . 7 . . . 61 F N . 51748 1
289 . 1 . 1 62 62 VAL H H 1 9.173 0.002 . . . 10 . . . 62 V H . 51748 1
290 . 1 . 1 62 62 VAL C C 13 174.940 0.028 . . . 2 . . . 62 V C . 51748 1
291 . 1 . 1 62 62 VAL CA C 13 60.744 0.042 . . . 3 . . . 62 V CA . 51748 1
292 . 1 . 1 62 62 VAL CB C 13 35.158 0.012 . . . 3 . . . 62 V CB . 51748 1
293 . 1 . 1 62 62 VAL N N 15 120.171 0.036 . . . 10 . . . 62 V N . 51748 1
294 . 1 . 1 63 63 SER H H 1 8.666 0.001 . . . 9 . . . 63 S H . 51748 1
295 . 1 . 1 63 63 SER C C 13 174.392 0.133 . . . 2 . . . 63 S C . 51748 1
296 . 1 . 1 63 63 SER CA C 13 57.948 0.063 . . . 3 . . . 63 S CA . 51748 1
297 . 1 . 1 63 63 SER CB C 13 64.448 0.050 . . . 3 . . . 63 S CB . 51748 1
298 . 1 . 1 63 63 SER N N 15 120.285 0.044 . . . 9 . . . 63 S N . 51748 1
299 . 1 . 1 64 64 VAL H H 1 9.511 0.003 . . . 9 . . . 64 V H . 51748 1
300 . 1 . 1 64 64 VAL C C 13 173.627 0.030 . . . 3 . . . 64 V C . 51748 1
301 . 1 . 1 64 64 VAL CA C 13 61.410 0.054 . . . 3 . . . 64 V CA . 51748 1
302 . 1 . 1 64 64 VAL CB C 13 35.051 0.032 . . . 3 . . . 64 V CB . 51748 1
303 . 1 . 1 64 64 VAL N N 15 125.748 0.023 . . . 9 . . . 64 V N . 51748 1
304 . 1 . 1 65 65 GLU H H 1 8.768 0.002 . . . 10 . . . 65 E H . 51748 1
305 . 1 . 1 65 65 GLU C C 13 175.177 0.031 . . . 2 . . . 65 E C . 51748 1
306 . 1 . 1 65 65 GLU CA C 13 56.353 0.040 . . . 3 . . . 65 E CA . 51748 1
307 . 1 . 1 65 65 GLU CB C 13 30.762 0.009 . . . 2 . . . 65 E CB . 51748 1
308 . 1 . 1 65 65 GLU N N 15 129.231 0.051 . . . 10 . . . 65 E N . 51748 1
309 . 1 . 1 66 66 LEU H H 1 7.362 0.004 . . . 8 . . . 66 L H . 51748 1
310 . 1 . 1 66 66 LEU C C 13 177.209 0.069 . . . 3 . . . 66 L C . 51748 1
311 . 1 . 1 66 66 LEU CA C 13 53.070 0.067 . . . 3 . . . 66 L CA . 51748 1
312 . 1 . 1 66 66 LEU CB C 13 43.322 0.067 . . . 3 . . . 66 L CB . 51748 1
313 . 1 . 1 66 66 LEU N N 15 122.202 0.053 . . . 8 . . . 66 L N . 51748 1
314 . 1 . 1 67 67 GLN H H 1 8.567 0.003 . . . 10 . . . 67 Q H . 51748 1
315 . 1 . 1 67 67 GLN C C 13 173.317 0.000 . . . 1 . . . 67 Q C . 51748 1
316 . 1 . 1 67 67 GLN CA C 13 55.472 0.000 . . . 1 . . . 67 Q CA . 51748 1
317 . 1 . 1 67 67 GLN CB C 13 28.148 0.000 . . . 1 . . . 67 Q CB . 51748 1
318 . 1 . 1 67 67 GLN N N 15 119.964 0.052 . . . 10 . . . 67 Q N . 51748 1
319 . 1 . 1 75 75 ALA C C 13 176.845 0.015 . . . 2 . . . 75 A C . 51748 1
320 . 1 . 1 75 75 ALA CA C 13 52.017 0.005 . . . 2 . . . 75 A CA . 51748 1
