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 50897
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name backbone
_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' . . . 50897 1
2 '2D 1H-13C HSQC' . . . 50897 1
3 '3D HNCO' . . . 50897 1
4 '3D HNCACB' . . . 50897 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 . . 50897 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 HA H 1 4.310 0.02 . 1 . . . . . 402 ILE HA . 50897 1
2 . 1 . 1 2 2 ILE C C 13 176.624 0.05 . 1 . . . . . 402 ILE C . 50897 1
3 . 1 . 1 2 2 ILE CA C 13 61.590 0.08 . 1 . . . . . 402 ILE CA . 50897 1
4 . 1 . 1 2 2 ILE CB C 13 38.797 0.08 . 1 . . . . . 402 ILE CB . 50897 1
5 . 1 . 1 3 3 THR H H 1 8.381 0.01 . 1 . . . . . 403 THR H . 50897 1
6 . 1 . 1 3 3 THR HA H 1 4.402 0.02 . 1 . . . . . 403 THR HA . 50897 1
7 . 1 . 1 3 3 THR C C 13 174.665 0.05 . 1 . . . . . 403 THR C . 50897 1
8 . 1 . 1 3 3 THR CA C 13 61.813 0.08 . 1 . . . . . 403 THR CA . 50897 1
9 . 1 . 1 3 3 THR CB C 13 69.753 0.08 . 1 . . . . . 403 THR CB . 50897 1
10 . 1 . 1 3 3 THR N N 15 118.149 0.03 . 1 . . . . . 403 THR N . 50897 1
11 . 1 . 1 4 4 SER H H 1 8.430 0.01 . 1 . . . . . 404 SER H . 50897 1
12 . 1 . 1 4 4 SER HA H 1 4.468 0.02 . 1 . . . . . 404 SER HA . 50897 1
13 . 1 . 1 4 4 SER C C 13 175.092 0.05 . 1 . . . . . 404 SER C . 50897 1
14 . 1 . 1 4 4 SER CA C 13 58.627 0.08 . 1 . . . . . 404 SER CA . 50897 1
15 . 1 . 1 4 4 SER CB C 13 63.938 0.08 . 1 . . . . . 404 SER CB . 50897 1
16 . 1 . 1 4 4 SER N N 15 118.822 0.03 . 1 . . . . . 404 SER N . 50897 1
17 . 1 . 1 5 5 GLY H H 1 8.552 0.01 . 1 . . . . . 405 GLY H . 50897 1
18 . 1 . 1 5 5 GLY HA2 H 1 4.014 0.02 . 2 . . . . . 405 GLY HA2 . 50897 1
19 . 1 . 1 5 5 GLY HA3 H 1 4.000 0.02 . 2 . . . . . 405 GLY HA3 . 50897 1
20 . 1 . 1 5 5 GLY C C 13 174.188 0.05 . 1 . . . . . 405 GLY C . 50897 1
21 . 1 . 1 5 5 GLY CA C 13 45.404 0.08 . 1 . . . . . 405 GLY CA . 50897 1
22 . 1 . 1 5 5 GLY N N 15 111.376 0.03 . 1 . . . . . 405 GLY N . 50897 1
23 . 1 . 1 6 6 SER H H 1 8.274 0.01 . 1 . . . . . 406 SER H . 50897 1
24 . 1 . 1 6 6 SER HA H 1 4.512 0.02 . 1 . . . . . 406 SER HA . 50897 1
25 . 1 . 1 6 6 SER C C 13 174.536 0.05 . 1 . . . . . 406 SER C . 50897 1
26 . 1 . 1 6 6 SER CA C 13 58.346 0.08 . 1 . . . . . 406 SER CA . 50897 1
27 . 1 . 1 6 6 SER CB C 13 64.162 0.08 . 1 . . . . . 406 SER CB . 50897 1
28 . 1 . 1 6 6 SER N N 15 115.629 0.03 . 1 . . . . . 406 SER N . 50897 1
29 . 1 . 1 7 7 SER H H 1 8.469 0.01 . 1 . . . . . 407 SER H . 50897 1
30 . 1 . 1 7 7 SER HA H 1 4.480 0.02 . 1 . . . . . 407 SER HA . 50897 1
31 . 1 . 1 7 7 SER C C 13 174.070 0.05 . 1 . . . . . 407 SER C . 50897 1
32 . 1 . 1 7 7 SER CA C 13 58.403 0.08 . 1 . . . . . 407 SER CA . 50897 1
33 . 1 . 1 7 7 SER CB C 13 63.938 0.08 . 1 . . . . . 407 SER CB . 50897 1
34 . 1 . 1 7 7 SER N N 15 118.208 0.03 . 1 . . . . . 407 SER N . 50897 1
35 . 1 . 1 8 8 LEU H H 1 8.339 0.01 . 1 . . . . . 408 LEU H . 50897 1
36 . 1 . 1 8 8 LEU HA H 1 4.603 0.02 . 1 . . . . . 408 LEU HA . 50897 1
37 . 1 . 1 8 8 LEU C C 13 175.395 0.05 . 1 . . . . . 408 LEU C . 50897 1
38 . 1 . 1 8 8 LEU CA C 13 53.147 0.08 . 1 . . . . . 408 LEU CA . 50897 1
39 . 1 . 1 8 8 LEU CB C 13 41.602 0.08 . 1 . . . . . 408 LEU CB . 50897 1
40 . 1 . 1 8 8 LEU N N 15 125.073 0.03 . 1 . . . . . 408 LEU N . 50897 1
41 . 1 . 1 9 9 PRO HA H 1 4.401 0.02 . 1 . . . . . 409 PRO HA . 50897 1
42 . 1 . 1 9 9 PRO C C 13 176.703 0.05 . 1 . . . . . 409 PRO C . 50897 1
43 . 1 . 1 9 9 PRO CA C 13 63.136 0.08 . 1 . . . . . 409 PRO CA . 50897 1
44 . 1 . 1 9 9 PRO CB C 13 32.012 0.08 . 1 . . . . . 409 PRO CB . 50897 1
45 . 1 . 1 10 10 ASP H H 1 8.482 0.01 . 1 . . . . . 410 ASP H . 50897 1
46 . 1 . 1 10 10 ASP HA H 1 4.524 0.02 . 1 . . . . . 410 ASP HA . 50897 1
47 . 1 . 1 10 10 ASP C C 13 177.090 0.05 . 1 . . . . . 410 ASP C . 50897 1
48 . 1 . 1 10 10 ASP CA C 13 54.741 0.08 . 1 . . . . . 410 ASP CA . 50897 1
49 . 1 . 1 10 10 ASP CB C 13 41.131 0.08 . 1 . . . . . 410 ASP CB . 50897 1
50 . 1 . 1 10 10 ASP N N 15 120.520 0.03 . 1 . . . . . 410 ASP N . 50897 1
51 . 1 . 1 11 11 GLY H H 1 8.486 0.01 . 1 . . . . . 411 GLY H . 50897 1
52 . 1 . 1 11 11 GLY HA2 H 1 3.949 0.02 . 2 . . . . . 411 GLY HA2 . 50897 1
53 . 1 . 1 11 11 GLY HA3 H 1 3.933 0.02 . 2 . . . . . 411 GLY HA3 . 50897 1
54 . 1 . 1 11 11 GLY C C 13 174.654 0.05 . 1 . . . . . 411 GLY C . 50897 1
55 . 1 . 1 11 11 GLY CA C 13 45.543 0.08 . 1 . . . . . 411 GLY CA . 50897 1
56 . 1 . 1 11 11 GLY N N 15 109.841 0.03 . 1 . . . . . 411 GLY N . 50897 1
57 . 1 . 1 12 12 CYS H H 1 8.251 0.01 . 1 . . . . . 412 CYS H . 50897 1
58 . 1 . 1 12 12 CYS HA H 1 4.466 0.02 . 1 . . . . . 412 CYS HA . 50897 1
59 . 1 . 1 12 12 CYS C C 13 174.867 0.05 . 1 . . . . . 412 CYS C . 50897 1
60 . 1 . 1 12 12 CYS CA C 13 59.074 0.08 . 1 . . . . . 412 CYS CA . 50897 1
61 . 1 . 1 12 12 CYS CB C 13 28.131 0.08 . 1 . . . . . 412 CYS CB . 50897 1
62 . 1 . 1 12 12 CYS N N 15 118.681 0.03 . 1 . . . . . 412 CYS N . 50897 1
63 . 1 . 1 13 13 GLU H H 1 8.756 0.01 . 1 . . . . . 413 GLU H . 50897 1
64 . 1 . 1 13 13 GLU HA H 1 4.256 0.02 . 1 . . . . . 413 GLU HA . 50897 1
65 . 1 . 1 13 13 GLU C C 13 177.057 0.05 . 1 . . . . . 413 GLU C . 50897 1
66 . 1 . 1 13 13 GLU CA C 13 57.145 0.08 . 1 . . . . . 413 GLU CA . 50897 1
67 . 1 . 1 13 13 GLU CB C 13 29.860 0.08 . 1 . . . . . 413 GLU CB . 50897 1
68 . 1 . 1 13 13 GLU N N 15 123.106 0.03 . 1 . . . . . 413 GLU N . 50897 1
69 . 1 . 1 14 14 GLY H H 1 8.567 0.01 . 1 . . . . . 414 GLY H . 50897 1
70 . 1 . 1 14 14 GLY HA2 H 1 3.966 0.02 . 2 . . . . . 414 GLY HA2 . 50897 1
71 . 1 . 1 14 14 GLY HA3 H 1 3.967 0.02 . 2 . . . . . 414 GLY HA3 . 50897 1
72 . 1 . 1 14 14 GLY C C 13 174.328 0.05 . 1 . . . . . 414 GLY C . 50897 1
73 . 1 . 1 14 14 GLY CA C 13 45.543 0.08 . 1 . . . . . 414 GLY CA . 50897 1
74 . 1 . 1 14 14 GLY N N 15 110.078 0.03 . 1 . . . . . 414 GLY N . 50897 1
75 . 1 . 1 15 15 ARG H H 1 8.277 0.01 . 1 . . . . . 415 ARG H . 50897 1
