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 52152
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Xylanase A'
_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 '3D HNCA' . . . 52152 1
2 '3D HNCO' . . . 52152 1
3 '3D HNCACB' . . . 52152 1
4 '3D CBCA(CO)NH' . . . 52152 1
5 '3D HN(CA)CO' . . . 52152 1
6 '3D HN(CO)CA' . . . 52152 1
7 '2D 1H-15N HSQC' . . . 52152 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
3 $software_3 . . 52152 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 4 4 MET H H 1 8.330434431 0.001547312456 . 1 . . . . . 0 MET H . 52152 1
2 . 1 . 1 4 4 MET C C 13 175.5496242 0 . 1 . . . . . 0 MET C . 52152 1
3 . 1 . 1 4 4 MET CA C 13 55.51110029 0.09181021902 . 1 . . . . . 0 MET CA . 52152 1
4 . 1 . 1 4 4 MET CB C 13 32.69410813 0 . 1 . . . . . 0 MET CB . 52152 1
5 . 1 . 1 4 4 MET N N 15 122.2710857 0.05932493093 . 1 . . . . . 0 MET N . 52152 1
6 . 1 . 1 5 5 ALA H H 1 8.460099561 0.001694319083 . 1 . . . . . 1 ALA H . 52152 1
7 . 1 . 1 5 5 ALA C C 13 177.6222638 0 . 1 . . . . . 1 ALA C . 52152 1
8 . 1 . 1 5 5 ALA CA C 13 52.31023368 0.1080827504 . 1 . . . . . 1 ALA CA . 52152 1
9 . 1 . 1 5 5 ALA CB C 13 19.29835884 0 . 1 . . . . . 1 ALA CB . 52152 1
10 . 1 . 1 5 5 ALA N N 15 126.2297907 0.08254467494 . 1 . . . . . 1 ALA N . 52152 1
11 . 1 . 1 6 6 SER H H 1 8.558637117 0.001475313419 . 1 . . . . . 2 SER H . 52152 1
12 . 1 . 1 6 6 SER C C 13 174.8478895 0 . 1 . . . . . 2 SER C . 52152 1
13 . 1 . 1 6 6 SER CA C 13 58.80825333 0.08430806297 . 1 . . . . . 2 SER CA . 52152 1
14 . 1 . 1 6 6 SER CB C 13 64.30541362 0 . 1 . . . . . 2 SER CB . 52152 1
15 . 1 . 1 6 6 SER N N 15 116.7184537 0.07314163675 . 1 . . . . . 2 SER N . 52152 1
16 . 1 . 1 7 7 THR H H 1 7.881507448 0.00167192773 . 1 . . . . . 3 THR H . 52152 1
17 . 1 . 1 7 7 THR C C 13 174.7661466 0 . 1 . . . . . 3 THR C . 52152 1
18 . 1 . 1 7 7 THR CA C 13 61.90417497 0.07794520085 . 1 . . . . . 3 THR CA . 52152 1
19 . 1 . 1 7 7 THR CB C 13 69.07865807 0 . 1 . . . . . 3 THR CB . 52152 1
20 . 1 . 1 7 7 THR N N 15 111.9214913 0.07279181218 . 1 . . . . . 3 THR N . 52152 1
21 . 1 . 1 8 8 ASP H H 1 7.998528772 0.00235476265 . 1 . . . . . 4 ASP H . 52152 1
22 . 1 . 1 8 8 ASP CA C 13 53.42266724 0 . 1 . . . . . 4 ASP CA . 52152 1
23 . 1 . 1 8 8 ASP CB C 13 41.99447832 0 . 1 . . . . . 4 ASP CB . 52152 1
24 . 1 . 1 8 8 ASP N N 15 119.3888582 0.05941484703 . 1 . . . . . 4 ASP N . 52152 1
25 . 1 . 1 9 9 TYR H H 1 7.884353131 0.002877469854 . 1 . . . . . 5 TYR H . 52152 1
26 . 1 . 1 9 9 TYR C C 13 172.9691964 0 . 1 . . . . . 5 TYR C . 52152 1
27 . 1 . 1 9 9 TYR CA C 13 58.24680446 0.07662056688 . 1 . . . . . 5 TYR CA . 52152 1
28 . 1 . 1 9 9 TYR N N 15 121.1924295 0.08096764003 . 1 . . . . . 5 TYR N . 52152 1
29 . 1 . 1 10 10 TRP H H 1 7.366664083 0.002137575417 . 1 . . . . . 6 TRP H . 52152 1
30 . 1 . 1 10 10 TRP C C 13 171.1462269 0 . 1 . . . . . 6 TRP C . 52152 1
31 . 1 . 1 10 10 TRP CA C 13 54.22054508 0.08614160842 . 1 . . . . . 6 TRP CA . 52152 1
32 . 1 . 1 10 10 TRP CB C 13 32.52469065 0 . 1 . . . . . 6 TRP CB . 52152 1
33 . 1 . 1 10 10 TRP N N 15 132.068829 0.08846476755 . 1 . . . . . 6 TRP N . 52152 1
34 . 1 . 1 11 11 GLN H H 1 8.099689361 0.002420555615 . 1 . . . . . 7 GLN H . 52152 1
35 . 1 . 1 11 11 GLN C C 13 171.9567945 0 . 1 . . . . . 7 GLN C . 52152 1
36 . 1 . 1 11 11 GLN CA C 13 52.37932286 0.03476477328 . 1 . . . . . 7 GLN CA . 52152 1
37 . 1 . 1 11 11 GLN CB C 13 29.93425329 0 . 1 . . . . . 7 GLN CB . 52152 1
38 . 1 . 1 11 11 GLN N N 15 127.6762451 0.07752029856 . 1 . . . . . 7 GLN N . 52152 1
39 . 1 . 1 12 12 ASN H H 1 7.951911521 0.00142431551 . 1 . . . . . 8 ASN H . 52152 1
40 . 1 . 1 12 12 ASN C C 13 172.7934573 0 . 1 . . . . . 8 ASN C . 52152 1
41 . 1 . 1 12 12 ASN CA C 13 52.34215607 0.1155850805 . 1 . . . . . 8 ASN CA . 52152 1
42 . 1 . 1 12 12 ASN CB C 13 37.16763239 0.000000674 . 1 . . . . . 8 ASN CB . 52152 1
43 . 1 . 1 12 12 ASN N N 15 124.1220626 0.05745545992 . 1 . . . . . 8 ASN N . 52152 1
44 . 1 . 1 13 13 TRP H H 1 8.573865249 0.00172756092 . 1 . . . . . 9 TRP H . 52152 1
45 . 1 . 1 13 13 TRP C C 13 173.7172448 0 . 1 . . . . . 9 TRP C . 52152 1
46 . 1 . 1 13 13 TRP CA C 13 57.21978146 0.05449982972 . 1 . . . . . 9 TRP CA . 52152 1
47 . 1 . 1 13 13 TRP CB C 13 31.36805623 0 . 1 . . . . . 9 TRP CB . 52152 1
48 . 1 . 1 13 13 TRP N N 15 126.544502 0.09548837015 . 1 . . . . . 9 TRP N . 52152 1
49 . 1 . 1 14 14 THR H H 1 7.08144484 0.002570427641 . 1 . . . . . 10 THR H . 52152 1
50 . 1 . 1 14 14 THR C C 13 170.804969 0 . 1 . . . . . 10 THR C . 52152 1
51 . 1 . 1 14 14 THR CA C 13 57.76452096 0 . 1 . . . . . 10 THR CA . 52152 1
52 . 1 . 1 14 14 THR CB C 13 70.02632862 0 . 1 . . . . . 10 THR CB . 52152 1
53 . 1 . 1 14 14 THR N N 15 119.5577055 0.1001149665 . 1 . . . . . 10 THR N . 52152 1
54 . 1 . 1 15 15 ASP H H 1 7.426890597 0.002145443428 . 1 . . . . . 11 ASP H . 52152 1
55 . 1 . 1 15 15 ASP C C 13 177.1395402 0 . 1 . . . . . 11 ASP C . 52152 1
56 . 1 . 1 15 15 ASP CA C 13 53.27446738 0 . 1 . . . . . 11 ASP CA . 52152 1
57 . 1 . 1 15 15 ASP CB C 13 39.89217859 0 . 1 . . . . . 11 ASP CB . 52152 1
58 . 1 . 1 15 15 ASP N N 15 122.8239529 0.05886826495 . 1 . . . . . 11 ASP N . 52152 1
59 . 1 . 1 16 16 GLY H H 1 8.411124086 0.00190483815 . 1 . . . . . 12 GLY H . 52152 1
60 . 1 . 1 16 16 GLY C C 13 174.9689163 0 . 1 . . . . . 12 GLY C . 52152 1
61 . 1 . 1 16 16 GLY CA C 13 44.73327432 0 . 1 . . . . . 12 GLY CA . 52152 1
62 . 1 . 1 16 16 GLY N N 15 109.1572975 0.0450548865 . 1 . . . . . 12 GLY N . 52152 1
63 . 1 . 1 17 17 GLY H H 1 8.429991352 0.00318550242 . 1 . . . . . 13 GLY H . 52152 1
64 . 1 . 1 17 17 GLY CA C 13 45.03842801 0.1825202845 . 1 . . . . . 13 GLY CA . 52152 1
65 . 1 . 1 17 17 GLY N N 15 109.77017 0.05406354996 . 1 . . . . . 13 GLY N . 52152 1
66 . 1 . 1 18 18 GLY H H 1 8.471335717 0.002018998193 . 1 . . . . . 14 GLY H . 52152 1
67 . 1 . 1 18 18 GLY C C 13 173.0021429 0 . 1 . . . . . 14 GLY C . 52152 1
68 . 1 . 1 18 18 GLY CA C 13 46.50198973 0 . 1 . . . . . 14 GLY CA . 52152 1
69 . 1 . 1 18 18 GLY N N 15 113.808344 0.02080708466 . 1 . . . . . 14 GLY N . 52152 1
70 . 1 . 1 19 19 ILE H H 1 8.142281145 0.002790576281 . 1 . . . . . 15 ILE H . 52152 1
71 . 1 . 1 19 19 ILE C C 13 174.6370509 0 . 1 . . . . . 15 ILE C . 52152 1
72 . 1 . 1 19 19 ILE CA C 13 59.94564061 0.1730156108 . 1 . . . . . 15 ILE CA . 52152 1
73 . 1 . 1 19 19 ILE CB C 13 40.88278117 0 . 1 . . . . . 15 ILE CB . 52152 1
74 . 1 . 1 19 19 ILE N N 15 121.3455604 0.04811275928 . 1 . . . . . 15 ILE N . 52152 1
75 . 1 . 1 20 20 VAL H H 1 8.44698217 0.002233665959 . 1 . . . . . 16 VAL H . 52152 1
76 . 1 . 1 20 20 VAL C C 13 174.1408223 0 . 1 . . . . . 16 VAL C . 52152 1
77 . 1 . 1 20 20 VAL CA C 13 62.20939538 0.1371942919 . 1 . . . . . 16 VAL CA . 52152 1
78 . 1 . 1 20 20 VAL CB C 13 32.68362843 0 . 1 . . . . . 16 VAL CB . 52152 1
79 . 1 . 1 20 20 VAL N N 15 127.2747944 0.06681634481 . 1 . . . . . 16 VAL N . 52152 1
80 . 1 . 1 21 21 ASN H H 1 8.687830617 0.002356187199 . 1 . . . . . 17 ASN H . 52152 1
81 . 1 . 1 21 21 ASN C C 13 173.4423348 0 . 1 . . . . . 17 ASN C . 52152 1
82 . 1 . 1 21 21 ASN CA C 13 51.93259876 0.09280742652 . 1 . . . . . 17 ASN CA . 52152 1
83 . 1 . 1 21 21 ASN CB C 13 38.20551106 0 . 1 . . . . . 17 ASN CB . 52152 1
84 . 1 . 1 21 21 ASN N N 15 126.1986451 0.09540279971 . 1 . . . . . 17 ASN N . 52152 1
85 . 1 . 1 22 22 ALA H H 1 8.773326117 0.001488364497 . 1 . . . . . 18 ALA H . 52152 1
86 . 1 . 1 22 22 ALA C C 13 176.285284 0 . 1 . . . . . 18 ALA C . 52152 1
87 . 1 . 1 22 22 ALA CA C 13 50.74078778 0.06928642483 . 1 . . . . . 18 ALA CA . 52152 1
88 . 1 . 1 22 22 ALA CB C 13 22.11830872 0.0000002384 . 1 . . . . . 18 ALA CB . 52152 1
89 . 1 . 1 22 22 ALA N N 15 130.2427934 0.01974706789 . 1 . . . . . 18 ALA N . 52152 1
90 . 1 . 1 23 23 VAL H H 1 9.351664965 0.001152764376 . 1 . . . . . 19 VAL H . 52152 1
91 . 1 . 1 23 23 VAL C C 13 174.1065189 0 . 1 . . . . . 19 VAL C . 52152 1
92 . 1 . 1 23 23 VAL CA C 13 62.06734249 0.09715586673 . 1 . . . . . 19 VAL CA . 52152 1
93 . 1 . 1 23 23 VAL CB C 13 33.70449411 0.1054311788 . 1 . . . . . 19 VAL CB . 52152 1
94 . 1 . 1 23 23 VAL N N 15 124.9126835 0.08513047267 . 1 . . . . . 19 VAL N . 52152 1
95 . 1 . 1 24 24 ASN H H 1 8.323153428 0.001702152528 . 1 . . . . . 20 ASN H . 52152 1
96 . 1 . 1 24 24 ASN C C 13 174.938203 0 . 1 . . . . . 20 ASN C . 52152 1
97 . 1 . 1 24 24 ASN CA C 13 51.50323327 0.126404748 . 1 . . . . . 20 ASN CA . 52152 1
98 . 1 . 1 24 24 ASN CB C 13 35.1370069 0 . 1 . . . . . 20 ASN CB . 52152 1
99 . 1 . 1 24 24 ASN N N 15 126.0733388 0.07407458639 . 1 . . . . . 20 ASN N . 52152 1
100 . 1 . 1 25 25 GLY H H 1 7.170438521 0.002735464949 . 1 . . . . . 21 GLY H . 52152 1