321 . 1 . 1 75 75 ALA CB C 13 18.673 0.000 . . . 1 . . . 75 A CB . 51748 1
322 . 1 . 1 76 76 GLY H H 1 7.701 0.004 . . . 8 . . . 76 G H . 51748 1
323 . 1 . 1 76 76 GLY C C 13 172.882 0.000 . . . 1 . . . 76 G C . 51748 1
324 . 1 . 1 76 76 GLY CA C 13 44.486 0.000 . . . 1 . . . 76 G CA . 51748 1
325 . 1 . 1 76 76 GLY N N 15 112.095 0.033 . . . 8 . . . 76 G N . 51748 1
326 . 1 . 1 80 80 PRO C C 13 177.219 0.040 . . . 2 . . . 80 P C . 51748 1
327 . 1 . 1 80 80 PRO CA C 13 62.758 0.078 . . . 2 . . . 80 P CA . 51748 1
328 . 1 . 1 80 80 PRO CB C 13 32.714 0.000 . . . 1 . . . 80 P CB . 51748 1
329 . 1 . 1 81 81 GLU H H 1 9.049 0.003 . . . 9 . . . 81 E H . 51748 1
330 . 1 . 1 81 81 GLU C C 13 174.560 0.035 . . . 2 . . . 81 E C . 51748 1
331 . 1 . 1 81 81 GLU CA C 13 54.579 0.056 . . . 3 . . . 81 E CA . 51748 1
332 . 1 . 1 81 81 GLU CB C 13 34.158 0.022 . . . 3 . . . 81 E CB . 51748 1
333 . 1 . 1 81 81 GLU N N 15 121.565 0.049 . . . 9 . . . 81 E N . 51748 1
334 . 1 . 1 82 82 ILE H H 1 8.496 0.003 . . . 8 . . . 82 I H . 51748 1
335 . 1 . 1 82 82 ILE CA C 13 61.323 0.000 . . . 1 . . . 82 I CA . 51748 1
336 . 1 . 1 82 82 ILE CB C 13 38.766 0.000 . . . 1 . . . 82 I CB . 51748 1
337 . 1 . 1 82 82 ILE N N 15 122.196 0.023 . . . 8 . . . 82 I N . 51748 1
338 . 1 . 1 83 83 ARG C C 13 177.434 0.105 . . . 2 . . . 83 R C . 51748 1
339 . 1 . 1 83 83 ARG CA C 13 62.665 0.022 . . . 2 . . . 83 R CA . 51748 1
340 . 1 . 1 83 83 ARG CB C 13 32.244 0.000 . . . 1 . . . 83 R CB . 51748 1
341 . 1 . 1 84 84 TYR H H 1 8.520 0.003 . . . 9 . . . 84 Y H . 51748 1
342 . 1 . 1 84 84 TYR C C 13 173.515 0.002 . . . 2 . . . 84 Y C . 51748 1
343 . 1 . 1 84 84 TYR CA C 13 57.054 0.010 . . . 2 . . . 84 Y CA . 51748 1
344 . 1 . 1 84 84 TYR CB C 13 29.158 0.000 . . . 1 . . . 84 Y CB . 51748 1
345 . 1 . 1 84 84 TYR N N 15 118.163 0.057 . . . 9 . . . 84 Y N . 51748 1
346 . 1 . 1 85 85 LEU H H 1 8.890 0.007 . . . 5 . . . 85 L H . 51748 1
347 . 1 . 1 85 85 LEU C C 13 175.226 0.061 . . . 2 . . . 85 L C . 51748 1
348 . 1 . 1 85 85 LEU CA C 13 52.967 0.040 . . . 3 . . . 85 L CA . 51748 1
349 . 1 . 1 85 85 LEU CB C 13 44.820 0.067 . . . 2 . . . 85 L CB . 51748 1
350 . 1 . 1 85 85 LEU N N 15 124.906 0.029 . . . 5 . . . 85 L N . 51748 1
351 . 1 . 1 86 86 TYR H H 1 9.608 0.007 . . . 9 . . . 86 Y H . 51748 1
