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 52551
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'hCHCHD2 N-Terminus'
_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 'Referenced to external standard, NYSBC calibrates temperature probe using external thermocoupler'
_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' . . . 52551 1
2 '3D HNCO' . . . 52551 1
3 '3D HNCA' . . . 52551 1
4 '3D HNCACO' . . . 52551 1
5 '3D HNCACB' . . . 52551 1
6 '3D CBCACONH' . . . 52551 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 . . 52551 1
2 $software_2 . . 52551 1
3 $software_3 . . 52551 1
4 $software_4 . . 52551 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 PRO C C 13 176.894 0.00 . . . . . . . 2 PRO C . 52551 1
2 . 1 . 1 2 2 PRO CA C 13 63.390 0.00 . . . . . . . 2 PRO CA . 52551 1
3 . 1 . 1 2 2 PRO CB C 13 32.100 0.04 . . . . . . . 2 PRO CB . 52551 1
4 . 1 . 1 3 3 ARG H H 1 8.685 0.00 . . . . . . . 3 ARG H . 52551 1
5 . 1 . 1 3 3 ARG C C 13 177.090 0.04 . . . . . . . 3 ARG C . 52551 1
6 . 1 . 1 3 3 ARG CA C 13 56.637 0.01 . . . . . . . 3 ARG CA . 52551 1
7 . 1 . 1 3 3 ARG CB C 13 30.628 0.04 . . . . . . . 3 ARG CB . 52551 1
8 . 1 . 1 3 3 ARG N N 15 122.430 0.02 . . . . . . . 3 ARG N . 52551 1
9 . 1 . 1 4 4 GLY H H 1 8.569 0.01 . . . . . . . 4 GLY H . 52551 1
10 . 1 . 1 4 4 GLY C C 13 174.252 0.03 . . . . . . . 4 GLY C . 52551 1
11 . 1 . 1 4 4 GLY CA C 13 45.184 0.01 . . . . . . . 4 GLY CA . 52551 1
12 . 1 . 1 4 4 GLY N N 15 110.625 0.03 . . . . . . . 4 GLY N . 52551 1
13 . 1 . 1 5 5 SER H H 1 8.315 0.00 . . . . . . . 5 SER H . 52551 1
14 . 1 . 1 5 5 SER C C 13 174.856 0.01 . . . . . . . 5 SER C . 52551 1
15 . 1 . 1 5 5 SER CA C 13 58.490 0.02 . . . . . . . 5 SER CA . 52551 1
16 . 1 . 1 5 5 SER CB C 13 63.866 0.02 . . . . . . . 5 SER CB . 52551 1
17 . 1 . 1 5 5 SER N N 15 115.894 0.02 . . . . . . . 5 SER N . 52551 1
18 . 1 . 1 6 6 ARG H H 1 8.554 0.01 . . . . . . . 6 ARG H . 52551 1
19 . 1 . 1 6 6 ARG C C 13 176.494 0.02 . . . . . . . 6 ARG C . 52551 1
20 . 1 . 1 6 6 ARG CA C 13 56.211 0.03 . . . . . . . 6 ARG CA . 52551 1
21 . 1 . 1 6 6 ARG CB C 13 30.619 0.04 . . . . . . . 6 ARG CB . 52551 1
22 . 1 . 1 6 6 ARG N N 15 123.192 0.04 . . . . . . . 6 ARG N . 52551 1
23 . 1 . 1 7 7 SER H H 1 8.423 0.01 . . . . . . . 7 SER H . 52551 1
24 . 1 . 1 7 7 SER C C 13 174.743 0.00 . . . . . . . 7 SER C . 52551 1
25 . 1 . 1 7 7 SER CA C 13 58.469 0.02 . . . . . . . 7 SER CA . 52551 1
26 . 1 . 1 7 7 SER CB C 13 63.726 0.01 . . . . . . . 7 SER CB . 52551 1
27 . 1 . 1 7 7 SER N N 15 117.265 0.01 . . . . . . . 7 SER N . 52551 1
28 . 1 . 1 8 8 ARG H H 1 8.575 0.01 . . . . . . . 8 ARG H . 52551 1
29 . 1 . 1 8 8 ARG C C 13 176.670 0.01 . . . . . . . 8 ARG C . 52551 1
30 . 1 . 1 8 8 ARG CA C 13 56.481 0.01 . . . . . . . 8 ARG CA . 52551 1
31 . 1 . 1 8 8 ARG CB C 13 30.718 0.04 . . . . . . . 8 ARG CB . 52551 1
32 . 1 . 1 8 8 ARG N N 15 123.492 0.07 . . . . . . . 8 ARG N . 52551 1
33 . 1 . 1 9 9 THR H H 1 8.256 0.01 . . . . . . . 9 THR H . 52551 1
34 . 1 . 1 9 9 THR C C 13 174.658 0.01 . . . . . . . 9 THR C . 52551 1
35 . 1 . 1 9 9 THR CA C 13 61.960 0.02 . . . . . . . 9 THR CA . 52551 1
36 . 1 . 1 9 9 THR CB C 13 69.724 0.01 . . . . . . . 9 THR CB . 52551 1
37 . 1 . 1 9 9 THR N N 15 114.939 0.01 . . . . . . . 9 THR N . 52551 1
38 . 1 . 1 10 10 SER H H 1 8.366 0.01 . . . . . . . 10 SER H . 52551 1
39 . 1 . 1 10 10 SER C C 13 174.478 0.00 . . . . . . . 10 SER C . 52551 1
40 . 1 . 1 10 10 SER CA C 13 58.437 0.02 . . . . . . . 10 SER CA . 52551 1
41 . 1 . 1 10 10 SER CB C 13 63.807 0.01 . . . . . . . 10 SER CB . 52551 1
42 . 1 . 1 10 10 SER N N 15 118.553 0.01 . . . . . . . 10 SER N . 52551 1
43 . 1 . 1 11 11 ARG H H 1 8.453 0.01 . . . . . . . 11 ARG H . 52551 1
44 . 1 . 1 11 11 ARG C C 13 176.161 0.02 . . . . . . . 11 ARG C . 52551 1
45 . 1 . 1 11 11 ARG CA C 13 56.110 0.04 . . . . . . . 11 ARG CA . 52551 1
46 . 1 . 1 11 11 ARG CB C 13 30.678 0.04 . . . . . . . 11 ARG CB . 52551 1
47 . 1 . 1 11 11 ARG N N 15 123.243 0.02 . . . . . . . 11 ARG N . 52551 1
48 . 1 . 1 12 12 MET H H 1 8.394 0.01 . . . . . . . 12 MET H . 52551 1
49 . 1 . 1 12 12 MET C C 13 175.523 0.02 . . . . . . . 12 MET C . 52551 1
50 . 1 . 1 12 12 MET CA C 13 55.124 0.02 . . . . . . . 12 MET CA . 52551 1
51 . 1 . 1 12 12 MET CB C 13 32.942 0.03 . . . . . . . 12 MET CB . 52551 1
52 . 1 . 1 12 12 MET N N 15 121.942 0.07 . . . . . . . 12 MET N . 52551 1
53 . 1 . 1 13 13 ALA H H 1 8.416 0.01 . . . . . . . 13 ALA H . 52551 1
54 . 1 . 1 13 13 ALA C C 13 174.898 0.00 . . . . . . . 13 ALA C . 52551 1
55 . 1 . 1 13 13 ALA CA C 13 50.517 0.02 . . . . . . . 13 ALA CA . 52551 1
56 . 1 . 1 13 13 ALA CB C 13 17.892 0.00 . . . . . . . 13 ALA CB . 52551 1