101 . 1 . 1 25 25 GLY C C 13 172.6172692 0 . 1 . . . . . 21 GLY C . 52152 1
102 . 1 . 1 25 25 GLY CA C 13 44.01062011 0.1983705442 . 1 . . . . . 21 GLY CA . 52152 1
103 . 1 . 1 25 25 GLY N N 15 113.433897 0.08899657943 . 1 . . . . . 21 GLY N . 52152 1
104 . 1 . 1 26 26 SER H H 1 8.290608613 0.001742769428 . 1 . . . . . 22 SER H . 52152 1
105 . 1 . 1 26 26 SER C C 13 176.7486172 0 . 1 . . . . . 22 SER C . 52152 1
106 . 1 . 1 26 26 SER CA C 13 58.53493091 0.1004762786 . 1 . . . . . 22 SER CA . 52152 1
107 . 1 . 1 26 26 SER CB C 13 63.51449835 0 . 1 . . . . . 22 SER CB . 52152 1
108 . 1 . 1 26 26 SER N N 15 113.0461526 0.06850615917 . 1 . . . . . 22 SER N . 52152 1
109 . 1 . 1 27 27 GLY H H 1 8.893267525 0.002376880911 . 1 . . . . . 23 GLY H . 52152 1
110 . 1 . 1 27 27 GLY C C 13 175.6881724 0 . 1 . . . . . 23 GLY C . 52152 1
111 . 1 . 1 27 27 GLY CA C 13 47.3925565 0.1284463103 . 1 . . . . . 23 GLY CA . 52152 1
112 . 1 . 1 27 27 GLY N N 15 113.88441 0.037960248 . 1 . . . . . 23 GLY N . 52152 1
113 . 1 . 1 28 28 GLY H H 1 9.276135494 0.004525343298 . 1 . . . . . 24 GLY H . 52152 1
114 . 1 . 1 28 28 GLY CA C 13 45.97597683 0 . 1 . . . . . 24 GLY CA . 52152 1
115 . 1 . 1 28 28 GLY N N 15 116.2891136 0.04130103846 . 1 . . . . . 24 GLY N . 52152 1
116 . 1 . 1 29 29 ASN H H 1 8.119165665 0.002405343052 . 1 . . . . . 25 ASN H . 52152 1
117 . 1 . 1 29 29 ASN C C 13 175.4934632 0 . 1 . . . . . 25 ASN C . 52152 1
118 . 1 . 1 29 29 ASN CA C 13 54.20087497 0.1175669312 . 1 . . . . . 25 ASN CA . 52152 1
119 . 1 . 1 29 29 ASN CB C 13 42.52679802 0 . 1 . . . . . 25 ASN CB . 52152 1
120 . 1 . 1 29 29 ASN N N 15 119.060989 0.07284620516 . 1 . . . . . 25 ASN N . 52152 1
121 . 1 . 1 30 30 TYR H H 1 9.69123056 0.001619512664 . 1 . . . . . 26 TYR H . 52152 1
122 . 1 . 1 30 30 TYR C C 13 170.8010193 0 . 1 . . . . . 26 TYR C . 52152 1
123 . 1 . 1 30 30 TYR CA C 13 57.46528619 0.09307718688 . 1 . . . . . 26 TYR CA . 52152 1
124 . 1 . 1 30 30 TYR CB C 13 42.7637525 0.05973043807 . 1 . . . . . 26 TYR CB . 52152 1
125 . 1 . 1 30 30 TYR N N 15 124.9828805 0.06132082013 . 1 . . . . . 26 TYR N . 52152 1
126 . 1 . 1 31 31 SER H H 1 8.694981665 0.001824627978 . 1 . . . . . 27 SER H . 52152 1
127 . 1 . 1 31 31 SER C C 13 173.0883439 0 . 1 . . . . . 27 SER C . 52152 1
128 . 1 . 1 31 31 SER CA C 13 56.53599092 0.01572117687 . 1 . . . . . 27 SER CA . 52152 1
129 . 1 . 1 31 31 SER CB C 13 66.4353266 0 . 1 . . . . . 27 SER CB . 52152 1
130 . 1 . 1 31 31 SER N N 15 111.785825 0.08024989617 . 1 . . . . . 27 SER N . 52152 1
131 . 1 . 1 32 32 VAL H H 1 9.106367468 0.001434578602 . 1 . . . . . 28 VAL H . 52152 1
132 . 1 . 1 32 32 VAL C C 13 174.007252 0 . 1 . . . . . 28 VAL C . 52152 1
133 . 1 . 1 32 32 VAL CA C 13 60.9835362 0.07748208742 . 1 . . . . . 28 VAL CA . 52152 1
134 . 1 . 1 32 32 VAL CB C 13 34.57687746 0 . 1 . . . . . 28 VAL CB . 52152 1
135 . 1 . 1 32 32 VAL N N 15 119.0006211 0.1153384037 . 1 . . . . . 28 VAL N . 52152 1
136 . 1 . 1 33 33 ASN H H 1 8.421834125 0.001587938992 . 1 . . . . . 29 ASN H . 52152 1
137 . 1 . 1 33 33 ASN C C 13 173.1841233 0 . 1 . . . . . 29 ASN C . 52152 1
138 . 1 . 1 33 33 ASN CA C 13 53.132247 0.01170904645 . 1 . . . . . 29 ASN CA . 52152 1
139 . 1 . 1 33 33 ASN CB C 13 41.44020379 0 . 1 . . . . . 29 ASN CB . 52152 1
140 . 1 . 1 33 33 ASN N N 15 126.2732276 0.08894775863 . 1 . . . . . 29 ASN N . 52152 1
141 . 1 . 1 34 34 TRP H H 1 9.331280441 0.002816226289 . 1 . . . . . 30 TRP H . 52152 1
142 . 1 . 1 34 34 TRP C C 13 175.1186696 0 . 1 . . . . . 30 TRP C . 52152 1
143 . 1 . 1 34 34 TRP CA C 13 55.43219035 0.08137736744 . 1 . . . . . 30 TRP CA . 52152 1
144 . 1 . 1 34 34 TRP CB C 13 32.77002557 0 . 1 . . . . . 30 TRP CB . 52152 1
145 . 1 . 1 34 34 TRP N N 15 125.4999795 0.05499598726 . 1 . . . . . 30 TRP N . 52152 1
146 . 1 . 1 35 35 SER H H 1 9.19911728 0.002847436422 . 1 . . . . . 31 SER H . 52152 1
147 . 1 . 1 35 35 SER C C 13 172.3357991 0 . 1 . . . . . 31 SER C . 52152 1
148 . 1 . 1 35 35 SER CA C 13 57.42121423 0 . 1 . . . . . 31 SER CA . 52152 1
149 . 1 . 1 35 35 SER CB C 13 64.76224686 0 . 1 . . . . . 31 SER CB . 52152 1
150 . 1 . 1 35 35 SER N N 15 116.4102318 0.08709404563 . 1 . . . . . 31 SER N . 52152 1
151 . 1 . 1 37 37 THR H H 1 8.145131037 0.002461117233 . 1 . . . . . 33 THR H . 52152 1
152 . 1 . 1 37 37 THR C C 13 178.78249 0 . 1 . . . . . 33 THR C . 52152 1
153 . 1 . 1 37 37 THR CA C 13 63.00849226 0.0720230552 . 1 . . . . . 33 THR CA . 52152 1
154 . 1 . 1 37 37 THR CB C 13 71.23418782 0.00000095 . 1 . . . . . 33 THR CB . 52152 1
155 . 1 . 1 37 37 THR N N 15 106.2922637 0.06110768792 . 1 . . . . . 33 THR N . 52152 1
156 . 1 . 1 38 38 GLY H H 1 7.572032563 0.001815264325 . 1 . . . . . 34 GLY H . 52152 1
157 . 1 . 1 38 38 GLY N N 15 106.1163424 0.06942546124 . 1 . . . . . 34 GLY N . 52152 1
158 . 1 . 1 39 39 ASN H H 1 9.675556763 0.002595507931 . 1 . . . . . 35 ASN H . 52152 1
159 . 1 . 1 39 39 ASN CA C 13 52.28162246 0.2203691729 . 1 . . . . . 35 ASN CA . 52152 1
160 . 1 . 1 39 39 ASN N N 15 128.2199562 0.07035144535 . 1 . . . . . 35 ASN N . 52152 1
161 . 1 . 1 40 40 PHE H H 1 7.689669197 0.001659374767 . 1 . . . . . 36 PHE H . 52152 1
162 . 1 . 1 40 40 PHE C C 13 172.3991719 0 . 1 . . . . . 36 PHE C . 52152 1
163 . 1 . 1 40 40 PHE CA C 13 52.3434921 0.2112451432 . 1 . . . . . 36 PHE CA . 52152 1
164 . 1 . 1 40 40 PHE CB C 13 41.6915544 0 . 1 . . . . . 36 PHE CB . 52152 1
165 . 1 . 1 40 40 PHE N N 15 119.1707949 0.09548388327 . 1 . . . . . 36 PHE N . 52152 1
166 . 1 . 1 41 41 VAL H H 1 9.112555906 0.00271895798 . 1 . . . . . 37 VAL H . 52152 1
167 . 1 . 1 41 41 VAL C C 13 173.4176607 0 . 1 . . . . . 37 VAL C . 52152 1
168 . 1 . 1 41 41 VAL CA C 13 62.72245786 0.09260818285 . 1 . . . . . 37 VAL CA . 52152 1
169 . 1 . 1 41 41 VAL CB C 13 35.46544951 0 . 1 . . . . . 37 VAL CB . 52152 1
170 . 1 . 1 41 41 VAL N N 15 120.0779404 0.08451621888 . 1 . . . . . 37 VAL N . 52152 1
171 . 1 . 1 42 42 VAL H H 1 8.55446706 0.003030203247 . 1 . . . . . 38 VAL H . 52152 1
172 . 1 . 1 42 42 VAL C C 13 174.7350167 0 . 1 . . . . . 38 VAL C . 52152 1
173 . 1 . 1 42 42 VAL CA C 13 58.34834356 0 . 1 . . . . . 38 VAL CA . 52152 1
174 . 1 . 1 42 42 VAL CB C 13 36.29346714 0 . 1 . . . . . 38 VAL CB . 52152 1
175 . 1 . 1 42 42 VAL N N 15 127.0491436 0.08109748382 . 1 . . . . . 38 VAL N . 52152 1
176 . 1 . 1 43 43 GLY H H 1 8.39038282 0.002330048508 . 1 . . . . . 39 GLY H . 52152 1
177 . 1 . 1 43 43 GLY C C 13 169.737829 0 . 1 . . . . . 39 GLY C . 52152 1
178 . 1 . 1 43 43 GLY CA C 13 45.62143735 0.1692300878 . 1 . . . . . 39 GLY CA . 52152 1
179 . 1 . 1 43 43 GLY N N 15 108.7896143 0.09558064228 . 1 . . . . . 39 GLY N . 52152 1
180 . 1 . 1 44 44 LYS H H 1 6.368567534 0.002428579925 . 1 . . . . . 40 LYS H . 52152 1
181 . 1 . 1 44 44 LYS C C 13 175.4056183 0 . 1 . . . . . 40 LYS C . 52152 1
182 . 1 . 1 44 44 LYS CA C 13 54.52729857 0.1175330708 . 1 . . . . . 40 LYS CA . 52152 1
183 . 1 . 1 44 44 LYS CB C 13 38.22424144 0 . 1 . . . . . 40 LYS CB . 52152 1
184 . 1 . 1 44 44 LYS N N 15 115.7377471 0.07498408282 . 1 . . . . . 40 LYS N . 52152 1
185 . 1 . 1 45 45 GLY H H 1 7.966132837 0.002172627243 . 1 . . . . . 41 GLY H . 52152 1
186 . 1 . 1 45 45 GLY C C 13 170.3389841 0 . 1 . . . . . 41 GLY C . 52152 1
187 . 1 . 1 45 45 GLY CA C 13 47.32987371 0.05234544529 . 1 . . . . . 41 GLY CA . 52152 1
188 . 1 . 1 45 45 GLY N N 15 108.5481169 0.09558179433 . 1 . . . . . 41 GLY N . 52152 1
189 . 1 . 1 46 46 TRP H H 1 9.622094603 0.002502530849 . 1 . . . . . 42 TRP H . 52152 1
190 . 1 . 1 46 46 TRP C C 13 174.9283257 0 . 1 . . . . . 42 TRP C . 52152 1
191 . 1 . 1 46 46 TRP CA C 13 59.57096785 0.01757626147 . 1 . . . . . 42 TRP CA . 52152 1
192 . 1 . 1 46 46 TRP CB C 13 32.51070762 0 . 1 . . . . . 42 TRP CB . 52152 1
193 . 1 . 1 46 46 TRP N N 15 130.0219081 0.06916269474 . 1 . . . . . 42 TRP N . 52152 1
194 . 1 . 1 47 47 THR H H 1 10.10941842 0.002015564595 . 1 . . . . . 43 THR H . 52152 1
195 . 1 . 1 47 47 THR C C 13 174.9996164 0 . 1 . . . . . 43 THR C . 52152 1
196 . 1 . 1 47 47 THR CA C 13 66.2871332 0 . 1 . . . . . 43 THR CA . 52152 1
197 . 1 . 1 47 47 THR N N 15 123.4127992 0.07678142418 . 1 . . . . . 43 THR N . 52152 1
198 . 1 . 1 48 48 THR H H 1 7.96083857 0.001801424595 . 1 . . . . . 44 THR H . 52152 1
199 . 1 . 1 48 48 THR C C 13 174.9612146 0 . 1 . . . . . 44 THR C . 52152 1
200 . 1 . 1 48 48 THR CA C 13 60.82196289 0.0630230912 . 1 . . . . . 44 THR CA . 52152 1
201 . 1 . 1 48 48 THR CB C 13 69.64738009 0 . 1 . . . . . 44 THR CB . 52152 1
202 . 1 . 1 48 48 THR N N 15 114.5069897 0.07080430986 . 1 . . . . . 44 THR N . 52152 1
203 . 1 . 1 49 49 GLY H H 1 8.116673143 0.004839767527 . 1 . . . . . 45 GLY H . 52152 1
204 . 1 . 1 49 49 GLY CA C 13 45.59831449 0 . 1 . . . . . 45 GLY CA . 52152 1
