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 52153
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Xylanase A D11F/R122D'
_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' . . . 52153 1
2 '3D HNCO' . . . 52153 1
3 '3D HNCACB' . . . 52153 1
4 '3D CBCA(CO)NH' . . . 52153 1
5 '3D HN(CA)CO' . . . 52153 1
6 '2D 1H-15N TROSY' . . . 52153 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52153 1
3 $software_3 . . 52153 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 8.372360645 0.0005872064591 . 1 . . . . . 0 MET H . 52153 1
2 . 1 . 1 4 4 MET CA C 13 55.72468851 0.08774346384 . 1 . . . . . 0 MET CA . 52153 1
3 . 1 . 1 4 4 MET CB C 13 33.00075712 0 . 1 . . . . . 0 MET CB . 52153 1
4 . 1 . 1 4 4 MET N N 15 122.8425337 0.02731150447 . 1 . . . . . 0 MET N . 52153 1
5 . 1 . 1 5 5 ALA H H 1 8.498557697 0.0005099241702 . 1 . . . . . 1 ALA H . 52153 1
6 . 1 . 1 5 5 ALA C C 13 178.1687448 0 . 1 . . . . . 1 ALA C . 52153 1
7 . 1 . 1 5 5 ALA CA C 13 52.46507864 0.03963936187 . 1 . . . . . 1 ALA CA . 52153 1
8 . 1 . 1 5 5 ALA CB C 13 19.69953506 0 . 1 . . . . . 1 ALA CB . 52153 1
9 . 1 . 1 5 5 ALA N N 15 126.8014572 0.05840302534 . 1 . . . . . 1 ALA N . 52153 1
10 . 1 . 1 6 6 SER H H 1 8.588737526 0.0005161540883 . 1 . . . . . 2 SER H . 52153 1
11 . 1 . 1 6 6 SER C C 13 175.4404481 0 . 1 . . . . . 2 SER C . 52153 1
12 . 1 . 1 6 6 SER CA C 13 58.99475336 0.07845050945 . 1 . . . . . 2 SER CA . 52153 1
13 . 1 . 1 6 6 SER CB C 13 64.61942592 0 . 1 . . . . . 2 SER CB . 52153 1
14 . 1 . 1 6 6 SER N N 15 117.2634888 0.03683101685 . 1 . . . . . 2 SER N . 52153 1
15 . 1 . 1 7 7 THR H H 1 7.910240104 0.001242506436 . 1 . . . . . 3 THR H . 52153 1
16 . 1 . 1 7 7 THR C C 13 175.2974553 0 . 1 . . . . . 3 THR C . 52153 1
17 . 1 . 1 7 7 THR CA C 13 62.06016438 0.1053719631 . 1 . . . . . 3 THR CA . 52153 1
18 . 1 . 1 7 7 THR CB C 13 69.41514213 0 . 1 . . . . . 3 THR CB . 52153 1
19 . 1 . 1 7 7 THR N N 15 112.5192469 0.05536910226 . 1 . . . . . 3 THR N . 52153 1
20 . 1 . 1 8 8 ASP H H 1 8.049591015 0.001726284676 . 1 . . . . . 4 ASP H . 52153 1
21 . 1 . 1 8 8 ASP C C 13 175.5033361 0 . 1 . . . . . 4 ASP C . 52153 1
22 . 1 . 1 8 8 ASP CA C 13 53.52357794 0 . 1 . . . . . 4 ASP CA . 52153 1
23 . 1 . 1 8 8 ASP CB C 13 42.23864805 0 . 1 . . . . . 4 ASP CB . 52153 1
24 . 1 . 1 8 8 ASP N N 15 120.0397591 0.03446013977 . 1 . . . . . 4 ASP N . 52153 1
25 . 1 . 1 9 9 TYR H H 1 7.875746077 0.002224480644 . 1 . . . . . 5 TYR H . 52153 1
26 . 1 . 1 9 9 TYR C C 13 173.4890406 0 . 1 . . . . . 5 TYR C . 52153 1
27 . 1 . 1 9 9 TYR CA C 13 58.38728628 0.04310026073 . 1 . . . . . 5 TYR CA . 52153 1
28 . 1 . 1 9 9 TYR CB C 13 42.33980728 0 . 1 . . . . . 5 TYR CB . 52153 1
29 . 1 . 1 9 9 TYR N N 15 121.7550041 0.04370013734 . 1 . . . . . 5 TYR N . 52153 1
30 . 1 . 1 10 10 TRP H H 1 7.309940679 0.00278506887 . 1 . . . . . 6 TRP H . 52153 1