57 . 1 . 1 13 13 ALA N N 15 127.418 0.09 . . . . . . . 13 ALA N . 52551 1
58 . 1 . 1 15 15 PRO C C 13 176.689 0.01 . . . . . . . 15 PRO C . 52551 1
59 . 1 . 1 15 15 PRO CA C 13 63.010 0.02 . . . . . . . 15 PRO CA . 52551 1
60 . 1 . 1 15 15 PRO CB C 13 32.038 0.04 . . . . . . . 15 PRO CB . 52551 1
61 . 1 . 1 16 16 ALA H H 1 8.537 0.01 . . . . . . . 16 ALA H . 52551 1
62 . 1 . 1 16 16 ALA C C 13 177.947 0.04 . . . . . . . 16 ALA C . 52551 1
63 . 1 . 1 16 16 ALA CA C 13 52.559 0.01 . . . . . . . 16 ALA CA . 52551 1
64 . 1 . 1 16 16 ALA CB C 13 19.051 0.04 . . . . . . . 16 ALA CB . 52551 1
65 . 1 . 1 16 16 ALA N N 15 124.474 0.01 . . . . . . . 16 ALA N . 52551 1
66 . 1 . 1 17 17 SER H H 1 8.375 0.00 . . . . . . . 17 SER H . 52551 1
67 . 1 . 1 17 17 SER C C 13 174.400 0.02 . . . . . . . 17 SER C . 52551 1
68 . 1 . 1 17 17 SER CA C 13 58.250 0.01 . . . . . . . 17 SER CA . 52551 1
69 . 1 . 1 17 17 SER CB C 13 63.800 0.02 . . . . . . . 17 SER CB . 52551 1
70 . 1 . 1 17 17 SER N N 15 115.254 0.01 . . . . . . . 17 SER N . 52551 1
71 . 1 . 1 18 18 ARG H H 1 8.404 0.00 . . . . . . . 18 ARG H . 52551 1
72 . 1 . 1 18 18 ARG C C 13 175.620 0.01 . . . . . . . 18 ARG C . 52551 1
73 . 1 . 1 18 18 ARG CA C 13 55.658 0.01 . . . . . . . 18 ARG CA . 52551 1
74 . 1 . 1 18 18 ARG CB C 13 30.850 0.05 . . . . . . . 18 ARG CB . 52551 1
75 . 1 . 1 18 18 ARG N N 15 123.221 0.01 . . . . . . . 18 ARG N . 52551 1
76 . 1 . 1 19 19 ALA H H 1 8.398 0.00 . . . . . . . 19 ALA H . 52551 1
77 . 1 . 1 19 19 ALA C C 13 175.520 0.00 . . . . . . . 19 ALA C . 52551 1
78 . 1 . 1 19 19 ALA CA C 13 50.736 0.01 . . . . . . . 19 ALA CA . 52551 1
79 . 1 . 1 19 19 ALA CB C 13 17.866 0.00 . . . . . . . 19 ALA CB . 52551 1
80 . 1 . 1 19 19 ALA N N 15 127.143 0.04 . . . . . . . 19 ALA N . 52551 1
81 . 1 . 1 20 20 PRO C C 13 176.885 0.01 . . . . . . . 20 PRO C . 52551 1
82 . 1 . 1 20 20 PRO CA C 13 63.117 0.01 . . . . . . . 20 PRO CA . 52551 1
83 . 1 . 1 20 20 PRO CB C 13 32.032 0.03 . . . . . . . 20 PRO CB . 52551 1
84 . 1 . 1 21 21 GLN H H 1 8.578 0.00 . . . . . . . 21 GLN H . 52551 1
85 . 1 . 1 21 21 GLN C C 13 176.031 0.00 . . . . . . . 21 GLN C . 52551 1
86 . 1 . 1 21 21 GLN CA C 13 55.728 0.01 . . . . . . . 21 GLN CA . 52551 1
87 . 1 . 1 21 21 GLN CB C 13 29.456 0.04 . . . . . . . 21 GLN CB . 52551 1
88 . 1 . 1 21 21 GLN N N 15 120.723 0.02 . . . . . . . 21 GLN N . 52551 1
89 . 1 . 1 22 22 MET H H 1 8.518 0.00 . . . . . . . 22 MET H . 52551 1
90 . 1 . 1 22 22 MET C C 13 176.032 0.00 . . . . . . . 22 MET C . 52551 1
91 . 1 . 1 22 22 MET CA C 13 55.442 0.01 . . . . . . . 22 MET CA . 52551 1
92 . 1 . 1 22 22 MET CB C 13 32.765 0.00 . . . . . . . 22 MET CB . 52551 1
93 . 1 . 1 22 22 MET N N 15 122.658 0.02 . . . . . . . 22 MET N . 52551 1
94 . 1 . 1 23 23 ARG H H 1 8.454 0.00 . . . . . . . 23 ARG H . 52551 1
95 . 1 . 1 23 23 ARG C C 13 175.706 0.00 . . . . . . . 23 ARG C . 52551 1
96 . 1 . 1 23 23 ARG CA C 13 55.973 0.07 . . . . . . . 23 ARG CA . 52551 1
97 . 1 . 1 23 23 ARG CB C 13 30.848 0.08 . . . . . . . 23 ARG CB . 52551 1
98 . 1 . 1 23 23 ARG N N 15 123.282 0.03 . . . . . . . 23 ARG N . 52551 1
99 . 1 . 1 24 24 ALA H H 1 8.444 0.00 . . . . . . . 24 ALA H . 52551 1
100 . 1 . 1 24 24 ALA C C 13 176.952 0.01 . . . . . . . 24 ALA C . 52551 1
101 . 1 . 1 24 24 ALA CA C 13 52.120 0.12 . . . . . . . 24 ALA CA . 52551 1
102 . 1 . 1 24 24 ALA CB C 13 19.239 0.08 . . . . . . . 24 ALA CB . 52551 1
103 . 1 . 1 24 24 ALA N N 15 126.229 0.01 . . . . . . . 24 ALA N . 52551 1
104 . 1 . 1 25 25 ALA H H 1 8.417 0.01 . . . . . . . 25 ALA H . 52551 1
105 . 1 . 1 25 25 ALA C C 13 175.473 0.00 . . . . . . . 25 ALA C . 52551 1
106 . 1 . 1 25 25 ALA CA C 13 50.388 0.00 . . . . . . . 25 ALA CA . 52551 1
107 . 1 . 1 25 25 ALA CB C 13 17.924 0.00 . . . . . . . 25 ALA CB . 52551 1
108 . 1 . 1 25 25 ALA N N 15 125.501 0.03 . . . . . . . 25 ALA N . 52551 1
109 . 1 . 1 28 28 PRO C C 13 176.173 0.01 . . . . . . . 28 PRO C . 52551 1
110 . 1 . 1 28 28 PRO CA C 13 62.791 0.03 . . . . . . . 28 PRO CA . 52551 1
111 . 1 . 1 28 28 PRO CB C 13 32.046 0.04 . . . . . . . 28 PRO CB . 52551 1
112 . 1 . 1 29 29 ALA H H 1 8.489 0.00 . . . . . . . 29 ALA H . 52551 1
113 . 1 . 1 29 29 ALA C C 13 175.563 0.00 . . . . . . . 29 ALA C . 52551 1
114 . 1 . 1 29 29 ALA CA C 13 50.415 0.01 . . . . . . . 29 ALA CA . 52551 1
115 . 1 . 1 29 29 ALA CB C 13 17.836 0.00 . . . . . . . 29 ALA CB . 52551 1
116 . 1 . 1 29 29 ALA N N 15 126.180 0.01 . . . . . . . 29 ALA N . 52551 1
117 . 1 . 1 30 30 PRO C C 13 176.791 0.01 . . . . . . . 30 PRO C . 52551 1
118 . 1 . 1 30 30 PRO CA C 13 62.840 0.03 . . . . . . . 30 PRO CA . 52551 1
119 . 1 . 1 30 30 PRO CB C 13 32.027 0.05 . . . . . . . 30 PRO CB . 52551 1