205 . 1 . 1 49 49 GLY N N 15 110.1852548 0.1446289906 . 1 . . . . . 45 GLY N . 52152 1
206 . 1 . 1 50 50 SER H H 1 6.734777726 0.001252275007 . 1 . . . . . 46 SER H . 52152 1
207 . 1 . 1 50 50 SER CA C 13 52.12585553 0.2369628177 . 1 . . . . . 46 SER CA . 52152 1
208 . 1 . 1 50 50 SER CB C 13 65.39829262 0 . 1 . . . . . 46 SER CB . 52152 1
209 . 1 . 1 50 50 SER N N 15 109.648778 0.07610604774 . 1 . . . . . 46 SER N . 52152 1
210 . 1 . 1 52 52 PHE H H 1 7.173078455 0.001276911469 . 1 . . . . . 48 PHE H . 52152 1
211 . 1 . 1 52 52 PHE C C 13 175.6503048 0 . 1 . . . . . 48 PHE C . 52152 1
212 . 1 . 1 52 52 PHE CA C 13 55.4582092 0.103662644 . 1 . . . . . 48 PHE CA . 52152 1
213 . 1 . 1 52 52 PHE CB C 13 39.25652025 0 . 1 . . . . . 48 PHE CB . 52152 1
214 . 1 . 1 52 52 PHE N N 15 113.5570686 0.06150546714 . 1 . . . . . 48 PHE N . 52152 1
215 . 1 . 1 53 53 ARG H H 1 6.512591584 0.002220445442 . 1 . . . . . 49 ARG H . 52152 1
216 . 1 . 1 53 53 ARG C C 13 175.8045727 0 . 1 . . . . . 49 ARG C . 52152 1
217 . 1 . 1 53 53 ARG CA C 13 56.67431703 0 . 1 . . . . . 49 ARG CA . 52152 1
218 . 1 . 1 53 53 ARG CB C 13 31.45960911 0 . 1 . . . . . 49 ARG CB . 52152 1
219 . 1 . 1 53 53 ARG N N 15 121.9726126 0.0292608726 . 1 . . . . . 49 ARG N . 52152 1
220 . 1 . 1 54 54 THR H H 1 8.598209253 0.001704037226 . 1 . . . . . 50 THR H . 52152 1
221 . 1 . 1 54 54 THR C C 13 175.8329244 0 . 1 . . . . . 50 THR C . 52152 1
222 . 1 . 1 54 54 THR CA C 13 62.38526281 0 . 1 . . . . . 50 THR CA . 52152 1
223 . 1 . 1 54 54 THR CB C 13 68.95524032 0 . 1 . . . . . 50 THR CB . 52152 1
224 . 1 . 1 54 54 THR N N 15 124.912823 0.05216981741 . 1 . . . . . 50 THR N . 52152 1
225 . 1 . 1 55 55 ILE H H 1 8.686138184 0.002064299385 . 1 . . . . . 51 ILE H . 52152 1
226 . 1 . 1 55 55 ILE C C 13 173.1481867 0 . 1 . . . . . 51 ILE C . 52152 1
227 . 1 . 1 55 55 ILE CA C 13 62.7384165 0.1911229552 . 1 . . . . . 51 ILE CA . 52152 1
228 . 1 . 1 55 55 ILE CB C 13 40.04757285 0 . 1 . . . . . 51 ILE CB . 52152 1
229 . 1 . 1 55 55 ILE N N 15 129.3104342 0.0766589706 . 1 . . . . . 51 ILE N . 52152 1
230 . 1 . 1 56 56 ASN H H 1 8.537423409 0.002982090049 . 1 . . . . . 52 ASN H . 52152 1
231 . 1 . 1 56 56 ASN C C 13 172.4731156 0 . 1 . . . . . 52 ASN C . 52152 1
232 . 1 . 1 56 56 ASN CA C 13 51.00409161 0.08128050741 . 1 . . . . . 52 ASN CA . 52152 1
233 . 1 . 1 56 56 ASN CB C 13 39.78314134 0 . 1 . . . . . 52 ASN CB . 52152 1
234 . 1 . 1 56 56 ASN N N 15 126.0894465 0.09135014288 . 1 . . . . . 52 ASN N . 52152 1
235 . 1 . 1 57 57 TYR H H 1 8.575729396 0.001825335059 . 1 . . . . . 53 TYR H . 52152 1
236 . 1 . 1 57 57 TYR C C 13 172.3763305 0 . 1 . . . . . 53 TYR C . 52152 1
237 . 1 . 1 57 57 TYR CA C 13 56.67068811 0.1043543455 . 1 . . . . . 53 TYR CA . 52152 1
238 . 1 . 1 57 57 TYR CB C 13 40.78845894 0 . 1 . . . . . 53 TYR CB . 52152 1
239 . 1 . 1 57 57 TYR N N 15 115.6615163 0.07401982401 . 1 . . . . . 53 TYR N . 52152 1
240 . 1 . 1 58 58 ASN H H 1 8.912116353 0.003670538725 . 1 . . . . . 54 ASN H . 52152 1
241 . 1 . 1 58 58 ASN C C 13 176.0640931 0 . 1 . . . . . 54 ASN C . 52152 1
242 . 1 . 1 58 58 ASN CA C 13 52.95818335 0.07259241299 . 1 . . . . . 54 ASN CA . 52152 1
243 . 1 . 1 58 58 ASN CB C 13 40.5536459 0 . 1 . . . . . 54 ASN CB . 52152 1
244 . 1 . 1 58 58 ASN N N 15 116.7821309 0.08944857146 . 1 . . . . . 54 ASN N . 52152 1
245 . 1 . 1 59 59 ALA H H 1 9.618858985 0.003168683449 . 1 . . . . . 55 ALA H . 52152 1
246 . 1 . 1 59 59 ALA C C 13 174.9375445 0 . 1 . . . . . 55 ALA C . 52152 1
247 . 1 . 1 59 59 ALA CA C 13 50.20821955 0 . 1 . . . . . 55 ALA CA . 52152 1
248 . 1 . 1 59 59 ALA CB C 13 18.02330859 0 . 1 . . . . . 55 ALA CB . 52152 1
249 . 1 . 1 59 59 ALA N N 15 132.5663729 0.09434924644 . 1 . . . . . 55 ALA N . 52152 1
250 . 1 . 1 60 60 GLY H H 1 8.260238143 0.002124166159 . 1 . . . . . 56 GLY H . 52152 1
251 . 1 . 1 60 60 GLY C C 13 175.0339766 0 . 1 . . . . . 56 GLY C . 52152 1
252 . 1 . 1 60 60 GLY CA C 13 46.90005974 0.09810177941 . 1 . . . . . 56 GLY CA . 52152 1
253 . 1 . 1 60 60 GLY N N 15 116.3311463 0.07272753035 . 1 . . . . . 56 GLY N . 52152 1
254 . 1 . 1 61 61 VAL H H 1 8.181750375 0.001572651102 . 1 . . . . . 57 VAL H . 52152 1
255 . 1 . 1 61 61 VAL CA C 13 62.41439431 0 . 1 . . . . . 57 VAL CA . 52152 1
256 . 1 . 1 61 61 VAL CB C 13 35.58850998 0 . 1 . . . . . 57 VAL CB . 52152 1
257 . 1 . 1 61 61 VAL N N 15 117.6915856 0.02994654088 . 1 . . . . . 57 VAL N . 52152 1
258 . 1 . 1 62 62 TRP H H 1 8.989394828 0.001886015124 . 1 . . . . . 58 TRP H . 52152 1
259 . 1 . 1 62 62 TRP C C 13 172.1305107 0 . 1 . . . . . 58 TRP C . 52152 1
260 . 1 . 1 62 62 TRP CA C 13 56.1057493 0.104772433 . 1 . . . . . 58 TRP CA . 52152 1
261 . 1 . 1 62 62 TRP CB C 13 30.93047813 0 . 1 . . . . . 58 TRP CB . 52152 1
262 . 1 . 1 62 62 TRP N N 15 127.8103177 0.08843084232 . 1 . . . . . 58 TRP N . 52152 1
263 . 1 . 1 63 63 ALA H H 1 7.99714852 0.001863509355 . 1 . . . . . 59 ALA H . 52152 1
264 . 1 . 1 63 63 ALA C C 13 173.8901849 0 . 1 . . . . . 59 ALA C . 52152 1
265 . 1 . 1 63 63 ALA CA C 13 49.59622397 0.1041677717 . 1 . . . . . 59 ALA CA . 52152 1
266 . 1 . 1 63 63 ALA CB C 13 18.1283845 0 . 1 . . . . . 59 ALA CB . 52152 1
267 . 1 . 1 63 63 ALA N N 15 128.2414105 0.07652985601 . 1 . . . . . 59 ALA N . 52152 1
268 . 1 . 1 65 65 ASN H H 1 9.259385284 0.00180296865 . 1 . . . . . 61 ASN H . 52152 1
269 . 1 . 1 65 65 ASN C C 13 173.6142827 0 . 1 . . . . . 61 ASN C . 52152 1
270 . 1 . 1 65 65 ASN CA C 13 51.77725282 0 . 1 . . . . . 61 ASN CA . 52152 1
271 . 1 . 1 65 65 ASN CB C 13 37.2663527 0 . 1 . . . . . 61 ASN CB . 52152 1
272 . 1 . 1 65 65 ASN N N 15 125.0421653 0.07681944731 . 1 . . . . . 61 ASN N . 52152 1
273 . 1 . 1 66 66 GLY H H 1 8.163408735 0.003091415552 . 1 . . . . . 62 GLY H . 52152 1
274 . 1 . 1 66 66 GLY C C 13 174.4710564 0 . 1 . . . . . 62 GLY C . 52152 1
275 . 1 . 1 66 66 GLY CA C 13 44.34079482 0 . 1 . . . . . 62 GLY CA . 52152 1
276 . 1 . 1 66 66 GLY N N 15 109.7949649 0.05878070017 . 1 . . . . . 62 GLY N . 52152 1
277 . 1 . 1 67 67 ASN H H 1 8.888905403 0.001808070457 . 1 . . . . . 63 ASN H . 52152 1
278 . 1 . 1 67 67 ASN C C 13 176.2528213 0 . 1 . . . . . 63 ASN C . 52152 1
279 . 1 . 1 67 67 ASN CA C 13 53.67775541 0 . 1 . . . . . 63 ASN CA . 52152 1
280 . 1 . 1 67 67 ASN CB C 13 37.92628818 0 . 1 . . . . . 63 ASN CB . 52152 1
281 . 1 . 1 67 67 ASN N N 15 123.3547744 0.07502601664 . 1 . . . . . 63 ASN N . 52152 1
282 . 1 . 1 68 68 GLY H H 1 7.990877297 0.002308149107 . 1 . . . . . 64 GLY H . 52152 1
283 . 1 . 1 68 68 GLY CA C 13 46.10625321 0.09888491974 . 1 . . . . . 64 GLY CA . 52152 1
284 . 1 . 1 68 68 GLY N N 15 117.5767281 0.0300892769 . 1 . . . . . 64 GLY N . 52152 1
285 . 1 . 1 69 69 TYR H H 1 9.660852055 0.00266281437 . 1 . . . . . 65 TYR H . 52152 1
286 . 1 . 1 69 69 TYR CA C 13 53.86629339 0.1658198433 . 1 . . . . . 65 TYR CA . 52152 1
287 . 1 . 1 69 69 TYR CB C 13 42.19800707 0 . 1 . . . . . 65 TYR CB . 52152 1
288 . 1 . 1 69 69 TYR N N 15 118.2514466 0.06042643171 . 1 . . . . . 65 TYR N . 52152 1
289 . 1 . 1 70 70 LEU H H 1 7.905812204 0.001576686773 . 1 . . . . . 66 LEU H . 52152 1
290 . 1 . 1 70 70 LEU CA C 13 54.00093598 0 . 1 . . . . . 66 LEU CA . 52152 1
291 . 1 . 1 70 70 LEU CB C 13 42.43119002 0 . 1 . . . . . 66 LEU CB . 52152 1
292 . 1 . 1 70 70 LEU N N 15 126.3820292 0.01267651065 . 1 . . . . . 66 LEU N . 52152 1
293 . 1 . 1 71 71 THR H H 1 8.909668135 0.001497042451 . 1 . . . . . 67 THR H . 52152 1
294 . 1 . 1 71 71 THR C C 13 172.06336 0 . 1 . . . . . 67 THR C . 52152 1
295 . 1 . 1 71 71 THR CA C 13 57.75574097 0.125821783 . 1 . . . . . 67 THR CA . 52152 1
296 . 1 . 1 71 71 THR CB C 13 72.22531824 0 . 1 . . . . . 67 THR CB . 52152 1
297 . 1 . 1 71 71 THR N N 15 121.133675 0.07260039409 . 1 . . . . . 67 THR N . 52152 1
298 . 1 . 1 72 72 LEU H H 1 9.273427151 0.001557312622 . 1 . . . . . 68 LEU H . 52152 1
299 . 1 . 1 72 72 LEU CA C 13 55.83883587 0.1017808055 . 1 . . . . . 68 LEU CA . 52152 1
300 . 1 . 1 72 72 LEU CB C 13 42.74244748 0 . 1 . . . . . 68 LEU CB . 52152 1
301 . 1 . 1 72 72 LEU N N 15 133.5860962 0.04322896611 . 1 . . . . . 68 LEU N . 52152 1
302 . 1 . 1 73 73 TYR H H 1 9.569402961 0.001132547647 . 1 . . . . . 69 TYR H . 52152 1
303 . 1 . 1 73 73 TYR CA C 13 56.24984376 0.2116919527 . 1 . . . . . 69 TYR CA . 52152 1
304 . 1 . 1 73 73 TYR CB C 13 43.21436907 0 . 1 . . . . . 69 TYR CB . 52152 1
305 . 1 . 1 73 73 TYR N N 15 133.1176147 0.07796365384 . 1 . . . . . 69 TYR N . 52152 1
306 . 1 . 1 74 74 GLY H H 1 6.352228596 0.002916381352 . 1 . . . . . 70 GLY H . 52152 1
307 . 1 . 1 74 74 GLY C C 13 182.400518 0 . 1 . . . . . 70 GLY C . 52152 1
308 . 1 . 1 74 74 GLY CA C 13 45.23755818 0 . 1 . . . . . 70 GLY CA . 52152 1
309 . 1 . 1 74 74 GLY N N 15 112.2489867 0.05750483248 . 1 . . . . . 70 GLY N . 52152 1