31 . 1 . 1 10 10 TRP CA C 13 54.45274002 0.07204537059 . 1 . . . . . 6 TRP CA . 52153 1
32 . 1 . 1 10 10 TRP CB C 13 32.50116866 0.052 . 1 . . . . . 6 TRP CB . 52153 1
33 . 1 . 1 10 10 TRP N N 15 132.2956432 0.08482676961 . 1 . . . . . 6 TRP N . 52153 1
34 . 1 . 1 11 11 GLN H H 1 7.955798728 0.001772870641 . 1 . . . . . 7 GLN H . 52153 1
35 . 1 . 1 11 11 GLN CA C 13 52.48599549 0 . 1 . . . . . 7 GLN CA . 52153 1
36 . 1 . 1 11 11 GLN N N 15 127.535956 0.01952931196 . 1 . . . . . 7 GLN N . 52153 1
37 . 1 . 1 12 12 ASN H H 1 7.846772918 0.001283883763 . 1 . . . . . 8 ASN H . 52153 1
38 . 1 . 1 12 12 ASN C C 13 172.6452686 0 . 1 . . . . . 8 ASN C . 52153 1
39 . 1 . 1 12 12 ASN CA C 13 52.58259188 0.000210243554 . 1 . . . . . 8 ASN CA . 52153 1
40 . 1 . 1 12 12 ASN CB C 13 37.53933256 0 . 1 . . . . . 8 ASN CB . 52153 1
41 . 1 . 1 12 12 ASN N N 15 123.9700911 0.04051861515 . 1 . . . . . 8 ASN N . 52153 1
42 . 1 . 1 13 13 TRP H H 1 8.494247751 0.001789710658 . 1 . . . . . 9 TRP H . 52153 1
43 . 1 . 1 13 13 TRP CA C 13 56.33735306 0 . 1 . . . . . 9 TRP CA . 52153 1
44 . 1 . 1 13 13 TRP N N 15 128.2119413 0.07369978151 . 1 . . . . . 9 TRP N . 52153 1
45 . 1 . 1 21 21 ASN H H 1 8.736689455 0.001621902575 . 1 . . . . . 17 ASN H . 52153 1
46 . 1 . 1 21 21 ASN CB C 13 38.74319932 0 . 1 . . . . . 17 ASN CB . 52153 1
47 . 1 . 1 21 21 ASN N N 15 126.7645295 0.07710390492 . 1 . . . . . 17 ASN N . 52153 1
48 . 1 . 1 22 22 ALA H H 1 8.769449032 0.002474986646 . 1 . . . . . 18 ALA H . 52153 1
49 . 1 . 1 22 22 ALA C C 13 176.6623518 0 . 1 . . . . . 18 ALA C . 52153 1
50 . 1 . 1 22 22 ALA CA C 13 50.80498788 0.1367527686 . 1 . . . . . 18 ALA CA . 52153 1
51 . 1 . 1 22 22 ALA N N 15 130.8506739 0.07131411662 . 1 . . . . . 18 ALA N . 52153 1
52 . 1 . 1 23 23 VAL H H 1 9.385323092 0.002121298478 . 1 . . . . . 19 VAL H . 52153 1
53 . 1 . 1 23 23 VAL C C 13 174.640841 0 . 1 . . . . . 19 VAL C . 52153 1
54 . 1 . 1 23 23 VAL CA C 13 62.15358117 0.03140293393 . 1 . . . . . 19 VAL CA . 52153 1
55 . 1 . 1 23 23 VAL CB C 13 33.82267421 0 . 1 . . . . . 19 VAL CB . 52153 1
56 . 1 . 1 23 23 VAL N N 15 125.7084963 0.05789837237 . 1 . . . . . 19 VAL N . 52153 1
57 . 1 . 1 24 24 ASN H H 1 8.306805047 0.0008169211522 . 1 . . . . . 20 ASN H . 52153 1
58 . 1 . 1 24 24 ASN CA C 13 51.67237859 0 . 1 . . . . . 20 ASN CA . 52153 1
59 . 1 . 1 24 24 ASN CB C 13 35.32080533 0 . 1 . . . . . 20 ASN CB . 52153 1
60 . 1 . 1 24 24 ASN N N 15 126.675173 0.04355309232 . 1 . . . . . 20 ASN N . 52153 1
61 . 1 . 1 25 25 GLY H H 1 7.210738009 0.003194192087 . 1 . . . . . 21 GLY H . 52153 1
62 . 1 . 1 25 25 GLY CA C 13 44.18837607 0 . 1 . . . . . 21 GLY CA . 52153 1
63 . 1 . 1 25 25 GLY N N 15 113.9014735 0.03540769604 . 1 . . . . . 21 GLY N . 52153 1
64 . 1 . 1 26 26 SER H H 1 8.32835581 0.001420238673 . 1 . . . . . 22 SER H . 52153 1