76 . 1 . 1 15 15 ARG HA H 1 4.390 0.02 . 1 . . . . . 415 ARG HA . 50897 1
77 . 1 . 1 15 15 ARG C C 13 176.849 0.05 . 1 . . . . . 415 ARG C . 50897 1
78 . 1 . 1 15 15 ARG CA C 13 55.999 0.08 . 1 . . . . . 415 ARG CA . 50897 1
79 . 1 . 1 15 15 ARG CB C 13 30.951 0.08 . 1 . . . . . 415 ARG CB . 50897 1
80 . 1 . 1 15 15 ARG N N 15 120.280 0.03 . 1 . . . . . 415 ARG N . 50897 1
81 . 1 . 1 16 16 GLY H H 1 8.512 0.01 . 1 . . . . . 416 GLY H . 50897 1
82 . 1 . 1 16 16 GLY HA2 H 1 4.206 0.02 . 2 . . . . . 416 GLY HA2 . 50897 1
83 . 1 . 1 16 16 GLY HA3 H 1 3.890 0.02 . 2 . . . . . 416 GLY HA3 . 50897 1
84 . 1 . 1 16 16 GLY C C 13 173.778 0.05 . 1 . . . . . 416 GLY C . 50897 1
85 . 1 . 1 16 16 GLY CA C 13 45.068 0.08 . 1 . . . . . 416 GLY CA . 50897 1
86 . 1 . 1 16 16 GLY N N 15 109.844 0.03 . 1 . . . . . 416 GLY N . 50897 1
87 . 1 . 1 17 17 LEU H H 1 8.300 0.01 . 1 . . . . . 417 LEU H . 50897 1
88 . 1 . 1 17 17 LEU HA H 1 4.508 0.02 . 1 . . . . . 417 LEU HA . 50897 1
89 . 1 . 1 17 17 LEU C C 13 176.731 0.05 . 1 . . . . . 417 LEU C . 50897 1
90 . 1 . 1 17 17 LEU CA C 13 54.573 0.08 . 1 . . . . . 417 LEU CA . 50897 1
91 . 1 . 1 17 17 LEU CB C 13 44.088 0.08 . 1 . . . . . 417 LEU CB . 50897 1
92 . 1 . 1 17 17 LEU N N 15 120.601 0.03 . 1 . . . . . 417 LEU N . 50897 1
93 . 1 . 1 18 18 SER H H 1 9.234 0.01 . 1 . . . . . 418 SER H . 50897 1
94 . 1 . 1 18 18 SER HA H 1 5.328 0.02 . 1 . . . . . 418 SER HA . 50897 1
95 . 1 . 1 18 18 SER C C 13 175.866 0.05 . 1 . . . . . 418 SER C . 50897 1
96 . 1 . 1 18 18 SER CA C 13 57.536 0.08 . 1 . . . . . 418 SER CA . 50897 1
97 . 1 . 1 18 18 SER CB C 13 68.047 0.08 . 1 . . . . . 418 SER CB . 50897 1
98 . 1 . 1 18 18 SER N N 15 119.229 0.03 . 1 . . . . . 418 SER N . 50897 1
99 . 1 . 1 19 19 VAL H H 1 7.593 0.01 . 1 . . . . . 419 VAL H . 50897 1
100 . 1 . 1 19 19 VAL HA H 1 3.605 0.02 . 1 . . . . . 419 VAL HA . 50897 1
101 . 1 . 1 19 19 VAL C C 13 175.878 0.05 . 1 . . . . . 419 VAL C . 50897 1
102 . 1 . 1 19 19 VAL CA C 13 63.630 0.08 . 1 . . . . . 419 VAL CA . 50897 1
103 . 1 . 1 19 19 VAL CB C 13 31.007 0.08 . 1 . . . . . 419 VAL CB . 50897 1
104 . 1 . 1 19 19 VAL N N 15 113.288 0.03 . 1 . . . . . 419 VAL N . 50897 1
105 . 1 . 1 20 20 HIS H H 1 8.092 0.01 . 1 . . . . . 420 HIS H . 50897 1
106 . 1 . 1 20 20 HIS HA H 1 4.689 0.02 . 1 . . . . . 420 HIS HA . 50897 1
107 . 1 . 1 20 20 HIS C C 13 175.906 0.05 . 1 . . . . . 420 HIS C . 50897 1
108 . 1 . 1 20 20 HIS CA C 13 55.747 0.08 . 1 . . . . . 420 HIS CA . 50897 1
109 . 1 . 1 20 20 HIS CB C 13 29.898 0.08 . 1 . . . . . 420 HIS CB . 50897 1
110 . 1 . 1 20 20 HIS N N 15 118.562 0.03 . 1 . . . . . 420 HIS N . 50897 1
111 . 1 . 1 21 21 THR H H 1 7.942 0.01 . 1 . . . . . 421 THR H . 50897 1
112 . 1 . 1 21 21 THR HA H 1 4.128 0.02 . 1 . . . . . 421 THR HA . 50897 1
113 . 1 . 1 21 21 THR C C 13 173.497 0.05 . 1 . . . . . 421 THR C . 50897 1
114 . 1 . 1 21 21 THR CA C 13 64.245 0.08 . 1 . . . . . 421 THR CA . 50897 1
115 . 1 . 1 21 21 THR CB C 13 68.820 0.08 . 1 . . . . . 421 THR CB . 50897 1
116 . 1 . 1 21 21 THR N N 15 121.595 0.03 . 1 . . . . . 421 THR N . 50897 1
117 . 1 . 1 22 22 ASP H H 1 8.772 0.01 . 1 . . . . . 422 ASP H . 50897 1
118 . 1 . 1 22 22 ASP HA H 1 4.544 0.02 . 1 . . . . . 422 ASP HA . 50897 1
119 . 1 . 1 22 22 ASP C C 13 177.001 0.05 . 1 . . . . . 422 ASP C . 50897 1
120 . 1 . 1 22 22 ASP CA C 13 55.356 0.08 . 1 . . . . . 422 ASP CA . 50897 1
121 . 1 . 1 22 22 ASP CB C 13 41.602 0.08 . 1 . . . . . 422 ASP CB . 50897 1
122 . 1 . 1 22 22 ASP N N 15 126.582 0.03 . 1 . . . . . 422 ASP N . 50897 1
123 . 1 . 1 23 23 MET H H 1 8.941 0.01 . 1 . . . . . 423 MET H . 50897 1
124 . 1 . 1 23 23 MET HA H 1 4.381 0.02 . 1 . . . . . 423 MET HA . 50897 1
125 . 1 . 1 23 23 MET C C 13 179.409 0.05 . 1 . . . . . 423 MET C . 50897 1
126 . 1 . 1 23 23 MET CA C 13 60.052 0.08 . 1 . . . . . 423 MET CA . 50897 1
127 . 1 . 1 23 23 MET CB C 13 33.690 0.08 . 1 . . . . . 423 MET CB . 50897 1
128 . 1 . 1 23 23 MET N N 15 122.874 0.03 . 1 . . . . . 423 MET N . 50897 1
129 . 1 . 1 24 24 ALA H H 1 8.874 0.01 . 1 . . . . . 424 ALA H . 50897 1
130 . 1 . 1 24 24 ALA HA H 1 4.088 0.02 . 1 . . . . . 424 ALA HA . 50897 1
131 . 1 . 1 24 24 ALA C C 13 179.976 0.05 . 1 . . . . . 424 ALA C . 50897 1
132 . 1 . 1 24 24 ALA CA C 13 56.082 0.08 . 1 . . . . . 424 ALA CA . 50897 1
133 . 1 . 1 24 24 ALA CB C 13 17.489 0.08 . 1 . . . . . 424 ALA CB . 50897 1
134 . 1 . 1 24 24 ALA N N 15 123.602 0.03 . 1 . . . . . 424 ALA N . 50897 1
135 . 1 . 1 25 25 SER H H 1 7.971 0.01 . 1 . . . . . 425 SER H . 50897 1
136 . 1 . 1 25 25 SER HA H 1 4.200 0.02 . 1 . . . . . 425 SER HA . 50897 1
137 . 1 . 1 25 25 SER C C 13 177.613 0.05 . 1 . . . . . 425 SER C . 50897 1
138 . 1 . 1 25 25 SER CA C 13 62.456 0.08 . 1 . . . . . 425 SER CA . 50897 1
139 . 1 . 1 25 25 SER CB C 13 62.234 0.08 . 1 . . . . . 425 SER CB . 50897 1
140 . 1 . 1 25 25 SER N N 15 116.375 0.03 . 1 . . . . . 425 SER N . 50897 1
141 . 1 . 1 26 26 VAL H H 1 7.866 0.01 . 1 . . . . . 426 VAL H . 50897 1
142 . 1 . 1 26 26 VAL HA H 1 3.667 0.02 . 1 . . . . . 426 VAL HA . 50897 1
143 . 1 . 1 26 26 VAL C C 13 177.107 0.05 . 1 . . . . . 426 VAL C . 50897 1
144 . 1 . 1 26 26 VAL CA C 13 67.432 0.08 . 1 . . . . . 426 VAL CA . 50897 1
145 . 1 . 1 26 26 VAL CB C 13 32.013 0.08 . 1 . . . . . 426 VAL CB . 50897 1
146 . 1 . 1 26 26 VAL N N 15 124.292 0.03 . 1 . . . . . 426 VAL N . 50897 1
147 . 1 . 1 27 27 THR H H 1 8.134 0.01 . 1 . . . . . 427 THR H . 50897 1
148 . 1 . 1 27 27 THR HA H 1 3.655 0.02 . 1 . . . . . 427 THR HA . 50897 1
149 . 1 . 1 27 27 THR C C 13 176.018 0.05 . 1 . . . . . 427 THR C . 50897 1
150 . 1 . 1 27 27 THR CA C 13 68.187 0.08 . 1 . . . . . 427 THR CA . 50897 1
151 . 1 . 1 27 27 THR CB C 13 67.575 0.08 . 1 . . . . . 427 THR CB . 50897 1
152 . 1 . 1 27 27 THR N N 15 115.476 0.03 . 1 . . . . . 427 THR N . 50897 1
153 . 1 . 1 28 28 LYS H H 1 8.289 0.01 . 1 . . . . . 428 LYS H . 50897 1