310 . 1 . 1 75 75 TRP H H 1 6.060732691 0.002201562914 . 1 . . . . . 71 TRP H . 52152 1
311 . 1 . 1 75 75 TRP CA C 13 55.03934512 0 . 1 . . . . . 71 TRP CA . 52152 1
312 . 1 . 1 75 75 TRP CB C 13 35.4528822 0 . 1 . . . . . 71 TRP CB . 52152 1
313 . 1 . 1 75 75 TRP N N 15 110.704025 0.1229721431 . 1 . . . . . 71 TRP N . 52152 1
314 . 1 . 1 76 76 THR H H 1 9.07546328 0.002044140916 . 1 . . . . . 72 THR H . 52152 1
315 . 1 . 1 76 76 THR C C 13 171.7108095 0 . 1 . . . . . 72 THR C . 52152 1
316 . 1 . 1 76 76 THR CA C 13 60.7542758 0.03890177776 . 1 . . . . . 72 THR CA . 52152 1
317 . 1 . 1 76 76 THR CB C 13 72.53738962 0 . 1 . . . . . 72 THR CB . 52152 1
318 . 1 . 1 76 76 THR N N 15 112.578303 0.1002657056 . 1 . . . . . 72 THR N . 52152 1
319 . 1 . 1 77 77 ARG H H 1 8.834509739 0.002434227612 . 1 . . . . . 73 ARG H . 52152 1
320 . 1 . 1 77 77 ARG C C 13 175.8377704 0 . 1 . . . . . 73 ARG C . 52152 1
321 . 1 . 1 77 77 ARG CA C 13 55.25440137 0 . 1 . . . . . 73 ARG CA . 52152 1
322 . 1 . 1 77 77 ARG CB C 13 33.335541 0 . 1 . . . . . 73 ARG CB . 52152 1
323 . 1 . 1 77 77 ARG N N 15 116.6351049 0.03951159499 . 1 . . . . . 73 ARG N . 52152 1
324 . 1 . 1 78 78 SER H H 1 8.549231958 0.001356809587 . 1 . . . . . 74 SER H . 52152 1
325 . 1 . 1 78 78 SER C C 13 175.847238 0 . 1 . . . . . 74 SER C . 52152 1
326 . 1 . 1 78 78 SER CA C 13 57.70975698 0 . 1 . . . . . 74 SER CA . 52152 1
327 . 1 . 1 78 78 SER CB C 13 61.70167989 0 . 1 . . . . . 74 SER CB . 52152 1
328 . 1 . 1 78 78 SER N N 15 110.4810253 0.07478866983 . 1 . . . . . 74 SER N . 52152 1
329 . 1 . 1 80 80 LEU H H 1 7.735577304 0.001906891062 . 1 . . . . . 76 LEU H . 52152 1
330 . 1 . 1 80 80 LEU C C 13 174.3533033 0 . 1 . . . . . 76 LEU C . 52152 1
331 . 1 . 1 80 80 LEU CA C 13 54.87717252 0.000000674 . 1 . . . . . 76 LEU CA . 52152 1
332 . 1 . 1 80 80 LEU CB C 13 42.13948915 0 . 1 . . . . . 76 LEU CB . 52152 1
333 . 1 . 1 80 80 LEU N N 15 119.220999 0.02775649249 . 1 . . . . . 76 LEU N . 52152 1
334 . 1 . 1 81 81 ILE H H 1 8.052631953 0.00265632409 . 1 . . . . . 77 ILE H . 52152 1
335 . 1 . 1 81 81 ILE C C 13 173.043236 0 . 1 . . . . . 77 ILE C . 52152 1
336 . 1 . 1 81 81 ILE CA C 13 58.9794352 0.08934466912 . 1 . . . . . 77 ILE CA . 52152 1
337 . 1 . 1 81 81 ILE CB C 13 41.08768055 0 . 1 . . . . . 77 ILE CB . 52152 1
338 . 1 . 1 81 81 ILE N N 15 129.8278925 0.0933912394 . 1 . . . . . 77 ILE N . 52152 1
339 . 1 . 1 82 82 GLU H H 1 7.362407549 0.001508165725 . 1 . . . . . 78 GLU H . 52152 1
340 . 1 . 1 82 82 GLU C C 13 173.3874539 0 . 1 . . . . . 78 GLU C . 52152 1
341 . 1 . 1 82 82 GLU CA C 13 52.86309681 0.1367565221 . 1 . . . . . 78 GLU CA . 52152 1
342 . 1 . 1 82 82 GLU CB C 13 31.9959884 0 . 1 . . . . . 78 GLU CB . 52152 1
343 . 1 . 1 82 82 GLU N N 15 128.8179947 0.02640743765 . 1 . . . . . 78 GLU N . 52152 1
344 . 1 . 1 83 83 TYR H H 1 7.661057112 0.002724183752 . 1 . . . . . 79 TYR H . 52152 1
345 . 1 . 1 83 83 TYR C C 13 171.6669175 0 . 1 . . . . . 79 TYR C . 52152 1
346 . 1 . 1 83 83 TYR CA C 13 54.33127724 0.07253602333 . 1 . . . . . 79 TYR CA . 52152 1
347 . 1 . 1 83 83 TYR CB C 13 42.34095461 0 . 1 . . . . . 79 TYR CB . 52152 1
348 . 1 . 1 83 83 TYR N N 15 122.6651448 0.06898822174 . 1 . . . . . 79 TYR N . 52152 1
349 . 1 . 1 84 84 TYR H H 1 8.109845358 0.002953207447 . 1 . . . . . 80 TYR H . 52152 1
350 . 1 . 1 84 84 TYR CA C 13 56.87010088 0 . 1 . . . . . 80 TYR CA . 52152 1
351 . 1 . 1 84 84 TYR N N 15 114.9337443 0.02286541951 . 1 . . . . . 80 TYR N . 52152 1
352 . 1 . 1 85 85 VAL H H 1 8.00772734 0.00223262451 . 1 . . . . . 81 VAL H . 52152 1
353 . 1 . 1 85 85 VAL C C 13 174.2325686 0 . 1 . . . . . 81 VAL C . 52152 1
354 . 1 . 1 85 85 VAL CA C 13 62.63805607 0 . 1 . . . . . 81 VAL CA . 52152 1
355 . 1 . 1 85 85 VAL CB C 13 32.05080401 0 . 1 . . . . . 81 VAL CB . 52152 1
356 . 1 . 1 85 85 VAL N N 15 118.9588495 0.09181338622 . 1 . . . . . 81 VAL N . 52152 1
357 . 1 . 1 86 86 VAL H H 1 9.58229731 0.002257916783 . 1 . . . . . 82 VAL H . 52152 1
358 . 1 . 1 86 86 VAL C C 13 175.3737691 0 . 1 . . . . . 82 VAL C . 52152 1
359 . 1 . 1 86 86 VAL CA C 13 62.91457356 0.03637441792 . 1 . . . . . 82 VAL CA . 52152 1
360 . 1 . 1 86 86 VAL CB C 13 32.90641703 0 . 1 . . . . . 82 VAL CB . 52152 1
361 . 1 . 1 86 86 VAL N N 15 126.6375516 0.06345277556 . 1 . . . . . 82 VAL N . 52152 1
362 . 1 . 1 87 87 ASP H H 1 8.351996519 0.002157141405 . 1 . . . . . 83 ASP H . 52152 1
363 . 1 . 1 87 87 ASP CA C 13 54.69710284 0.1277227062 . 1 . . . . . 83 ASP CA . 52152 1
364 . 1 . 1 87 87 ASP CB C 13 43.59071839 0 . 1 . . . . . 83 ASP CB . 52152 1
365 . 1 . 1 87 87 ASP N N 15 128.3726794 0.08157515183 . 1 . . . . . 83 ASP N . 52152 1
366 . 1 . 1 88 88 SER H H 1 8.189738176 0.001861158491 . 1 . . . . . 84 SER H . 52152 1
367 . 1 . 1 88 88 SER CA C 13 57.55123877 0.01340098436 . 1 . . . . . 84 SER CA . 52152 1
368 . 1 . 1 88 88 SER CB C 13 61.46703656 0 . 1 . . . . . 84 SER CB . 52152 1
369 . 1 . 1 88 88 SER N N 15 108.6915405 0.0585888565 . 1 . . . . . 84 SER N . 52152 1
370 . 1 . 1 89 89 TRP H H 1 7.701942017 0.002001487497 . 1 . . . . . 85 TRP H . 52152 1
371 . 1 . 1 89 89 TRP C C 13 174.9798051 0 . 1 . . . . . 85 TRP C . 52152 1
372 . 1 . 1 89 89 TRP CA C 13 57.23826272 0.1159037564 . 1 . . . . . 85 TRP CA . 52152 1
373 . 1 . 1 89 89 TRP CB C 13 29.16494562 0 . 1 . . . . . 85 TRP CB . 52152 1
374 . 1 . 1 89 89 TRP N N 15 119.5005881 0.0868637951 . 1 . . . . . 85 TRP N . 52152 1
375 . 1 . 1 90 90 GLY H H 1 9.296404617 0.003950861301 . 1 . . . . . 86 GLY H . 52152 1
376 . 1 . 1 90 90 GLY C C 13 175.0213129 0.009658673551 . 1 . . . . . 86 GLY C . 52152 1
377 . 1 . 1 90 90 GLY CA C 13 44.73374881 0.246165015 . 1 . . . . . 86 GLY CA . 52152 1
378 . 1 . 1 90 90 GLY N N 15 110.7679679 0.04748371434 . 1 . . . . . 86 GLY N . 52152 1
379 . 1 . 1 91 91 THR H H 1 8.00501547 0.001772509361 . 1 . . . . . 87 THR H . 52152 1
380 . 1 . 1 91 91 THR C C 13 175.064266 0 . 1 . . . . . 87 THR C . 52152 1
381 . 1 . 1 91 91 THR CA C 13 63.35129807 0.06789481762 . 1 . . . . . 87 THR CA . 52152 1
382 . 1 . 1 91 91 THR CB C 13 68.65640949 0 . 1 . . . . . 87 THR CB . 52152 1
383 . 1 . 1 91 91 THR N N 15 117.7585161 0.08497821464 . 1 . . . . . 87 THR N . 52152 1
384 . 1 . 1 92 92 TYR H H 1 8.159171388 0.003229919318 . 1 . . . . . 88 TYR H . 52152 1
385 . 1 . 1 92 92 TYR C C 13 172.7712317 0 . 1 . . . . . 88 TYR C . 52152 1
386 . 1 . 1 92 92 TYR CA C 13 56.43873361 0 . 1 . . . . . 88 TYR CA . 52152 1
387 . 1 . 1 92 92 TYR CB C 13 40.47374927 0 . 1 . . . . . 88 TYR CB . 52152 1
388 . 1 . 1 92 92 TYR N N 15 122.2465812 0.0379221252 . 1 . . . . . 88 TYR N . 52152 1
389 . 1 . 1 93 93 ARG H H 1 8.036488203 0.00139065714 . 1 . . . . . 89 ARG H . 52152 1
390 . 1 . 1 93 93 ARG C C 13 171.4875474 0 . 1 . . . . . 89 ARG C . 52152 1
391 . 1 . 1 93 93 ARG CA C 13 51.76377821 0 . 1 . . . . . 89 ARG CA . 52152 1
392 . 1 . 1 93 93 ARG CB C 13 30.40326306 0 . 1 . . . . . 89 ARG CB . 52152 1
393 . 1 . 1 93 93 ARG N N 15 132.5239573 0.07616014915 . 1 . . . . . 89 ARG N . 52152 1
394 . 1 . 1 95 95 THR H H 1 5.972937655 0.00213683263 . 1 . . . . . 91 THR H . 52152 1
395 . 1 . 1 95 95 THR CA C 13 58.70963997 0 . 1 . . . . . 91 THR CA . 52152 1
396 . 1 . 1 95 95 THR CB C 13 71.43594597 0 . 1 . . . . . 91 THR CB . 52152 1
397 . 1 . 1 95 95 THR N N 15 105.4684203 0.04217275351 . 1 . . . . . 91 THR N . 52152 1
398 . 1 . 1 96 96 GLY H H 1 5.168600742 0 . 1 . . . . . 92 GLY H . 52152 1
399 . 1 . 1 96 96 GLY N N 15 107.0428134 0 . 1 . . . . . 92 GLY N . 52152 1
400 . 1 . 1 97 97 THR H H 1 8.993939537 0.00155910662 . 1 . . . . . 93 THR H . 52152 1
401 . 1 . 1 97 97 THR C C 13 174.3290491 0 . 1 . . . . . 93 THR C . 52152 1
402 . 1 . 1 97 97 THR CA C 13 64.08861716 0.0293836448 . 1 . . . . . 93 THR CA . 52152 1
403 . 1 . 1 97 97 THR CB C 13 68.3023265 0 . 1 . . . . . 93 THR CB . 52152 1
404 . 1 . 1 97 97 THR N N 15 124.474158 0.06487546335 . 1 . . . . . 93 THR N . 52152 1
405 . 1 . 1 98 98 TYR H H 1 9.061852932 0.002267480871 . 1 . . . . . 94 TYR H . 52152 1
406 . 1 . 1 98 98 TYR C C 13 175.7334964 0 . 1 . . . . . 94 TYR C . 52152 1
407 . 1 . 1 98 98 TYR CA C 13 59.76057775 0.0990733847 . 1 . . . . . 94 TYR CA . 52152 1
408 . 1 . 1 98 98 TYR CB C 13 38.76053141 0 . 1 . . . . . 94 TYR CB . 52152 1
409 . 1 . 1 98 98 TYR N N 15 130.4862275 0.05634462742 . 1 . . . . . 94 TYR N . 52152 1
410 . 1 . 1 99 99 LYS H H 1 8.427729862 0.002357671009 . 1 . . . . . 95 LYS H . 52152 1
411 . 1 . 1 99 99 LYS C C 13 175.2108506 0 . 1 . . . . . 95 LYS C . 52152 1
412 . 1 . 1 99 99 LYS CA C 13 53.59851481 0.005909140066 . 1 . . . . . 95 LYS CA . 52152 1
413 . 1 . 1 99 99 LYS CB C 13 33.08071138 0 . 1 . . . . . 95 LYS CB . 52152 1
