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 53466
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'N-terminal domain of Caulobacter crescentus PcoB'
_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 '2D 1H-15N HSQC' . . . 53466 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 . . 53466 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 ILE C C 13 175.939 0.012 . 1 . . . . . 2 ILE C . 53466 1
2 . 1 . 1 2 2 ILE CA C 13 60.896 0.000 . 1 . . . . . 2 ILE CA . 53466 1
3 . 1 . 1 2 2 ILE CB C 13 38.538 0.004 . 1 . . . . . 2 ILE CB . 53466 1
4 . 1 . 1 3 3 ILE H H 1 8.591 0.001 . 1 . . . . . 3 ILE H . 53466 1
5 . 1 . 1 3 3 ILE C C 13 175.482 0.012 . 1 . . . . . 3 ILE C . 53466 1
6 . 1 . 1 3 3 ILE CA C 13 60.538 0.038 . 1 . . . . . 3 ILE CA . 53466 1
7 . 1 . 1 3 3 ILE CB C 13 38.545 0.022 . 1 . . . . . 3 ILE CB . 53466 1
8 . 1 . 1 3 3 ILE N N 15 127.738 0.025 . 1 . . . . . 3 ILE N . 53466 1
9 . 1 . 1 4 4 ASP H H 1 8.669 0.001 . 1 . . . . . 4 ASP H . 53466 1
10 . 1 . 1 4 4 ASP C C 13 174.890 0.000 . 1 . . . . . 4 ASP C . 53466 1
11 . 1 . 1 4 4 ASP CA C 13 51.994 0.000 . 1 . . . . . 4 ASP CA . 53466 1
12 . 1 . 1 4 4 ASP CB C 13 41.206 0.000 . 1 . . . . . 4 ASP CB . 53466 1
13 . 1 . 1 4 4 ASP N N 15 127.238 0.035 . 1 . . . . . 4 ASP N . 53466 1
14 . 1 . 1 5 5 PRO C C 13 177.464 0.007 . 1 . . . . . 5 PRO C . 53466 1
15 . 1 . 1 5 5 PRO CA C 13 63.772 0.002 . 1 . . . . . 5 PRO CA . 53466 1
16 . 1 . 1 5 5 PRO CB C 13 32.155 0.010 . 1 . . . . . 5 PRO CB . 53466 1
17 . 1 . 1 6 6 GLN H H 1 8.566 0.001 . 1 . . . . . 6 GLN H . 53466 1
18 . 1 . 1 6 6 GLN C C 13 176.162 0.005 . 1 . . . . . 6 GLN C . 53466 1
19 . 1 . 1 6 6 GLN CA C 13 56.147 0.006 . 1 . . . . . 6 GLN CA . 53466 1
20 . 1 . 1 6 6 GLN CB C 13 28.902 0.042 . 1 . . . . . 6 GLN CB . 53466 1
21 . 1 . 1 6 6 GLN N N 15 118.397 0.015 . 1 . . . . . 6 GLN N . 53466 1
22 . 1 . 1 7 7 HIS H H 1 8.117 0.001 . 1 . . . . . 7 HIS H . 53466 1
23 . 1 . 1 7 7 HIS C C 13 175.527 0.012 . 1 . . . . . 7 HIS C . 53466 1
24 . 1 . 1 7 7 HIS CA C 13 56.410 0.009 . 1 . . . . . 7 HIS CA . 53466 1
25 . 1 . 1 7 7 HIS CB C 13 30.831 0.007 . 1 . . . . . 7 HIS CB . 53466 1
26 . 1 . 1 7 7 HIS N N 15 119.739 0.027 . 1 . . . . . 7 HIS N . 53466 1
27 . 1 . 1 8 8 GLU H H 1 8.290 0.001 . 1 . . . . . 8 GLU H . 53466 1
28 . 1 . 1 8 8 GLU C C 13 176.204 0.004 . 1 . . . . . 8 GLU C . 53466 1
29 . 1 . 1 8 8 GLU CA C 13 56.806 0.000 . 1 . . . . . 8 GLU CA . 53466 1
30 . 1 . 1 8 8 GLU CB C 13 30.254 0.063 . 1 . . . . . 8 GLU CB . 53466 1
31 . 1 . 1 8 8 GLU N N 15 121.765 0.021 . 1 . . . . . 8 GLU N . 53466 1
32 . 1 . 1 9 9 HIS H H 1 8.485 0.002 . 1 . . . . . 9 HIS H . 53466 1
33 . 1 . 1 9 9 HIS C C 13 175.273 0.011 . 1 . . . . . 9 HIS C . 53466 1
34 . 1 . 1 9 9 HIS CA C 13 56.246 0.069 . 1 . . . . . 9 HIS CA . 53466 1
35 . 1 . 1 9 9 HIS CB C 13 30.691 0.035 . 1 . . . . . 9 HIS CB . 53466 1
36 . 1 . 1 9 9 HIS N N 15 120.348 0.012 . 1 . . . . . 9 HIS N . 53466 1
37 . 1 . 1 10 10 HIS H H 1 8.200 0.003 . 1 . . . . . 10 HIS H . 53466 1
38 . 1 . 1 10 10 HIS C C 13 175.025 0.011 . 1 . . . . . 10 HIS C . 53466 1
39 . 1 . 1 10 10 HIS CA C 13 56.093 0.000 . 1 . . . . . 10 HIS CA . 53466 1
40 . 1 . 1 10 10 HIS CB C 13 30.675 0.000 . 1 . . . . . 10 HIS CB . 53466 1
41 . 1 . 1 10 10 HIS N N 15 120.571 0.044 . 1 . . . . . 10 HIS N . 53466 1
42 . 1 . 1 11 11 HIS H H 1 8.374 0.005 . 1 . . . . . 11 HIS H . 53466 1
43 . 1 . 1 11 11 HIS C C 13 174.992 0.031 . 1 . . . . . 11 HIS C . 53466 1
44 . 1 . 1 11 11 HIS CA C 13 56.179 0.000 . 1 . . . . . 11 HIS CA . 53466 1
45 . 1 . 1 11 11 HIS CB C 13 30.656 0.043 . 1 . . . . . 11 HIS CB . 53466 1
46 . 1 . 1 11 11 HIS N N 15 121.191 0.012 . 1 . . . . . 11 HIS N . 53466 1
47 . 1 . 1 12 12 HIS H H 1 8.344 0.007 . 1 . . . . . 12 HIS H . 53466 1
48 . 1 . 1 12 12 HIS C C 13 174.516 0.016 . 1 . . . . . 12 HIS C . 53466 1
49 . 1 . 1 12 12 HIS CA C 13 55.743 0.052 . 1 . . . . . 12 HIS CA . 53466 1
50 . 1 . 1 12 12 HIS CB C 13 30.881 0.000 . 1 . . . . . 12 HIS CB . 53466 1
51 . 1 . 1 12 12 HIS N N 15 121.619 0.016 . 1 . . . . . 12 HIS N . 53466 1
52 . 1 . 1 13 13 ALA H H 1 8.473 0.001 . 1 . . . . . 13 ALA H . 53466 1
53 . 1 . 1 13 13 ALA C C 13 175.189 0.000 . 1 . . . . . 13 ALA C . 53466 1
54 . 1 . 1 13 13 ALA CA C 13 50.523 0.000 . 1 . . . . . 13 ALA CA . 53466 1
55 . 1 . 1 13 13 ALA CB C 13 18.071 0.000 . 1 . . . . . 13 ALA CB . 53466 1
56 . 1 . 1 13 13 ALA N N 15 127.342 0.025 . 1 . . . . . 13 ALA N . 53466 1
57 . 1 . 1 14 14 PRO C C 13 176.581 0.002 . 1 . . . . . 14 PRO C . 53466 1
58 . 1 . 1 14 14 PRO CA C 13 62.760 0.020 . 1 . . . . . 14 PRO CA . 53466 1