154 . 1 . 1 28 28 LYS HA H 1 3.595 0.02 . 1 . . . . . 428 LYS HA . 50897 1
155 . 1 . 1 28 28 LYS C C 13 178.983 0.05 . 1 . . . . . 428 LYS C . 50897 1
156 . 1 . 1 28 28 LYS CA C 13 60.024 0.08 . 1 . . . . . 428 LYS CA . 50897 1
157 . 1 . 1 28 28 LYS CB C 13 32.556 0.08 . 1 . . . . . 428 LYS CB . 50897 1
158 . 1 . 1 28 28 LYS N N 15 120.280 0.03 . 1 . . . . . 428 LYS N . 50897 1
159 . 1 . 1 29 29 ALA H H 1 7.496 0.01 . 1 . . . . . 429 ALA H . 50897 1
160 . 1 . 1 29 29 ALA HA H 1 4.114 0.02 . 1 . . . . . 429 ALA HA . 50897 1
161 . 1 . 1 29 29 ALA C C 13 180.263 0.05 . 1 . . . . . 429 ALA C . 50897 1
162 . 1 . 1 29 29 ALA CA C 13 54.881 0.08 . 1 . . . . . 429 ALA CA . 50897 1
163 . 1 . 1 29 29 ALA CB C 13 18.504 0.08 . 1 . . . . . 429 ALA CB . 50897 1
164 . 1 . 1 29 29 ALA N N 15 120.952 0.03 . 1 . . . . . 429 ALA N . 50897 1
165 . 1 . 1 30 30 MET H H 1 7.612 0.01 . 1 . . . . . 430 MET H . 50897 1
166 . 1 . 1 30 30 MET HA H 1 2.591 0.02 . 1 . . . . . 430 MET HA . 50897 1
167 . 1 . 1 30 30 MET C C 13 176.523 0.05 . 1 . . . . . 430 MET C . 50897 1
168 . 1 . 1 30 30 MET CA C 13 59.074 0.08 . 1 . . . . . 430 MET CA . 50897 1
169 . 1 . 1 30 30 MET CB C 13 33.031 0.08 . 1 . . . . . 430 MET CB . 50897 1
170 . 1 . 1 30 30 MET N N 15 119.259 0.03 . 1 . . . . . 430 MET N . 50897 1
171 . 1 . 1 31 31 ALA H H 1 7.390 0.01 . 1 . . . . . 431 ALA H . 50897 1
172 . 1 . 1 31 31 ALA HA H 1 3.636 0.02 . 1 . . . . . 431 ALA HA . 50897 1
173 . 1 . 1 31 31 ALA C C 13 177.147 0.05 . 1 . . . . . 431 ALA C . 50897 1
174 . 1 . 1 31 31 ALA CA C 13 52.041 0.08 . 1 . . . . . 431 ALA CA . 50897 1
175 . 1 . 1 31 31 ALA CB C 13 17.893 0.08 . 1 . . . . . 431 ALA CB . 50897 1
176 . 1 . 1 31 31 ALA N N 15 118.616 0.03 . 1 . . . . . 431 ALA N . 50897 1
177 . 1 . 1 32 32 ALA H H 1 6.905 0.01 . 1 . . . . . 432 ALA H . 50897 1
178 . 1 . 1 32 32 ALA HA H 1 4.344 0.02 . 1 . . . . . 432 ALA HA . 50897 1
179 . 1 . 1 32 32 ALA C C 13 176.209 0.05 . 1 . . . . . 432 ALA C . 50897 1
180 . 1 . 1 32 32 ALA CA C 13 51.028 0.08 . 1 . . . . . 432 ALA CA . 50897 1
181 . 1 . 1 32 32 ALA CB C 13 17.271 0.08 . 1 . . . . . 432 ALA CB . 50897 1
182 . 1 . 1 32 32 ALA N N 15 123.960 0.03 . 1 . . . . . 432 ALA N . 50897 1
183 . 1 . 1 33 33 PRO HA H 1 4.398 0.02 . 1 . . . . . 433 PRO HA . 50897 1
184 . 1 . 1 33 33 PRO C C 13 178.146 0.05 . 1 . . . . . 433 PRO C . 50897 1
185 . 1 . 1 33 33 PRO CA C 13 64.385 0.08 . 1 . . . . . 433 PRO CA . 50897 1
186 . 1 . 1 33 33 PRO CB C 13 31.733 0.08 . 1 . . . . . 433 PRO CB . 50897 1
187 . 1 . 1 34 34 GLU H H 1 8.842 0.01 . 1 . . . . . 434 GLU H . 50897 1
188 . 1 . 1 34 34 GLU HA H 1 4.353 0.02 . 1 . . . . . 434 GLU HA . 50897 1
189 . 1 . 1 34 34 GLU C C 13 177.472 0.05 . 1 . . . . . 434 GLU C . 50897 1
190 . 1 . 1 34 34 GLU CA C 13 56.376 0.08 . 1 . . . . . 434 GLU CA . 50897 1
191 . 1 . 1 34 34 GLU CB C 13 27.512 0.08 . 1 . . . . . 434 GLU CB . 50897 1
192 . 1 . 1 34 34 GLU N N 15 115.900 0.03 . 1 . . . . . 434 GLU N . 50897 1
193 . 1 . 1 35 35 SER H H 1 8.090 0.01 . 1 . . . . . 435 SER H . 50897 1
194 . 1 . 1 35 35 SER HA H 1 4.267 0.02 . 1 . . . . . 435 SER HA . 50897 1
195 . 1 . 1 35 35 SER C C 13 176.961 0.05 . 1 . . . . . 435 SER C . 50897 1
196 . 1 . 1 35 35 SER CA C 13 59.975 0.08 . 1 . . . . . 435 SER CA . 50897 1
197 . 1 . 1 35 35 SER CB C 13 64.954 0.08 . 1 . . . . . 435 SER CB . 50897 1
198 . 1 . 1 35 35 SER N N 15 115.920 0.03 . 1 . . . . . 435 SER N . 50897 1
199 . 1 . 1 36 36 GLY H H 1 8.848 0.01 . 1 . . . . . 436 GLY H . 50897 1
200 . 1 . 1 36 36 GLY C C 13 174.210 0.05 . 1 . . . . . 436 GLY C . 50897 1
201 . 1 . 1 36 36 GLY N N 15 112.342 0.03 . 1 . . . . . 436 GLY N . 50897 1
202 . 1 . 1 37 37 LEU H H 1 8.010 0.01 . 1 . . . . . 437 LEU H . 50897 1
203 . 1 . 1 37 37 LEU HA H 1 4.383 0.02 . 1 . . . . . 437 LEU HA . 50897 1
204 . 1 . 1 37 37 LEU C C 13 175.793 0.05 . 1 . . . . . 437 LEU C . 50897 1
205 . 1 . 1 37 37 LEU CA C 13 54.213 0.08 . 1 . . . . . 437 LEU CA . 50897 1
206 . 1 . 1 37 37 LEU CB C 13 42.019 0.08 . 1 . . . . . 437 LEU CB . 50897 1
207 . 1 . 1 37 37 LEU N N 15 124.391 0.03 . 1 . . . . . 437 LEU N . 50897 1
208 . 1 . 1 38 38 GLU H H 1 9.032 0.01 . 1 . . . . . 438 GLU H . 50897 1
209 . 1 . 1 38 38 GLU HA H 1 4.250 0.02 . 1 . . . . . 438 GLU HA . 50897 1
210 . 1 . 1 38 38 GLU C C 13 174.547 0.05 . 1 . . . . . 438 GLU C . 50897 1
211 . 1 . 1 38 38 GLU CA C 13 57.284 0.08 . 1 . . . . . 438 GLU CA . 50897 1
212 . 1 . 1 38 38 GLU CB C 13 29.749 0.08 . 1 . . . . . 438 GLU CB . 50897 1
213 . 1 . 1 38 38 GLU N N 15 130.469 0.03 . 1 . . . . . 438 GLU N . 50897 1
214 . 1 . 1 39 39 VAL H H 1 8.308 0.01 . 1 . . . . . 439 VAL H . 50897 1
215 . 1 . 1 39 39 VAL HA H 1 4.639 0.02 . 1 . . . . . 439 VAL HA . 50897 1
216 . 1 . 1 39 39 VAL C C 13 175.793 0.05 . 1 . . . . . 439 VAL C . 50897 1
217 . 1 . 1 39 39 VAL CA C 13 61.142 0.08 . 1 . . . . . 439 VAL CA . 50897 1
218 . 1 . 1 39 39 VAL CB C 13 33.718 0.08 . 1 . . . . . 439 VAL CB . 50897 1
219 . 1 . 1 39 39 VAL N N 15 127.990 0.03 . 1 . . . . . 439 VAL N . 50897 1
220 . 1 . 1 40 40 ARG H H 1 9.050 0.01 . 1 . . . . . 440 ARG H . 50897 1
221 . 1 . 1 40 40 ARG C C 13 175.047 0.05 . 1 . . . . . 440 ARG C . 50897 1
222 . 1 . 1 40 40 ARG CA C 13 54.936 0.08 . 1 . . . . . 440 ARG CA . 50897 1
223 . 1 . 1 40 40 ARG CB C 13 33.131 0.08 . 1 . . . . . 440 ARG CB . 50897 1
224 . 1 . 1 40 40 ARG N N 15 122.127 0.03 . 1 . . . . . 440 ARG N . 50897 1
225 . 1 . 1 41 41 ASP H H 1 8.878 0.01 . 1 . . . . . 441 ASP H . 50897 1
226 . 1 . 1 41 41 ASP HA H 1 5.041 0.02 . 1 . . . . . 441 ASP HA . 50897 1
227 . 1 . 1 41 41 ASP C C 13 176.428 0.05 . 1 . . . . . 441 ASP C . 50897 1
228 . 1 . 1 41 41 ASP CA C 13 54.768 0.08 . 1 . . . . . 441 ASP CA . 50897 1
229 . 1 . 1 41 41 ASP CB C 13 40.092 0.08 . 1 . . . . . 441 ASP CB . 50897 1
230 . 1 . 1 41 41 ASP N N 15 124.147 0.03 . 1 . . . . . 441 ASP N . 50897 1