414 . 1 . 1 99 99 LYS N N 15 124.4334395 0.08256062499 . 1 . . . . . 95 LYS N . 52152 1
415 . 1 . 1 100 100 GLY H H 1 5.57534387 0.003034537443 . 1 . . . . . 96 GLY H . 52152 1
416 . 1 . 1 100 100 GLY CA C 13 44.70523243 0 . 1 . . . . . 96 GLY CA . 52152 1
417 . 1 . 1 100 100 GLY N N 15 102.9410545 0.008568337196 . 1 . . . . . 96 GLY N . 52152 1
418 . 1 . 1 101 101 THR H H 1 8.104281063 0.001897360997 . 1 . . . . . 97 THR H . 52152 1
419 . 1 . 1 101 101 THR C C 13 173.8862652 0 . 1 . . . . . 97 THR C . 52152 1
420 . 1 . 1 101 101 THR CA C 13 59.82537323 0.1283016877 . 1 . . . . . 97 THR CA . 52152 1
421 . 1 . 1 101 101 THR CB C 13 74.1128539 0 . 1 . . . . . 97 THR CB . 52152 1
422 . 1 . 1 101 101 THR N N 15 109.2051698 0.07128834668 . 1 . . . . . 97 THR N . 52152 1
423 . 1 . 1 102 102 VAL H H 1 9.228189383 0.001726523487 . 1 . . . . . 98 VAL H . 52152 1
424 . 1 . 1 102 102 VAL C C 13 171.9896309 0 . 1 . . . . . 98 VAL C . 52152 1
425 . 1 . 1 102 102 VAL CA C 13 59.69655705 0.09213031659 . 1 . . . . . 98 VAL CA . 52152 1
426 . 1 . 1 102 102 VAL CB C 13 34.53079733 0 . 1 . . . . . 98 VAL CB . 52152 1
427 . 1 . 1 102 102 VAL N N 15 119.5496014 0.05334946288 . 1 . . . . . 98 VAL N . 52152 1
428 . 1 . 1 103 103 LYS H H 1 8.482631978 0.002323437804 . 1 . . . . . 99 LYS H . 52152 1
429 . 1 . 1 103 103 LYS C C 13 176.0612828 0 . 1 . . . . . 99 LYS C . 52152 1
430 . 1 . 1 103 103 LYS CA C 13 54.96036482 0.03356448093 . 1 . . . . . 99 LYS CA . 52152 1
431 . 1 . 1 103 103 LYS CB C 13 32.81643171 0 . 1 . . . . . 99 LYS CB . 52152 1
432 . 1 . 1 103 103 LYS N N 15 128.8702493 0.02993585393 . 1 . . . . . 99 LYS N . 52152 1
433 . 1 . 1 104 104 SER H H 1 8.733113057 0.00172868834 . 1 . . . . . 100 SER H . 52152 1
434 . 1 . 1 104 104 SER C C 13 174.4939812 0 . 1 . . . . . 100 SER C . 52152 1
435 . 1 . 1 104 104 SER CA C 13 59.20014969 0.07802799382 . 1 . . . . . 100 SER CA . 52152 1
436 . 1 . 1 104 104 SER CB C 13 64.15300153 0 . 1 . . . . . 100 SER CB . 52152 1
437 . 1 . 1 104 104 SER N N 15 116.7725542 0.0622496833 . 1 . . . . . 100 SER N . 52152 1
438 . 1 . 1 105 105 ASP H H 1 9.631805986 0.001564519752 . 1 . . . . . 101 ASP H . 52152 1
439 . 1 . 1 105 105 ASP CA C 13 55.74955658 0 . 1 . . . . . 101 ASP CA . 52152 1
440 . 1 . 1 105 105 ASP CB C 13 41.34266648 0 . 1 . . . . . 101 ASP CB . 52152 1
441 . 1 . 1 105 105 ASP N N 15 124.3662037 0.0912230566 . 1 . . . . . 101 ASP N . 52152 1
442 . 1 . 1 106 106 GLY H H 1 8.816737825 0.002280617809 . 1 . . . . . 102 GLY H . 52152 1
443 . 1 . 1 106 106 GLY C C 13 173.459015 0 . 1 . . . . . 102 GLY C . 52152 1
444 . 1 . 1 106 106 GLY CA C 13 45.97862825 0.1131401328 . 1 . . . . . 102 GLY CA . 52152 1
445 . 1 . 1 106 106 GLY N N 15 105.8131212 0.0759818292 . 1 . . . . . 102 GLY N . 52152 1
446 . 1 . 1 107 107 GLY H H 1 8.168697471 0.00239107731 . 1 . . . . . 103 GLY H . 52152 1
447 . 1 . 1 107 107 GLY C C 13 172.2473383 0 . 1 . . . . . 103 GLY C . 52152 1
448 . 1 . 1 107 107 GLY CA C 13 43.16980669 0.09538400635 . 1 . . . . . 103 GLY CA . 52152 1
449 . 1 . 1 107 107 GLY N N 15 109.0354929 0.07106264005 . 1 . . . . . 103 GLY N . 52152 1
450 . 1 . 1 108 108 THR H H 1 8.19850338 0.001488564852 . 1 . . . . . 104 THR H . 52152 1
451 . 1 . 1 108 108 THR C C 13 172.3925442 0 . 1 . . . . . 104 THR C . 52152 1
452 . 1 . 1 108 108 THR CA C 13 62.58530957 0 . 1 . . . . . 104 THR CA . 52152 1
453 . 1 . 1 108 108 THR CB C 13 69.54377572 0 . 1 . . . . . 104 THR CB . 52152 1
454 . 1 . 1 108 108 THR N N 15 116.6890963 0.07416848581 . 1 . . . . . 104 THR N . 52152 1
455 . 1 . 1 109 109 TYR H H 1 9.758674915 0.002380654106 . 1 . . . . . 105 TYR H . 52152 1
456 . 1 . 1 109 109 TYR C C 13 175.4101305 0 . 1 . . . . . 105 TYR C . 52152 1
457 . 1 . 1 109 109 TYR CA C 13 55.94167488 0.03770609962 . 1 . . . . . 105 TYR CA . 52152 1
458 . 1 . 1 109 109 TYR CB C 13 39.30456988 0 . 1 . . . . . 105 TYR CB . 52152 1
459 . 1 . 1 109 109 TYR N N 15 126.013587 0.1032941295 . 1 . . . . . 105 TYR N . 52152 1
460 . 1 . 1 110 110 ASP H H 1 8.765694434 0.00194817777 . 1 . . . . . 106 ASP H . 52152 1
461 . 1 . 1 110 110 ASP CB C 13 44.79378128 0 . 1 . . . . . 106 ASP CB . 52152 1
462 . 1 . 1 110 110 ASP N N 15 121.8683885 0.07101384565 . 1 . . . . . 106 ASP N . 52152 1
463 . 1 . 1 111 111 ILE H H 1 8.401207049 0.001423453213 . 1 . . . . . 107 ILE H . 52152 1
464 . 1 . 1 111 111 ILE C C 13 174.7401089 0 . 1 . . . . . 107 ILE C . 52152 1
465 . 1 . 1 111 111 ILE CA C 13 59.38225962 0 . 1 . . . . . 107 ILE CA . 52152 1
466 . 1 . 1 111 111 ILE CB C 13 39.19634991 0 . 1 . . . . . 107 ILE CB . 52152 1
467 . 1 . 1 111 111 ILE N N 15 121.6058476 0.06818305791 . 1 . . . . . 107 ILE N . 52152 1
468 . 1 . 1 112 112 TYR H H 1 9.143117418 0.003706467122 . 1 . . . . . 108 TYR H . 52152 1
469 . 1 . 1 112 112 TYR C C 13 175.1333728 0 . 1 . . . . . 108 TYR C . 52152 1
470 . 1 . 1 112 112 TYR CA C 13 54.59928707 0.1096360993 . 1 . . . . . 108 TYR CA . 52152 1
471 . 1 . 1 112 112 TYR CB C 13 43.35243528 0 . 1 . . . . . 108 TYR CB . 52152 1
472 . 1 . 1 112 112 TYR N N 15 122.8485291 0.05367563223 . 1 . . . . . 108 TYR N . 52152 1
473 . 1 . 1 113 113 THR H H 1 8.307170243 0.00188052276 . 1 . . . . . 109 THR H . 52152 1
474 . 1 . 1 113 113 THR C C 13 174.3333944 0 . 1 . . . . . 109 THR C . 52152 1
475 . 1 . 1 113 113 THR CA C 13 59.77793644 0.1242386284 . 1 . . . . . 109 THR CA . 52152 1
476 . 1 . 1 113 113 THR CB C 13 71.66287094 0 . 1 . . . . . 109 THR CB . 52152 1
477 . 1 . 1 113 113 THR N N 15 108.626248 0.06864658661 . 1 . . . . . 109 THR N . 52152 1
478 . 1 . 1 114 114 THR H H 1 8.774751228 0.001876139969 . 1 . . . . . 110 THR H . 52152 1
479 . 1 . 1 114 114 THR C C 13 173.0827501 0 . 1 . . . . . 110 THR C . 52152 1
480 . 1 . 1 114 114 THR CA C 13 61.5204493 0.0894309842 . 1 . . . . . 110 THR CA . 52152 1
481 . 1 . 1 114 114 THR CB C 13 72.6257549 0 . 1 . . . . . 110 THR CB . 52152 1
482 . 1 . 1 114 114 THR N N 15 114.601894 0.09076817356 . 1 . . . . . 110 THR N . 52152 1
483 . 1 . 1 115 115 THR H H 1 8.480709681 0.001699911587 . 1 . . . . . 111 THR H . 52152 1
484 . 1 . 1 115 115 THR C C 13 172.5779278 0 . 1 . . . . . 111 THR C . 52152 1
485 . 1 . 1 115 115 THR CA C 13 62.4582561 0 . 1 . . . . . 111 THR CA . 52152 1
486 . 1 . 1 115 115 THR CB C 13 70.8634513 0 . 1 . . . . . 111 THR CB . 52152 1
487 . 1 . 1 115 115 THR N N 15 117.2806945 0.07066558548 . 1 . . . . . 111 THR N . 52152 1
488 . 1 . 1 116 116 ARG H H 1 8.272330335 0.001907186427 . 1 . . . . . 112 ARG H . 52152 1
489 . 1 . 1 116 116 ARG C C 13 172.8991249 0 . 1 . . . . . 112 ARG C . 52152 1
490 . 1 . 1 116 116 ARG CA C 13 53.36161156 0.0851791443 . 1 . . . . . 112 ARG CA . 52152 1
491 . 1 . 1 116 116 ARG CB C 13 30.56551263 0 . 1 . . . . . 112 ARG CB . 52152 1
492 . 1 . 1 116 116 ARG N N 15 125.5128556 0.07605047304 . 1 . . . . . 112 ARG N . 52152 1
493 . 1 . 1 117 117 TYR H H 1 8.145150649 0.002489415629 . 1 . . . . . 113 TYR H . 52152 1
494 . 1 . 1 117 117 TYR C C 13 175.1726116 0 . 1 . . . . . 113 TYR C . 52152 1
495 . 1 . 1 117 117 TYR CA C 13 56.53584248 0.05383338654 . 1 . . . . . 113 TYR CA . 52152 1
496 . 1 . 1 117 117 TYR CB C 13 40.42218044 0 . 1 . . . . . 113 TYR CB . 52152 1
497 . 1 . 1 117 117 TYR N N 15 119.1487682 0.08251308048 . 1 . . . . . 113 TYR N . 52152 1
498 . 1 . 1 118 118 ASN H H 1 7.974332153 0.002435637512 . 1 . . . . . 114 ASN H . 52152 1
499 . 1 . 1 118 118 ASN C C 13 173.1754394 0 . 1 . . . . . 114 ASN C . 52152 1
500 . 1 . 1 118 118 ASN CA C 13 53.93743988 0.1105089328 . 1 . . . . . 114 ASN CA . 52152 1
501 . 1 . 1 118 118 ASN CB C 13 37.20708895 0 . 1 . . . . . 114 ASN CB . 52152 1
502 . 1 . 1 118 118 ASN N N 15 121.0946915 0.09815588888 . 1 . . . . . 114 ASN N . 52152 1
503 . 1 . 1 119 119 ALA H H 1 9.281362471 0.001081647425 . 1 . . . . . 115 ALA H . 52152 1
504 . 1 . 1 119 119 ALA C C 13 174.578277 0 . 1 . . . . . 115 ALA C . 52152 1
505 . 1 . 1 119 119 ALA CA C 13 49.91398697 0.1424801249 . 1 . . . . . 115 ALA CA . 52152 1
506 . 1 . 1 119 119 ALA CB C 13 21.82379811 0 . 1 . . . . . 115 ALA CB . 52152 1
507 . 1 . 1 119 119 ALA N N 15 122.7627617 0.06534711855 . 1 . . . . . 115 ALA N . 52152 1
508 . 1 . 1 121 121 SER H H 1 8.609893618 0.003331907243 . 1 . . . . . 117 SER H . 52152 1
509 . 1 . 1 121 121 SER C C 13 176.049472 0 . 1 . . . . . 117 SER C . 52152 1
510 . 1 . 1 121 121 SER CA C 13 56.1739483 0.05959323419 . 1 . . . . . 117 SER CA . 52152 1
511 . 1 . 1 121 121 SER CB C 13 67.78903528 0 . 1 . . . . . 117 SER CB . 52152 1
512 . 1 . 1 121 121 SER N N 15 115.5836936 0.07331319731 . 1 . . . . . 117 SER N . 52152 1
513 . 1 . 1 123 123 ASP H H 1 7.233224918 0.002332385602 . 1 . . . . . 119 ASP H . 52152 1
514 . 1 . 1 123 123 ASP C C 13 175.8336421 0 . 1 . . . . . 119 ASP C . 52152 1