65 . 1 . 1 26 26 SER C C 13 177.2567248 0 . 1 . . . . . 22 SER C . 52153 1
66 . 1 . 1 26 26 SER CA C 13 58.64448156 0.0000006743 . 1 . . . . . 22 SER CA . 52153 1
67 . 1 . 1 26 26 SER CB C 13 63.80435074 0 . 1 . . . . . 22 SER CB . 52153 1
68 . 1 . 1 26 26 SER N N 15 113.7612362 0.05118584032 . 1 . . . . . 22 SER N . 52153 1
69 . 1 . 1 27 27 GLY H H 1 8.92597698 0.001724988288 . 1 . . . . . 23 GLY H . 52153 1
70 . 1 . 1 27 27 GLY CA C 13 47.55670111 0.04025559169 . 1 . . . . . 23 GLY CA . 52153 1
71 . 1 . 1 27 27 GLY N N 15 114.4296403 0.01547819503 . 1 . . . . . 23 GLY N . 52153 1
72 . 1 . 1 28 28 GLY H H 1 9.302241479 0.001519448194 . 1 . . . . . 24 GLY H . 52153 1
73 . 1 . 1 28 28 GLY CA C 13 46.10999049 0 . 1 . . . . . 24 GLY CA . 52153 1
74 . 1 . 1 28 28 GLY N N 15 116.7632017 0.042572866 . 1 . . . . . 24 GLY N . 52153 1
75 . 1 . 1 29 29 ASN H H 1 8.162270177 0.0006182256395 . 1 . . . . . 25 ASN H . 52153 1
76 . 1 . 1 29 29 ASN C C 13 175.9396099 0 . 1 . . . . . 25 ASN C . 52153 1
77 . 1 . 1 29 29 ASN CA C 13 54.46770216 0.08895032973 . 1 . . . . . 25 ASN CA . 52153 1
78 . 1 . 1 29 29 ASN CB C 13 42.82573424 0 . 1 . . . . . 25 ASN CB . 52153 1
79 . 1 . 1 29 29 ASN N N 15 119.6584657 0.09317275455 . 1 . . . . . 25 ASN N . 52153 1
80 . 1 . 1 30 30 TYR H H 1 9.709165564 0.001358985477 . 1 . . . . . 26 TYR H . 52153 1
81 . 1 . 1 30 30 TYR CA C 13 57.56384457 0 . 1 . . . . . 26 TYR CA . 52153 1
82 . 1 . 1 30 30 TYR CB C 13 43.02617252 0 . 1 . . . . . 26 TYR CB . 52153 1
83 . 1 . 1 30 30 TYR N N 15 125.4236639 0.02792024755 . 1 . . . . . 26 TYR N . 52153 1
84 . 1 . 1 31 31 SER H H 1 8.718528353 0.00312637928 . 1 . . . . . 27 SER H . 52153 1
85 . 1 . 1 31 31 SER CA C 13 56.6708447 0.1323993203 . 1 . . . . . 27 SER CA . 52153 1
86 . 1 . 1 31 31 SER CB C 13 66.84484753 0 . 1 . . . . . 27 SER CB . 52153 1
87 . 1 . 1 31 31 SER N N 15 112.3588188 0.05123586557 . 1 . . . . . 27 SER N . 52153 1
88 . 1 . 1 32 32 VAL H H 1 9.133080098 0.001527155067 . 1 . . . . . 28 VAL H . 52153 1
89 . 1 . 1 32 32 VAL C C 13 174.2218842 0 . 1 . . . . . 28 VAL C . 52153 1
90 . 1 . 1 32 32 VAL CA C 13 61.03029998 0 . 1 . . . . . 28 VAL CA . 52153 1
91 . 1 . 1 32 32 VAL CB C 13 34.73143702 0 . 1 . . . . . 28 VAL CB . 52153 1
92 . 1 . 1 32 32 VAL N N 15 119.4517199 0.04693758756 . 1 . . . . . 28 VAL N . 52153 1
93 . 1 . 1 33 33 ASN H H 1 8.357302713 0.002081679384 . 1 . . . . . 29 ASN H . 52153 1
94 . 1 . 1 33 33 ASN C C 13 174.3304659 0 . 1 . . . . . 29 ASN C . 52153 1
95 . 1 . 1 33 33 ASN CA C 13 53.18019131 0.06519841483 . 1 . . . . . 29 ASN CA . 52153 1
96 . 1 . 1 33 33 ASN CB C 13 41.75384206 0 . 1 . . . . . 29 ASN CB . 52153 1
97 . 1 . 1 33 33 ASN N N 15 126.7503778 0.1036541009 . 1 . . . . . 29 ASN N . 52153 1
98 . 1 . 1 41 41 VAL H H 1 8.985201364 0.0008547001049 . 1 . . . . . 37 VAL H . 52153 1