231 . 1 . 1 42 42 ARG H H 1 8.851 0.01 . 1 . . . . . 442 ARG H . 50897 1
232 . 1 . 1 42 42 ARG HA H 1 4.572 0.02 . 1 . . . . . 442 ARG HA . 50897 1
233 . 1 . 1 42 42 ARG C C 13 174.592 0.05 . 1 . . . . . 442 ARG C . 50897 1
234 . 1 . 1 42 42 ARG CA C 13 52.784 0.08 . 1 . . . . . 442 ARG CA . 50897 1
235 . 1 . 1 42 42 ARG CB C 13 32.796 0.08 . 1 . . . . . 442 ARG CB . 50897 1
236 . 1 . 1 42 42 ARG N N 15 121.854 0.03 . 1 . . . . . 442 ARG N . 50897 1
237 . 1 . 1 43 43 MET H H 1 8.510 0.01 . 1 . . . . . 443 MET H . 50897 1
238 . 1 . 1 43 43 MET HA H 1 5.091 0.02 . 1 . . . . . 443 MET HA . 50897 1
239 . 1 . 1 43 43 MET C C 13 175.485 0.05 . 1 . . . . . 443 MET C . 50897 1
240 . 1 . 1 43 43 MET CA C 13 54.629 0.08 . 1 . . . . . 443 MET CA . 50897 1
241 . 1 . 1 43 43 MET CB C 13 33.243 0.08 . 1 . . . . . 443 MET CB . 50897 1
242 . 1 . 1 43 43 MET N N 15 122.608 0.03 . 1 . . . . . 443 MET N . 50897 1
243 . 1 . 1 44 44 TRP H H 1 8.939 0.01 . 1 . . . . . 444 TRP H . 50897 1
244 . 1 . 1 44 44 TRP C C 13 174.350 0.05 . 1 . . . . . 444 TRP C . 50897 1
245 . 1 . 1 44 44 TRP CA C 13 56.586 0.08 . 1 . . . . . 444 TRP CA . 50897 1
246 . 1 . 1 44 44 TRP CB C 13 31.280 0.08 . 1 . . . . . 444 TRP CB . 50897 1
247 . 1 . 1 44 44 TRP N N 15 127.587 0.03 . 1 . . . . . 444 TRP N . 50897 1
248 . 1 . 1 45 45 LEU H H 1 8.719 0.01 . 1 . . . . . 445 LEU H . 50897 1
249 . 1 . 1 45 45 LEU HA H 1 3.574 0.02 . 1 . . . . . 445 LEU HA . 50897 1
250 . 1 . 1 45 45 LEU C C 13 176.742 0.05 . 1 . . . . . 445 LEU C . 50897 1
251 . 1 . 1 45 45 LEU CA C 13 56.389 0.08 . 1 . . . . . 445 LEU CA . 50897 1
252 . 1 . 1 45 45 LEU CB C 13 38.611 0.08 . 1 . . . . . 445 LEU CB . 50897 1
253 . 1 . 1 45 45 LEU N N 15 125.074 0.03 . 1 . . . . . 445 LEU N . 50897 1
254 . 1 . 1 46 46 LYS H H 1 8.157 0.01 . 1 . . . . . 446 LYS H . 50897 1
255 . 1 . 1 46 46 LYS HA H 1 4.076 0.02 . 1 . . . . . 446 LYS HA . 50897 1
256 . 1 . 1 46 46 LYS C C 13 176.091 0.05 . 1 . . . . . 446 LYS C . 50897 1
257 . 1 . 1 46 46 LYS CA C 13 57.368 0.08 . 1 . . . . . 446 LYS CA . 50897 1
258 . 1 . 1 46 46 LYS CB C 13 31.266 0.08 . 1 . . . . . 446 LYS CB . 50897 1
259 . 1 . 1 46 46 LYS N N 15 114.291 0.03 . 1 . . . . . 446 LYS N . 50897 1
260 . 1 . 1 47 47 ILE H H 1 8.295 0.01 . 1 . . . . . 447 ILE H . 50897 1
261 . 1 . 1 47 47 ILE HA H 1 4.402 0.02 . 1 . . . . . 447 ILE HA . 50897 1
262 . 1 . 1 47 47 ILE C C 13 175.271 0.05 . 1 . . . . . 447 ILE C . 50897 1
263 . 1 . 1 47 47 ILE CA C 13 60.010 0.08 . 1 . . . . . 447 ILE CA . 50897 1
264 . 1 . 1 47 47 ILE CB C 13 40.173 0.08 . 1 . . . . . 447 ILE CB . 50897 1
265 . 1 . 1 47 47 ILE N N 15 121.579 0.03 . 1 . . . . . 447 ILE N . 50897 1
266 . 1 . 1 48 48 THR H H 1 8.453 0.01 . 1 . . . . . 448 THR H . 50897 1
267 . 1 . 1 48 48 THR HA H 1 4.729 0.02 . 1 . . . . . 448 THR HA . 50897 1
268 . 1 . 1 48 48 THR C C 13 174.165 0.05 . 1 . . . . . 448 THR C . 50897 1
269 . 1 . 1 48 48 THR CA C 13 62.680 0.08 . 1 . . . . . 448 THR CA . 50897 1
270 . 1 . 1 48 48 THR CB C 13 69.566 0.08 . 1 . . . . . 448 THR CB . 50897 1
271 . 1 . 1 48 48 THR N N 15 121.126 0.03 . 1 . . . . . 448 THR N . 50897 1
272 . 1 . 1 49 49 ILE H H 1 9.323 0.01 . 1 . . . . . 449 ILE H . 50897 1
273 . 1 . 1 49 49 ILE HA H 1 4.406 0.02 . 1 . . . . . 449 ILE HA . 50897 1
274 . 1 . 1 49 49 ILE C C 13 173.256 0.05 . 1 . . . . . 449 ILE C . 50897 1
275 . 1 . 1 49 49 ILE CA C 13 57.872 0.08 . 1 . . . . . 449 ILE CA . 50897 1
276 . 1 . 1 49 49 ILE CB C 13 40.595 0.08 . 1 . . . . . 449 ILE CB . 50897 1
277 . 1 . 1 49 49 ILE N N 15 130.749 0.03 . 1 . . . . . 449 ILE N . 50897 1
278 . 1 . 1 50 50 PRO HA H 1 4.498 0.02 . 1 . . . . . 450 PRO HA . 50897 1
279 . 1 . 1 50 50 PRO C C 13 177.180 0.05 . 1 . . . . . 450 PRO C . 50897 1
280 . 1 . 1 50 50 PRO CA C 13 62.009 0.08 . 1 . . . . . 450 PRO CA . 50897 1
281 . 1 . 1 50 50 PRO CB C 13 32.432 0.08 . 1 . . . . . 450 PRO CB . 50897 1
282 . 1 . 1 51 51 ASN H H 1 8.717 0.01 . 1 . . . . . 451 ASN H . 50897 1
283 . 1 . 1 51 51 ASN HA H 1 3.861 0.02 . 1 . . . . . 451 ASN HA . 50897 1
284 . 1 . 1 51 51 ASN C C 13 171.751 0.05 . 1 . . . . . 451 ASN C . 50897 1
285 . 1 . 1 51 51 ASN CA C 13 54.852 0.08 . 1 . . . . . 451 ASN CA . 50897 1
286 . 1 . 1 51 51 ASN CB C 13 38.122 0.08 . 1 . . . . . 451 ASN CB . 50897 1
287 . 1 . 1 51 51 ASN N N 15 115.779 0.03 . 1 . . . . . 451 ASN N . 50897 1
288 . 1 . 1 52 52 ALA H H 1 7.646 0.01 . 1 . . . . . 452 ALA H . 50897 1
289 . 1 . 1 52 52 ALA HA H 1 5.232 0.02 . 1 . . . . . 452 ALA HA . 50897 1
290 . 1 . 1 52 52 ALA C C 13 178.118 0.05 . 1 . . . . . 452 ALA C . 50897 1
291 . 1 . 1 52 52 ALA CA C 13 50.433 0.08 . 1 . . . . . 452 ALA CA . 50897 1
292 . 1 . 1 52 52 ALA CB C 13 23.039 0.08 . 1 . . . . . 452 ALA CB . 50897 1
293 . 1 . 1 52 52 ALA N N 15 119.272 0.03 . 1 . . . . . 452 ALA N . 50897 1
294 . 1 . 1 53 53 PHE H H 1 8.487 0.01 . 1 . . . . . 453 PHE H . 50897 1
295 . 1 . 1 53 53 PHE HA H 1 5.246 0.02 . 1 . . . . . 453 PHE HA . 50897 1
296 . 1 . 1 53 53 PHE C C 13 174.446 0.05 . 1 . . . . . 453 PHE C . 50897 1
297 . 1 . 1 53 53 PHE CA C 13 54.349 0.08 . 1 . . . . . 453 PHE CA . 50897 1
298 . 1 . 1 53 53 PHE CB C 13 40.561 0.08 . 1 . . . . . 453 PHE CB . 50897 1
299 . 1 . 1 53 53 PHE N N 15 116.181 0.03 . 1 . . . . . 453 PHE N . 50897 1
300 . 1 . 1 54 54 LEU H H 1 9.539 0.01 . 1 . . . . . 454 LEU H . 50897 1
301 . 1 . 1 54 54 LEU HA H 1 4.298 0.02 . 1 . . . . . 454 LEU HA . 50897 1
302 . 1 . 1 54 54 LEU C C 13 179.668 0.05 . 1 . . . . . 454 LEU C . 50897 1
303 . 1 . 1 54 54 LEU CA C 13 54.310 0.08 . 1 . . . . . 454 LEU CA . 50897 1
304 . 1 . 1 54 54 LEU CB C 13 44.495 0.08 . 1 . . . . . 454 LEU CB . 50897 1
305 . 1 . 1 54 54 LEU N N 15 124.173 0.03 . 1 . . . . . 454 LEU N . 50897 1
306 . 1 . 1 55 55 GLY H H 1 9.291 0.01 . 1 . . . . . 455 GLY H . 50897 1
307 . 1 . 1 55 55 GLY HA2 H 1 4.094 0.02 . 2 . . . . . 455 GLY HA2 . 50897 1
308 . 1 . 1 55 55 GLY HA3 H 1 3.895 0.02 . 2 . . . . . 455 GLY HA3 . 50897 1