515 . 1 . 1 123 123 ASP CA C 13 54.00087616 0.153314556 . 1 . . . . . 119 ASP CA . 52152 1
516 . 1 . 1 123 123 ASP CB C 13 41.75491793 0 . 1 . . . . . 119 ASP CB . 52152 1
517 . 1 . 1 123 123 ASP N N 15 119.5798785 0.07649773619 . 1 . . . . . 119 ASP N . 52152 1
518 . 1 . 1 124 124 GLY H H 1 7.168377695 0.002276670666 . 1 . . . . . 120 GLY H . 52152 1
519 . 1 . 1 124 124 GLY C C 13 172.1081149 0 . 1 . . . . . 120 GLY C . 52152 1
520 . 1 . 1 124 124 GLY CA C 13 44.99704576 0.09627712475 . 1 . . . . . 120 GLY CA . 52152 1
521 . 1 . 1 124 124 GLY N N 15 108.5022447 0.08222357233 . 1 . . . . . 120 GLY N . 52152 1
522 . 1 . 1 125 125 ASP H H 1 8.081469914 0.001617076161 . 1 . . . . . 121 ASP H . 52152 1
523 . 1 . 1 125 125 ASP C C 13 175.4852825 0 . 1 . . . . . 121 ASP C . 52152 1
524 . 1 . 1 125 125 ASP CB C 13 41.12494927 0 . 1 . . . . . 121 ASP CB . 52152 1
525 . 1 . 1 125 125 ASP N N 15 118.0002143 0.0702141774 . 1 . . . . . 121 ASP N . 52152 1
526 . 1 . 1 126 126 ARG H H 1 8.250814742 0.001584447961 . 1 . . . . . 122 ARG H . 52152 1
527 . 1 . 1 126 126 ARG C C 13 174.6504807 0 . 1 . . . . . 122 ARG C . 52152 1
528 . 1 . 1 126 126 ARG CA C 13 55.19929456 0.1153247241 . 1 . . . . . 122 ARG CA . 52152 1
529 . 1 . 1 126 126 ARG CB C 13 30.30575701 0 . 1 . . . . . 122 ARG CB . 52152 1
530 . 1 . 1 126 126 ARG N N 15 120.6080048 0.06226564056 . 1 . . . . . 122 ARG N . 52152 1
531 . 1 . 1 127 127 THR H H 1 8.998484648 0.002290296015 . 1 . . . . . 123 THR H . 52152 1
532 . 1 . 1 127 127 THR C C 13 172.3568446 0 . 1 . . . . . 123 THR C . 52152 1
533 . 1 . 1 127 127 THR CA C 13 60.28313852 0.05453328316 . 1 . . . . . 123 THR CA . 52152 1
534 . 1 . 1 127 127 THR CB C 13 72.2088118 0.00000095 . 1 . . . . . 123 THR CB . 52152 1
535 . 1 . 1 127 127 THR N N 15 116.995179 0.07953302169 . 1 . . . . . 123 THR N . 52152 1
536 . 1 . 1 128 128 THR H H 1 8.272114096 0.002018529768 . 1 . . . . . 124 THR H . 52152 1
537 . 1 . 1 128 128 THR C C 13 173.4528438 0 . 1 . . . . . 124 THR C . 52152 1
538 . 1 . 1 128 128 THR CA C 13 60.58386297 0.05409118967 . 1 . . . . . 124 THR CA . 52152 1
539 . 1 . 1 128 128 THR CB C 13 71.35120708 0 . 1 . . . . . 124 THR CB . 52152 1
540 . 1 . 1 128 128 THR N N 15 118.3400059 0.08409685185 . 1 . . . . . 124 THR N . 52152 1
541 . 1 . 1 129 129 PHE H H 1 8.116118104 0.003086294157 . 1 . . . . . 125 PHE H . 52152 1
542 . 1 . 1 129 129 PHE C C 13 172.2632224 0 . 1 . . . . . 125 PHE C . 52152 1
543 . 1 . 1 129 129 PHE CA C 13 55.85933566 0.1290337568 . 1 . . . . . 125 PHE CA . 52152 1
544 . 1 . 1 129 129 PHE CB C 13 39.59265776 0 . 1 . . . . . 125 PHE CB . 52152 1
545 . 1 . 1 129 129 PHE N N 15 122.2589069 0.07808398863 . 1 . . . . . 125 PHE N . 52152 1
546 . 1 . 1 130 130 THR H H 1 7.448167892 0.003041954966 . 1 . . . . . 126 THR H . 52152 1
547 . 1 . 1 130 130 THR C C 13 171.3859506 0 . 1 . . . . . 126 THR C . 52152 1
548 . 1 . 1 130 130 THR CA C 13 62.18861598 0.1422908549 . 1 . . . . . 126 THR CA . 52152 1
549 . 1 . 1 130 130 THR CB C 13 70.174517 0 . 1 . . . . . 126 THR CB . 52152 1
550 . 1 . 1 130 130 THR N N 15 116.761774 0.06551701443 . 1 . . . . . 126 THR N . 52152 1
551 . 1 . 1 131 131 GLN H H 1 8.926440008 0.002373858664 . 1 . . . . . 127 GLN H . 52152 1
552 . 1 . 1 131 131 GLN C C 13 175.4260371 0 . 1 . . . . . 127 GLN C . 52152 1
553 . 1 . 1 131 131 GLN CA C 13 53.01330783 0.05914825002 . 1 . . . . . 127 GLN CA . 52152 1
554 . 1 . 1 131 131 GLN N N 15 121.5870281 0.06370390016 . 1 . . . . . 127 GLN N . 52152 1
555 . 1 . 1 132 132 TYR H H 1 8.003121316 0.002543129823 . 1 . . . . . 128 TYR H . 52152 1
556 . 1 . 1 132 132 TYR C C 13 173.5440969 0 . 1 . . . . . 128 TYR C . 52152 1
557 . 1 . 1 132 132 TYR CA C 13 51.95438002 0 . 1 . . . . . 128 TYR CA . 52152 1
558 . 1 . 1 132 132 TYR CB C 13 37.45311573 0.0000004768 . 1 . . . . . 128 TYR CB . 52152 1
559 . 1 . 1 132 132 TYR N N 15 121.9920344 0.009172384742 . 1 . . . . . 128 TYR N . 52152 1
560 . 1 . 1 133 133 TRP H H 1 8.589729005 0.001685706765 . 1 . . . . . 129 TRP H . 52152 1
561 . 1 . 1 133 133 TRP C C 13 177.0318673 0 . 1 . . . . . 129 TRP C . 52152 1
562 . 1 . 1 133 133 TRP CA C 13 55.81660148 0.2116645012 . 1 . . . . . 129 TRP CA . 52152 1
563 . 1 . 1 133 133 TRP CB C 13 32.25197472 0 . 1 . . . . . 129 TRP CB . 52152 1
564 . 1 . 1 133 133 TRP N N 15 117.8253555 0.08118621082 . 1 . . . . . 129 TRP N . 52152 1
565 . 1 . 1 134 134 SER H H 1 9.061735236 0.00244498352 . 1 . . . . . 130 SER H . 52152 1
566 . 1 . 1 134 134 SER C C 13 177.1005835 0 . 1 . . . . . 130 SER C . 52152 1
567 . 1 . 1 134 134 SER CA C 13 58.31625966 0 . 1 . . . . . 130 SER CA . 52152 1
568 . 1 . 1 134 134 SER CB C 13 66.15991209 0 . 1 . . . . . 130 SER CB . 52152 1
569 . 1 . 1 134 134 SER N N 15 120.0610981 0.07213313193 . 1 . . . . . 130 SER N . 52152 1
570 . 1 . 1 135 135 VAL H H 1 10.23957411 0.001957254285 . 1 . . . . . 131 VAL H . 52152 1
571 . 1 . 1 135 135 VAL C C 13 175.6384605 0 . 1 . . . . . 131 VAL C . 52152 1
572 . 1 . 1 135 135 VAL CA C 13 61.35367933 0.05842053497 . 1 . . . . . 131 VAL CA . 52152 1
573 . 1 . 1 135 135 VAL CB C 13 35.05499339 0 . 1 . . . . . 131 VAL CB . 52152 1
574 . 1 . 1 135 135 VAL N N 15 124.4028231 0.0762122714 . 1 . . . . . 131 VAL N . 52152 1
575 . 1 . 1 136 136 ARG H H 1 8.985281068 0.003822507306 . 1 . . . . . 132 ARG H . 52152 1
576 . 1 . 1 136 136 ARG C C 13 177.3741884 0 . 1 . . . . . 132 ARG C . 52152 1
577 . 1 . 1 136 136 ARG CA C 13 58.98309733 0 . 1 . . . . . 132 ARG CA . 52152 1
578 . 1 . 1 136 136 ARG N N 15 136.2906705 0.09801790709 . 1 . . . . . 132 ARG N . 52152 1
579 . 1 . 1 137 137 GLN H H 1 8.983813152 0.002449566096 . 1 . . . . . 133 GLN H . 52152 1
580 . 1 . 1 137 137 GLN C C 13 176.0851727 0 . 1 . . . . . 133 GLN C . 52152 1
581 . 1 . 1 137 137 GLN CA C 13 59.53215008 0.3936337108 . 1 . . . . . 133 GLN CA . 52152 1
582 . 1 . 1 137 137 GLN N N 15 122.1260714 0.08268752178 . 1 . . . . . 133 GLN N . 52152 1
583 . 1 . 1 138 138 SER H H 1 7.628285767 0.001767582527 . 1 . . . . . 134 SER H . 52152 1
584 . 1 . 1 138 138 SER C C 13 173.9087156 0 . 1 . . . . . 134 SER C . 52152 1
585 . 1 . 1 138 138 SER CA C 13 56.19970158 0.1381122338 . 1 . . . . . 134 SER CA . 52152 1
586 . 1 . 1 138 138 SER CB C 13 65.36951152 0 . 1 . . . . . 134 SER CB . 52152 1
587 . 1 . 1 138 138 SER N N 15 109.9068606 0.06627487112 . 1 . . . . . 134 SER N . 52152 1
588 . 1 . 1 139 139 LYS H H 1 8.668038967 0.00173906023 . 1 . . . . . 135 LYS H . 52152 1
589 . 1 . 1 139 139 LYS C C 13 176.6214408 0 . 1 . . . . . 135 LYS C . 52152 1
590 . 1 . 1 139 139 LYS CA C 13 58.5206818 0.07964206721 . 1 . . . . . 135 LYS CA . 52152 1
591 . 1 . 1 139 139 LYS CB C 13 32.11458287 0 . 1 . . . . . 135 LYS CB . 52152 1
592 . 1 . 1 139 139 LYS N N 15 124.9138682 0.1003459069 . 1 . . . . . 135 LYS N . 52152 1
593 . 1 . 1 140 140 ARG H H 1 8.985462427 0.001858113311 . 1 . . . . . 136 ARG H . 52152 1
594 . 1 . 1 140 140 ARG C C 13 173.4657762 0 . 1 . . . . . 136 ARG C . 52152 1
595 . 1 . 1 140 140 ARG CA C 13 55.21984661 0 . 1 . . . . . 136 ARG CA . 52152 1
596 . 1 . 1 140 140 ARG CB C 13 32.70993562 0 . 1 . . . . . 136 ARG CB . 52152 1
597 . 1 . 1 140 140 ARG N N 15 127.0210917 0.05927308909 . 1 . . . . . 136 ARG N . 52152 1
598 . 1 . 1 142 142 THR H H 1 8.513009055 0.002130610017 . 1 . . . . . 138 THR H . 52152 1
599 . 1 . 1 142 142 THR C C 13 174.7662091 0 . 1 . . . . . 138 THR C . 52152 1
600 . 1 . 1 142 142 THR CA C 13 60.49364544 0.05096054416 . 1 . . . . . 138 THR CA . 52152 1
601 . 1 . 1 142 142 THR CB C 13 70.05518229 0 . 1 . . . . . 138 THR CB . 52152 1
602 . 1 . 1 142 142 THR N N 15 114.2610198 0.08208993833 . 1 . . . . . 138 THR N . 52152 1
603 . 1 . 1 143 143 GLY H H 1 9.068665495 0.002217434208 . 1 . . . . . 139 GLY H . 52152 1
604 . 1 . 1 143 143 GLY CA C 13 45.56750063 0.127990196 . 1 . . . . . 139 GLY CA . 52152 1
605 . 1 . 1 143 143 GLY N N 15 113.5968452 0.05758176411 . 1 . . . . . 139 GLY N . 52152 1
606 . 1 . 1 144 144 SER H H 1 7.469293526 0.002170035532 . 1 . . . . . 140 SER H . 52152 1
607 . 1 . 1 144 144 SER C C 13 173.1121633 0 . 1 . . . . . 140 SER C . 52152 1
608 . 1 . 1 144 144 SER CA C 13 56.19980049 0.1007727144 . 1 . . . . . 140 SER CA . 52152 1
609 . 1 . 1 144 144 SER CB C 13 64.95634008 0 . 1 . . . . . 140 SER CB . 52152 1
610 . 1 . 1 144 144 SER N N 15 113.3729176 0.05661497238 . 1 . . . . . 140 SER N . 52152 1
611 . 1 . 1 145 145 ASN H H 1 8.716369581 0.002160426231 . 1 . . . . . 141 ASN H . 52152 1
612 . 1 . 1 145 145 ASN C C 13 174.2786687 0 . 1 . . . . . 141 ASN C . 52152 1
613 . 1 . 1 145 145 ASN CA C 13 54.50658419 0 . 1 . . . . . 141 ASN CA . 52152 1
614 . 1 . 1 145 145 ASN CB C 13 36.68895325 0 . 1 . . . . . 141 ASN CB . 52152 1
615 . 1 . 1 145 145 ASN N N 15 121.9165496 0.09809234742 . 1 . . . . . 141 ASN N . 52152 1