120 . 1 . 1 31 31 VAL H H 1 8.315 0.00 . . . . . . . 31 VAL H . 52551 1
121 . 1 . 1 31 31 VAL C C 13 175.918 0.00 . . . . . . . 31 VAL C . 52551 1
122 . 1 . 1 31 31 VAL CA C 13 62.073 0.01 . . . . . . . 31 VAL CA . 52551 1
123 . 1 . 1 31 31 VAL CB C 13 32.821 0.02 . . . . . . . 31 VAL CB . 52551 1
124 . 1 . 1 31 31 VAL N N 15 121.146 0.02 . . . . . . . 31 VAL N . 52551 1
125 . 1 . 1 32 32 ALA H H 1 8.501 0.00 . . . . . . . 32 ALA H . 52551 1
126 . 1 . 1 32 32 ALA C C 13 177.304 0.00 . . . . . . . 32 ALA C . 52551 1
127 . 1 . 1 32 32 ALA CA C 13 52.280 0.02 . . . . . . . 32 ALA CA . 52551 1
128 . 1 . 1 32 32 ALA CB C 13 19.144 0.05 . . . . . . . 32 ALA CB . 52551 1
129 . 1 . 1 32 32 ALA N N 15 128.547 0.06 . . . . . . . 32 ALA N . 52551 1
130 . 1 . 1 33 33 GLN H H 1 8.477 0.00 . . . . . . . 33 GLN H . 52551 1
131 . 1 . 1 33 33 GLN C C 13 173.566 0.00 . . . . . . . 33 GLN C . 52551 1
132 . 1 . 1 33 33 GLN CA C 13 53.377 0.01 . . . . . . . 33 GLN CA . 52551 1
133 . 1 . 1 33 33 GLN CB C 13 28.902 0.00 . . . . . . . 33 GLN CB . 52551 1
134 . 1 . 1 33 33 GLN N N 15 121.477 0.02 . . . . . . . 33 GLN N . 52551 1
135 . 1 . 1 35 35 PRO C C 13 176.513 0.00 . . . . . . . 35 PRO C . 52551 1
136 . 1 . 1 35 35 PRO CA C 13 62.776 0.01 . . . . . . . 35 PRO CA . 52551 1
137 . 1 . 1 35 35 PRO CB C 13 32.010 0.04 . . . . . . . 35 PRO CB . 52551 1
138 . 1 . 1 36 36 ALA H H 1 8.460 0.00 . . . . . . . 36 ALA H . 52551 1
139 . 1 . 1 36 36 ALA C C 13 177.421 0.01 . . . . . . . 36 ALA C . 52551 1
140 . 1 . 1 36 36 ALA CA C 13 52.218 0.01 . . . . . . . 36 ALA CA . 52551 1
141 . 1 . 1 36 36 ALA CB C 13 19.203 0.03 . . . . . . . 36 ALA CB . 52551 1
142 . 1 . 1 36 36 ALA N N 15 124.586 0.01 . . . . . . . 36 ALA N . 52551 1
143 . 1 . 1 37 37 ALA H H 1 8.362 0.00 . . . . . . . 37 ALA H . 52551 1
144 . 1 . 1 37 37 ALA C C 13 177.034 0.00 . . . . . . . 37 ALA C . 52551 1
145 . 1 . 1 37 37 ALA CA C 13 51.974 0.04 . . . . . . . 37 ALA CA . 52551 1
146 . 1 . 1 37 37 ALA CB C 13 19.306 0.04 . . . . . . . 37 ALA CB . 52551 1
147 . 1 . 1 37 37 ALA N N 15 123.921 0.01 . . . . . . . 37 ALA N . 52551 1
148 . 1 . 1 38 38 ALA H H 1 8.371 0.00 . . . . . . . 38 ALA H . 52551 1
149 . 1 . 1 38 38 ALA C C 13 175.015 0.00 . . . . . . . 38 ALA C . 52551 1
150 . 1 . 1 38 38 ALA CA C 13 50.287 0.01 . . . . . . . 38 ALA CA . 52551 1
151 . 1 . 1 38 38 ALA CB C 13 17.971 0.00 . . . . . . . 38 ALA CB . 52551 1
152 . 1 . 1 38 38 ALA N N 15 125.298 0.01 . . . . . . . 38 ALA N . 52551 1
153 . 1 . 1 40 40 PRO C C 13 176.960 0.00 . . . . . . . 40 PRO C . 52551 1
154 . 1 . 1 40 40 PRO CA C 13 63.048 0.01 . . . . . . . 40 PRO CA . 52551 1
155 . 1 . 1 40 40 PRO CB C 13 31.995 0.03 . . . . . . . 40 PRO CB . 52551 1
156 . 1 . 1 41 41 SER H H 1 8.424 0.00 . . . . . . . 41 SER H . 52551 1
157 . 1 . 1 41 41 SER C C 13 174.359 0.04 . . . . . . . 41 SER C . 52551 1
158 . 1 . 1 41 41 SER CA C 13 58.224 0.02 . . . . . . . 41 SER CA . 52551 1
159 . 1 . 1 41 41 SER CB C 13 63.818 0.02 . . . . . . . 41 SER CB . 52551 1
160 . 1 . 1 41 41 SER N N 15 115.979 0.02 . . . . . . . 41 SER N . 52551 1
161 . 1 . 1 42 42 ALA H H 1 8.491 0.00 . . . . . . . 42 ALA H . 52551 1
162 . 1 . 1 42 42 ALA C C 13 177.786 0.02 . . . . . . . 42 ALA C . 52551 1
163 . 1 . 1 42 42 ALA CA C 13 52.412 0.02 . . . . . . . 42 ALA CA . 52551 1
164 . 1 . 1 42 42 ALA CB C 13 19.221 0.04 . . . . . . . 42 ALA CB . 52551 1
165 . 1 . 1 42 42 ALA N N 15 126.567 0.02 . . . . . . . 42 ALA N . 52551 1
166 . 1 . 1 43 43 VAL H H 1 8.219 0.00 . . . . . . . 43 VAL H . 52551 1
167 . 1 . 1 43 43 VAL C C 13 176.908 0.01 . . . . . . . 43 VAL C . 52551 1
168 . 1 . 1 43 43 VAL CA C 13 62.671 0.03 . . . . . . . 43 VAL CA . 52551 1
169 . 1 . 1 43 43 VAL CB C 13 32.586 0.04 . . . . . . . 43 VAL CB . 52551 1
170 . 1 . 1 43 43 VAL N N 15 119.821 0.02 . . . . . . . 43 VAL N . 52551 1
171 . 1 . 1 44 44 GLY H H 1 8.588 0.00 . . . . . . . 44 GLY H . 52551 1
172 . 1 . 1 44 44 GLY C C 13 174.256 0.03 . . . . . . . 44 GLY C . 52551 1
173 . 1 . 1 44 44 GLY CA C 13 45.185 0.01 . . . . . . . 44 GLY CA . 52551 1
174 . 1 . 1 44 44 GLY N N 15 112.890 0.03 . . . . . . . 44 GLY N . 52551 1
175 . 1 . 1 45 45 SER H H 1 8.326 0.05 . . . . . . . 45 SER H . 52551 1
176 . 1 . 1 45 45 SER C C 13 174.870 0.01 . . . . . . . 45 SER C . 52551 1
177 . 1 . 1 45 45 SER CA C 13 58.422 0.04 . . . . . . . 45 SER CA . 52551 1
178 . 1 . 1 45 45 SER CB C 13 63.871 0.06 . . . . . . . 45 SER CB . 52551 1
179 . 1 . 1 45 45 SER N N 15 116.164 0.75 . . . . . . . 45 SER N . 52551 1
180 . 1 . 1 46 46 SER H H 1 8.499 0.01 . . . . . . . 46 SER H . 52551 1
181 . 1 . 1 46 46 SER C C 13 174.253 0.01 . . . . . . . 46 SER C . 52551 1