309 . 1 . 1 55 55 GLY CA C 13 49.726 0.05 . 1 . . . . . 455 GLY CA . 50897 1
310 . 1 . 1 55 55 GLY N N 15 112.472 0.03 . 1 . . . . . 455 GLY N . 50897 1
311 . 1 . 1 56 56 SER H H 1 9.016 0.01 . 1 . . . . . 456 SER H . 50897 1
312 . 1 . 1 56 56 SER C C 13 176.119 0.05 . 1 . . . . . 456 SER C . 50897 1
313 . 1 . 1 56 56 SER CB C 13 62.512 0.08 . 1 . . . . . 456 SER CB . 50897 1
314 . 1 . 1 56 56 SER N N 15 117.766 0.03 . 1 . . . . . 456 SER N . 50897 1
315 . 1 . 1 57 57 ASP H H 1 6.907 0.01 . 1 . . . . . 457 ASP H . 50897 1
316 . 1 . 1 57 57 ASP HA H 1 4.673 0.02 . 1 . . . . . 457 ASP HA . 50897 1
317 . 1 . 1 57 57 ASP C C 13 179.729 0.05 . 1 . . . . . 457 ASP C . 50897 1
318 . 1 . 1 57 57 ASP CA C 13 57.146 0.08 . 1 . . . . . 457 ASP CA . 50897 1
319 . 1 . 1 57 57 ASP CB C 13 40.120 0.08 . 1 . . . . . 457 ASP CB . 50897 1
320 . 1 . 1 57 57 ASP N N 15 120.758 0.03 . 1 . . . . . 457 ASP N . 50897 1
321 . 1 . 1 58 58 VAL H H 1 7.998 0.01 . 1 . . . . . 458 VAL H . 50897 1
322 . 1 . 1 58 58 VAL HA H 1 3.764 0.02 . 1 . . . . . 458 VAL HA . 50897 1
323 . 1 . 1 58 58 VAL C C 13 176.810 0.05 . 1 . . . . . 458 VAL C . 50897 1
324 . 1 . 1 58 58 VAL CA C 13 66.262 0.08 . 1 . . . . . 458 VAL CA . 50897 1
325 . 1 . 1 58 58 VAL CB C 13 31.793 0.08 . 1 . . . . . 458 VAL CB . 50897 1
326 . 1 . 1 58 58 VAL N N 15 122.738 0.03 . 1 . . . . . 458 VAL N . 50897 1
327 . 1 . 1 59 59 VAL H H 1 7.865 0.01 . 1 . . . . . 459 VAL H . 50897 1
328 . 1 . 1 59 59 VAL HA H 1 3.232 0.02 . 1 . . . . . 459 VAL HA . 50897 1
329 . 1 . 1 59 59 VAL C C 13 177.500 0.05 . 1 . . . . . 459 VAL C . 50897 1
330 . 1 . 1 59 59 VAL CA C 13 67.908 0.08 . 1 . . . . . 459 VAL CA . 50897 1
331 . 1 . 1 59 59 VAL CB C 13 31.677 0.08 . 1 . . . . . 459 VAL CB . 50897 1
332 . 1 . 1 59 59 VAL N N 15 119.869 0.03 . 1 . . . . . 459 VAL N . 50897 1
333 . 1 . 1 60 60 ASP H H 1 8.337 0.01 . 1 . . . . . 460 ASP H . 50897 1
334 . 1 . 1 60 60 ASP HA H 1 4.406 0.02 . 1 . . . . . 460 ASP HA . 50897 1
335 . 1 . 1 60 60 ASP C C 13 178.168 0.05 . 1 . . . . . 460 ASP C . 50897 1
336 . 1 . 1 60 60 ASP CA C 13 58.207 0.08 . 1 . . . . . 460 ASP CA . 50897 1
337 . 1 . 1 60 60 ASP CB C 13 40.735 0.08 . 1 . . . . . 460 ASP CB . 50897 1
338 . 1 . 1 60 60 ASP N N 15 117.969 0.03 . 1 . . . . . 460 ASP N . 50897 1
339 . 1 . 1 61 61 TRP H H 1 8.644 0.01 . 1 . . . . . 461 TRP H . 50897 1
340 . 1 . 1 61 61 TRP HA H 1 4.216 0.02 . 1 . . . . . 461 TRP HA . 50897 1
341 . 1 . 1 61 61 TRP C C 13 180.532 0.05 . 1 . . . . . 461 TRP C . 50897 1
342 . 1 . 1 61 61 TRP CA C 13 63.323 0.08 . 1 . . . . . 461 TRP CA . 50897 1
343 . 1 . 1 61 61 TRP CB C 13 29.749 0.08 . 1 . . . . . 461 TRP CB . 50897 1
344 . 1 . 1 61 61 TRP N N 15 121.487 0.03 . 1 . . . . . 461 TRP N . 50897 1
345 . 1 . 1 62 62 LEU H H 1 9.026 0.01 . 1 . . . . . 462 LEU H . 50897 1
346 . 1 . 1 62 62 LEU HA H 1 4.018 0.02 . 1 . . . . . 462 LEU HA . 50897 1
347 . 1 . 1 62 62 LEU C C 13 177.517 0.05 . 1 . . . . . 462 LEU C . 50897 1
348 . 1 . 1 62 62 LEU CA C 13 58.123 0.08 . 1 . . . . . 462 LEU CA . 50897 1
349 . 1 . 1 62 62 LEU CB C 13 43.089 0.08 . 1 . . . . . 462 LEU CB . 50897 1
350 . 1 . 1 62 62 LEU N N 15 120.928 0.03 . 1 . . . . . 462 LEU N . 50897 1
351 . 1 . 1 63 63 TYR H H 1 8.453 0.01 . 1 . . . . . 463 TYR H . 50897 1
352 . 1 . 1 63 63 TYR HA H 1 4.364 0.02 . 1 . . . . . 463 TYR HA . 50897 1
353 . 1 . 1 63 63 TYR C C 13 176.725 0.05 . 1 . . . . . 463 TYR C . 50897 1
354 . 1 . 1 63 63 TYR CA C 13 59.661 0.08 . 1 . . . . . 463 TYR CA . 50897 1
355 . 1 . 1 63 63 TYR CB C 13 38.499 0.08 . 1 . . . . . 463 TYR CB . 50897 1
356 . 1 . 1 63 63 TYR N N 15 115.854 0.03 . 1 . . . . . 463 TYR N . 50897 1
357 . 1 . 1 64 64 HIS H H 1 7.772 0.01 . 1 . . . . . 464 HIS H . 50897 1
358 . 1 . 1 64 64 HIS HA H 1 4.252 0.02 . 1 . . . . . 464 HIS HA . 50897 1
359 . 1 . 1 64 64 HIS C C 13 175.894 0.05 . 1 . . . . . 464 HIS C . 50897 1
360 . 1 . 1 64 64 HIS CA C 13 57.005 0.08 . 1 . . . . . 464 HIS CA . 50897 1
361 . 1 . 1 64 64 HIS CB C 13 30.308 0.08 . 1 . . . . . 464 HIS CB . 50897 1
362 . 1 . 1 64 64 HIS N N 15 111.490 0.03 . 1 . . . . . 464 HIS N . 50897 1
363 . 1 . 1 65 65 HIS H H 1 7.959 0.01 . 1 . . . . . 465 HIS H . 50897 1
364 . 1 . 1 65 65 HIS HA H 1 4.276 0.02 . 1 . . . . . 465 HIS HA . 50897 1
365 . 1 . 1 65 65 HIS C C 13 172.902 0.05 . 1 . . . . . 465 HIS C . 50897 1
366 . 1 . 1 65 65 HIS CA C 13 57.229 0.08 . 1 . . . . . 465 HIS CA . 50897 1
367 . 1 . 1 65 65 HIS CB C 13 28.574 0.08 . 1 . . . . . 465 HIS CB . 50897 1
368 . 1 . 1 65 65 HIS N N 15 113.541 0.03 . 1 . . . . . 465 HIS N . 50897 1
369 . 1 . 1 66 66 VAL H H 1 7.847 0.01 . 1 . . . . . 466 VAL H . 50897 1
370 . 1 . 1 66 66 VAL HA H 1 3.827 0.02 . 1 . . . . . 466 VAL HA . 50897 1
371 . 1 . 1 66 66 VAL C C 13 173.980 0.05 . 1 . . . . . 466 VAL C . 50897 1
372 . 1 . 1 66 66 VAL CA C 13 61.394 0.08 . 1 . . . . . 466 VAL CA . 50897 1
373 . 1 . 1 66 66 VAL CB C 13 31.761 0.08 . 1 . . . . . 466 VAL CB . 50897 1
374 . 1 . 1 66 66 VAL N N 15 121.484 0.03 . 1 . . . . . 466 VAL N . 50897 1
375 . 1 . 1 67 67 GLU H H 1 8.219 0.01 . 1 . . . . . 467 GLU H . 50897 1
376 . 1 . 1 67 67 GLU HA H 1 3.965 0.02 . 1 . . . . . 467 GLU HA . 50897 1
377 . 1 . 1 67 67 GLU C C 13 176.125 0.05 . 1 . . . . . 467 GLU C . 50897 1
378 . 1 . 1 67 67 GLU CA C 13 57.536 0.08 . 1 . . . . . 467 GLU CA . 50897 1
379 . 1 . 1 67 67 GLU CB C 13 30.615 0.08 . 1 . . . . . 467 GLU CB . 50897 1
380 . 1 . 1 67 67 GLU N N 15 127.646 0.03 . 1 . . . . . 467 GLU N . 50897 1
381 . 1 . 1 68 68 GLY H H 1 8.466 0.01 . 1 . . . . . 468 GLY H . 50897 1
382 . 1 . 1 68 68 GLY HA2 H 1 4.211 0.02 . 2 . . . . . 468 GLY HA2 . 50897 1
383 . 1 . 1 68 68 GLY HA3 H 1 4.011 0.02 . 2 . . . . . 468 GLY HA3 . 50897 1
384 . 1 . 1 68 68 GLY C C 13 175.080 0.05 . 1 . . . . . 468 GLY C . 50897 1
385 . 1 . 1 68 68 GLY CA C 13 45.040 0.08 . 1 . . . . . 468 GLY CA . 50897 1
386 . 1 . 1 68 68 GLY N N 15 108.769 0.03 . 1 . . . . . 468 GLY N . 50897 1