352 . 1 . 1 86 86 TYR C C 13 175.595 0.003 . . . 2 . . . 86 Y C . 51748 1
353 . 1 . 1 86 86 TYR CA C 13 55.809 0.110 . . . 3 . . . 86 Y CA . 51748 1
354 . 1 . 1 86 86 TYR CB C 13 41.082 0.021 . . . 2 . . . 86 Y CB . 51748 1
355 . 1 . 1 86 86 TYR N N 15 127.427 0.027 . . . 9 . . . 86 Y N . 51748 1
356 . 1 . 1 87 87 PHE H H 1 8.839 0.003 . . . 8 . . . 87 F H . 51748 1
357 . 1 . 1 87 87 PHE C C 13 176.183 0.094 . . . 2 . . . 87 F C . 51748 1
358 . 1 . 1 87 87 PHE CA C 13 57.925 0.028 . . . 2 . . . 87 F CA . 51748 1
359 . 1 . 1 87 87 PHE CB C 13 40.569 0.050 . . . 2 . . . 87 F CB . 51748 1
360 . 1 . 1 87 87 PHE N N 15 122.299 0.062 . . . 8 . . . 87 F N . 51748 1
361 . 1 . 1 88 88 VAL H H 1 7.594 0.002 . . . 7 . . . 88 V H . 51748 1
362 . 1 . 1 88 88 VAL C C 13 176.492 0.000 . . . 1 . . . 88 V C . 51748 1
363 . 1 . 1 88 88 VAL CA C 13 62.502 0.000 . . . 1 . . . 88 V CA . 51748 1
364 . 1 . 1 88 88 VAL CB C 13 32.399 0.000 . . . 1 . . . 88 V CB . 51748 1
365 . 1 . 1 88 88 VAL N N 15 115.691 0.054 . . . 7 . . . 88 V N . 51748 1
366 . 1 . 1 89 89 LYS C C 13 176.797 0.096 . . . 2 . . . 89 K C . 51748 1
367 . 1 . 1 89 89 LYS CA C 13 59.011 0.026 . . . 2 . . . 89 K CA . 51748 1
368 . 1 . 1 89 89 LYS CB C 13 33.039 0.062 . . . 2 . . . 89 K CB . 51748 1
369 . 1 . 1 90 90 ASN H H 1 8.970 0.004 . . . 10 . . . 90 N H . 51748 1
370 . 1 . 1 90 90 ASN HD21 H 1 7.685 0.001 . . . 5 . . . 90 N HD21 . 51748 1
371 . 1 . 1 90 90 ASN HD22 H 1 7.025 0.002 . . . 5 . . . 90 N HD22 . 51748 1
372 . 1 . 1 90 90 ASN C C 13 174.225 0.016 . . . 3 . . . 90 N C . 51748 1
373 . 1 . 1 90 90 ASN CA C 13 54.494 0.072 . . . 6 . . . 90 N CA . 51748 1
374 . 1 . 1 90 90 ASN CB C 13 37.139 0.022 . . . 5 . . . 90 N CB . 51748 1
375 . 1 . 1 90 90 ASN CG C 13 177.993 0.015 . . . 2 . . . 90 N CG . 51748 1
376 . 1 . 1 90 90 ASN N N 15 116.631 0.048 . . . 10 . . . 90 N N . 51748 1
377 . 1 . 1 90 90 ASN ND2 N 15 113.186 0.220 . . . 10 . . . 90 N ND2 . 51748 1
378 . 1 . 1 91 91 LEU H H 1 7.283 0.002 . . . 9 . . . 91 L H . 51748 1
379 . 1 . 1 91 91 LEU C C 13 177.228 0.006 . . . 2 . . . 91 L C . 51748 1
380 . 1 . 1 91 91 LEU CA C 13 55.739 0.083 . . . 3 . . . 91 L CA . 51748 1
381 . 1 . 1 91 91 LEU CB C 13 42.965 0.073 . . . 2 . . . 91 L CB . 51748 1
382 . 1 . 1 91 91 LEU N N 15 121.299 0.033 . . . 9 . . . 91 L N . 51748 1
383 . 1 . 1 92 92 ASN H H 1 8.978 0.007 . . . 8 . . . 92 N H . 51748 1