182 . 1 . 1 46 46 SER CA C 13 58.415 0.00 . . . . . . . 46 SER CA . 52551 1
183 . 1 . 1 46 46 SER CB C 13 63.779 0.02 . . . . . . . 46 SER CB . 52551 1
184 . 1 . 1 46 46 SER N N 15 118.182 0.01 . . . . . . . 46 SER N . 52551 1
185 . 1 . 1 47 47 ALA H H 1 8.331 0.01 . . . . . . . 47 ALA H . 52551 1
186 . 1 . 1 47 47 ALA C C 13 177.282 0.00 . . . . . . . 47 ALA C . 52551 1
187 . 1 . 1 47 47 ALA CA C 13 52.478 0.00 . . . . . . . 47 ALA CA . 52551 1
188 . 1 . 1 47 47 ALA CB C 13 19.172 0.02 . . . . . . . 47 ALA CB . 52551 1
189 . 1 . 1 47 47 ALA N N 15 125.998 0.01 . . . . . . . 47 ALA N . 52551 1
190 . 1 . 1 48 48 ALA H H 1 8.211 0.00 . . . . . . . 48 ALA H . 52551 1
191 . 1 . 1 48 48 ALA C C 13 177.100 0.02 . . . . . . . 48 ALA C . 52551 1
192 . 1 . 1 48 48 ALA CA C 13 52.051 0.04 . . . . . . . 48 ALA CA . 52551 1
193 . 1 . 1 48 48 ALA CB C 13 19.226 0.03 . . . . . . . 48 ALA CB . 52551 1
194 . 1 . 1 48 48 ALA N N 15 123.245 0.01 . . . . . . . 48 ALA N . 52551 1
195 . 1 . 1 49 49 ALA H H 1 8.268 0.00 . . . . . . . 49 ALA H . 52551 1
196 . 1 . 1 49 49 ALA C C 13 175.416 0.00 . . . . . . . 49 ALA C . 52551 1
197 . 1 . 1 49 49 ALA CA C 13 50.459 0.00 . . . . . . . 49 ALA CA . 52551 1
198 . 1 . 1 49 49 ALA CB C 13 17.920 0.00 . . . . . . . 49 ALA CB . 52551 1
199 . 1 . 1 49 49 ALA N N 15 125.111 0.01 . . . . . . . 49 ALA N . 52551 1
200 . 1 . 1 50 50 PRO C C 13 176.843 0.01 . . . . . . . 50 PRO C . 52551 1
201 . 1 . 1 50 50 PRO CA C 13 62.905 0.02 . . . . . . . 50 PRO CA . 52551 1
202 . 1 . 1 50 50 PRO CB C 13 32.089 0.03 . . . . . . . 50 PRO CB . 52551 1
203 . 1 . 1 51 51 ARG H H 1 8.539 0.01 . . . . . . . 51 ARG H . 52551 1
204 . 1 . 1 51 51 ARG C C 13 176.228 0.00 . . . . . . . 51 ARG C . 52551 1
205 . 1 . 1 51 51 ARG CA C 13 55.978 0.19 . . . . . . . 51 ARG CA . 52551 1
206 . 1 . 1 51 51 ARG CB C 13 30.774 0.10 . . . . . . . 51 ARG CB . 52551 1
207 . 1 . 1 51 51 ARG N N 15 121.897 0.11 . . . . . . . 51 ARG N . 52551 1
208 . 1 . 1 52 52 GLN H H 1 8.548 0.00 . . . . . . . 52 GLN H . 52551 1
209 . 1 . 1 52 52 GLN C C 13 174.075 0.00 . . . . . . . 52 GLN C . 52551 1
210 . 1 . 1 52 52 GLN CA C 13 53.733 0.01 . . . . . . . 52 GLN CA . 52551 1
211 . 1 . 1 52 52 GLN CB C 13 28.893 0.00 . . . . . . . 52 GLN CB . 52551 1
212 . 1 . 1 52 52 GLN N N 15 123.082 0.07 . . . . . . . 52 GLN N . 52551 1
213 . 1 . 1 53 53 PRO C C 13 177.542 0.01 . . . . . . . 53 PRO C . 52551 1
214 . 1 . 1 53 53 PRO CA C 13 63.558 0.01 . . . . . . . 53 PRO CA . 52551 1
215 . 1 . 1 53 53 PRO CB C 13 32.115 0.05 . . . . . . . 53 PRO CB . 52551 1
216 . 1 . 1 54 54 GLY H H 1 8.557 0.01 . . . . . . . 54 GLY H . 52551 1
217 . 1 . 1 54 54 GLY C C 13 174.154 0.01 . . . . . . . 54 GLY C . 52551 1
218 . 1 . 1 54 54 GLY CA C 13 45.205 0.02 . . . . . . . 54 GLY CA . 52551 1
219 . 1 . 1 54 54 GLY N N 15 109.040 0.02 . . . . . . . 54 GLY N . 52551 1
220 . 1 . 1 55 55 LEU H H 1 8.089 0.01 . . . . . . . 55 LEU H . 52551 1
221 . 1 . 1 55 55 LEU C C 13 177.739 0.02 . . . . . . . 55 LEU C . 52551 1
222 . 1 . 1 55 55 LEU CA C 13 55.470 0.06 . . . . . . . 55 LEU CA . 52551 1
223 . 1 . 1 55 55 LEU CB C 13 42.340 0.00 . . . . . . . 55 LEU CB . 52551 1
224 . 1 . 1 55 55 LEU N N 15 121.640 0.02 . . . . . . . 55 LEU N . 52551 1
225 . 1 . 1 56 56 MET H H 1 8.428 0.01 . . . . . . . 56 MET H . 52551 1
226 . 1 . 1 56 56 MET C C 13 176.354 0.01 . . . . . . . 56 MET C . 52551 1
227 . 1 . 1 56 56 MET CA C 13 55.594 0.02 . . . . . . . 56 MET CA . 52551 1
228 . 1 . 1 56 56 MET CB C 13 32.536 0.01 . . . . . . . 56 MET CB . 52551 1
229 . 1 . 1 56 56 MET N N 15 121.075 0.08 . . . . . . . 56 MET N . 52551 1
230 . 1 . 1 57 57 ALA H H 1 8.315 0.00 . . . . . . . 57 ALA H . 52551 1
231 . 1 . 1 57 57 ALA C C 13 177.820 0.02 . . . . . . . 57 ALA C . 52551 1
232 . 1 . 1 57 57 ALA CA C 13 52.829 0.02 . . . . . . . 57 ALA CA . 52551 1
233 . 1 . 1 57 57 ALA CB C 13 19.008 0.03 . . . . . . . 57 ALA CB . 52551 1
234 . 1 . 1 57 57 ALA N N 15 124.989 0.03 . . . . . . . 57 ALA N . 52551 1
235 . 1 . 1 58 58 GLN H H 1 8.366 0.00 . . . . . . . 58 GLN H . 52551 1
236 . 1 . 1 58 58 GLN C C 13 176.177 0.03 . . . . . . . 58 GLN C . 52551 1
237 . 1 . 1 58 58 GLN CA C 13 55.985 0.08 . . . . . . . 58 GLN CA . 52551 1
238 . 1 . 1 58 58 GLN CB C 13 29.344 0.03 . . . . . . . 58 GLN CB . 52551 1
239 . 1 . 1 58 58 GLN N N 15 119.329 0.02 . . . . . . . 58 GLN N . 52551 1
240 . 1 . 1 59 59 MET H H 1 8.406 0.01 . . . . . . . 59 MET H . 52551 1
241 . 1 . 1 59 59 MET C C 13 176.120 0.01 . . . . . . . 59 MET C . 52551 1
242 . 1 . 1 59 59 MET CA C 13 55.495 0.09 . . . . . . . 59 MET CA . 52551 1
243 . 1 . 1 59 59 MET CB C 13 32.929 0.02 . . . . . . . 59 MET CB . 52551 1
244 . 1 . 1 59 59 MET N N 15 121.744 0.08 . . . . . . . 59 MET N . 52551 1