387 . 1 . 1 69 69 PHE H H 1 7.985 0.01 . 1 . . . . . 469 PHE H . 50897 1
388 . 1 . 1 69 69 PHE HA H 1 5.197 0.02 . 1 . . . . . 469 PHE HA . 50897 1
389 . 1 . 1 69 69 PHE CA C 13 55.188 0.08 . 1 . . . . . 469 PHE CA . 50897 1
390 . 1 . 1 69 69 PHE CB C 13 39.137 0.08 . 1 . . . . . 469 PHE CB . 50897 1
391 . 1 . 1 69 69 PHE N N 15 120.513 0.03 . 1 . . . . . 469 PHE N . 50897 1
392 . 1 . 1 70 70 PRO HA H 1 4.530 0.02 . 1 . . . . . 470 PRO HA . 50897 1
393 . 1 . 1 70 70 PRO C C 13 176.164 0.05 . 1 . . . . . 470 PRO C . 50897 1
394 . 1 . 1 70 70 PRO CA C 13 64.553 0.08 . 1 . . . . . 470 PRO CA . 50897 1
395 . 1 . 1 70 70 PRO CB C 13 32.348 0.08 . 1 . . . . . 470 PRO CB . 50897 1
396 . 1 . 1 71 71 GLU H H 1 7.115 0.01 . 1 . . . . . 471 GLU H . 50897 1
397 . 1 . 1 71 71 GLU HA H 1 4.795 0.02 . 1 . . . . . 471 GLU HA . 50897 1
398 . 1 . 1 71 71 GLU C C 13 176.265 0.05 . 1 . . . . . 471 GLU C . 50897 1
399 . 1 . 1 71 71 GLU CA C 13 54.265 0.08 . 1 . . . . . 471 GLU CA . 50897 1
400 . 1 . 1 71 71 GLU CB C 13 32.908 0.08 . 1 . . . . . 471 GLU CB . 50897 1
401 . 1 . 1 71 71 GLU N N 15 109.801 0.03 . 1 . . . . . 471 GLU N . 50897 1
402 . 1 . 1 72 72 ARG H H 1 8.948 0.01 . 1 . . . . . 472 ARG H . 50897 1
403 . 1 . 1 72 72 ARG HA H 1 2.669 0.02 . 1 . . . . . 472 ARG HA . 50897 1
404 . 1 . 1 72 72 ARG C C 13 178.309 0.05 . 1 . . . . . 472 ARG C . 50897 1
405 . 1 . 1 72 72 ARG CA C 13 60.108 0.08 . 1 . . . . . 472 ARG CA . 50897 1
406 . 1 . 1 72 72 ARG CB C 13 29.357 0.08 . 1 . . . . . 472 ARG CB . 50897 1
407 . 1 . 1 72 72 ARG N N 15 126.415 0.03 . 1 . . . . . 472 ARG N . 50897 1
408 . 1 . 1 73 73 ARG H H 1 8.806 0.01 . 1 . . . . . 473 ARG H . 50897 1
409 . 1 . 1 73 73 ARG HA H 1 3.943 0.02 . 1 . . . . . 473 ARG HA . 50897 1
410 . 1 . 1 73 73 ARG C C 13 178.887 0.05 . 1 . . . . . 473 ARG C . 50897 1
411 . 1 . 1 73 73 ARG CA C 13 59.269 0.08 . 1 . . . . . 473 ARG CA . 50897 1
412 . 1 . 1 73 73 ARG CB C 13 29.553 0.08 . 1 . . . . . 473 ARG CB . 50897 1
413 . 1 . 1 73 73 ARG N N 15 117.272 0.03 . 1 . . . . . 473 ARG N . 50897 1
414 . 1 . 1 74 74 GLU H H 1 7.528 0.01 . 1 . . . . . 474 GLU H . 50897 1
415 . 1 . 1 74 74 GLU HA H 1 4.268 0.02 . 1 . . . . . 474 GLU HA . 50897 1
416 . 1 . 1 74 74 GLU C C 13 178.769 0.05 . 1 . . . . . 474 GLU C . 50897 1
417 . 1 . 1 74 74 GLU CA C 13 58.515 0.08 . 1 . . . . . 474 GLU CA . 50897 1
418 . 1 . 1 74 74 GLU CB C 13 29.567 0.08 . 1 . . . . . 474 GLU CB . 50897 1
419 . 1 . 1 74 74 GLU N N 15 118.039 0.03 . 1 . . . . . 474 GLU N . 50897 1
420 . 1 . 1 75 75 ALA H H 1 6.991 0.01 . 1 . . . . . 475 ALA H . 50897 1
421 . 1 . 1 75 75 ALA HA H 1 3.016 0.02 . 1 . . . . . 475 ALA HA . 50897 1
422 . 1 . 1 75 75 ALA CA C 13 54.228 0.08 . 1 . . . . . 475 ALA CA . 50897 1
423 . 1 . 1 75 75 ALA CB C 13 17.532 0.05 . 1 . . . . . 475 ALA CB . 50897 1
424 . 1 . 1 75 75 ALA N N 15 124.485 0.03 . 1 . . . . . 475 ALA N . 50897 1
425 . 1 . 1 76 76 ARG H H 1 7.661 0.01 . 1 . . . . . 476 ARG H . 50897 1
426 . 1 . 1 76 76 ARG HA H 1 3.715 0.02 . 1 . . . . . 476 ARG HA . 50897 1
427 . 1 . 1 76 76 ARG C C 13 177.865 0.05 . 1 . . . . . 476 ARG C . 50897 1
428 . 1 . 1 76 76 ARG CA C 13 59.493 0.08 . 1 . . . . . 476 ARG CA . 50897 1
429 . 1 . 1 76 76 ARG CB C 13 29.245 0.08 . 1 . . . . . 476 ARG CB . 50897 1
430 . 1 . 1 76 76 ARG N N 15 120.071 0.03 . 1 . . . . . 476 ARG N . 50897 1
431 . 1 . 1 77 77 LYS H H 1 7.576 0.01 . 1 . . . . . 477 LYS H . 50897 1
432 . 1 . 1 77 77 LYS HA H 1 3.991 0.02 . 1 . . . . . 477 LYS HA . 50897 1
433 . 1 . 1 77 77 LYS C C 13 179.499 0.05 . 1 . . . . . 477 LYS C . 50897 1
434 . 1 . 1 77 77 LYS CA C 13 59.399 0.08 . 1 . . . . . 477 LYS CA . 50897 1
435 . 1 . 1 77 77 LYS CB C 13 32.237 0.08 . 1 . . . . . 477 LYS CB . 50897 1
436 . 1 . 1 77 77 LYS N N 15 120.005 0.03 . 1 . . . . . 477 LYS N . 50897 1
437 . 1 . 1 78 78 TYR H H 1 7.721 0.01 . 1 . . . . . 478 TYR H . 50897 1
438 . 1 . 1 78 78 TYR HA H 1 4.090 0.02 . 1 . . . . . 478 TYR HA . 50897 1
439 . 1 . 1 78 78 TYR C C 13 178.399 0.05 . 1 . . . . . 478 TYR C . 50897 1
440 . 1 . 1 78 78 TYR CA C 13 61.282 0.08 . 1 . . . . . 478 TYR CA . 50897 1
441 . 1 . 1 78 78 TYR CB C 13 39.025 0.08 . 1 . . . . . 478 TYR CB . 50897 1
442 . 1 . 1 78 78 TYR N N 15 123.166 0.03 . 1 . . . . . 478 TYR N . 50897 1
443 . 1 . 1 79 79 ALA H H 1 8.140 0.01 . 1 . . . . . 479 ALA H . 50897 1
444 . 1 . 1 79 79 ALA HA H 1 3.525 0.02 . 1 . . . . . 479 ALA HA . 50897 1
445 . 1 . 1 79 79 ALA C C 13 178.466 0.05 . 1 . . . . . 479 ALA C . 50897 1
446 . 1 . 1 79 79 ALA CA C 13 55.551 0.08 . 1 . . . . . 479 ALA CA . 50897 1
447 . 1 . 1 79 79 ALA CB C 13 17.592 0.08 . 1 . . . . . 479 ALA CB . 50897 1
448 . 1 . 1 79 79 ALA N N 15 122.826 0.03 . 1 . . . . . 479 ALA N . 50897 1
449 . 1 . 1 80 80 SER H H 1 7.620 0.01 . 1 . . . . . 480 SER H . 50897 1
450 . 1 . 1 80 80 SER C C 13 177.292 0.05 . 1 . . . . . 480 SER C . 50897 1
451 . 1 . 1 80 80 SER CA C 13 61.701 0.08 . 1 . . . . . 480 SER CA . 50897 1
452 . 1 . 1 80 80 SER CB C 13 62.093 0.08 . 1 . . . . . 480 SER CB . 50897 1
453 . 1 . 1 80 80 SER N N 15 111.756 0.03 . 1 . . . . . 480 SER N . 50897 1
454 . 1 . 1 81 81 GLY H H 1 7.860 0.01 . 1 . . . . . 481 GLY H . 50897 1
455 . 1 . 1 81 81 GLY HA2 H 1 3.837 0.02 . 2 . . . . . 481 GLY HA2 . 50897 1
456 . 1 . 1 81 81 GLY HA3 H 1 3.817 0.02 . 2 . . . . . 481 GLY HA3 . 50897 1
457 . 1 . 1 81 81 GLY C C 13 176.821 0.05 . 1 . . . . . 481 GLY C . 50897 1
458 . 1 . 1 81 81 GLY CA C 13 46.941 0.08 . 1 . . . . . 481 GLY CA . 50897 1
459 . 1 . 1 81 81 GLY N N 15 111.636 0.03 . 1 . . . . . 481 GLY N . 50897 1
460 . 1 . 1 82 82 LEU H H 1 7.962 0.01 . 1 . . . . . 482 LEU H . 50897 1
461 . 1 . 1 82 82 LEU HA H 1 4.008 0.02 . 1 . . . . . 482 LEU HA . 50897 1
462 . 1 . 1 82 82 LEU C C 13 179.213 0.05 . 1 . . . . . 482 LEU C . 50897 1
463 . 1 . 1 82 82 LEU CA C 13 57.983 0.08 . 1 . . . . . 482 LEU CA . 50897 1