59 . 1 . 1 14 14 PRO CB C 13 32.094 0.012 . 1 . . . . . 14 PRO CB . 53466 1
60 . 1 . 1 15 15 ALA H H 1 8.558 0.001 . 1 . . . . . 15 ALA H . 53466 1
61 . 1 . 1 15 15 ALA C C 13 177.196 0.008 . 1 . . . . . 15 ALA C . 53466 1
62 . 1 . 1 15 15 ALA CA C 13 52.065 0.028 . 1 . . . . . 15 ALA CA . 53466 1
63 . 1 . 1 15 15 ALA CB C 13 19.208 0.012 . 1 . . . . . 15 ALA CB . 53466 1
64 . 1 . 1 15 15 ALA N N 15 124.905 0.008 . 1 . . . . . 15 ALA N . 53466 1
65 . 1 . 1 16 16 ALA H H 1 8.436 0.001 . 1 . . . . . 16 ALA H . 53466 1
66 . 1 . 1 16 16 ALA C C 13 175.544 0.000 . 1 . . . . . 16 ALA C . 53466 1
67 . 1 . 1 16 16 ALA CA C 13 50.337 0.000 . 1 . . . . . 16 ALA CA . 53466 1
68 . 1 . 1 16 16 ALA CB C 13 17.997 0.000 . 1 . . . . . 16 ALA CB . 53466 1
69 . 1 . 1 16 16 ALA N N 15 125.255 0.031 . 1 . . . . . 16 ALA N . 53466 1
70 . 1 . 1 17 17 PRO C C 13 176.972 0.004 . 1 . . . . . 17 PRO C . 53466 1
71 . 1 . 1 17 17 PRO CA C 13 62.824 0.000 . 1 . . . . . 17 PRO CA . 53466 1
72 . 1 . 1 17 17 PRO CB C 13 32.062 0.000 . 1 . . . . . 17 PRO CB . 53466 1
73 . 1 . 1 18 18 VAL H H 1 8.463 0.001 . 1 . . . . . 18 VAL H . 53466 1
74 . 1 . 1 18 18 VAL C C 13 176.426 0.003 . 1 . . . . . 18 VAL C . 53466 1
75 . 1 . 1 18 18 VAL CA C 13 62.309 0.035 . 1 . . . . . 18 VAL CA . 53466 1
76 . 1 . 1 18 18 VAL CB C 13 32.910 0.036 . 1 . . . . . 18 VAL CB . 53466 1
77 . 1 . 1 18 18 VAL N N 15 121.235 0.023 . 1 . . . . . 18 VAL N . 53466 1
78 . 1 . 1 19 19 SER H H 1 8.537 0.002 . 1 . . . . . 19 SER H . 53466 1
79 . 1 . 1 19 19 SER C C 13 173.603 0.015 . 1 . . . . . 19 SER C . 53466 1
80 . 1 . 1 19 19 SER CA C 13 57.973 0.030 . 1 . . . . . 19 SER CA . 53466 1
81 . 1 . 1 19 19 SER CB C 13 63.911 0.006 . 1 . . . . . 19 SER CB . 53466 1
82 . 1 . 1 19 19 SER N N 15 120.567 0.038 . 1 . . . . . 19 SER N . 53466 1
83 . 1 . 1 20 20 ALA H H 1 8.512 0.002 . 1 . . . . . 20 ALA H . 53466 1
84 . 1 . 1 20 20 ALA C C 13 175.271 0.000 . 1 . . . . . 20 ALA C . 53466 1
85 . 1 . 1 20 20 ALA CA C 13 50.513 0.000 . 1 . . . . . 20 ALA CA . 53466 1
86 . 1 . 1 20 20 ALA CB C 13 18.170 0.000 . 1 . . . . . 20 ALA CB . 53466 1
87 . 1 . 1 20 20 ALA N N 15 127.756 0.039 . 1 . . . . . 20 ALA N . 53466 1
88 . 1 . 1 21 21 PRO C C 13 176.335 0.002 . 1 . . . . . 21 PRO C . 53466 1
89 . 1 . 1 21 21 PRO CA C 13 62.688 0.010 . 1 . . . . . 21 PRO CA . 53466 1
90 . 1 . 1 21 21 PRO CB C 13 32.064 0.009 . 1 . . . . . 21 PRO CB . 53466 1
91 . 1 . 1 22 22 ALA H H 1 8.599 0.001 . 1 . . . . . 22 ALA H . 53466 1
92 . 1 . 1 22 22 ALA C C 13 175.690 0.000 . 1 . . . . . 22 ALA C . 53466 1
93 . 1 . 1 22 22 ALA CA C 13 50.407 0.000 . 1 . . . . . 22 ALA CA . 53466 1
94 . 1 . 1 22 22 ALA CB C 13 17.850 0.000 . 1 . . . . . 22 ALA CB . 53466 1
95 . 1 . 1 22 22 ALA N N 15 126.244 0.006 . 1 . . . . . 22 ALA N . 53466 1
96 . 1 . 1 23 23 PRO C C 13 176.939 0.004 . 1 . . . . . 23 PRO C . 53466 1
97 . 1 . 1 23 23 PRO CA C 13 62.940 0.009 . 1 . . . . . 23 PRO CA . 53466 1
98 . 1 . 1 23 23 PRO CB C 13 32.076 0.003 . 1 . . . . . 23 PRO CB . 53466 1
99 . 1 . 1 24 24 GLN H H 1 8.630 0.001 . 1 . . . . . 24 GLN H . 53466 1
100 . 1 . 1 24 24 GLN C C 13 175.791 0.005 . 1 . . . . . 24 GLN C . 53466 1
101 . 1 . 1 24 24 GLN CA C 13 55.485 0.027 . 1 . . . . . 24 GLN CA . 53466 1
102 . 1 . 1 24 24 GLN CB C 13 29.679 0.023 . 1 . . . . . 24 GLN CB . 53466 1
103 . 1 . 1 24 24 GLN N N 15 121.151 0.007 . 1 . . . . . 24 GLN N . 53466 1
104 . 1 . 1 25 25 ALA H H 1 8.539 0.002 . 1 . . . . . 25 ALA H . 53466 1
105 . 1 . 1 25 25 ALA C C 13 177.338 0.035 . 1 . . . . . 25 ALA C . 53466 1
106 . 1 . 1 25 25 ALA CA C 13 52.293 0.059 . 1 . . . . . 25 ALA CA . 53466 1
107 . 1 . 1 25 25 ALA CB C 13 19.243 0.034 . 1 . . . . . 25 ALA CB . 53466 1
108 . 1 . 1 25 25 ALA N N 15 126.379 0.039 . 1 . . . . . 25 ALA N . 53466 1
109 . 1 . 1 26 26 ALA H H 1 8.455 0.001 . 1 . . . . . 26 ALA H . 53466 1
110 . 1 . 1 26 26 ALA C C 13 177.275 0.007 . 1 . . . . . 26 ALA C . 53466 1
111 . 1 . 1 26 26 ALA CA C 13 52.216 0.000 . 1 . . . . . 26 ALA CA . 53466 1
112 . 1 . 1 26 26 ALA CB C 13 19.176 0.011 . 1 . . . . . 26 ALA CB . 53466 1
113 . 1 . 1 26 26 ALA N N 15 123.716 0.050 . 1 . . . . . 26 ALA N . 53466 1
114 . 1 . 1 27 27 ASP H H 1 8.479 0.003 . 1 . . . . . 27 ASP H . 53466 1
115 . 1 . 1 27 27 ASP C C 13 175.438 0.000 . 1 . . . . . 27 ASP C . 53466 1
116 . 1 . 1 27 27 ASP CA C 13 51.822 0.000 . 1 . . . . . 27 ASP CA . 53466 1
117 . 1 . 1 27 27 ASP CB C 13 41.424 0.000 . 1 . . . . . 27 ASP CB . 53466 1
118 . 1 . 1 27 27 ASP N N 15 121.409 0.002 . 1 . . . . . 27 ASP N . 53466 1
119 . 1 . 1 28 28 PRO C C 13 177.076 0.006 . 1 . . . . . 28 PRO C . 53466 1