384 . 1 . 1 92 92 ASN C C 13 177.282 0.000 . . . 1 . . . 92 N C . 51748 1
385 . 1 . 1 92 92 ASN CA C 13 53.030 0.000 . . . 1 . . . 92 N CA . 51748 1
386 . 1 . 1 92 92 ASN CB C 13 38.239 0.000 . . . 1 . . . 92 N CB . 51748 1
387 . 1 . 1 92 92 ASN N N 15 126.542 0.038 . . . 8 . . . 92 N N . 51748 1
388 . 1 . 1 99 99 VAL C C 13 178.164 0.039 . . . 2 . . . 99 V C . 51748 1
389 . 1 . 1 99 99 VAL CA C 13 64.951 0.067 . . . 2 . . . 99 V CA . 51748 1
390 . 1 . 1 99 99 VAL CB C 13 32.246 0.000 . . . 1 . . . 99 V CB . 51748 1
391 . 1 . 1 100 100 LEU H H 1 8.735 0.002 . . . 9 . . . 100 L H . 51748 1
392 . 1 . 1 100 100 LEU C C 13 175.766 0.066 . . . 3 . . . 100 L C . 51748 1
393 . 1 . 1 100 100 LEU CA C 13 54.796 0.043 . . . 3 . . . 100 L CA . 51748 1
394 . 1 . 1 100 100 LEU CB C 13 32.614 0.060 . . . 3 . . . 100 L CB . 51748 1
395 . 1 . 1 100 100 LEU N N 15 116.629 0.033 . . . 9 . . . 100 L N . 51748 1
396 . 1 . 1 101 101 GLY H H 1 7.309 0.001 . . . 8 . . . 101 G H . 51748 1
397 . 1 . 1 101 101 GLY CA C 13 44.349 0.000 . . . 1 . . . 101 G CA . 51748 1
398 . 1 . 1 101 101 GLY N N 15 108.709 0.030 . . . 8 . . . 101 G N . 51748 1
399 . 1 . 1 106 106 THR C C 13 174.169 0.000 . . . 1 . . . 106 T C . 51748 1
400 . 1 . 1 106 106 THR CA C 13 61.960 0.000 . . . 1 . . . 106 T CA . 51748 1
401 . 1 . 1 106 106 THR CB C 13 69.775 0.000 . . . 1 . . . 106 T CB . 51748 1
402 . 1 . 1 107 107 VAL H H 1 8.381 0.001 . . . 7 . . . 107 V H . 51748 1
403 . 1 . 1 107 107 VAL C C 13 175.815 0.011 . . . 2 . . . 107 V C . 51748 1
404 . 1 . 1 107 107 VAL CA C 13 55.522 0.067 . . . 3 . . . 107 V CA . 51748 1
405 . 1 . 1 107 107 VAL CB C 13 33.103 0.019 . . . 2 . . . 107 V CB . 51748 1
406 . 1 . 1 107 107 VAL N N 15 123.316 0.063 . . . 7 . . . 107 V N . 51748 1
407 . 1 . 1 108 108 ARG H H 1 8.222 0.002 . . . 8 . . . 108 R H . 51748 1
408 . 1 . 1 108 108 ARG C C 13 175.973 0.024 . . . 2 . . . 108 R C . 51748 1
409 . 1 . 1 108 108 ARG CA C 13 62.384 0.069 . . . 2 . . . 108 R CA . 51748 1
410 . 1 . 1 108 108 ARG CB C 13 32.807 0.020 . . . 2 . . . 108 R CB . 51748 1
411 . 1 . 1 108 108 ARG N N 15 122.819 0.042 . . . 8 . . . 108 R N . 51748 1
412 . 1 . 1 109 109 LEU H H 1 8.325 0.002 . . . 7 . . . 109 L H . 51748 1
413 . 1 . 1 109 109 LEU C C 13 176.158 0.000 . . . 1 . . . 109 L C . 51748 1
414 . 1 . 1 109 109 LEU N N 15 124.844 0.051 . . . 7 . . . 109 L N . 51748 1
stop_
save_