245 . 1 . 1 60 60 ALA H H 1 8.430 0.01 . . . . . . . 60 ALA H . 52551 1
246 . 1 . 1 60 60 ALA C C 13 177.993 0.02 . . . . . . . 60 ALA C . 52551 1
247 . 1 . 1 60 60 ALA CA C 13 52.629 0.07 . . . . . . . 60 ALA CA . 52551 1
248 . 1 . 1 60 60 ALA CB C 13 19.181 0.03 . . . . . . . 60 ALA CB . 52551 1
249 . 1 . 1 60 60 ALA N N 15 125.439 0.05 . . . . . . . 60 ALA N . 52551 1
250 . 1 . 1 61 61 THR H H 1 8.255 0.00 . . . . . . . 61 THR H . 52551 1
251 . 1 . 1 61 61 THR C C 13 174.892 0.00 . . . . . . . 61 THR C . 52551 1
252 . 1 . 1 61 61 THR CA C 13 61.853 0.03 . . . . . . . 61 THR CA . 52551 1
253 . 1 . 1 61 61 THR CB C 13 69.871 0.01 . . . . . . . 61 THR CB . 52551 1
254 . 1 . 1 61 61 THR N N 15 113.599 0.02 . . . . . . . 61 THR N . 52551 1
255 . 1 . 1 62 62 THR H H 1 8.215 0.00 . . . . . . . 62 THR H . 52551 1
256 . 1 . 1 62 62 THR C C 13 174.460 0.00 . . . . . . . 62 THR C . 52551 1
257 . 1 . 1 62 62 THR CA C 13 61.818 0.04 . . . . . . . 62 THR CA . 52551 1
258 . 1 . 1 62 62 THR CB C 13 70.029 0.01 . . . . . . . 62 THR CB . 52551 1
259 . 1 . 1 62 62 THR N N 15 116.327 0.02 . . . . . . . 62 THR N . 52551 1
260 . 1 . 1 63 63 ALA H H 1 8.458 0.01 . . . . . . . 63 ALA H . 52551 1
261 . 1 . 1 63 63 ALA C C 13 177.553 0.01 . . . . . . . 63 ALA C . 52551 1
262 . 1 . 1 63 63 ALA CA C 13 52.714 0.02 . . . . . . . 63 ALA CA . 52551 1
263 . 1 . 1 63 63 ALA CB C 13 19.050 0.02 . . . . . . . 63 ALA CB . 52551 1
264 . 1 . 1 63 63 ALA N N 15 126.653 0.02 . . . . . . . 63 ALA N . 52551 1
265 . 1 . 1 64 64 ALA H H 1 8.319 0.00 . . . . . . . 64 ALA H . 52551 1
266 . 1 . 1 64 64 ALA C C 13 178.350 0.00 . . . . . . . 64 ALA C . 52551 1
267 . 1 . 1 64 64 ALA CA C 13 52.686 0.01 . . . . . . . 64 ALA CA . 52551 1
268 . 1 . 1 64 64 ALA CB C 13 19.059 0.04 . . . . . . . 64 ALA CB . 52551 1
269 . 1 . 1 64 64 ALA N N 15 123.147 0.01 . . . . . . . 64 ALA N . 52551 1
270 . 1 . 1 65 65 GLY H H 1 8.345 0.00 . . . . . . . 65 GLY H . 52551 1
271 . 1 . 1 65 65 GLY C C 13 174.004 0.01 . . . . . . . 65 GLY C . 52551 1
272 . 1 . 1 65 65 GLY CA C 13 45.188 0.01 . . . . . . . 65 GLY CA . 52551 1
273 . 1 . 1 65 65 GLY N N 15 108.088 0.01 . . . . . . . 65 GLY N . 52551 1
274 . 1 . 1 66 66 VAL H H 1 7.913 0.00 . . . . . . . 66 VAL H . 52551 1
275 . 1 . 1 66 66 VAL C C 13 175.911 0.01 . . . . . . . 66 VAL C . 52551 1
276 . 1 . 1 66 66 VAL CA C 13 62.074 0.01 . . . . . . . 66 VAL CA . 52551 1
277 . 1 . 1 66 66 VAL CB C 13 32.784 0.04 . . . . . . . 66 VAL CB . 52551 1
278 . 1 . 1 66 66 VAL N N 15 119.543 0.01 . . . . . . . 66 VAL N . 52551 1
279 . 1 . 1 67 67 ALA H H 1 8.498 0.00 . . . . . . . 67 ALA H . 52551 1
280 . 1 . 1 67 67 ALA C C 13 177.771 0.01 . . . . . . . 67 ALA C . 52551 1
281 . 1 . 1 67 67 ALA CA C 13 52.325 0.02 . . . . . . . 67 ALA CA . 52551 1
282 . 1 . 1 67 67 ALA CB C 13 19.047 0.04 . . . . . . . 67 ALA CB . 52551 1
283 . 1 . 1 67 67 ALA N N 15 128.467 0.06 . . . . . . . 67 ALA N . 52551 1
284 . 1 . 1 68 68 VAL H H 1 8.279 0.00 . . . . . . . 68 VAL H . 52551 1
285 . 1 . 1 68 68 VAL C C 13 176.899 0.02 . . . . . . . 68 VAL C . 52551 1
286 . 1 . 1 68 68 VAL CA C 13 62.652 0.01 . . . . . . . 68 VAL CA . 52551 1
287 . 1 . 1 68 68 VAL CB C 13 32.622 0.02 . . . . . . . 68 VAL CB . 52551 1
288 . 1 . 1 68 68 VAL N N 15 120.480 0.02 . . . . . . . 68 VAL N . 52551 1
289 . 1 . 1 69 69 GLY H H 1 8.588 0.00 . . . . . . . 69 GLY H . 52551 1
290 . 1 . 1 69 69 GLY C C 13 174.217 0.01 . . . . . . . 69 GLY C . 52551 1
291 . 1 . 1 69 69 GLY CA C 13 45.196 0.01 . . . . . . . 69 GLY CA . 52551 1
292 . 1 . 1 69 69 GLY N N 15 112.883 0.02 . . . . . . . 69 GLY N . 52551 1
293 . 1 . 1 70 70 SER H H 1 8.250 0.00 . . . . . . . 70 SER H . 52551 1
294 . 1 . 1 70 70 SER C C 13 174.292 0.05 . . . . . . . 70 SER C . 52551 1
295 . 1 . 1 70 70 SER CA C 13 58.354 0.01 . . . . . . . 70 SER CA . 52551 1
296 . 1 . 1 70 70 SER CB C 13 63.909 0.01 . . . . . . . 70 SER CB . 52551 1
297 . 1 . 1 70 70 SER N N 15 115.774 0.02 . . . . . . . 70 SER N . 52551 1
298 . 1 . 1 71 71 ALA H H 1 8.459 0.01 . . . . . . . 71 ALA H . 52551 1
299 . 1 . 1 71 71 ALA C C 13 177.772 0.02 . . . . . . . 71 ALA C . 52551 1
300 . 1 . 1 71 71 ALA CA C 13 52.487 0.02 . . . . . . . 71 ALA CA . 52551 1
301 . 1 . 1 71 71 ALA CB C 13 19.169 0.04 . . . . . . . 71 ALA CB . 52551 1
302 . 1 . 1 71 71 ALA N N 15 126.239 0.02 . . . . . . . 71 ALA N . 52551 1
303 . 1 . 1 72 72 VAL H H 1 8.123 0.00 . . . . . . . 72 VAL H . 52551 1
304 . 1 . 1 72 72 VAL C C 13 176.814 0.01 . . . . . . . 72 VAL C . 52551 1
305 . 1 . 1 72 72 VAL CA C 13 62.657 0.02 . . . . . . . 72 VAL CA . 52551 1
306 . 1 . 1 72 72 VAL CB C 13 32.499 0.04 . . . . . . . 72 VAL CB . 52551 1