120 . 1 . 1 28 28 PRO CA C 13 63.828 0.000 . 1 . . . . . 28 PRO CA . 53466 1
121 . 1 . 1 28 28 PRO CB C 13 32.051 0.000 . 1 . . . . . 28 PRO CB . 53466 1
122 . 1 . 1 29 29 HIS H H 1 8.372 0.001 . 1 . . . . . 29 HIS H . 53466 1
123 . 1 . 1 29 29 HIS C C 13 175.638 0.022 . 1 . . . . . 29 HIS C . 53466 1
124 . 1 . 1 29 29 HIS CA C 13 55.743 0.011 . 1 . . . . . 29 HIS CA . 53466 1
125 . 1 . 1 29 29 HIS CB C 13 30.185 0.031 . 1 . . . . . 29 HIS CB . 53466 1
126 . 1 . 1 29 29 HIS N N 15 117.891 0.021 . 1 . . . . . 29 HIS N . 53466 1
127 . 1 . 1 30 30 ALA H H 1 7.756 0.001 . 1 . . . . . 30 ALA H . 53466 1
128 . 1 . 1 30 30 ALA C C 13 177.707 0.011 . 1 . . . . . 30 ALA C . 53466 1
129 . 1 . 1 30 30 ALA CA C 13 53.152 0.022 . 1 . . . . . 30 ALA CA . 53466 1
130 . 1 . 1 30 30 ALA CB C 13 18.972 0.008 . 1 . . . . . 30 ALA CB . 53466 1
131 . 1 . 1 30 30 ALA N N 15 123.767 0.012 . 1 . . . . . 30 ALA N . 53466 1
132 . 1 . 1 31 31 HIS H H 1 8.366 0.003 . 1 . . . . . 31 HIS H . 53466 1
133 . 1 . 1 31 31 HIS C C 13 175.494 0.011 . 1 . . . . . 31 HIS C . 53466 1
134 . 1 . 1 31 31 HIS CA C 13 56.378 0.081 . 1 . . . . . 31 HIS CA . 53466 1
135 . 1 . 1 31 31 HIS CB C 13 30.697 0.062 . 1 . . . . . 31 HIS CB . 53466 1
136 . 1 . 1 31 31 HIS N N 15 117.904 0.037 . 1 . . . . . 31 HIS N . 53466 1
137 . 1 . 1 32 32 HIS H H 1 8.175 0.003 . 1 . . . . . 32 HIS H . 53466 1
138 . 1 . 1 32 32 HIS C C 13 175.210 0.011 . 1 . . . . . 32 HIS C . 53466 1
139 . 1 . 1 32 32 HIS CA C 13 56.284 0.000 . 1 . . . . . 32 HIS CA . 53466 1
140 . 1 . 1 32 32 HIS CB C 13 30.842 0.073 . 1 . . . . . 32 HIS CB . 53466 1
141 . 1 . 1 32 32 HIS N N 15 120.832 0.023 . 1 . . . . . 32 HIS N . 53466 1
142 . 1 . 1 33 33 ARG H H 1 8.297 0.002 . 1 . . . . . 33 ARG H . 53466 1
143 . 1 . 1 33 33 ARG C C 13 175.520 0.040 . 1 . . . . . 33 ARG C . 53466 1
144 . 1 . 1 33 33 ARG CA C 13 55.577 0.007 . 1 . . . . . 33 ARG CA . 53466 1
145 . 1 . 1 33 33 ARG CB C 13 30.956 0.000 . 1 . . . . . 33 ARG CB . 53466 1
146 . 1 . 1 33 33 ARG N N 15 122.831 0.024 . 1 . . . . . 33 ARG N . 53466 1
147 . 1 . 1 34 34 ALA H H 1 8.508 0.003 . 1 . . . . . 34 ALA H . 53466 1
148 . 1 . 1 34 34 ALA C C 13 175.796 0.000 . 1 . . . . . 34 ALA C . 53466 1
149 . 1 . 1 34 34 ALA CA C 13 50.575 0.000 . 1 . . . . . 34 ALA CA . 53466 1
150 . 1 . 1 34 34 ALA CB C 13 17.939 0.000 . 1 . . . . . 34 ALA CB . 53466 1
151 . 1 . 1 34 34 ALA N N 15 127.400 0.069 . 1 . . . . . 34 ALA N . 53466 1
152 . 1 . 1 35 35 PRO C C 13 176.732 0.006 . 1 . . . . . 35 PRO C . 53466 1
153 . 1 . 1 35 35 PRO CA C 13 62.893 0.011 . 1 . . . . . 35 PRO CA . 53466 1
154 . 1 . 1 35 35 PRO CB C 13 32.088 0.001 . 1 . . . . . 35 PRO CB . 53466 1
155 . 1 . 1 36 36 ALA H H 1 8.604 0.003 . 1 . . . . . 36 ALA H . 53466 1
156 . 1 . 1 36 36 ALA C C 13 177.866 0.002 . 1 . . . . . 36 ALA C . 53466 1
157 . 1 . 1 36 36 ALA CA C 13 52.502 0.002 . 1 . . . . . 36 ALA CA . 53466 1
158 . 1 . 1 36 36 ALA CB C 13 19.154 0.004 . 1 . . . . . 36 ALA CB . 53466 1
159 . 1 . 1 36 36 ALA N N 15 124.679 0.045 . 1 . . . . . 36 ALA N . 53466 1
160 . 1 . 1 37 37 SER H H 1 8.394 0.002 . 1 . . . . . 37 SER H . 53466 1
161 . 1 . 1 37 37 SER C C 13 173.732 0.007 . 1 . . . . . 37 SER C . 53466 1
162 . 1 . 1 37 37 SER CA C 13 58.051 0.014 . 1 . . . . . 37 SER CA . 53466 1
163 . 1 . 1 37 37 SER CB C 13 63.989 0.004 . 1 . . . . . 37 SER CB . 53466 1
164 . 1 . 1 37 37 SER N N 15 115.513 0.018 . 1 . . . . . 37 SER N . 53466 1
165 . 1 . 1 38 38 ALA H H 1 8.441 0.002 . 1 . . . . . 38 ALA H . 53466 1
166 . 1 . 1 38 38 ALA C C 13 174.990 0.000 . 1 . . . . . 38 ALA C . 53466 1
167 . 1 . 1 38 38 ALA CA C 13 50.438 0.000 . 1 . . . . . 38 ALA CA . 53466 1
168 . 1 . 1 38 38 ALA CB C 13 18.132 0.000 . 1 . . . . . 38 ALA CB . 53466 1
169 . 1 . 1 38 38 ALA N N 15 127.367 0.040 . 1 . . . . . 38 ALA N . 53466 1
170 . 1 . 1 41 41 PRO C C 13 176.711 0.000 . 1 . . . . . 41 PRO C . 53466 1
171 . 1 . 1 41 41 PRO CA C 13 62.712 0.000 . 1 . . . . . 41 PRO CA . 53466 1
172 . 1 . 1 41 41 PRO CB C 13 32.093 0.000 . 1 . . . . . 41 PRO CB . 53466 1
173 . 1 . 1 42 42 VAL H H 1 8.401 0.001 . 1 . . . . . 42 VAL H . 53466 1
174 . 1 . 1 42 42 VAL C C 13 176.174 0.008 . 1 . . . . . 42 VAL C . 53466 1
175 . 1 . 1 42 42 VAL CA C 13 62.317 0.021 . 1 . . . . . 42 VAL CA . 53466 1
176 . 1 . 1 42 42 VAL CB C 13 32.727 0.018 . 1 . . . . . 42 VAL CB . 53466 1
177 . 1 . 1 42 42 VAL N N 15 121.555 0.032 . 1 . . . . . 42 VAL N . 53466 1
178 . 1 . 1 43 43 LEU C C 13 176.482 0.006 . 1 . . . . . 43 LEU C . 53466 1
179 . 1 . 1 43 43 LEU CA C 13 54.513 0.012 . 1 . . . . . 43 LEU CA . 53466 1