99 . 1 . 1 41 41 VAL C C 13 174.4433086 0 . 1 . . . . . 37 VAL C . 52153 1
100 . 1 . 1 41 41 VAL CA C 13 62.81198686 0 . 1 . . . . . 37 VAL CA . 52153 1
101 . 1 . 1 41 41 VAL CB C 13 35.35304265 0 . 1 . . . . . 37 VAL CB . 52153 1
102 . 1 . 1 41 41 VAL N N 15 120.3327878 0.0511291223 . 1 . . . . . 37 VAL N . 52153 1
103 . 1 . 1 42 42 VAL H H 1 8.584221928 0.002291432517 . 1 . . . . . 38 VAL H . 52153 1
104 . 1 . 1 42 42 VAL C C 13 175.0553526 0.05199999999 . 1 . . . . . 38 VAL C . 52153 1
105 . 1 . 1 42 42 VAL CA C 13 58.54903632 0.1305102715 . 1 . . . . . 38 VAL CA . 52153 1
106 . 1 . 1 42 42 VAL CB C 13 36.56918466 0 . 1 . . . . . 38 VAL CB . 52153 1
107 . 1 . 1 42 42 VAL N N 15 127.3041324 0.08783945022 . 1 . . . . . 38 VAL N . 52153 1
108 . 1 . 1 43 43 GLY H H 1 7.975764426 0.0007953444042 . 1 . . . . . 39 GLY H . 52153 1
109 . 1 . 1 43 43 GLY C C 13 170.2511832 0 . 1 . . . . . 39 GLY C . 52153 1
110 . 1 . 1 43 43 GLY CA C 13 45.55538171 0.03792907329 . 1 . . . . . 39 GLY CA . 52153 1
111 . 1 . 1 43 43 GLY N N 15 108.6825034 0.08174144569 . 1 . . . . . 39 GLY N . 52153 1
112 . 1 . 1 44 44 LYS H H 1 6.280909179 0.002108304799 . 1 . . . . . 40 LYS H . 52153 1
113 . 1 . 1 44 44 LYS CA C 13 54.51291703 0.01300276694 . 1 . . . . . 40 LYS CA . 52153 1
114 . 1 . 1 44 44 LYS CB C 13 38.66198522 0 . 1 . . . . . 40 LYS CB . 52153 1
115 . 1 . 1 44 44 LYS N N 15 116.2486014 0.09363064843 . 1 . . . . . 40 LYS N . 52153 1
116 . 1 . 1 45 45 GLY H H 1 7.970552575 0.001611979277 . 1 . . . . . 41 GLY H . 52153 1
117 . 1 . 1 45 45 GLY CA C 13 47.52232839 0.129461787 . 1 . . . . . 41 GLY CA . 52153 1
118 . 1 . 1 45 45 GLY N N 15 109.0935455 0.02811071529 . 1 . . . . . 41 GLY N . 52153 1
119 . 1 . 1 46 46 TRP H H 1 9.662048211 0.001484718967 . 1 . . . . . 42 TRP H . 52153 1
120 . 1 . 1 46 46 TRP C C 13 175.5257536 0 . 1 . . . . . 42 TRP C . 52153 1
121 . 1 . 1 46 46 TRP CA C 13 59.57268738 0 . 1 . . . . . 42 TRP CA . 52153 1
122 . 1 . 1 46 46 TRP N N 15 130.6505209 0.05168320643 . 1 . . . . . 42 TRP N . 52153 1
123 . 1 . 1 47 47 THR H H 1 10.09448633 0.001305769465 . 1 . . . . . 43 THR H . 52153 1
124 . 1 . 1 47 47 THR C C 13 175.3470487 0 . 1 . . . . . 43 THR C . 52153 1
125 . 1 . 1 47 47 THR CA C 13 66.26668082 0 . 1 . . . . . 43 THR CA . 52153 1
126 . 1 . 1 47 47 THR CB C 13 69.4189025 0 . 1 . . . . . 43 THR CB . 52153 1
127 . 1 . 1 47 47 THR N N 15 123.9448067 0.06348092797 . 1 . . . . . 43 THR N . 52153 1
128 . 1 . 1 48 48 THR H H 1 7.963695983 0.002381474531 . 1 . . . . . 44 THR H . 52153 1
129 . 1 . 1 48 48 THR CA C 13 60.93530837 0 . 1 . . . . . 44 THR CA . 52153 1
130 . 1 . 1 48 48 THR CB C 13 70.04237425 0 . 1 . . . . . 44 THR CB . 52153 1
131 . 1 . 1 48 48 THR N N 15 114.9909443 0.03851955205 . 1 . . . . . 44 THR N . 52153 1
132 . 1 . 1 49 49 GLY H H 1 8.150060811 0.001956383991 . 1 . . . . . 45 GLY H . 52153 1