616 . 1 . 1 146 146 ALA H H 1 9.378113792 0.004277252139 . 1 . . . . . 142 ALA H . 52152 1
617 . 1 . 1 146 146 ALA C C 13 175.7005925 0 . 1 . . . . . 142 ALA C . 52152 1
618 . 1 . 1 146 146 ALA CA C 13 51.11286242 0.08134679051 . 1 . . . . . 142 ALA CA . 52152 1
619 . 1 . 1 146 146 ALA CB C 13 20.88549275 0 . 1 . . . . . 142 ALA CB . 52152 1
620 . 1 . 1 146 146 ALA N N 15 129.9756888 0.05826179844 . 1 . . . . . 142 ALA N . 52152 1
621 . 1 . 1 147 147 THR H H 1 7.272742467 0.001629407642 . 1 . . . . . 143 THR H . 52152 1
622 . 1 . 1 147 147 THR C C 13 175.6131798 0 . 1 . . . . . 143 THR C . 52152 1
623 . 1 . 1 147 147 THR CA C 13 60.55346791 0.09857923379 . 1 . . . . . 143 THR CA . 52152 1
624 . 1 . 1 147 147 THR CB C 13 72.04394701 0.00000095 . 1 . . . . . 143 THR CB . 52152 1
625 . 1 . 1 147 147 THR N N 15 111.0711179 0.02093288947 . 1 . . . . . 143 THR N . 52152 1
626 . 1 . 1 148 148 ILE H H 1 9.444700042 0.003430825619 . 1 . . . . . 144 ILE H . 52152 1
627 . 1 . 1 148 148 ILE C C 13 175.2351481 0 . 1 . . . . . 144 ILE C . 52152 1
628 . 1 . 1 148 148 ILE CA C 13 61.10235035 0.2534319381 . 1 . . . . . 144 ILE CA . 52152 1
629 . 1 . 1 148 148 ILE CB C 13 40.86666743 0 . 1 . . . . . 144 ILE CB . 52152 1
630 . 1 . 1 148 148 ILE N N 15 124.480449 0.04627516622 . 1 . . . . . 144 ILE N . 52152 1
631 . 1 . 1 149 149 THR H H 1 10.57634412 0.001182813181 . 1 . . . . . 145 THR H . 52152 1
632 . 1 . 1 149 149 THR CA C 13 61.59199877 0 . 1 . . . . . 145 THR CA . 52152 1
633 . 1 . 1 149 149 THR N N 15 131.2878913 0.0534222148 . 1 . . . . . 145 THR N . 52152 1
634 . 1 . 1 150 150 PHE H H 1 7.546048777 0.002065240811 . 1 . . . . . 146 PHE H . 52152 1
635 . 1 . 1 150 150 PHE CA C 13 59.8896007 0.120278302 . 1 . . . . . 146 PHE CA . 52152 1
636 . 1 . 1 150 150 PHE CB C 13 39.149656 0 . 1 . . . . . 146 PHE CB . 52152 1
637 . 1 . 1 150 150 PHE N N 15 128.135823 0.08939931651 . 1 . . . . . 146 PHE N . 52152 1
638 . 1 . 1 151 151 SER H H 1 8.935794094 0.003057378616 . 1 . . . . . 147 SER H . 52152 1
639 . 1 . 1 151 151 SER CA C 13 61.1929934 0.2315759599 . 1 . . . . . 147 SER CA . 52152 1
640 . 1 . 1 151 151 SER CB C 13 62.02953968 0 . 1 . . . . . 147 SER CB . 52152 1
641 . 1 . 1 151 151 SER N N 15 114.4436537 0.05110542007 . 1 . . . . . 147 SER N . 52152 1
642 . 1 . 1 152 152 ASN H H 1 7.200937985 0.003285139352 . 1 . . . . . 148 ASN H . 52152 1
643 . 1 . 1 152 152 ASN C C 13 178.6586575 0.0000019 . 1 . . . . . 148 ASN C . 52152 1
644 . 1 . 1 152 152 ASN CA C 13 55.04961431 0.05376682819 . 1 . . . . . 148 ASN CA . 52152 1
645 . 1 . 1 152 152 ASN CB C 13 36.00225886 0 . 1 . . . . . 148 ASN CB . 52152 1
646 . 1 . 1 152 152 ASN N N 15 118.1734139 0.01919216669 . 1 . . . . . 148 ASN N . 52152 1
647 . 1 . 1 153 153 HIS H H 1 6.651413555 0.001438453527 . 1 . . . . . 149 HIS H . 52152 1
648 . 1 . 1 153 153 HIS C C 13 174.2864631 0 . 1 . . . . . 149 HIS C . 52152 1
649 . 1 . 1 153 153 HIS CA C 13 59.27227735 0 . 1 . . . . . 149 HIS CA . 52152 1
650 . 1 . 1 153 153 HIS CB C 13 29.66481094 0 . 1 . . . . . 149 HIS CB . 52152 1
651 . 1 . 1 153 153 HIS N N 15 122.1279061 0.06841636317 . 1 . . . . . 149 HIS N . 52152 1
652 . 1 . 1 154 154 VAL H H 1 7.145370249 0.002247173742 . 1 . . . . . 150 VAL H . 52152 1
653 . 1 . 1 154 154 VAL C C 13 179.5076686 0 . 1 . . . . . 150 VAL C . 52152 1
654 . 1 . 1 154 154 VAL CA C 13 66.437744 0.08685260275 . 1 . . . . . 150 VAL CA . 52152 1
655 . 1 . 1 154 154 VAL CB C 13 31.38121305 0 . 1 . . . . . 150 VAL CB . 52152 1
656 . 1 . 1 154 154 VAL N N 15 117.3531665 0.06632012135 . 1 . . . . . 150 VAL N . 52152 1
657 . 1 . 1 155 155 ASN H H 1 7.95150166 0.002299421741 . 1 . . . . . 151 ASN H . 52152 1
658 . 1 . 1 155 155 ASN C C 13 177.4560006 0 . 1 . . . . . 151 ASN C . 52152 1
659 . 1 . 1 155 155 ASN CA C 13 55.95319747 0.06636247541 . 1 . . . . . 151 ASN CA . 52152 1
660 . 1 . 1 155 155 ASN CB C 13 37.52514366 0 . 1 . . . . . 151 ASN CB . 52152 1
661 . 1 . 1 155 155 ASN N N 15 116.4094327 0.06663489081 . 1 . . . . . 151 ASN N . 52152 1
662 . 1 . 1 156 156 ALA H H 1 7.302959953 0.002009382822 . 1 . . . . . 152 ALA H . 52152 1
663 . 1 . 1 156 156 ALA C C 13 180.9147309 0 . 1 . . . . . 152 ALA C . 52152 1
664 . 1 . 1 156 156 ALA CA C 13 54.8926691 0.05730105545 . 1 . . . . . 152 ALA CA . 52152 1
665 . 1 . 1 156 156 ALA CB C 13 18.29584141 0 . 1 . . . . . 152 ALA CB . 52152 1
666 . 1 . 1 156 156 ALA N N 15 124.9944086 0.06182774751 . 1 . . . . . 152 ALA N . 52152 1
667 . 1 . 1 157 157 TRP H H 1 9.211399623 0.001674410859 . 1 . . . . . 153 TRP H . 52152 1
668 . 1 . 1 157 157 TRP C C 13 179.5249117 0 . 1 . . . . . 153 TRP C . 52152 1
669 . 1 . 1 157 157 TRP CA C 13 58.47677087 0.0736072261 . 1 . . . . . 153 TRP CA . 52152 1
670 . 1 . 1 157 157 TRP CB C 13 27.23853906 0 . 1 . . . . . 153 TRP CB . 52152 1
671 . 1 . 1 157 157 TRP N N 15 122.2745116 0.06362573391 . 1 . . . . . 153 TRP N . 52152 1
672 . 1 . 1 158 158 LYS H H 1 8.281795739 0.002291870311 . 1 . . . . . 154 LYS H . 52152 1
673 . 1 . 1 158 158 LYS C C 13 180.0264994 0 . 1 . . . . . 154 LYS C . 52152 1
674 . 1 . 1 158 158 LYS CA C 13 60.47965159 0.09484821706 . 1 . . . . . 154 LYS CA . 52152 1
675 . 1 . 1 158 158 LYS CB C 13 32.12414457 0 . 1 . . . . . 154 LYS CB . 52152 1
676 . 1 . 1 158 158 LYS N N 15 121.9051989 0.05994513601 . 1 . . . . . 154 LYS N . 52152 1
677 . 1 . 1 159 159 SER H H 1 7.715824195 0.001901297982 . 1 . . . . . 155 SER H . 52152 1
678 . 1 . 1 159 159 SER C C 13 180.0397454 0 . 1 . . . . . 155 SER C . 52152 1
679 . 1 . 1 159 159 SER CA C 13 60.89872282 0.1799345363 . 1 . . . . . 155 SER CA . 52152 1
680 . 1 . 1 159 159 SER CB C 13 62.44898138 0 . 1 . . . . . 155 SER CB . 52152 1
681 . 1 . 1 159 159 SER N N 15 116.39612 0.05849276162 . 1 . . . . . 155 SER N . 52152 1
682 . 1 . 1 160 160 HIS H H 1 7.47130402 0.003960557881 . 1 . . . . . 156 HIS H . 52152 1
683 . 1 . 1 160 160 HIS CA C 13 55.35222564 0.1631955277 . 1 . . . . . 156 HIS CA . 52152 1
684 . 1 . 1 160 160 HIS CB C 13 28.7660073 0 . 1 . . . . . 156 HIS CB . 52152 1
685 . 1 . 1 160 160 HIS N N 15 118.4213916 0.05887001428 . 1 . . . . . 156 HIS N . 52152 1
686 . 1 . 1 161 161 GLY H H 1 7.799491044 0.002278907699 . 1 . . . . . 157 GLY H . 52152 1
687 . 1 . 1 161 161 GLY C C 13 173.581937 0 . 1 . . . . . 157 GLY C . 52152 1
688 . 1 . 1 161 161 GLY CA C 13 46.02781787 0.1220598807 . 1 . . . . . 157 GLY CA . 52152 1
689 . 1 . 1 161 161 GLY N N 15 107.6845937 0.07910045771 . 1 . . . . . 157 GLY N . 52152 1
690 . 1 . 1 162 162 MET H H 1 7.750916731 0.001927880999 . 1 . . . . . 158 MET H . 52152 1
691 . 1 . 1 162 162 MET CA C 13 53.90371719 0.1607893594 . 1 . . . . . 158 MET CA . 52152 1
692 . 1 . 1 162 162 MET CB C 13 32.68802992 0 . 1 . . . . . 158 MET CB . 52152 1
693 . 1 . 1 162 162 MET N N 15 121.7627938 0.08252413886 . 1 . . . . . 158 MET N . 52152 1
694 . 1 . 1 163 163 ASN H H 1 8.046373322 0.002439688083 . 1 . . . . . 159 ASN H . 52152 1
695 . 1 . 1 163 163 ASN C C 13 176.5104044 0 . 1 . . . . . 159 ASN C . 52152 1
696 . 1 . 1 163 163 ASN CA C 13 52.92593691 0 . 1 . . . . . 159 ASN CA . 52152 1
697 . 1 . 1 163 163 ASN CB C 13 39.54803355 0 . 1 . . . . . 159 ASN CB . 52152 1
698 . 1 . 1 163 163 ASN N N 15 119.7712432 0.04408812336 . 1 . . . . . 159 ASN N . 52152 1
699 . 1 . 1 164 164 LEU H H 1 9.172153665 0 . 1 . . . . . 160 LEU H . 52152 1
700 . 1 . 1 164 164 LEU C C 13 176.0832401 0 . 1 . . . . . 160 LEU C . 52152 1
701 . 1 . 1 164 164 LEU CA C 13 54.37051957 0.0370935354 . 1 . . . . . 160 LEU CA . 52152 1
702 . 1 . 1 164 164 LEU CB C 13 42.95957071 0 . 1 . . . . . 160 LEU CB . 52152 1
703 . 1 . 1 164 164 LEU N N 15 128.7851659 0 . 1 . . . . . 160 LEU N . 52152 1
704 . 1 . 1 165 165 GLY H H 1 7.055038533 0.002199810447 . 1 . . . . . 161 GLY H . 52152 1
705 . 1 . 1 165 165 GLY CA C 13 45.13043989 0.1783212512 . 1 . . . . . 161 GLY CA . 52152 1
706 . 1 . 1 165 165 GLY N N 15 105.7394504 0.07492023919 . 1 . . . . . 161 GLY N . 52152 1
707 . 1 . 1 166 166 SER H H 1 7.415735075 0.001341343789 . 1 . . . . . 162 SER H . 52152 1
708 . 1 . 1 166 166 SER C C 13 174.5375086 0 . 1 . . . . . 162 SER C . 52152 1
709 . 1 . 1 166 166 SER CA C 13 58.67162109 0.07258565222 . 1 . . . . . 162 SER CA . 52152 1
710 . 1 . 1 166 166 SER CB C 13 64.16829309 0 . 1 . . . . . 162 SER CB . 52152 1
711 . 1 . 1 166 166 SER N N 15 109.2566838 0.06479809675 . 1 . . . . . 162 SER N . 52152 1
712 . 1 . 1 167 167 ASN H H 1 7.698686909 0.001881906386 . 1 . . . . . 163 ASN H . 52152 1
713 . 1 . 1 167 167 ASN C C 13 174.130456 0 . 1 . . . . . 163 ASN C . 52152 1
714 . 1 . 1 167 167 ASN CA C 13 51.5927925 0.1335842459 . 1 . . . . . 163 ASN CA . 52152 1
715 . 1 . 1 167 167 ASN CB C 13 39.9045092 0 . 1 . . . . . 163 ASN CB . 52152 1