180 . 1 . 1 43 43 LEU CB C 13 42.402 0.005 . 1 . . . . . 43 LEU CB . 53466 1
181 . 1 . 1 43 43 LEU N N 15 127.721 0.028 . 1 . . . . . 43 LEU N . 53466 1
182 . 1 . 1 44 44 ALA H H 1 8.482 0.002 . 1 . . . . . 44 ALA H . 53466 1
183 . 1 . 1 44 44 ALA C C 13 175.227 0.000 . 1 . . . . . 44 ALA C . 53466 1
184 . 1 . 1 44 44 ALA CA C 13 50.377 0.000 . 1 . . . . . 44 ALA CA . 53466 1
185 . 1 . 1 44 44 ALA CB C 13 18.073 0.000 . 1 . . . . . 44 ALA CB . 53466 1
186 . 1 . 1 44 44 ALA N N 15 127.299 0.020 . 1 . . . . . 44 ALA N . 53466 1
187 . 1 . 1 45 45 PRO C C 13 176.594 0.003 . 1 . . . . . 45 PRO C . 53466 1
188 . 1 . 1 45 45 PRO CA C 13 62.728 0.023 . 1 . . . . . 45 PRO CA . 53466 1
189 . 1 . 1 45 45 PRO CB C 13 32.098 0.002 . 1 . . . . . 45 PRO CB . 53466 1
190 . 1 . 1 46 46 ALA H H 1 8.531 0.001 . 1 . . . . . 46 ALA H . 53466 1
191 . 1 . 1 46 46 ALA C C 13 177.329 0.010 . 1 . . . . . 46 ALA C . 53466 1
192 . 1 . 1 46 46 ALA CA C 13 52.211 0.001 . 1 . . . . . 46 ALA CA . 53466 1
193 . 1 . 1 46 46 ALA CB C 13 19.158 0.019 . 1 . . . . . 46 ALA CB . 53466 1
194 . 1 . 1 46 46 ALA N N 15 124.759 0.023 . 1 . . . . . 46 ALA N . 53466 1
195 . 1 . 1 47 47 ASP H H 1 8.505 0.003 . 1 . . . . . 47 ASP H . 53466 1
196 . 1 . 1 47 47 ASP C C 13 170.705 0.000 . 1 . . . . . 47 ASP C . 53466 1
197 . 1 . 1 47 47 ASP CA C 13 51.826 0.000 . 1 . . . . . 47 ASP CA . 53466 1
198 . 1 . 1 47 47 ASP CB C 13 41.395 0.000 . 1 . . . . . 47 ASP CB . 53466 1
199 . 1 . 1 47 47 ASP N N 15 121.407 0.038 . 1 . . . . . 47 ASP N . 53466 1
200 . 1 . 1 48 48 PRO C C 13 177.114 0.005 . 1 . . . . . 48 PRO C . 53466 1
201 . 1 . 1 48 48 PRO CA C 13 63.744 0.018 . 1 . . . . . 48 PRO CA . 53466 1
202 . 1 . 1 48 48 PRO CB C 13 32.046 0.006 . 1 . . . . . 48 PRO CB . 53466 1
203 . 1 . 1 49 49 HIS H H 1 8.438 0.001 . 1 . . . . . 49 HIS H . 53466 1
204 . 1 . 1 49 49 HIS C C 13 175.540 0.033 . 1 . . . . . 49 HIS C . 53466 1
205 . 1 . 1 49 49 HIS CA C 13 55.848 0.006 . 1 . . . . . 49 HIS CA . 53466 1
206 . 1 . 1 49 49 HIS CB C 13 30.110 0.003 . 1 . . . . . 49 HIS CB . 53466 1
207 . 1 . 1 49 49 HIS N N 15 118.362 0.014 . 1 . . . . . 49 HIS N . 53466 1
208 . 1 . 1 50 50 ALA H H 1 7.868 0.001 . 1 . . . . . 50 ALA H . 53466 1
209 . 1 . 1 50 50 ALA C C 13 178.306 0.006 . 1 . . . . . 50 ALA C . 53466 1
210 . 1 . 1 50 50 ALA CA C 13 53.107 0.009 . 1 . . . . . 50 ALA CA . 53466 1
211 . 1 . 1 50 50 ALA CB C 13 19.059 0.005 . 1 . . . . . 50 ALA CB . 53466 1
212 . 1 . 1 50 50 ALA N N 15 124.147 0.052 . 1 . . . . . 50 ALA N . 53466 1
213 . 1 . 1 51 51 GLY H H 1 8.534 0.001 . 1 . . . . . 51 GLY H . 53466 1
214 . 1 . 1 51 51 GLY C C 13 174.084 0.075 . 1 . . . . . 51 GLY C . 53466 1
215 . 1 . 1 51 51 GLY CA C 13 45.247 0.014 . 1 . . . . . 51 GLY CA . 53466 1
216 . 1 . 1 51 51 GLY N N 15 108.044 0.019 . 1 . . . . . 51 GLY N . 53466 1
217 . 1 . 1 52 52 HIS H H 1 8.160 0.002 . 1 . . . . . 52 HIS H . 53466 1
218 . 1 . 1 52 52 HIS C C 13 175.236 0.014 . 1 . . . . . 52 HIS C . 53466 1
219 . 1 . 1 52 52 HIS CA C 13 56.049 0.072 . 1 . . . . . 52 HIS CA . 53466 1
220 . 1 . 1 52 52 HIS CB C 13 30.941 0.010 . 1 . . . . . 52 HIS CB . 53466 1
221 . 1 . 1 52 52 HIS N N 15 119.568 0.037 . 1 . . . . . 52 HIS N . 53466 1
222 . 1 . 1 53 53 LYS H H 1 8.381 0.002 . 1 . . . . . 53 LYS H . 53466 1
223 . 1 . 1 53 53 LYS C C 13 176.245 0.007 . 1 . . . . . 53 LYS C . 53466 1
224 . 1 . 1 53 53 LYS CA C 13 55.883 0.009 . 1 . . . . . 53 LYS CA . 53466 1
225 . 1 . 1 53 53 LYS CB C 13 33.079 0.014 . 1 . . . . . 53 LYS CB . 53466 1
226 . 1 . 1 53 53 LYS N N 15 123.293 0.008 . 1 . . . . . 53 LYS N . 53466 1
227 . 1 . 1 54 54 MET H H 1 8.659 0.001 . 1 . . . . . 54 MET H . 53466 1
228 . 1 . 1 54 54 MET C C 13 174.396 0.000 . 1 . . . . . 54 MET C . 53466 1
229 . 1 . 1 54 54 MET CA C 13 53.144 0.000 . 1 . . . . . 54 MET CA . 53466 1
230 . 1 . 1 54 54 MET CB C 13 32.011 0.000 . 1 . . . . . 54 MET CB . 53466 1
231 . 1 . 1 54 54 MET N N 15 124.220 0.012 . 1 . . . . . 54 MET N . 53466 1
232 . 1 . 1 55 55 PRO C C 13 177.099 0.001 . 1 . . . . . 55 PRO C . 53466 1
233 . 1 . 1 55 55 PRO CA C 13 63.213 0.006 . 1 . . . . . 55 PRO CA . 53466 1
234 . 1 . 1 55 55 PRO CB C 13 32.292 0.016 . 1 . . . . . 55 PRO CB . 53466 1
235 . 1 . 1 56 56 GLY H H 1 8.492 0.001 . 1 . . . . . 56 GLY H . 53466 1
236 . 1 . 1 56 56 GLY C C 13 172.017 0.004 . 1 . . . . . 56 GLY C . 53466 1
237 . 1 . 1 56 56 GLY CA C 13 44.468 0.000 . 1 . . . . . 56 GLY CA . 53466 1
238 . 1 . 1 56 56 GLY N N 15 109.910 0.015 . 1 . . . . . 56 GLY N . 53466 1
239 . 1 . 1 57 57 PRO C C 13 177.355 0.005 . 1 . . . . . 57 PRO C . 53466 1