133 . 1 . 1 49 49 GLY CA C 13 45.83188638 0.02382380913 . 1 . . . . . 45 GLY CA . 52153 1
134 . 1 . 1 49 49 GLY N N 15 110.7057775 0.08564230574 . 1 . . . . . 45 GLY N . 52153 1
135 . 1 . 1 50 50 SER H H 1 6.778129091 0.00229696548 . 1 . . . . . 46 SER H . 52153 1
136 . 1 . 1 50 50 SER CA C 13 52.3829511 0 . 1 . . . . . 46 SER CA . 52153 1
137 . 1 . 1 50 50 SER CB C 13 65.79682051 0 . 1 . . . . . 46 SER CB . 52153 1
138 . 1 . 1 50 50 SER N N 15 110.3446571 0.0303559942 . 1 . . . . . 46 SER N . 52153 1
139 . 1 . 1 52 52 PHE H H 1 7.200997008 0.001554179556 . 1 . . . . . 48 PHE H . 52153 1
140 . 1 . 1 52 52 PHE CA C 13 55.76675441 0.1270568993 . 1 . . . . . 48 PHE CA . 52153 1
141 . 1 . 1 52 52 PHE CB C 13 39.45345316 0 . 1 . . . . . 48 PHE CB . 52153 1
142 . 1 . 1 52 52 PHE N N 15 114.152261 0.08101409823 . 1 . . . . . 48 PHE N . 52153 1
143 . 1 . 1 53 53 ARG H H 1 6.543864805 0.002531165924 . 1 . . . . . 49 ARG H . 52153 1
144 . 1 . 1 53 53 ARG C C 13 176.3396292 0 . 1 . . . . . 49 ARG C . 52153 1
145 . 1 . 1 53 53 ARG CA C 13 56.81931185 0.05938573795 . 1 . . . . . 49 ARG CA . 52153 1
146 . 1 . 1 53 53 ARG CB C 13 31.69359233 0 . 1 . . . . . 49 ARG CB . 52153 1
147 . 1 . 1 53 53 ARG N N 15 122.6209155 0.05928349838 . 1 . . . . . 49 ARG N . 52153 1
148 . 1 . 1 54 54 THR H H 1 8.621166915 0.001140832316 . 1 . . . . . 50 THR H . 52153 1
149 . 1 . 1 54 54 THR C C 13 176.3187572 0 . 1 . . . . . 50 THR C . 52153 1
150 . 1 . 1 54 54 THR CA C 13 62.49369993 0 . 1 . . . . . 50 THR CA . 52153 1
151 . 1 . 1 54 54 THR CB C 13 69.35410762 0 . 1 . . . . . 50 THR CB . 52153 1
152 . 1 . 1 54 54 THR N N 15 125.4608275 0.05915673188 . 1 . . . . . 50 THR N . 52153 1
153 . 1 . 1 55 55 ILE H H 1 8.719576898 0.001527899191 . 1 . . . . . 51 ILE H . 52153 1
154 . 1 . 1 55 55 ILE C C 13 173.7546208 0 . 1 . . . . . 51 ILE C . 52153 1
155 . 1 . 1 55 55 ILE CA C 13 62.91329021 0.05925126555 . 1 . . . . . 51 ILE CA . 52153 1
156 . 1 . 1 55 55 ILE N N 15 129.8683111 0.07285391836 . 1 . . . . . 51 ILE N . 52153 1
157 . 1 . 1 56 56 ASN H H 1 8.562228775 0.003203472904 . 1 . . . . . 52 ASN H . 52153 1
158 . 1 . 1 56 56 ASN C C 13 172.8972354 0 . 1 . . . . . 52 ASN C . 52153 1
159 . 1 . 1 56 56 ASN CA C 13 51.12245545 0.0298389557 . 1 . . . . . 52 ASN CA . 52153 1
160 . 1 . 1 56 56 ASN CB C 13 40.16079964 0 . 1 . . . . . 52 ASN CB . 52153 1
161 . 1 . 1 56 56 ASN N N 15 126.6548589 0.03901504406 . 1 . . . . . 52 ASN N . 52153 1
162 . 1 . 1 57 57 TYR H H 1 8.60957553 0.001390173445 . 1 . . . . . 53 TYR H . 52153 1
163 . 1 . 1 57 57 TYR CA C 13 56.84804851 0.07228271132 . 1 . . . . . 53 TYR CA . 52153 1
164 . 1 . 1 57 57 TYR CB C 13 41.11941187 0 . 1 . . . . . 53 TYR CB . 52153 1
165 . 1 . 1 57 57 TYR N N 15 116.2677293 0.02374062558 . 1 . . . . . 53 TYR N . 52153 1
166 . 1 . 1 58 58 ASN H H 1 8.923859599 0.001673105458 . 1 . . . . . 54 ASN H . 52153 1