716 . 1 . 1 167 167 ASN N N 15 121.2412783 0.07686216693 . 1 . . . . . 163 ASN N . 52152 1
717 . 1 . 1 168 168 TRP H H 1 9.050368052 0.005150628863 . 1 . . . . . 164 TRP H . 52152 1
718 . 1 . 1 168 168 TRP C C 13 175.1892186 0 . 1 . . . . . 164 TRP C . 52152 1
719 . 1 . 1 168 168 TRP CA C 13 59.92557824 0 . 1 . . . . . 164 TRP CA . 52152 1
720 . 1 . 1 168 168 TRP CB C 13 29.5157225 0.1841118317 . 1 . . . . . 164 TRP CB . 52152 1
721 . 1 . 1 168 168 TRP N N 15 127.9790456 0.05291468293 . 1 . . . . . 164 TRP N . 52152 1
722 . 1 . 1 169 169 ALA H H 1 7.31701221 0.001497491829 . 1 . . . . . 165 ALA H . 52152 1
723 . 1 . 1 169 169 ALA C C 13 175.1262732 0 . 1 . . . . . 165 ALA C . 52152 1
724 . 1 . 1 169 169 ALA CA C 13 49.80767038 0.07298322142 . 1 . . . . . 165 ALA CA . 52152 1
725 . 1 . 1 169 169 ALA CB C 13 18.13313919 0 . 1 . . . . . 165 ALA CB . 52152 1
726 . 1 . 1 169 169 ALA N N 15 126.9069898 0.0299078691 . 1 . . . . . 165 ALA N . 52152 1
727 . 1 . 1 170 170 TYR H H 1 6.092381717 0.002087928483 . 1 . . . . . 166 TYR H . 52152 1
728 . 1 . 1 170 170 TYR C C 13 175.2914136 0 . 1 . . . . . 166 TYR C . 52152 1
729 . 1 . 1 170 170 TYR CA C 13 57.65521535 0.002433195968 . 1 . . . . . 166 TYR CA . 52152 1
730 . 1 . 1 170 170 TYR CB C 13 38.0224053 0 . 1 . . . . . 166 TYR CB . 52152 1
731 . 1 . 1 170 170 TYR N N 15 115.69223 0.06044647985 . 1 . . . . . 166 TYR N . 52152 1
732 . 1 . 1 171 171 GLN H H 1 8.516753735 0.00359537836 . 1 . . . . . 167 GLN H . 52152 1
733 . 1 . 1 171 171 GLN C C 13 174.2101403 0 . 1 . . . . . 167 GLN C . 52152 1
734 . 1 . 1 171 171 GLN CA C 13 54.89808066 0 . 1 . . . . . 167 GLN CA . 52152 1
735 . 1 . 1 171 171 GLN CB C 13 34.57449708 0 . 1 . . . . . 167 GLN CB . 52152 1
736 . 1 . 1 171 171 GLN N N 15 122.8259569 0.0924025633 . 1 . . . . . 167 GLN N . 52152 1
737 . 1 . 1 172 172 VAL H H 1 9.98808317 0.001919190923 . 1 . . . . . 168 VAL H . 52152 1
738 . 1 . 1 172 172 VAL C C 13 173.1178153 0.07902057971 . 1 . . . . . 168 VAL C . 52152 1
739 . 1 . 1 172 172 VAL CA C 13 59.02839041 0.0919204804 . 1 . . . . . 168 VAL CA . 52152 1
740 . 1 . 1 172 172 VAL CB C 13 36.6577404 0.1428540778 . 1 . . . . . 168 VAL CB . 52152 1
741 . 1 . 1 172 172 VAL N N 15 119.7588915 0.06327470923 . 1 . . . . . 168 VAL N . 52152 1
742 . 1 . 1 173 173 MET H H 1 8.503868986 0.005429330567 . 1 . . . . . 169 MET H . 52152 1
743 . 1 . 1 173 173 MET C C 13 175.3952953 0 . 1 . . . . . 169 MET C . 52152 1
744 . 1 . 1 173 173 MET CA C 13 54.74910513 0.02467908338 . 1 . . . . . 169 MET CA . 52152 1
745 . 1 . 1 173 173 MET CB C 13 32.12016983 0 . 1 . . . . . 169 MET CB . 52152 1
746 . 1 . 1 173 173 MET N N 15 122.7892776 0.094241298 . 1 . . . . . 169 MET N . 52152 1
747 . 1 . 1 174 174 ALA H H 1 9.787322904 0.001645223899 . 1 . . . . . 170 ALA H . 52152 1
748 . 1 . 1 174 174 ALA C C 13 176.012892 0 . 1 . . . . . 170 ALA C . 52152 1
749 . 1 . 1 174 174 ALA CA C 13 52.10941562 0 . 1 . . . . . 170 ALA CA . 52152 1
750 . 1 . 1 174 174 ALA CB C 13 23.32539037 0 . 1 . . . . . 170 ALA CB . 52152 1
751 . 1 . 1 174 174 ALA N N 15 134.3940125 0.07961562224 . 1 . . . . . 170 ALA N . 52152 1
752 . 1 . 1 175 175 THR H H 1 9.096619498 0.00282014826 . 1 . . . . . 171 THR H . 52152 1
753 . 1 . 1 175 175 THR C C 13 175.9941438 0 . 1 . . . . . 171 THR C . 52152 1
754 . 1 . 1 175 175 THR CA C 13 62.47588017 0.1190702045 . 1 . . . . . 171 THR CA . 52152 1
755 . 1 . 1 175 175 THR CB C 13 71.78050188 0 . 1 . . . . . 171 THR CB . 52152 1
756 . 1 . 1 175 175 THR N N 15 114.2304383 0.08652997363 . 1 . . . . . 171 THR N . 52152 1
757 . 1 . 1 176 176 GLU H H 1 8.638631788 0.002510497356 . 1 . . . . . 172 GLU H . 52152 1
758 . 1 . 1 176 176 GLU C C 13 173.7990846 0 . 1 . . . . . 172 GLU C . 52152 1
759 . 1 . 1 176 176 GLU CA C 13 52.49748818 0.1052690056 . 1 . . . . . 172 GLU CA . 52152 1
760 . 1 . 1 176 176 GLU CB C 13 31.53654926 0 . 1 . . . . . 172 GLU CB . 52152 1
761 . 1 . 1 176 176 GLU N N 15 126.012428 0.08886349471 . 1 . . . . . 172 GLU N . 52152 1
762 . 1 . 1 177 177 GLY H H 1 5.961046534 0.002760735624 . 1 . . . . . 173 GLY H . 52152 1
763 . 1 . 1 177 177 GLY CA C 13 44.40184571 0 . 1 . . . . . 173 GLY CA . 52152 1
764 . 1 . 1 177 177 GLY N N 15 108.8390283 0.0300080823 . 1 . . . . . 173 GLY N . 52152 1
765 . 1 . 1 178 178 TYR H H 1 6.994487809 0.001956387004 . 1 . . . . . 174 TYR H . 52152 1
766 . 1 . 1 178 178 TYR CA C 13 56.56213493 0 . 1 . . . . . 174 TYR CA . 52152 1
767 . 1 . 1 178 178 TYR CB C 13 40.29763726 0 . 1 . . . . . 174 TYR CB . 52152 1
768 . 1 . 1 178 178 TYR N N 15 117.2070658 0.04899640172 . 1 . . . . . 174 TYR N . 52152 1
769 . 1 . 1 179 179 GLN H H 1 7.576216703 0.004426884683 . 1 . . . . . 175 GLN H . 52152 1
770 . 1 . 1 179 179 GLN CA C 13 55.64189018 0 . 1 . . . . . 175 GLN CA . 52152 1
771 . 1 . 1 179 179 GLN N N 15 122.9104711 0.1181655992 . 1 . . . . . 175 GLN N . 52152 1
772 . 1 . 1 180 180 SER H H 1 7.596701866 0.002847330502 . 1 . . . . . 176 SER H . 52152 1
773 . 1 . 1 180 180 SER C C 13 171.5529974 0 . 1 . . . . . 176 SER C . 52152 1
774 . 1 . 1 180 180 SER CA C 13 56.31475247 0.0555052655 . 1 . . . . . 176 SER CA . 52152 1
775 . 1 . 1 180 180 SER CB C 13 68.02589933 0 . 1 . . . . . 176 SER CB . 52152 1
776 . 1 . 1 180 180 SER N N 15 111.1748359 0.04834043703 . 1 . . . . . 176 SER N . 52152 1
777 . 1 . 1 181 181 SER H H 1 7.533130504 0.002627919407 . 1 . . . . . 177 SER H . 52152 1
778 . 1 . 1 181 181 SER CA C 13 56.393143 0 . 1 . . . . . 177 SER CA . 52152 1
779 . 1 . 1 181 181 SER CB C 13 67.08658912 0 . 1 . . . . . 177 SER CB . 52152 1
780 . 1 . 1 181 181 SER N N 15 110.9255967 0.07235488547 . 1 . . . . . 177 SER N . 52152 1
781 . 1 . 1 182 182 GLY H H 1 7.486759575 0.002462983903 . 1 . . . . . 178 GLY H . 52152 1
782 . 1 . 1 182 182 GLY C C 13 170.5215595 0 . 1 . . . . . 178 GLY C . 52152 1
783 . 1 . 1 182 182 GLY CA C 13 44.56807367 0.1430986442 . 1 . . . . . 178 GLY CA . 52152 1
784 . 1 . 1 182 182 GLY N N 15 107.3746686 0.07722288083 . 1 . . . . . 178 GLY N . 52152 1
785 . 1 . 1 183 183 SER H H 1 6.261214913 0.001432246346 . 1 . . . . . 179 SER H . 52152 1
786 . 1 . 1 183 183 SER C C 13 172.6113575 0 . 1 . . . . . 179 SER C . 52152 1
787 . 1 . 1 183 183 SER CA C 13 57.44122151 0.06825328835 . 1 . . . . . 179 SER CA . 52152 1
788 . 1 . 1 183 183 SER CB C 13 66.4847618 0 . 1 . . . . . 179 SER CB . 52152 1
789 . 1 . 1 183 183 SER N N 15 111.930427 0.08079701903 . 1 . . . . . 179 SER N . 52152 1
790 . 1 . 1 184 184 SER H H 1 9.454993271 0.001345818521 . 1 . . . . . 180 SER H . 52152 1
791 . 1 . 1 184 184 SER CA C 13 56.94723524 0.07968357173 . 1 . . . . . 180 SER CA . 52152 1
792 . 1 . 1 184 184 SER CB C 13 66.8451519 0 . 1 . . . . . 180 SER CB . 52152 1
793 . 1 . 1 184 184 SER N N 15 116.2144871 0.06494534578 . 1 . . . . . 180 SER N . 52152 1
794 . 1 . 1 185 185 ASN H H 1 9.131600225 0.002430796831 . 1 . . . . . 181 ASN H . 52152 1
795 . 1 . 1 185 185 ASN CA C 13 54.83046439 0.1173484687 . 1 . . . . . 181 ASN CA . 52152 1
796 . 1 . 1 185 185 ASN CB C 13 40.84577104 0 . 1 . . . . . 181 ASN CB . 52152 1
797 . 1 . 1 185 185 ASN N N 15 125.1536156 0.0696899502 . 1 . . . . . 181 ASN N . 52152 1
798 . 1 . 1 186 186 VAL H H 1 8.555986646 0.001933259092 . 1 . . . . . 182 VAL H . 52152 1
799 . 1 . 1 186 186 VAL C C 13 173.2652362 0 . 1 . . . . . 182 VAL C . 52152 1
800 . 1 . 1 186 186 VAL CA C 13 60.93250938 0.1382792943 . 1 . . . . . 182 VAL CA . 52152 1
801 . 1 . 1 186 186 VAL CB C 13 36.23754843 0 . 1 . . . . . 182 VAL CB . 52152 1
802 . 1 . 1 186 186 VAL N N 15 125.5226915 0.07553908368 . 1 . . . . . 182 VAL N . 52152 1
803 . 1 . 1 187 187 THR H H 1 8.489042981 0.001319864135 . 1 . . . . . 183 THR H . 52152 1
804 . 1 . 1 187 187 THR CA C 13 61.90952557 0.1941574119 . 1 . . . . . 183 THR CA . 52152 1
805 . 1 . 1 187 187 THR CB C 13 70.24904663 0 . 1 . . . . . 183 THR CB . 52152 1
806 . 1 . 1 187 187 THR N N 15 122.7565307 0.06201749812 . 1 . . . . . 183 THR N . 52152 1
807 . 1 . 1 188 188 VAL H H 1 8.472492434 0.002518094548 . 1 . . . . . 184 VAL H . 52152 1
808 . 1 . 1 188 188 VAL C C 13 174.0511618 0.0000019 . 1 . . . . . 184 VAL C . 52152 1
809 . 1 . 1 188 188 VAL CA C 13 61.28330198 0 . 1 . . . . . 184 VAL CA . 52152 1
810 . 1 . 1 188 188 VAL N N 15 128.4595643 0.05633555157 . 1 . . . . . 184 VAL N . 52152 1
811 . 1 . 1 189 189 TRP H H 1 9.354318424 0.001692112791 . 1 . . . . . 185 TRP H . 52152 1
812 . 1 . 1 189 189 TRP C C 13 178.0695215 0 . 1 . . . . . 185 TRP C . 52152 1
813 . 1 . 1 189 189 TRP CA C 13 60.49231427 0.02152283983 . 1 . . . . . 185 TRP CA . 52152 1
814 . 1 . 1 189 189 TRP CB C 13 30.25312527 0 . 1 . . . . . 185 TRP CB . 52152 1
815 . 1 . 1 189 189 TRP N N 15 131.582163 0.05424345198 . 1 . . . . . 185 TRP N . 52152 1
stop_
save_