240 . 1 . 1 57 57 PRO CA C 13 63.236 0.008 . 1 . . . . . 57 PRO CA . 53466 1
241 . 1 . 1 57 57 PRO CB C 13 32.097 0.003 . 1 . . . . . 57 PRO CB . 53466 1
242 . 1 . 1 58 58 GLU H H 1 8.829 0.001 . 1 . . . . . 58 GLU H . 53466 1
243 . 1 . 1 58 58 GLU C C 13 176.643 0.010 . 1 . . . . . 58 GLU C . 53466 1
244 . 1 . 1 58 58 GLU CA C 13 56.867 0.036 . 1 . . . . . 58 GLU CA . 53466 1
245 . 1 . 1 58 58 GLU CB C 13 29.713 0.090 . 1 . . . . . 58 GLU CB . 53466 1
246 . 1 . 1 58 58 GLU N N 15 121.264 0.011 . 1 . . . . . 58 GLU N . 53466 1
247 . 1 . 1 59 59 GLN H H 1 8.430 0.001 . 1 . . . . . 59 GLN H . 53466 1
248 . 1 . 1 59 59 GLN C C 13 175.458 0.004 . 1 . . . . . 59 GLN C . 53466 1
249 . 1 . 1 59 59 GLN CA C 13 55.513 0.023 . 1 . . . . . 59 GLN CA . 53466 1
250 . 1 . 1 59 59 GLN N N 15 121.800 0.014 . 1 . . . . . 59 GLN N . 53466 1
251 . 1 . 1 60 60 ALA H H 1 8.435 0.001 . 1 . . . . . 60 ALA H . 53466 1
252 . 1 . 1 60 60 ALA C C 13 177.138 0.002 . 1 . . . . . 60 ALA C . 53466 1
253 . 1 . 1 60 60 ALA CA C 13 52.190 0.033 . 1 . . . . . 60 ALA CA . 53466 1
254 . 1 . 1 60 60 ALA CB C 13 19.289 0.017 . 1 . . . . . 60 ALA CB . 53466 1
255 . 1 . 1 60 60 ALA N N 15 126.090 0.027 . 1 . . . . . 60 ALA N . 53466 1
256 . 1 . 1 61 61 ALA H H 1 8.480 0.001 . 1 . . . . . 61 ALA H . 53466 1
257 . 1 . 1 61 61 ALA C C 13 175.569 0.000 . 1 . . . . . 61 ALA C . 53466 1
258 . 1 . 1 61 61 ALA CA C 13 50.429 0.000 . 1 . . . . . 61 ALA CA . 53466 1
259 . 1 . 1 61 61 ALA CB C 13 17.864 0.000 . 1 . . . . . 61 ALA CB . 53466 1
260 . 1 . 1 61 61 ALA N N 15 125.368 0.027 . 1 . . . . . 61 ALA N . 53466 1
261 . 1 . 1 62 62 PRO C C 13 176.944 0.017 . 1 . . . . . 62 PRO C . 53466 1
262 . 1 . 1 62 62 PRO CA C 13 63.052 0.013 . 1 . . . . . 62 PRO CA . 53466 1
263 . 1 . 1 62 62 PRO CB C 13 32.212 0.012 . 1 . . . . . 62 PRO CB . 53466 1
264 . 1 . 1 63 63 GLN H H 1 8.632 0.004 . 1 . . . . . 63 GLN H . 53466 1
265 . 1 . 1 63 63 GLN C C 13 175.670 0.014 . 1 . . . . . 63 GLN C . 53466 1
266 . 1 . 1 63 63 GLN CA C 13 55.444 0.020 . 1 . . . . . 63 GLN CA . 53466 1
267 . 1 . 1 63 63 GLN CB C 13 29.698 0.016 . 1 . . . . . 63 GLN CB . 53466 1
268 . 1 . 1 63 63 GLN N N 15 121.196 0.003 . 1 . . . . . 63 GLN N . 53466 1
269 . 1 . 1 64 64 ALA H H 1 8.528 0.002 . 1 . . . . . 64 ALA H . 53466 1
270 . 1 . 1 64 64 ALA C C 13 177.202 0.004 . 1 . . . . . 64 ALA C . 53466 1
271 . 1 . 1 64 64 ALA CA C 13 52.287 0.025 . 1 . . . . . 64 ALA CA . 53466 1
272 . 1 . 1 64 64 ALA CB C 13 19.277 0.049 . 1 . . . . . 64 ALA CB . 53466 1
273 . 1 . 1 64 64 ALA N N 15 126.172 0.018 . 1 . . . . . 64 ALA N . 53466 1
274 . 1 . 1 65 65 ASP H H 1 8.567 0.001 . 1 . . . . . 65 ASP H . 53466 1
275 . 1 . 1 65 65 ASP C C 13 175.444 0.000 . 1 . . . . . 65 ASP C . 53466 1
276 . 1 . 1 65 65 ASP CA C 13 51.858 0.000 . 1 . . . . . 65 ASP CA . 53466 1
277 . 1 . 1 65 65 ASP CB C 13 41.383 0.000 . 1 . . . . . 65 ASP CB . 53466 1
278 . 1 . 1 65 65 ASP N N 15 121.677 0.011 . 1 . . . . . 65 ASP N . 53466 1
279 . 1 . 1 66 66 PRO C C 13 177.098 0.012 . 1 . . . . . 66 PRO C . 53466 1
280 . 1 . 1 66 66 PRO CA C 13 63.946 0.048 . 1 . . . . . 66 PRO CA . 53466 1
281 . 1 . 1 66 66 PRO CB C 13 32.254 0.025 . 1 . . . . . 66 PRO CB . 53466 1
282 . 1 . 1 67 67 HIS H H 1 8.439 0.003 . 1 . . . . . 67 HIS H . 53466 1
283 . 1 . 1 67 67 HIS C C 13 175.467 0.032 . 1 . . . . . 67 HIS C . 53466 1
284 . 1 . 1 67 67 HIS CA C 13 55.543 0.096 . 1 . . . . . 67 HIS CA . 53466 1
285 . 1 . 1 67 67 HIS CB C 13 29.860 0.031 . 1 . . . . . 67 HIS CB . 53466 1
286 . 1 . 1 67 67 HIS N N 15 118.328 0.041 . 1 . . . . . 67 HIS N . 53466 1
287 . 1 . 1 68 68 ALA H H 1 7.868 0.001 . 1 . . . . . 68 ALA H . 53466 1
288 . 1 . 1 68 68 ALA C C 13 178.276 0.020 . 1 . . . . . 68 ALA C . 53466 1
289 . 1 . 1 68 68 ALA CA C 13 52.912 0.000 . 1 . . . . . 68 ALA CA . 53466 1
290 . 1 . 1 68 68 ALA CB C 13 19.287 0.036 . 1 . . . . . 68 ALA CB . 53466 1
291 . 1 . 1 68 68 ALA N N 15 124.070 0.008 . 1 . . . . . 68 ALA N . 53466 1
292 . 1 . 1 69 69 GLY C C 13 174.114 0.068 . 1 . . . . . 69 GLY C . 53466 1
293 . 1 . 1 69 69 GLY CA C 13 45.500 0.097 . 1 . . . . . 69 GLY CA . 53466 1
294 . 1 . 1 69 69 GLY N N 15 107.970 0.021 . 1 . . . . . 69 GLY N . 53466 1
295 . 1 . 1 70 70 HIS H H 1 8.161 0.003 . 1 . . . . . 70 HIS H . 53466 1
296 . 1 . 1 70 70 HIS C C 13 175.415 0.015 . 1 . . . . . 70 HIS C . 53466 1
297 . 1 . 1 70 70 HIS CA C 13 56.420 0.043 . 1 . . . . . 70 HIS CA . 53466 1
298 . 1 . 1 70 70 HIS CB C 13 30.747 0.083 . 1 . . . . . 70 HIS CB . 53466 1
299 . 1 . 1 70 70 HIS N N 15 119.545 0.042 . 1 . . . . . 70 HIS N . 53466 1
300 . 1 . 1 71 71 HIS H H 1 8.331 0.005 . 1 . . . . . 71 HIS H . 53466 1