167 . 1 . 1 58 58 ASN CA C 13 53.27482555 0.211546985 . 1 . . . . . 54 ASN CA . 52153 1
168 . 1 . 1 58 58 ASN CB C 13 41.03884534 0 . 1 . . . . . 54 ASN CB . 52153 1
169 . 1 . 1 58 58 ASN N N 15 117.3298162 0.0447171031 . 1 . . . . . 54 ASN N . 52153 1
170 . 1 . 1 59 59 ALA H H 1 9.648407239 0.00240034493 . 1 . . . . . 55 ALA H . 52153 1
171 . 1 . 1 59 59 ALA C C 13 175.4681214 0 . 1 . . . . . 55 ALA C . 52153 1
172 . 1 . 1 59 59 ALA CA C 13 50.24376973 0 . 1 . . . . . 55 ALA CA . 52153 1
173 . 1 . 1 59 59 ALA CB C 13 18.3409082 0 . 1 . . . . . 55 ALA CB . 52153 1
174 . 1 . 1 59 59 ALA N N 15 133.1894127 0.04275590708 . 1 . . . . . 55 ALA N . 52153 1
175 . 1 . 1 60 60 GLY H H 1 8.29288018 0.001121232129 . 1 . . . . . 56 GLY H . 52153 1
176 . 1 . 1 60 60 GLY CA C 13 47.00630184 0.03604538515 . 1 . . . . . 56 GLY CA . 52153 1
177 . 1 . 1 60 60 GLY N N 15 116.8969104 0.05374908051 . 1 . . . . . 56 GLY N . 52153 1
178 . 1 . 1 61 61 VAL H H 1 8.195543519 0.001712637027 . 1 . . . . . 57 VAL H . 52153 1
179 . 1 . 1 61 61 VAL C C 13 175.613213 0 . 1 . . . . . 57 VAL C . 52153 1
180 . 1 . 1 61 61 VAL CA C 13 62.61570381 0.1076776141 . 1 . . . . . 57 VAL CA . 52153 1
181 . 1 . 1 61 61 VAL CB C 13 35.90048243 0 . 1 . . . . . 57 VAL CB . 52153 1
182 . 1 . 1 61 61 VAL N N 15 118.3718753 0.05182162069 . 1 . . . . . 57 VAL N . 52153 1
183 . 1 . 1 62 62 TRP H H 1 9.013774859 0.001375446805 . 1 . . . . . 58 TRP H . 52153 1
184 . 1 . 1 62 62 TRP CA C 13 56.15747033 0.006127467618 . 1 . . . . . 58 TRP CA . 52153 1
185 . 1 . 1 62 62 TRP CB C 13 31.26574521 0 . 1 . . . . . 58 TRP CB . 52153 1
186 . 1 . 1 62 62 TRP N N 15 128.340737 0.05043098977 . 1 . . . . . 58 TRP N . 52153 1
187 . 1 . 1 63 63 ALA H H 1 8.025536607 0.001320038682 . 1 . . . . . 59 ALA H . 52153 1
188 . 1 . 1 63 63 ALA C C 13 174.4478726 0 . 1 . . . . . 59 ALA C . 52153 1
189 . 1 . 1 63 63 ALA CA C 13 49.85135467 0.1133448194 . 1 . . . . . 59 ALA CA . 52153 1
190 . 1 . 1 63 63 ALA CB C 13 18.62512406 0 . 1 . . . . . 59 ALA CB . 52153 1
191 . 1 . 1 63 63 ALA N N 15 128.8694159 0.04633856877 . 1 . . . . . 59 ALA N . 52153 1
192 . 1 . 1 65 65 ASN H H 1 9.208792869 0.001809679392 . 1 . . . . . 61 ASN H . 52153 1
193 . 1 . 1 65 65 ASN C C 13 174.2552964 0 . 1 . . . . . 61 ASN C . 52153 1
194 . 1 . 1 65 65 ASN CA C 13 51.88426049 0.03156328679 . 1 . . . . . 61 ASN CA . 52153 1
195 . 1 . 1 65 65 ASN CB C 13 37.5928441 0 . 1 . . . . . 61 ASN CB . 52153 1
196 . 1 . 1 65 65 ASN N N 15 125.5102353 0.08770878421 . 1 . . . . . 61 ASN N . 52153 1
197 . 1 . 1 66 66 GLY H H 1 8.18232041 0.0009172666439 . 1 . . . . . 62 GLY H . 52153 1
198 . 1 . 1 66 66 GLY CA C 13 44.45691383 0 . 1 . . . . . 62 GLY CA . 52153 1
199 . 1 . 1 66 66 GLY N N 15 110.442766 0.02465237446 . 1 . . . . . 62 GLY N . 52153 1
200 . 1 . 1 67 67 ASN H H 1 8.885122291 0.001961616287 . 1 . . . . . 63 ASN H . 52153 1