464 . 1 . 1 82 82 LEU CB C 13 41.853 0.08 . 1 . . . . . 482 LEU CB . 50897 1
465 . 1 . 1 82 82 LEU N N 15 123.212 0.03 . 1 . . . . . 482 LEU N . 50897 1
466 . 1 . 1 83 83 LEU H H 1 7.529 0.01 . 1 . . . . . 483 LEU H . 50897 1
467 . 1 . 1 83 83 LEU HA H 1 4.493 0.02 . 1 . . . . . 483 LEU HA . 50897 1
468 . 1 . 1 83 83 LEU C C 13 180.532 0.05 . 1 . . . . . 483 LEU C . 50897 1
469 . 1 . 1 83 83 LEU CA C 13 57.005 0.08 . 1 . . . . . 483 LEU CA . 50897 1
470 . 1 . 1 83 83 LEU CB C 13 42.500 0.08 . 1 . . . . . 483 LEU CB . 50897 1
471 . 1 . 1 83 83 LEU N N 15 120.718 0.03 . 1 . . . . . 483 LEU N . 50897 1
472 . 1 . 1 84 84 LYS H H 1 8.345 0.01 . 1 . . . . . 484 LYS H . 50897 1
473 . 1 . 1 84 84 LYS HA H 1 4.082 0.02 . 1 . . . . . 484 LYS HA . 50897 1
474 . 1 . 1 84 84 LYS C C 13 178.466 0.05 . 1 . . . . . 484 LYS C . 50897 1
475 . 1 . 1 84 84 LYS CA C 13 59.515 0.08 . 1 . . . . . 484 LYS CA . 50897 1
476 . 1 . 1 84 84 LYS CB C 13 32.376 0.08 . 1 . . . . . 484 LYS CB . 50897 1
477 . 1 . 1 84 84 LYS N N 15 122.065 0.03 . 1 . . . . . 484 LYS N . 50897 1
478 . 1 . 1 85 85 ALA H H 1 7.755 0.01 . 1 . . . . . 485 ALA H . 50897 1
479 . 1 . 1 85 85 ALA HA H 1 4.367 0.02 . 1 . . . . . 485 ALA HA . 50897 1
480 . 1 . 1 85 85 ALA C C 13 177.803 0.05 . 1 . . . . . 485 ALA C . 50897 1
481 . 1 . 1 85 85 ALA CA C 13 52.570 0.08 . 1 . . . . . 485 ALA CA . 50897 1
482 . 1 . 1 85 85 ALA CB C 13 19.504 0.08 . 1 . . . . . 485 ALA CB . 50897 1
483 . 1 . 1 85 85 ALA N N 15 117.350 0.03 . 1 . . . . . 485 ALA N . 50897 1
484 . 1 . 1 86 86 GLY H H 1 8.062 0.01 . 1 . . . . . 486 GLY H . 50897 1
485 . 1 . 1 86 86 GLY C C 13 174.547 0.05 . 1 . . . . . 486 GLY C . 50897 1
486 . 1 . 1 86 86 GLY N N 15 107.148 0.03 . 1 . . . . . 486 GLY N . 50897 1
487 . 1 . 1 87 87 LEU H H 1 7.991 0.01 . 1 . . . . . 487 LEU H . 50897 1
488 . 1 . 1 87 87 LEU HA H 1 4.154 0.02 . 1 . . . . . 487 LEU HA . 50897 1
489 . 1 . 1 87 87 LEU C C 13 178.904 0.05 . 1 . . . . . 487 LEU C . 50897 1
490 . 1 . 1 87 87 LEU CA C 13 57.536 0.08 . 1 . . . . . 487 LEU CA . 50897 1
491 . 1 . 1 87 87 LEU CB C 13 41.949 0.08 . 1 . . . . . 487 LEU CB . 50897 1
492 . 1 . 1 87 87 LEU N N 15 121.835 0.03 . 1 . . . . . 487 LEU N . 50897 1
493 . 1 . 1 88 88 ILE H H 1 7.300 0.01 . 1 . . . . . 488 ILE H . 50897 1
494 . 1 . 1 88 88 ILE HA H 1 5.033 0.02 . 1 . . . . . 488 ILE HA . 50897 1
495 . 1 . 1 88 88 ILE C C 13 174.030 0.05 . 1 . . . . . 488 ILE C . 50897 1
496 . 1 . 1 88 88 ILE CA C 13 59.884 0.08 . 1 . . . . . 488 ILE CA . 50897 1
497 . 1 . 1 88 88 ILE CB C 13 41.070 0.08 . 1 . . . . . 488 ILE CB . 50897 1
498 . 1 . 1 88 88 ILE N N 15 108.773 0.03 . 1 . . . . . 488 ILE N . 50897 1
499 . 1 . 1 89 89 ARG H H 1 9.256 0.01 . 1 . . . . . 489 ARG H . 50897 1
500 . 1 . 1 89 89 ARG C C 13 175.698 0.05 . 1 . . . . . 489 ARG C . 50897 1
501 . 1 . 1 89 89 ARG CA C 13 54.629 0.08 . 1 . . . . . 489 ARG CA . 50897 1
502 . 1 . 1 89 89 ARG CB C 13 34.138 0.08 . 1 . . . . . 489 ARG CB . 50897 1
503 . 1 . 1 89 89 ARG N N 15 117.329 0.03 . 1 . . . . . 489 ARG N . 50897 1
504 . 1 . 1 90 90 HIS H H 1 8.824 0.01 . 1 . . . . . 490 HIS H . 50897 1
505 . 1 . 1 90 90 HIS HA H 1 4.350 0.02 . 1 . . . . . 490 HIS HA . 50897 1
506 . 1 . 1 90 90 HIS C C 13 176.939 0.05 . 1 . . . . . 490 HIS C . 50897 1
507 . 1 . 1 90 90 HIS CA C 13 57.955 0.08 . 1 . . . . . 490 HIS CA . 50897 1
508 . 1 . 1 90 90 HIS CB C 13 33.047 0.08 . 1 . . . . . 490 HIS CB . 50897 1
509 . 1 . 1 90 90 HIS N N 15 121.114 0.03 . 1 . . . . . 490 HIS N . 50897 1
510 . 1 . 1 91 91 THR H H 1 8.920 0.01 . 1 . . . . . 491 THR H . 50897 1
511 . 1 . 1 91 91 THR HA H 1 4.211 0.02 . 1 . . . . . 491 THR HA . 50897 1
512 . 1 . 1 91 91 THR C C 13 174.844 0.05 . 1 . . . . . 491 THR C . 50897 1
513 . 1 . 1 91 91 THR CA C 13 62.261 0.08 . 1 . . . . . 491 THR CA . 50897 1
514 . 1 . 1 91 91 THR CB C 13 69.792 0.08 . 1 . . . . . 491 THR CB . 50897 1
515 . 1 . 1 91 91 THR N N 15 110.953 0.03 . 1 . . . . . 491 THR N . 50897 1
516 . 1 . 1 92 92 VAL H H 1 7.699 0.01 . 1 . . . . . 492 VAL H . 50897 1
517 . 1 . 1 92 92 VAL C C 13 175.709 0.05 . 1 . . . . . 492 VAL C . 50897 1
518 . 1 . 1 92 92 VAL CA C 13 60.527 0.08 . 1 . . . . . 492 VAL CA . 50897 1
519 . 1 . 1 92 92 VAL N N 15 116.636 0.03 . 1 . . . . . 492 VAL N . 50897 1
520 . 1 . 1 93 93 ASN H H 1 8.427 0.01 . 1 . . . . . 493 ASN H . 50897 1
521 . 1 . 1 93 93 ASN HA H 1 4.603 0.02 . 1 . . . . . 493 ASN HA . 50897 1
522 . 1 . 1 93 93 ASN C C 13 174.047 0.05 . 1 . . . . . 493 ASN C . 50897 1
523 . 1 . 1 93 93 ASN CA C 13 53.566 0.08 . 1 . . . . . 493 ASN CA . 50897 1
524 . 1 . 1 93 93 ASN CB C 13 37.324 0.08 . 1 . . . . . 493 ASN CB . 50897 1
525 . 1 . 1 93 93 ASN N N 15 118.813 0.03 . 1 . . . . . 493 ASN N . 50897 1
526 . 1 . 1 94 94 LYS H H 1 7.593 0.01 . 1 . . . . . 494 LYS H . 50897 1
527 . 1 . 1 94 94 LYS HA H 1 4.262 0.02 . 1 . . . . . 494 LYS HA . 50897 1
528 . 1 . 1 94 94 LYS C C 13 175.097 0.05 . 1 . . . . . 494 LYS C . 50897 1
529 . 1 . 1 94 94 LYS CA C 13 55.383 0.08 . 1 . . . . . 494 LYS CA . 50897 1
530 . 1 . 1 94 94 LYS CB C 13 35.254 0.08 . 1 . . . . . 494 LYS CB . 50897 1
531 . 1 . 1 94 94 LYS N N 15 123.698 0.03 . 1 . . . . . 494 LYS N . 50897 1
532 . 1 . 1 95 95 ILE H H 1 8.338 0.01 . 1 . . . . . 495 ILE H . 50897 1
533 . 1 . 1 95 95 ILE HA H 1 4.314 0.02 . 1 . . . . . 495 ILE HA . 50897 1
534 . 1 . 1 95 95 ILE C C 13 176.652 0.05 . 1 . . . . . 495 ILE C . 50897 1
535 . 1 . 1 95 95 ILE CA C 13 62.456 0.08 . 1 . . . . . 495 ILE CA . 50897 1
536 . 1 . 1 95 95 ILE CB C 13 39.871 0.08 . 1 . . . . . 495 ILE CB . 50897 1
537 . 1 . 1 95 95 ILE N N 15 117.530 0.03 . 1 . . . . . 495 ILE N . 50897 1
538 . 1 . 1 96 96 THR H H 1 7.835 0.01 . 1 . . . . . 496 THR H . 50897 1
539 . 1 . 1 96 96 THR HA H 1 4.404 0.02 . 1 . . . . . 496 THR HA . 50897 1
540 . 1 . 1 96 96 THR CA C 13 61.590 0.08 . 1 . . . . . 496 THR CA . 50897 1
541 . 1 . 1 96 96 THR CB C 13 70.340 0.08 . 1 . . . . . 496 THR CB . 50897 1