301 . 1 . 1 71 71 HIS C C 13 175.401 0.012 . 1 . . . . . 71 HIS C . 53466 1
302 . 1 . 1 71 71 HIS CA C 13 56.377 0.000 . 1 . . . . . 71 HIS CA . 53466 1
303 . 1 . 1 71 71 HIS CB C 13 30.642 0.039 . 1 . . . . . 71 HIS CB . 53466 1
304 . 1 . 1 71 71 HIS N N 15 120.832 0.052 . 1 . . . . . 71 HIS N . 53466 1
305 . 1 . 1 72 72 MET H H 1 8.400 0.002 . 1 . . . . . 72 MET H . 53466 1
306 . 1 . 1 72 72 MET C C 13 175.798 0.009 . 1 . . . . . 72 MET C . 53466 1
307 . 1 . 1 72 72 MET CA C 13 55.368 0.047 . 1 . . . . . 72 MET CA . 53466 1
308 . 1 . 1 72 72 MET CB C 13 32.587 0.029 . 1 . . . . . 72 MET CB . 53466 1
309 . 1 . 1 72 72 MET N N 15 121.487 0.029 . 1 . . . . . 72 MET N . 53466 1
310 . 1 . 1 73 73 HIS H H 1 8.407 0.002 . 1 . . . . . 73 HIS H . 53466 1
311 . 1 . 1 73 73 HIS C C 13 175.019 0.013 . 1 . . . . . 73 HIS C . 53466 1
312 . 1 . 1 73 73 HIS CA C 13 56.262 0.000 . 1 . . . . . 73 HIS CA . 53466 1
313 . 1 . 1 73 73 HIS CB C 13 30.858 0.062 . 1 . . . . . 73 HIS CB . 53466 1
314 . 1 . 1 73 73 HIS N N 15 120.976 0.068 . 1 . . . . . 73 HIS N . 53466 1
315 . 1 . 1 74 74 HIS H H 1 8.254 0.003 . 1 . . . . . 74 HIS H . 53466 1
316 . 1 . 1 74 74 HIS C C 13 174.412 0.019 . 1 . . . . . 74 HIS C . 53466 1
317 . 1 . 1 74 74 HIS CA C 13 55.864 0.015 . 1 . . . . . 74 HIS CA . 53466 1
318 . 1 . 1 74 74 HIS CB C 13 30.876 0.028 . 1 . . . . . 74 HIS CB . 53466 1
319 . 1 . 1 74 74 HIS N N 15 121.424 0.008 . 1 . . . . . 74 HIS N . 53466 1
320 . 1 . 1 75 75 ALA H H 1 8.433 0.002 . 1 . . . . . 75 ALA H . 53466 1
321 . 1 . 1 75 75 ALA C C 13 174.734 0.000 . 1 . . . . . 75 ALA C . 53466 1
322 . 1 . 1 75 75 ALA CA C 13 50.435 0.000 . 1 . . . . . 75 ALA CA . 53466 1
323 . 1 . 1 75 75 ALA CB C 13 18.143 0.000 . 1 . . . . . 75 ALA CB . 53466 1
324 . 1 . 1 75 75 ALA N N 15 127.200 0.008 . 1 . . . . . 75 ALA N . 53466 1
325 . 1 . 1 78 78 PRO C C 13 176.737 0.008 . 1 . . . . . 78 PRO C . 53466 1
326 . 1 . 1 78 78 PRO CA C 13 62.624 0.000 . 1 . . . . . 78 PRO CA . 53466 1
327 . 1 . 1 78 78 PRO CB C 13 32.028 0.010 . 1 . . . . . 78 PRO CB . 53466 1
328 . 1 . 1 79 79 ILE H H 1 8.379 0.003 . 1 . . . . . 79 ILE H . 53466 1
329 . 1 . 1 79 79 ILE C C 13 174.996 0.000 . 1 . . . . . 79 ILE C . 53466 1
330 . 1 . 1 79 79 ILE CA C 13 58.774 0.000 . 1 . . . . . 79 ILE CA . 53466 1
331 . 1 . 1 79 79 ILE CB C 13 38.478 0.000 . 1 . . . . . 79 ILE CB . 53466 1
332 . 1 . 1 79 79 ILE N N 15 122.847 0.037 . 1 . . . . . 79 ILE N . 53466 1
333 . 1 . 1 80 80 PRO C C 13 177.088 0.007 . 1 . . . . . 80 PRO C . 53466 1
334 . 1 . 1 80 80 PRO CA C 13 63.298 0.000 . 1 . . . . . 80 PRO CA . 53466 1
335 . 1 . 1 80 80 PRO CB C 13 32.272 0.000 . 1 . . . . . 80 PRO CB . 53466 1
336 . 1 . 1 81 81 THR H H 1 8.364 0.003 . 1 . . . . . 81 THR H . 53466 1
337 . 1 . 1 81 81 THR C C 13 174.316 0.006 . 1 . . . . . 81 THR C . 53466 1
338 . 1 . 1 81 81 THR CA C 13 62.093 0.010 . 1 . . . . . 81 THR CA . 53466 1
339 . 1 . 1 81 81 THR CB C 13 69.778 0.019 . 1 . . . . . 81 THR CB . 53466 1
340 . 1 . 1 81 81 THR N N 15 114.579 0.025 . 1 . . . . . 81 THR N . 53466 1
341 . 1 . 1 82 82 ASP H H 1 8.415 0.002 . 1 . . . . . 82 ASP H . 53466 1
342 . 1 . 1 82 82 ASP C C 13 176.210 0.007 . 1 . . . . . 82 ASP C . 53466 1
343 . 1 . 1 82 82 ASP CA C 13 53.928 0.004 . 1 . . . . . 82 ASP CA . 53466 1
344 . 1 . 1 82 82 ASP CB C 13 40.974 0.012 . 1 . . . . . 82 ASP CB . 53466 1
345 . 1 . 1 82 82 ASP N N 15 122.694 0.024 . 1 . . . . . 82 ASP N . 53466 1
346 . 1 . 1 83 83 HIS H H 1 8.381 0.003 . 1 . . . . . 83 HIS H . 53466 1
347 . 1 . 1 83 83 HIS C C 13 175.602 0.016 . 1 . . . . . 83 HIS C . 53466 1
348 . 1 . 1 83 83 HIS CA C 13 56.725 0.003 . 1 . . . . . 83 HIS CA . 53466 1
349 . 1 . 1 83 83 HIS CB C 13 30.240 0.036 . 1 . . . . . 83 HIS CB . 53466 1
350 . 1 . 1 83 83 HIS N N 15 120.870 0.030 . 1 . . . . . 83 HIS N . 53466 1
351 . 1 . 1 84 84 ALA H H 1 8.323 0.001 . 1 . . . . . 84 ALA H . 53466 1
352 . 1 . 1 84 84 ALA C C 13 177.988 0.009 . 1 . . . . . 84 ALA C . 53466 1
353 . 1 . 1 84 84 ALA CA C 13 53.029 0.015 . 1 . . . . . 84 ALA CA . 53466 1
354 . 1 . 1 84 84 ALA CB C 13 18.899 0.046 . 1 . . . . . 84 ALA CB . 53466 1
355 . 1 . 1 84 84 ALA N N 15 124.604 0.025 . 1 . . . . . 84 ALA N . 53466 1
356 . 1 . 1 85 85 ALA H H 1 8.240 0.001 . 1 . . . . . 85 ALA H . 53466 1
357 . 1 . 1 85 85 ALA C C 13 178.287 0.010 . 1 . . . . . 85 ALA C . 53466 1
358 . 1 . 1 85 85 ALA CA C 13 52.982 0.018 . 1 . . . . . 85 ALA CA . 53466 1
359 . 1 . 1 85 85 ALA CB C 13 19.022 0.020 . 1 . . . . . 85 ALA CB . 53466 1
360 . 1 . 1 85 85 ALA N N 15 122.613 0.011 . 1 . . . . . 85 ALA N . 53466 1