307 . 1 . 1 72 72 VAL N N 15 119.326 0.03 . . . . . . . 72 VAL N . 52551 1
308 . 1 . 1 73 73 GLY H H 1 8.510 0.00 . . . . . . . 73 GLY H . 52551 1
309 . 1 . 1 73 73 GLY C C 13 173.874 0.00 . . . . . . . 73 GLY C . 52551 1
310 . 1 . 1 73 73 GLY CA C 13 45.159 0.02 . . . . . . . 73 GLY CA . 52551 1
311 . 1 . 1 73 73 GLY N N 15 112.318 0.02 . . . . . . . 73 GLY N . 52551 1
312 . 1 . 1 74 74 HIS H H 1 8.306 0.00 . . . . . . . 74 HIS H . 52551 1
313 . 1 . 1 74 74 HIS C C 13 175.103 0.01 . . . . . . . 74 HIS C . 52551 1
314 . 1 . 1 74 74 HIS CA C 13 55.687 0.01 . . . . . . . 74 HIS CA . 52551 1
315 . 1 . 1 74 74 HIS CB C 13 30.051 0.05 . . . . . . . 74 HIS CB . 52551 1
316 . 1 . 1 74 74 HIS N N 15 118.890 0.03 . . . . . . . 74 HIS N . 52551 1
317 . 1 . 1 75 75 THR H H 1 8.295 0.01 . . . . . . . 75 THR H . 52551 1
318 . 1 . 1 75 75 THR C C 13 174.387 0.08 . . . . . . . 75 THR C . 52551 1
319 . 1 . 1 75 75 THR CA C 13 61.961 0.02 . . . . . . . 75 THR CA . 52551 1
320 . 1 . 1 75 75 THR CB C 13 69.840 0.00 . . . . . . . 75 THR CB . 52551 1
321 . 1 . 1 75 75 THR N N 15 116.088 0.05 . . . . . . . 75 THR N . 52551 1
322 . 1 . 1 76 76 LEU H H 1 8.489 0.00 . . . . . . . 76 LEU H . 52551 1
323 . 1 . 1 76 76 LEU C C 13 177.806 0.02 . . . . . . . 76 LEU C . 52551 1
324 . 1 . 1 76 76 LEU CA C 13 55.383 0.01 . . . . . . . 76 LEU CA . 52551 1
325 . 1 . 1 76 76 LEU CB C 13 42.220 0.01 . . . . . . . 76 LEU CB . 52551 1
326 . 1 . 1 76 76 LEU N N 15 124.926 0.01 . . . . . . . 76 LEU N . 52551 1
327 . 1 . 1 77 77 GLY H H 1 8.487 0.00 . . . . . . . 77 GLY H . 52551 1
328 . 1 . 1 77 77 GLY C C 13 173.774 0.01 . . . . . . . 77 GLY C . 52551 1
329 . 1 . 1 77 77 GLY CA C 13 45.123 0.02 . . . . . . . 77 GLY CA . 52551 1
330 . 1 . 1 77 77 GLY N N 15 109.700 0.02 . . . . . . . 77 GLY N . 52551 1
331 . 1 . 1 78 78 HIS H H 1 8.226 0.00 . . . . . . . 78 HIS H . 52551 1
332 . 1 . 1 78 78 HIS C C 13 174.457 0.01 . . . . . . . 78 HIS C . 52551 1
333 . 1 . 1 78 78 HIS CA C 13 55.410 0.02 . . . . . . . 78 HIS CA . 52551 1
334 . 1 . 1 78 78 HIS CB C 13 29.980 0.06 . . . . . . . 78 HIS CB . 52551 1
335 . 1 . 1 78 78 HIS N N 15 118.519 0.03 . . . . . . . 78 HIS N . 52551 1
336 . 1 . 1 79 79 ALA H H 1 8.447 0.01 . . . . . . . 79 ALA H . 52551 1
337 . 1 . 1 79 79 ALA C C 13 177.742 0.01 . . . . . . . 79 ALA C . 52551 1
338 . 1 . 1 79 79 ALA CA C 13 52.523 0.02 . . . . . . . 79 ALA CA . 52551 1
339 . 1 . 1 79 79 ALA CB C 13 19.159 0.03 . . . . . . . 79 ALA CB . 52551 1
340 . 1 . 1 79 79 ALA N N 15 125.497 0.02 . . . . . . . 79 ALA N . 52551 1
341 . 1 . 1 80 80 ILE H H 1 8.402 0.00 . . . . . . . 80 ILE H . 52551 1
342 . 1 . 1 80 80 ILE C C 13 176.699 0.01 . . . . . . . 80 ILE C . 52551 1
343 . 1 . 1 80 80 ILE CA C 13 61.214 0.03 . . . . . . . 80 ILE CA . 52551 1
344 . 1 . 1 80 80 ILE CB C 13 38.607 0.04 . . . . . . . 80 ILE CB . 52551 1
345 . 1 . 1 80 80 ILE N N 15 120.847 0.02 . . . . . . . 80 ILE N . 52551 1
346 . 1 . 1 81 81 THR H H 1 8.289 0.01 . . . . . . . 81 THR H . 52551 1
347 . 1 . 1 81 81 THR C C 13 175.012 0.01 . . . . . . . 81 THR C . 52551 1
348 . 1 . 1 81 81 THR CA C 13 61.900 0.05 . . . . . . . 81 THR CA . 52551 1
349 . 1 . 1 81 81 THR CB C 13 69.852 0.00 . . . . . . . 81 THR CB . 52551 1
350 . 1 . 1 81 81 THR N N 15 118.235 0.02 . . . . . . . 81 THR N . 52551 1
351 . 1 . 1 82 82 GLY H H 1 8.493 0.00 . . . . . . . 82 GLY H . 52551 1
352 . 1 . 1 82 82 GLY C C 13 174.375 0.09 . . . . . . . 82 GLY C . 52551 1
353 . 1 . 1 82 82 GLY CA C 13 45.241 0.08 . . . . . . . 82 GLY CA . 52551 1
354 . 1 . 1 82 82 GLY N N 15 111.497 0.01 . . . . . . . 82 GLY N . 52551 1
355 . 1 . 1 83 83 GLY H H 1 8.303 0.01 . . . . . . . 83 GLY H . 52551 1
356 . 1 . 1 83 83 GLY C C 13 173.823 0.01 . . . . . . . 83 GLY C . 52551 1
357 . 1 . 1 83 83 GLY CA C 13 45.061 0.07 . . . . . . . 83 GLY CA . 52551 1
358 . 1 . 1 83 83 GLY N N 15 108.644 0.11 . . . . . . . 83 GLY N . 52551 1
359 . 1 . 1 84 84 PHE H H 1 8.296 0.01 . . . . . . . 84 PHE H . 52551 1
360 . 1 . 1 84 84 PHE C C 13 176.122 0.00 . . . . . . . 84 PHE C . 52551 1
361 . 1 . 1 84 84 PHE CA C 13 57.831 0.02 . . . . . . . 84 PHE CA . 52551 1
362 . 1 . 1 84 84 PHE CB C 13 39.685 0.02 . . . . . . . 84 PHE CB . 52551 1
363 . 1 . 1 84 84 PHE N N 15 120.374 0.04 . . . . . . . 84 PHE N . 52551 1
364 . 1 . 1 85 85 SER H H 1 8.488 0.01 . . . . . . . 85 SER H . 52551 1
365 . 1 . 1 85 85 SER C C 13 174.806 0.00 . . . . . . . 85 SER C . 52551 1
366 . 1 . 1 85 85 SER CA C 13 58.272 0.08 . . . . . . . 85 SER CA . 52551 1
367 . 1 . 1 85 85 SER CB C 13 63.767 0.02 . . . . . . . 85 SER CB . 52551 1
368 . 1 . 1 85 85 SER N N 15 118.527 0.09 . . . . . . . 85 SER N . 52551 1
369 . 1 . 1 86 86 GLY H H 1 7.998 0.01 . . . . . . . 86 GLY H . 52551 1