201 . 1 . 1 67 67 ASN CA C 13 53.81861988 0 . 1 . . . . . 63 ASN CA . 52153 1
202 . 1 . 1 67 67 ASN N N 15 124.1095254 0.02774773855 . 1 . . . . . 63 ASN N . 52153 1
203 . 1 . 1 68 68 GLY H H 1 8.035993698 0.002569165147 . 1 . . . . . 64 GLY H . 52153 1
204 . 1 . 1 68 68 GLY CA C 13 46.36629417 0.02832353737 . 1 . . . . . 64 GLY CA . 52153 1
205 . 1 . 1 68 68 GLY N N 15 117.9445571 0.04468318253 . 1 . . . . . 64 GLY N . 52153 1
206 . 1 . 1 69 69 TYR H H 1 9.564827973 0.004094548441 . 1 . . . . . 65 TYR H . 52153 1
207 . 1 . 1 69 69 TYR CA C 13 54.09785117 0 . 1 . . . . . 65 TYR CA . 52153 1
208 . 1 . 1 69 69 TYR N N 15 118.4449223 0.01597168822 . 1 . . . . . 65 TYR N . 52153 1
209 . 1 . 1 70 70 LEU H H 1 7.932892391 0.005383725563 . 1 . . . . . 66 LEU H . 52153 1
210 . 1 . 1 70 70 LEU CA C 13 54.09729608 0.01990258259 . 1 . . . . . 66 LEU CA . 52153 1
211 . 1 . 1 70 70 LEU N N 15 127.1005036 0.06231604223 . 1 . . . . . 66 LEU N . 52153 1
212 . 1 . 1 71 71 THR H H 1 8.925191287 0.001204616342 . 1 . . . . . 67 THR H . 52153 1
213 . 1 . 1 71 71 THR C C 13 172.6619855 0 . 1 . . . . . 67 THR C . 52153 1
214 . 1 . 1 71 71 THR CA C 13 57.94687846 0.07001955636 . 1 . . . . . 67 THR CA . 52153 1
215 . 1 . 1 71 71 THR CB C 13 72.34299874 0 . 1 . . . . . 67 THR CB . 52153 1
216 . 1 . 1 71 71 THR N N 15 121.8083633 0.07232051059 . 1 . . . . . 67 THR N . 52153 1
217 . 1 . 1 72 72 LEU H H 1 9.295621076 0.001879652832 . 1 . . . . . 68 LEU H . 52153 1
218 . 1 . 1 72 72 LEU CA C 13 56.13686395 0 . 1 . . . . . 68 LEU CA . 52153 1
219 . 1 . 1 72 72 LEU N N 15 134.1513398 0.04838587598 . 1 . . . . . 68 LEU N . 52153 1
220 . 1 . 1 73 73 TYR H H 1 9.534889954 0.002102960049 . 1 . . . . . 69 TYR H . 52153 1
221 . 1 . 1 73 73 TYR CA C 13 56.61372312 0.06902837681 . 1 . . . . . 69 TYR CA . 52153 1
222 . 1 . 1 73 73 TYR CB C 13 43.41777321 0 . 1 . . . . . 69 TYR CB . 52153 1
223 . 1 . 1 73 73 TYR N N 15 133.6415162 0.07339556281 . 1 . . . . . 69 TYR N . 52153 1
224 . 1 . 1 74 74 GLY H H 1 6.314904224 0.001358055363 . 1 . . . . . 70 GLY H . 52153 1
225 . 1 . 1 74 74 GLY CA C 13 45.45133607 0 . 1 . . . . . 70 GLY CA . 52153 1
226 . 1 . 1 74 74 GLY N N 15 113.3123011 0.01351163227 . 1 . . . . . 70 GLY N . 52153 1
227 . 1 . 1 75 75 TRP H H 1 6.072385838 0.003021469988 . 1 . . . . . 71 TRP H . 52153 1
228 . 1 . 1 75 75 TRP CA C 13 55.21039587 0 . 1 . . . . . 71 TRP CA . 52153 1
229 . 1 . 1 75 75 TRP N N 15 111.1517868 0.0902651033 . 1 . . . . . 71 TRP N . 52153 1
230 . 1 . 1 76 76 THR H H 1 9.104103196 0.0009713333554 . 1 . . . . . 72 THR H . 52153 1
231 . 1 . 1 76 76 THR C C 13 172.2879363 0 . 1 . . . . . 72 THR C . 52153 1
232 . 1 . 1 76 76 THR CA C 13 60.77909553 0.0590585643 . 1 . . . . . 72 THR CA . 52153 1
233 . 1 . 1 76 76 THR CB C 13 72.69507426 0 . 1 . . . . . 72 THR CB . 52153 1