542 . 1 . 1 96 96 THR N N 15 113.602 0.03 . 1 . . . . . 496 THR N . 50897 1
543 . 1 . 1 97 97 PHE HA H 1 4.152 0.02 . 1 . . . . . 497 PHE HA . 50897 1
544 . 1 . 1 97 97 PHE C C 13 174.137 0.05 . 1 . . . . . 497 PHE C . 50897 1
545 . 1 . 1 97 97 PHE CA C 13 60.148 0.08 . 1 . . . . . 497 PHE CA . 50897 1
546 . 1 . 1 97 97 PHE CB C 13 39.645 0.08 . 1 . . . . . 497 PHE CB . 50897 1
547 . 1 . 1 98 98 SER H H 1 6.920 0.01 . 1 . . . . . 498 SER H . 50897 1
548 . 1 . 1 98 98 SER HA H 1 4.641 0.02 . 1 . . . . . 498 SER HA . 50897 1
549 . 1 . 1 98 98 SER CA C 13 55.244 0.08 . 1 . . . . . 498 SER CA . 50897 1
550 . 1 . 1 98 98 SER CB C 13 64.931 0.08 . 1 . . . . . 498 SER CB . 50897 1
551 . 1 . 1 98 98 SER N N 15 119.544 0.03 . 1 . . . . . 498 SER N . 50897 1
552 . 1 . 1 99 99 GLU HA H 1 3.490 0.02 . 1 . . . . . 499 GLU HA . 50897 1
553 . 1 . 1 99 99 GLU C C 13 175.799 0.05 . 1 . . . . . 499 GLU C . 50897 1
554 . 1 . 1 99 99 GLU CA C 13 60.424 0.08 . 1 . . . . . 499 GLU CA . 50897 1
555 . 1 . 1 99 99 GLU CB C 13 30.503 0.08 . 1 . . . . . 499 GLU CB . 50897 1
556 . 1 . 1 100 100 GLN H H 1 7.896 0.01 . 1 . . . . . 500 GLN H . 50897 1
557 . 1 . 1 100 100 GLN C C 13 175.698 0.05 . 1 . . . . . 500 GLN C . 50897 1
558 . 1 . 1 100 100 GLN CA C 13 56.362 0.08 . 1 . . . . . 500 GLN CA . 50897 1
559 . 1 . 1 100 100 GLN CB C 13 29.106 0.08 . 1 . . . . . 500 GLN CB . 50897 1
560 . 1 . 1 100 100 GLN N N 15 114.512 0.03 . 1 . . . . . 500 GLN N . 50897 1
561 . 1 . 1 101 101 CYS H H 1 6.565 0.01 . 1 . . . . . 501 CYS H . 50897 1
562 . 1 . 1 101 101 CYS HA H 1 4.171 0.02 . 1 . . . . . 501 CYS HA . 50897 1
563 . 1 . 1 101 101 CYS C C 13 171.201 0.05 . 1 . . . . . 501 CYS C . 50897 1
564 . 1 . 1 101 101 CYS CA C 13 58.469 0.08 . 1 . . . . . 501 CYS CA . 50897 1
565 . 1 . 1 101 101 CYS CB C 13 29.508 0.08 . 1 . . . . . 501 CYS CB . 50897 1
566 . 1 . 1 101 101 CYS N N 15 115.546 0.03 . 1 . . . . . 501 CYS N . 50897 1
567 . 1 . 1 102 102 TYR H H 1 8.092 0.01 . 1 . . . . . 502 TYR H . 50897 1
568 . 1 . 1 102 102 TYR HA H 1 5.008 0.02 . 1 . . . . . 502 TYR HA . 50897 1
569 . 1 . 1 102 102 TYR C C 13 175.552 0.05 . 1 . . . . . 502 TYR C . 50897 1
570 . 1 . 1 102 102 TYR CA C 13 56.935 0.08 . 1 . . . . . 502 TYR CA . 50897 1
571 . 1 . 1 102 102 TYR CB C 13 40.092 0.08 . 1 . . . . . 502 TYR CB . 50897 1
572 . 1 . 1 102 102 TYR N N 15 117.361 0.03 . 1 . . . . . 502 TYR N . 50897 1
573 . 1 . 1 103 103 TYR H H 1 9.228 0.01 . 1 . . . . . 503 TYR H . 50897 1
574 . 1 . 1 103 103 TYR C C 13 172.211 0.05 . 1 . . . . . 503 TYR C . 50897 1
575 . 1 . 1 103 103 TYR CA C 13 57.005 0.08 . 1 . . . . . 503 TYR CA . 50897 1
576 . 1 . 1 103 103 TYR CB C 13 43.770 0.08 . 1 . . . . . 503 TYR CB . 50897 1
577 . 1 . 1 103 103 TYR N N 15 123.289 0.03 . 1 . . . . . 503 TYR N . 50897 1
578 . 1 . 1 104 104 VAL H H 1 7.985 0.01 . 1 . . . . . 504 VAL H . 50897 1
579 . 1 . 1 104 104 VAL HA H 1 4.396 0.02 . 1 . . . . . 504 VAL HA . 50897 1
580 . 1 . 1 104 104 VAL C C 13 176.866 0.05 . 1 . . . . . 504 VAL C . 50897 1
581 . 1 . 1 104 104 VAL CA C 13 58.801 0.08 . 1 . . . . . 504 VAL CA . 50897 1
582 . 1 . 1 104 104 VAL N N 15 106.579 0.03 . 1 . . . . . 504 VAL N . 50897 1
583 . 1 . 1 105 105 PHE H H 1 8.964 0.01 . 1 . . . . . 505 PHE H . 50897 1
584 . 1 . 1 105 105 PHE C C 13 177.742 0.05 . 1 . . . . . 505 PHE C . 50897 1
585 . 1 . 1 105 105 PHE CA C 13 61.450 0.08 . 1 . . . . . 505 PHE CA . 50897 1
586 . 1 . 1 105 105 PHE CB C 13 40.260 0.08 . 1 . . . . . 505 PHE CB . 50897 1
587 . 1 . 1 105 105 PHE N N 15 118.989 0.03 . 1 . . . . . 505 PHE N . 50897 1
588 . 1 . 1 106 106 GLY H H 1 8.179 0.01 . 1 . . . . . 506 GLY H . 50897 1
589 . 1 . 1 106 106 GLY HA2 H 1 4.188 0.02 . 2 . . . . . 506 GLY HA2 . 50897 1
590 . 1 . 1 106 106 GLY HA3 H 1 3.813 0.02 . 2 . . . . . 506 GLY HA3 . 50897 1
591 . 1 . 1 106 106 GLY C C 13 172.200 0.05 . 1 . . . . . 506 GLY C . 50897 1
592 . 1 . 1 106 106 GLY CA C 13 43.642 0.08 . 1 . . . . . 506 GLY CA . 50897 1
593 . 1 . 1 106 106 GLY N N 15 107.973 0.03 . 1 . . . . . 506 GLY N . 50897 1
594 . 1 . 1 107 107 ASP H H 1 8.222 0.01 . 1 . . . . . 507 ASP H . 50897 1
595 . 1 . 1 107 107 ASP HA H 1 4.548 0.02 . 1 . . . . . 507 ASP HA . 50897 1
596 . 1 . 1 107 107 ASP C C 13 176.630 0.05 . 1 . . . . . 507 ASP C . 50897 1
597 . 1 . 1 107 107 ASP CA C 13 54.629 0.08 . 1 . . . . . 507 ASP CA . 50897 1
598 . 1 . 1 107 107 ASP CB C 13 40.595 0.08 . 1 . . . . . 507 ASP CB . 50897 1
599 . 1 . 1 107 107 ASP N N 15 119.353 0.03 . 1 . . . . . 507 ASP N . 50897 1
600 . 1 . 1 108 108 LEU H H 1 8.552 0.01 . 1 . . . . . 508 LEU H . 50897 1
601 . 1 . 1 108 108 LEU HA H 1 4.453 0.02 . 1 . . . . . 508 LEU HA . 50897 1
602 . 1 . 1 108 108 LEU C C 13 177.528 0.05 . 1 . . . . . 508 LEU C . 50897 1
603 . 1 . 1 108 108 LEU CA C 13 54.307 0.08 . 1 . . . . . 508 LEU CA . 50897 1
604 . 1 . 1 108 108 LEU CB C 13 41.350 0.08 . 1 . . . . . 508 LEU CB . 50897 1
605 . 1 . 1 108 108 LEU N N 15 126.189 0.03 . 1 . . . . . 508 LEU N . 50897 1
606 . 1 . 1 109 109 SER H H 1 8.336 0.01 . 1 . . . . . 509 SER H . 50897 1
607 . 1 . 1 109 109 SER HA H 1 4.324 0.02 . 1 . . . . . 509 SER HA . 50897 1
608 . 1 . 1 109 109 SER C C 13 174.294 0.05 . 1 . . . . . 509 SER C . 50897 1
609 . 1 . 1 109 109 SER CA C 13 59.269 0.08 . 1 . . . . . 509 SER CA . 50897 1
610 . 1 . 1 109 109 SER CB C 13 64.134 0.08 . 1 . . . . . 509 SER CB . 50897 1
611 . 1 . 1 109 109 SER N N 15 116.525 0.03 . 1 . . . . . 509 SER N . 50897 1
612 . 1 . 1 110 110 GLY H H 1 8.174 0.01 . 1 . . . . . 510 GLY H . 50897 1
613 . 1 . 1 110 110 GLY HA2 H 1 3.739 0.02 . 2 . . . . . 510 GLY HA2 . 50897 1
614 . 1 . 1 110 110 GLY HA3 H 1 3.727 0.02 . 2 . . . . . 510 GLY HA3 . 50897 1
615 . 1 . 1 110 110 GLY CA C 13 46.158 0.08 . 1 . . . . . 510 GLY CA . 50897 1
616 . 1 . 1 110 110 GLY N N 15 116.782 0.03 . 1 . . . . . 510 GLY N . 50897 1
stop_
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