370 . 1 . 1 86 86 GLY C C 13 174.506 0.01 . . . . . . . 86 GLY C . 52551 1
371 . 1 . 1 86 86 GLY CA C 13 45.406 0.02 . . . . . . . 86 GLY CA . 52551 1
372 . 1 . 1 86 86 GLY N N 15 110.606 0.00 . . . . . . . 86 GLY N . 52551 1
373 . 1 . 1 87 87 GLY H H 1 8.314 0.01 . . . . . . . 87 GLY H . 52551 1
374 . 1 . 1 87 87 GLY C C 13 174.260 0.02 . . . . . . . 87 GLY C . 52551 1
375 . 1 . 1 87 87 GLY CA C 13 45.136 0.02 . . . . . . . 87 GLY CA . 52551 1
376 . 1 . 1 87 87 GLY N N 15 108.817 0.04 . . . . . . . 87 GLY N . 52551 1
377 . 1 . 1 88 88 SER H H 1 8.378 0.01 . . . . . . . 88 SER H . 52551 1
378 . 1 . 1 88 88 SER C C 13 174.366 0.06 . . . . . . . 88 SER C . 52551 1
379 . 1 . 1 88 88 SER CA C 13 58.346 0.02 . . . . . . . 88 SER CA . 52551 1
380 . 1 . 1 88 88 SER CB C 13 63.846 0.02 . . . . . . . 88 SER CB . 52551 1
381 . 1 . 1 88 88 SER N N 15 115.762 0.01 . . . . . . . 88 SER N . 52551 1
382 . 1 . 1 89 89 ASN H H 1 8.575 0.01 . . . . . . . 89 ASN H . 52551 1
383 . 1 . 1 89 89 ASN C C 13 174.661 0.01 . . . . . . . 89 ASN C . 52551 1
384 . 1 . 1 89 89 ASN CA C 13 53.218 0.02 . . . . . . . 89 ASN CA . 52551 1
385 . 1 . 1 89 89 ASN CB C 13 38.799 0.03 . . . . . . . 89 ASN CB . 52551 1
386 . 1 . 1 89 89 ASN N N 15 120.800 0.05 . . . . . . . 89 ASN N . 52551 1
387 . 1 . 1 90 90 ALA H H 1 8.224 0.01 . . . . . . . 90 ALA H . 52551 1
388 . 1 . 1 90 90 ALA C C 13 177.342 0.01 . . . . . . . 90 ALA C . 52551 1
389 . 1 . 1 90 90 ALA CA C 13 52.298 0.01 . . . . . . . 90 ALA CA . 52551 1
390 . 1 . 1 90 90 ALA CB C 13 19.315 0.03 . . . . . . . 90 ALA CB . 52551 1
391 . 1 . 1 90 90 ALA N N 15 123.997 0.00 . . . . . . . 90 ALA N . 52551 1
392 . 1 . 1 91 91 GLU H H 1 8.362 0.00 . . . . . . . 91 GLU H . 52551 1
393 . 1 . 1 91 91 GLU C C 13 174.379 0.00 . . . . . . . 91 GLU C . 52551 1
394 . 1 . 1 91 91 GLU CA C 13 54.230 0.00 . . . . . . . 91 GLU CA . 52551 1
395 . 1 . 1 91 91 GLU CB C 13 29.615 0.00 . . . . . . . 91 GLU CB . 52551 1
396 . 1 . 1 91 91 GLU N N 15 121.881 0.02 . . . . . . . 91 GLU N . 52551 1
397 . 1 . 1 92 92 PRO C C 13 176.494 0.01 . . . . . . . 92 PRO C . 52551 1
398 . 1 . 1 92 92 PRO CA C 13 62.913 0.01 . . . . . . . 92 PRO CA . 52551 1
399 . 1 . 1 93 93 ALA H H 1 8.493 0.00 . . . . . . . 93 ALA H . 52551 1
400 . 1 . 1 93 93 ALA C C 13 177.572 0.02 . . . . . . . 93 ALA C . 52551 1
401 . 1 . 1 93 93 ALA CA C 13 52.318 0.02 . . . . . . . 93 ALA CA . 52551 1
402 . 1 . 1 93 93 ALA CB C 13 19.038 0.04 . . . . . . . 93 ALA CB . 52551 1
403 . 1 . 1 93 93 ALA N N 15 124.551 0.01 . . . . . . . 93 ALA N . 52551 1
404 . 1 . 1 94 94 ARG H H 1 8.453 0.00 . . . . . . . 94 ARG H . 52551 1
405 . 1 . 1 94 94 ARG C C 13 174.383 0.00 . . . . . . . 94 ARG C . 52551 1
406 . 1 . 1 94 94 ARG CA C 13 53.710 0.02 . . . . . . . 94 ARG CA . 52551 1
407 . 1 . 1 94 94 ARG CB C 13 30.206 0.00 . . . . . . . 94 ARG CB . 52551 1
408 . 1 . 1 94 94 ARG N N 15 121.794 0.03 . . . . . . . 94 ARG N . 52551 1
409 . 1 . 1 95 95 PRO C C 13 176.392 0.03 . . . . . . . 95 PRO C . 52551 1
410 . 1 . 1 95 95 PRO CA C 13 63.184 0.02 . . . . . . . 95 PRO CA . 52551 1
411 . 1 . 1 95 95 PRO CB C 13 32.072 0.05 . . . . . . . 95 PRO CB . 52551 1
412 . 1 . 1 96 96 ASP H H 1 8.542 0.01 . . . . . . . 96 ASP H . 52551 1
413 . 1 . 1 96 96 ASP C C 13 176.303 0.05 . . . . . . . 96 ASP C . 52551 1
414 . 1 . 1 96 96 ASP CA C 13 54.198 0.00 . . . . . . . 96 ASP CA . 52551 1
415 . 1 . 1 96 96 ASP CB C 13 40.853 0.01 . . . . . . . 96 ASP CB . 52551 1
416 . 1 . 1 96 96 ASP N N 15 120.324 0.01 . . . . . . . 96 ASP N . 52551 1
417 . 1 . 1 97 97 ILE H H 1 8.113 0.00 . . . . . . . 97 ILE H . 52551 1
418 . 1 . 1 97 97 ILE C C 13 176.238 0.00 . . . . . . . 97 ILE C . 52551 1
419 . 1 . 1 97 97 ILE CA C 13 61.211 0.02 . . . . . . . 97 ILE CA . 52551 1
420 . 1 . 1 97 97 ILE CB C 13 38.668 0.05 . . . . . . . 97 ILE CB . 52551 1
421 . 1 . 1 97 97 ILE N N 15 121.079 0.01 . . . . . . . 97 ILE N . 52551 1
422 . 1 . 1 98 98 THR H H 1 8.284 0.00 . . . . . . . 98 THR H . 52551 1
423 . 1 . 1 98 98 THR C C 13 174.074 0.01 . . . . . . . 98 THR C . 52551 1
424 . 1 . 1 98 98 THR CA C 13 62.007 0.05 . . . . . . . 98 THR CA . 52551 1
425 . 1 . 1 98 98 THR CB C 13 69.859 0.01 . . . . . . . 98 THR CB . 52551 1
426 . 1 . 1 98 98 THR N N 15 118.241 0.02 . . . . . . . 98 THR N . 52551 1
427 . 1 . 1 99 99 TYR H H 1 8.308 0.00 . . . . . . . 99 TYR H . 52551 1
428 . 1 . 1 99 99 TYR C C 13 175.082 0.01 . . . . . . . 99 TYR C . 52551 1
429 . 1 . 1 99 99 TYR CA C 13 58.245 0.01 . . . . . . . 99 TYR CA . 52551 1
430 . 1 . 1 99 99 TYR CB C 13 38.905 0.03 . . . . . . . 99 TYR CB . 52551 1
431 . 1 . 1 99 99 TYR N N 15 123.665 0.02 . . . . . . . 99 TYR N . 52551 1
432 . 1 . 1 100 100 GLN H H 1 8.097 0.01 . . . . . . . 100 GLN H . 52551 1