361 . 1 . 1 86 86 GLU H H 1 8.318 0.001 . 1 . . . . . 86 GLU H . 53466 1
362 . 1 . 1 86 86 GLU C C 13 176.752 0.006 . 1 . . . . . 86 GLU C . 53466 1
363 . 1 . 1 86 86 GLU CA C 13 56.936 0.022 . 1 . . . . . 86 GLU CA . 53466 1
364 . 1 . 1 86 86 GLU CB C 13 29.918 0.009 . 1 . . . . . 86 GLU CB . 53466 1
365 . 1 . 1 86 86 GLU N N 15 119.364 0.020 . 1 . . . . . 86 GLU N . 53466 1
366 . 1 . 1 87 87 ARG H H 1 8.156 0.001 . 1 . . . . . 87 ARG H . 53466 1
367 . 1 . 1 87 87 ARG C C 13 175.787 0.012 . 1 . . . . . 87 ARG C . 53466 1
368 . 1 . 1 87 87 ARG CA C 13 56.304 0.119 . 1 . . . . . 87 ARG CA . 53466 1
369 . 1 . 1 87 87 ARG CB C 13 30.663 0.004 . 1 . . . . . 87 ARG CB . 53466 1
370 . 1 . 1 87 87 ARG N N 15 121.061 0.024 . 1 . . . . . 87 ARG N . 53466 1
371 . 1 . 1 88 88 PHE H H 1 8.154 0.001 . 1 . . . . . 88 PHE H . 53466 1
372 . 1 . 1 88 88 PHE C C 13 175.219 0.029 . 1 . . . . . 88 PHE C . 53466 1
373 . 1 . 1 88 88 PHE CA C 13 57.658 0.000 . 1 . . . . . 88 PHE CA . 53466 1
374 . 1 . 1 88 88 PHE CB C 13 39.742 0.000 . 1 . . . . . 88 PHE CB . 53466 1
375 . 1 . 1 88 88 PHE N N 15 120.340 0.010 . 1 . . . . . 88 PHE N . 53466 1
376 . 1 . 1 89 89 TYR H H 1 8.131 0.001 . 1 . . . . . 89 TYR H . 53466 1
377 . 1 . 1 89 89 TYR C C 13 175.014 0.013 . 1 . . . . . 89 TYR C . 53466 1
378 . 1 . 1 89 89 TYR CA C 13 57.239 0.190 . 1 . . . . . 89 TYR CA . 53466 1
379 . 1 . 1 89 89 TYR CB C 13 39.350 0.037 . 1 . . . . . 89 TYR CB . 53466 1
380 . 1 . 1 89 89 TYR N N 15 121.727 0.013 . 1 . . . . . 89 TYR N . 53466 1
381 . 1 . 1 90 90 SER H H 1 8.281 0.002 . 1 . . . . . 90 SER H . 53466 1
382 . 1 . 1 90 90 SER C C 13 172.874 0.000 . 1 . . . . . 90 SER C . 53466 1
383 . 1 . 1 90 90 SER CA C 13 56.213 0.000 . 1 . . . . . 90 SER CA . 53466 1
384 . 1 . 1 90 90 SER CB C 13 63.173 0.000 . 1 . . . . . 90 SER CB . 53466 1
385 . 1 . 1 90 90 SER N N 15 119.186 0.035 . 1 . . . . . 90 SER N . 53466 1
386 . 1 . 1 91 91 PRO C C 13 178.210 0.055 . 1 . . . . . 91 PRO C . 53466 1
387 . 1 . 1 91 91 PRO CA C 13 64.662 0.000 . 1 . . . . . 91 PRO CA . 53466 1
388 . 1 . 1 91 91 PRO CB C 13 32.207 0.000 . 1 . . . . . 91 PRO CB . 53466 1
389 . 1 . 1 92 92 ALA H H 1 8.372 0.001 . 1 . . . . . 92 ALA H . 53466 1
390 . 1 . 1 92 92 ALA C C 13 179.812 0.014 . 1 . . . . . 92 ALA C . 53466 1
391 . 1 . 1 92 92 ALA CA C 13 54.128 0.036 . 1 . . . . . 92 ALA CA . 53466 1
392 . 1 . 1 92 92 ALA CB C 13 18.719 0.058 . 1 . . . . . 92 ALA CB . 53466 1
393 . 1 . 1 92 92 ALA N N 15 121.676 0.030 . 1 . . . . . 92 ALA N . 53466 1
394 . 1 . 1 93 93 VAL H H 1 7.875 0.003 . 1 . . . . . 93 VAL H . 53466 1
395 . 1 . 1 93 93 VAL C C 13 178.187 0.000 . 1 . . . . . 93 VAL C . 53466 1
396 . 1 . 1 93 93 VAL CA C 13 64.552 0.000 . 1 . . . . . 93 VAL CA . 53466 1
397 . 1 . 1 93 93 VAL CB C 13 32.296 0.000 . 1 . . . . . 93 VAL CB . 53466 1
398 . 1 . 1 93 93 VAL N N 15 121.121 0.035 . 1 . . . . . 93 VAL N . 53466 1
399 . 1 . 1 94 94 MET C C 13 177.913 0.027 . 1 . . . . . 94 MET C . 53466 1
400 . 1 . 1 94 94 MET CA C 13 56.993 0.000 . 1 . . . . . 94 MET CA . 53466 1
401 . 1 . 1 94 94 MET CB C 13 32.039 0.000 . 1 . . . . . 94 MET CB . 53466 1
402 . 1 . 1 95 95 ALA H H 1 8.409 0.001 . 1 . . . . . 95 ALA H . 53466 1
403 . 1 . 1 95 95 ALA C C 13 179.615 0.002 . 1 . . . . . 95 ALA C . 53466 1
404 . 1 . 1 95 95 ALA CA C 13 54.272 0.060 . 1 . . . . . 95 ALA CA . 53466 1
405 . 1 . 1 95 95 ALA CB C 13 18.321 0.051 . 1 . . . . . 95 ALA CB . 53466 1
406 . 1 . 1 95 95 ALA N N 15 123.536 0.060 . 1 . . . . . 95 ALA N . 53466 1
407 . 1 . 1 96 96 ALA H H 1 8.092 0.001 . 1 . . . . . 96 ALA H . 53466 1
408 . 1 . 1 96 96 ALA C C 13 179.328 0.017 . 1 . . . . . 96 ALA C . 53466 1
409 . 1 . 1 96 96 ALA CA C 13 53.989 0.013 . 1 . . . . . 96 ALA CA . 53466 1
410 . 1 . 1 96 96 ALA CB C 13 18.289 0.035 . 1 . . . . . 96 ALA CB . 53466 1
411 . 1 . 1 96 96 ALA N N 15 122.584 0.023 . 1 . . . . . 96 ALA N . 53466 1
412 . 1 . 1 97 97 ALA H H 1 8.127 0.002 . 1 . . . . . 97 ALA H . 53466 1
413 . 1 . 1 97 97 ALA C C 13 179.643 0.011 . 1 . . . . . 97 ALA C . 53466 1
414 . 1 . 1 97 97 ALA CA C 13 53.967 0.016 . 1 . . . . . 97 ALA CA . 53466 1
415 . 1 . 1 97 97 ALA CB C 13 18.375 0.054 . 1 . . . . . 97 ALA CB . 53466 1
416 . 1 . 1 97 97 ALA N N 15 122.548 0.031 . 1 . . . . . 97 ALA N . 53466 1
417 . 1 . 1 98 98 ARG H H 1 8.154 0.002 . 1 . . . . . 98 ARG H . 53466 1
418 . 1 . 1 98 98 ARG C C 13 177.663 0.012 . 1 . . . . . 98 ARG C . 53466 1
419 . 1 . 1 98 98 ARG CA C 13 58.025 0.097 . 1 . . . . . 98 ARG CA . 53466 1
420 . 1 . 1 98 98 ARG CB C 13 30.449 0.031 . 1 . . . . . 98 ARG CB . 53466 1