433 . 1 . 1 100 100 GLN C C 13 174.715 0.01 . . . . . . . 100 GLN C . 52551 1
434 . 1 . 1 100 100 GLN CA C 13 54.692 0.11 . . . . . . . 100 GLN CA . 52551 1
435 . 1 . 1 100 100 GLN CB C 13 30.129 0.04 . . . . . . . 100 GLN CB . 52551 1
436 . 1 . 1 100 100 GLN N N 15 123.963 0.02 . . . . . . . 100 GLN N . 52551 1
437 . 1 . 1 101 101 GLU H H 1 8.494 0.01 . . . . . . . 101 GLU H . 52551 1
438 . 1 . 1 101 101 GLU C C 13 177.528 0.00 . . . . . . . 101 GLU C . 52551 1
439 . 1 . 1 101 101 GLU CA C 13 54.555 0.02 . . . . . . . 101 GLU CA . 52551 1
440 . 1 . 1 101 101 GLU CB C 13 29.353 0.00 . . . . . . . 101 GLU CB . 52551 1
441 . 1 . 1 101 101 GLU N N 15 124.546 0.01 . . . . . . . 101 GLU N . 52551 1
442 . 1 . 1 102 102 PRO C C 13 177.002 0.00 . . . . . . . 102 PRO C . 52551 1
443 . 1 . 1 102 102 PRO CA C 13 63.270 0.02 . . . . . . . 102 PRO CA . 52551 1
444 . 1 . 1 102 102 PRO CB C 13 32.058 0.03 . . . . . . . 102 PRO CB . 52551 1
445 . 1 . 1 103 103 GLN H H 1 8.680 0.00 . . . . . . . 103 GLN H . 52551 1
446 . 1 . 1 103 103 GLN C C 13 176.626 0.02 . . . . . . . 103 GLN C . 52551 1
447 . 1 . 1 103 103 GLN CA C 13 55.787 0.01 . . . . . . . 103 GLN CA . 52551 1
448 . 1 . 1 103 103 GLN CB C 13 29.639 0.05 . . . . . . . 103 GLN CB . 52551 1
449 . 1 . 1 103 103 GLN N N 15 121.296 0.01 . . . . . . . 103 GLN N . 52551 1
450 . 1 . 1 104 104 GLY H H 1 8.561 0.01 . . . . . . . 104 GLY H . 52551 1
451 . 1 . 1 104 104 GLY C C 13 174.219 0.01 . . . . . . . 104 GLY C . 52551 1
452 . 1 . 1 104 104 GLY CA C 13 45.191 0.01 . . . . . . . 104 GLY CA . 52551 1
453 . 1 . 1 104 104 GLY N N 15 110.521 0.05 . . . . . . . 104 GLY N . 52551 1
454 . 1 . 1 105 105 THR H H 1 8.185 0.00 . . . . . . . 105 THR H . 52551 1
455 . 1 . 1 105 105 THR C C 13 174.509 0.03 . . . . . . . 105 THR C . 52551 1
456 . 1 . 1 105 105 THR CA C 13 62.003 0.02 . . . . . . . 105 THR CA . 52551 1
457 . 1 . 1 105 105 THR CB C 13 69.816 0.00 . . . . . . . 105 THR CB . 52551 1
458 . 1 . 1 105 105 THR N N 15 114.122 0.01 . . . . . . . 105 THR N . 52551 1
459 . 1 . 1 106 106 GLN H H 1 8.578 0.00 . . . . . . . 106 GLN H . 52551 1
460 . 1 . 1 106 106 GLN C C 13 173.881 0.00 . . . . . . . 106 GLN C . 52551 1
461 . 1 . 1 106 106 GLN CA C 13 53.654 0.01 . . . . . . . 106 GLN CA . 52551 1
462 . 1 . 1 106 106 GLN CB C 13 28.781 0.00 . . . . . . . 106 GLN CB . 52551 1
463 . 1 . 1 106 106 GLN N N 15 124.381 0.02 . . . . . . . 106 GLN N . 52551 1
464 . 1 . 1 107 107 PRO C C 13 176.689 0.01 . . . . . . . 107 PRO C . 52551 1
465 . 1 . 1 107 107 PRO CA C 13 63.010 0.02 . . . . . . . 107 PRO CA . 52551 1
466 . 1 . 1 107 107 PRO CB C 13 32.038 0.04 . . . . . . . 107 PRO CB . 52551 1
467 . 1 . 1 108 108 ALA H H 1 8.538 0.00 . . . . . . . 108 ALA H . 52551 1
468 . 1 . 1 108 108 ALA C C 13 177.885 0.02 . . . . . . . 108 ALA C . 52551 1
469 . 1 . 1 108 108 ALA CA C 13 52.556 0.01 . . . . . . . 108 ALA CA . 52551 1
470 . 1 . 1 108 108 ALA CB C 13 19.018 0.03 . . . . . . . 108 ALA CB . 52551 1
471 . 1 . 1 108 108 ALA N N 15 124.480 0.01 . . . . . . . 108 ALA N . 52551 1
472 . 1 . 1 109 109 GLN H H 1 8.463 0.00 . . . . . . . 109 GLN H . 52551 1
473 . 1 . 1 109 109 GLN C C 13 175.913 0.05 . . . . . . . 109 GLN C . 52551 1
474 . 1 . 1 109 109 GLN CA C 13 55.717 0.04 . . . . . . . 109 GLN CA . 52551 1
475 . 1 . 1 109 109 GLN CB C 13 29.515 0.05 . . . . . . . 109 GLN CB . 52551 1
476 . 1 . 1 109 109 GLN N N 15 119.729 0.01 . . . . . . . 109 GLN N . 52551 1
477 . 1 . 1 110 110 GLN H H 1 8.530 0.00 . . . . . . . 110 GLN H . 52551 1
478 . 1 . 1 110 110 GLN C C 13 175.834 0.01 . . . . . . . 110 GLN C . 52551 1
479 . 1 . 1 110 110 GLN CA C 13 55.765 0.01 . . . . . . . 110 GLN CA . 52551 1
480 . 1 . 1 110 110 GLN CB C 13 29.483 0.05 . . . . . . . 110 GLN CB . 52551 1
481 . 1 . 1 110 110 GLN N N 15 122.173 0.03 . . . . . . . 110 GLN N . 52551 1
482 . 1 . 1 111 111 GLN H H 1 8.591 0.00 . . . . . . . 111 GLN H . 52551 1
483 . 1 . 1 111 111 GLN C C 13 175.639 0.02 . . . . . . . 111 GLN C . 52551 1
484 . 1 . 1 111 111 GLN CA C 13 55.757 0.01 . . . . . . . 111 GLN CA . 52551 1
485 . 1 . 1 111 111 GLN CB C 13 29.495 0.04 . . . . . . . 111 GLN CB . 52551 1
486 . 1 . 1 111 111 GLN N N 15 122.506 0.02 . . . . . . . 111 GLN N . 52551 1
487 . 1 . 1 112 112 GLN H H 1 8.588 0.00 . . . . . . . 112 GLN H . 52551 1
488 . 1 . 1 112 112 GLN C C 13 175.615 0.00 . . . . . . . 112 GLN C . 52551 1
489 . 1 . 1 112 112 GLN CA C 13 53.537 0.02 . . . . . . . 112 GLN CA . 52551 1
490 . 1 . 1 112 112 GLN CB C 13 28.793 0.00 . . . . . . . 112 GLN CB . 52551 1
491 . 1 . 1 112 112 GLN N N 15 123.899 0.01 . . . . . . . 112 GLN N . 52551 1
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