421 . 1 . 1 98 98 ARG N N 15 119.594 0.075 . 1 . . . . . 98 ARG N . 53466 1
422 . 1 . 1 99 99 ALA H H 1 8.134 0.002 . 1 . . . . . 99 ALA H . 53466 1
423 . 1 . 1 99 99 ALA C C 13 179.289 0.011 . 1 . . . . . 99 ALA C . 53466 1
424 . 1 . 1 99 99 ALA CA C 13 53.980 0.047 . 1 . . . . . 99 ALA CA . 53466 1
425 . 1 . 1 99 99 ALA CB C 13 18.295 0.046 . 1 . . . . . 99 ALA CB . 53466 1
426 . 1 . 1 99 99 ALA N N 15 122.792 0.030 . 1 . . . . . 99 ALA N . 53466 1
427 . 1 . 1 100 100 GLN H H 1 8.078 0.003 . 1 . . . . . 100 GLN H . 53466 1
428 . 1 . 1 100 100 GLN C C 13 177.049 0.017 . 1 . . . . . 100 GLN C . 53466 1
429 . 1 . 1 100 100 GLN CA C 13 57.084 0.006 . 1 . . . . . 100 GLN CA . 53466 1
430 . 1 . 1 100 100 GLN CB C 13 28.630 0.001 . 1 . . . . . 100 GLN CB . 53466 1
431 . 1 . 1 100 100 GLN N N 15 118.653 0.096 . 1 . . . . . 100 GLN N . 53466 1
432 . 1 . 1 101 101 LEU H H 1 8.011 0.002 . 1 . . . . . 101 LEU H . 53466 1
433 . 1 . 1 101 101 LEU C C 13 178.381 0.021 . 1 . . . . . 101 LEU C . 53466 1
434 . 1 . 1 101 101 LEU CA C 13 56.367 0.040 . 1 . . . . . 101 LEU CA . 53466 1
435 . 1 . 1 101 101 LEU CB C 13 42.157 0.005 . 1 . . . . . 101 LEU CB . 53466 1
436 . 1 . 1 101 101 LEU N N 15 121.618 0.021 . 1 . . . . . 101 LEU N . 53466 1
437 . 1 . 1 102 102 MET H H 1 8.178 0.002 . 1 . . . . . 102 MET H . 53466 1
438 . 1 . 1 102 102 MET C C 13 177.232 0.008 . 1 . . . . . 102 MET C . 53466 1
439 . 1 . 1 102 102 MET CA C 13 56.169 0.000 . 1 . . . . . 102 MET CA . 53466 1
440 . 1 . 1 102 102 MET CB C 13 32.461 0.072 . 1 . . . . . 102 MET CB . 53466 1
441 . 1 . 1 102 102 MET N N 15 119.045 0.028 . 1 . . . . . 102 MET N . 53466 1
442 . 1 . 1 103 103 LYS H H 1 8.102 0.001 . 1 . . . . . 103 LYS H . 53466 1
443 . 1 . 1 103 103 LYS C C 13 177.336 0.062 . 1 . . . . . 103 LYS C . 53466 1
444 . 1 . 1 103 103 LYS CA C 13 57.230 0.077 . 1 . . . . . 103 LYS CA . 53466 1
445 . 1 . 1 103 103 LYS CB C 13 32.762 0.026 . 1 . . . . . 103 LYS CB . 53466 1
446 . 1 . 1 103 103 LYS N N 15 121.684 0.020 . 1 . . . . . 103 LYS N . 53466 1
447 . 1 . 1 104 104 GLU H H 1 8.389 0.002 . 1 . . . . . 104 GLU H . 53466 1
448 . 1 . 1 104 104 GLU C C 13 176.873 0.009 . 1 . . . . . 104 GLU C . 53466 1
449 . 1 . 1 104 104 GLU CA C 13 57.089 0.000 . 1 . . . . . 104 GLU CA . 53466 1
450 . 1 . 1 104 104 GLU CB C 13 30.048 0.042 . 1 . . . . . 104 GLU CB . 53466 1
451 . 1 . 1 104 104 GLU N N 15 120.877 0.028 . 1 . . . . . 104 GLU N . 53466 1
452 . 1 . 1 105 105 HIS H H 1 8.372 0.002 . 1 . . . . . 105 HIS H . 53466 1
453 . 1 . 1 105 105 HIS C C 13 176.288 0.018 . 1 . . . . . 105 HIS C . 53466 1
454 . 1 . 1 105 105 HIS CA C 13 56.597 0.058 . 1 . . . . . 105 HIS CA . 53466 1
455 . 1 . 1 105 105 HIS CB C 13 30.634 0.021 . 1 . . . . . 105 HIS CB . 53466 1
456 . 1 . 1 105 105 HIS N N 15 119.633 0.032 . 1 . . . . . 105 HIS N . 53466 1
457 . 1 . 1 106 106 GLY H H 1 8.414 0.002 . 1 . . . . . 106 GLY H . 53466 1
458 . 1 . 1 106 106 GLY C C 13 174.862 0.049 . 1 . . . . . 106 GLY C . 53466 1
459 . 1 . 1 106 106 GLY CA C 13 45.461 0.076 . 1 . . . . . 106 GLY CA . 53466 1
460 . 1 . 1 106 106 GLY N N 15 110.045 0.027 . 1 . . . . . 106 GLY N . 53466 1
461 . 1 . 1 107 107 GLY H H 1 8.473 0.005 . 1 . . . . . 107 GLY H . 53466 1
462 . 1 . 1 107 107 GLY C C 13 174.786 0.008 . 1 . . . . . 107 GLY C . 53466 1
463 . 1 . 1 107 107 GLY CA C 13 45.268 0.044 . 1 . . . . . 107 GLY CA . 53466 1
464 . 1 . 1 107 107 GLY N N 15 108.958 0.016 . 1 . . . . . 107 GLY N . 53466 1
465 . 1 . 1 108 108 GLY H H 1 8.472 0.003 . 1 . . . . . 108 GLY H . 53466 1
466 . 1 . 1 108 108 GLY C C 13 174.251 0.005 . 1 . . . . . 108 GLY C . 53466 1
467 . 1 . 1 108 108 GLY CA C 13 45.166 0.012 . 1 . . . . . 108 GLY CA . 53466 1
468 . 1 . 1 108 108 GLY N N 15 108.978 0.025 . 1 . . . . . 108 GLY N . 53466 1
469 . 1 . 1 109 109 THR H H 1 8.215 0.001 . 1 . . . . . 109 THR H . 53466 1
470 . 1 . 1 109 109 THR C C 13 173.659 0.009 . 1 . . . . . 109 THR C . 53466 1
471 . 1 . 1 109 109 THR CA C 13 61.616 0.018 . 1 . . . . . 109 THR CA . 53466 1
472 . 1 . 1 109 109 THR CB C 13 70.091 0.007 . 1 . . . . . 109 THR CB . 53466 1
473 . 1 . 1 109 109 THR N N 15 113.805 0.014 . 1 . . . . . 109 THR N . 53466 1
474 . 1 . 1 110 110 ALA H H 1 8.179 0.001 . 1 . . . . . 110 ALA H . 53466 1
475 . 1 . 1 110 110 ALA C C 13 182.692 0.000 . 1 . . . . . 110 ALA C . 53466 1
476 . 1 . 1 110 110 ALA CA C 13 54.008 0.000 . 1 . . . . . 110 ALA CA . 53466 1
477 . 1 . 1 110 110 ALA CB C 13 19.975 0.000 . 1 . . . . . 110 ALA CB . 53466 1
478 . 1 . 1 110 110 ALA N N 15 132.213 0.009 . 1 . . . . . 110 ALA N . 53466 1
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