234 . 1 . 1 76 76 THR N N 15 113.0192113 0.07129562524 . 1 . . . . . 72 THR N . 52153 1
235 . 1 . 1 77 77 ARG H H 1 8.850896622 0.001704201648 . 1 . . . . . 73 ARG H . 52153 1
236 . 1 . 1 77 77 ARG CA C 13 55.71751895 0.2088516914 . 1 . . . . . 73 ARG CA . 52153 1
237 . 1 . 1 77 77 ARG CB C 13 33.65970562 0 . 1 . . . . . 73 ARG CB . 52153 1
238 . 1 . 1 77 77 ARG N N 15 117.3522317 0.03888538873 . 1 . . . . . 73 ARG N . 52153 1
239 . 1 . 1 78 78 SER H H 1 8.636698143 0.001297692658 . 1 . . . . . 74 SER H . 52153 1
240 . 1 . 1 78 78 SER CA C 13 57.70341643 0 . 1 . . . . . 74 SER CA . 52153 1
241 . 1 . 1 78 78 SER N N 15 111.1629304 0.03339891456 . 1 . . . . . 74 SER N . 52153 1
242 . 1 . 1 80 80 LEU H H 1 7.784871618 0.002219516187 . 1 . . . . . 76 LEU H . 52153 1
243 . 1 . 1 80 80 LEU C C 13 175.5208016 0 . 1 . . . . . 76 LEU C . 52153 1
244 . 1 . 1 80 80 LEU CA C 13 54.93058167 0 . 1 . . . . . 76 LEU CA . 52153 1
245 . 1 . 1 80 80 LEU CB C 13 42.49400716 0 . 1 . . . . . 76 LEU CB . 52153 1
246 . 1 . 1 80 80 LEU N N 15 120.05047 0.06383563855 . 1 . . . . . 76 LEU N . 52153 1
247 . 1 . 1 81 81 ILE H H 1 8.149055787 0.001635139942 . 1 . . . . . 77 ILE H . 52153 1
248 . 1 . 1 81 81 ILE CA C 13 59.15823501 0.1237607825 . 1 . . . . . 77 ILE CA . 52153 1
249 . 1 . 1 81 81 ILE CB C 13 41.7869155 0.052 . 1 . . . . . 77 ILE CB . 52153 1
250 . 1 . 1 81 81 ILE N N 15 131.0889428 0.04851593819 . 1 . . . . . 77 ILE N . 52153 1
251 . 1 . 1 82 82 GLU H H 1 7.530985583 0.002256123619 . 1 . . . . . 78 GLU H . 52153 1
252 . 1 . 1 82 82 GLU CA C 13 53.03430074 0 . 1 . . . . . 78 GLU CA . 52153 1
253 . 1 . 1 82 82 GLU N N 15 129.6465393 0.009789093882 . 1 . . . . . 78 GLU N . 52153 1
254 . 1 . 1 83 83 TYR H H 1 7.647482063 0.002367633535 . 1 . . . . . 79 TYR H . 52153 1
255 . 1 . 1 83 83 TYR CA C 13 54.42113277 0 . 1 . . . . . 79 TYR CA . 52153 1
256 . 1 . 1 83 83 TYR CB C 13 42.6159129 0 . 1 . . . . . 79 TYR CB . 52153 1
257 . 1 . 1 83 83 TYR N N 15 123.2797206 0.02877466096 . 1 . . . . . 79 TYR N . 52153 1
258 . 1 . 1 84 84 TYR H H 1 8.091972392 0.001250704661 . 1 . . . . . 80 TYR H . 52153 1
259 . 1 . 1 84 84 TYR CA C 13 56.76167456 0 . 1 . . . . . 80 TYR CA . 52153 1
260 . 1 . 1 84 84 TYR N N 15 115.1589609 0.04897568328 . 1 . . . . . 80 TYR N . 52153 1
261 . 1 . 1 85 85 VAL H H 1 7.912488833 0.004823550484 . 1 . . . . . 81 VAL H . 52153 1
262 . 1 . 1 85 85 VAL CA C 13 62.7346361 0 . 1 . . . . . 81 VAL CA . 52153 1
263 . 1 . 1 85 85 VAL N N 15 119.578979 0.04427077176 . 1 . . . . . 81 VAL N . 52153 1
264 . 1 . 1 86 86 VAL H H 1 9.609257127 0.00128504896 . 1 . . . . . 82 VAL H . 52153 1
265 . 1 . 1 86 86 VAL C C 13 175.9482814 0 . 1 . . . . . 82 VAL C . 52153 1
266 . 1 . 1 86 86 VAL CA C 13 62.98933464 0 . 1 . . . . . 82 VAL CA . 52153 1
267 . 1 . 1 86 86 VAL N N 15 127.1544288 0.03127741888 . 1 . . . . . 82 VAL N . 52153 1
268 . 1 . 1 87 87 ASP H H 1 8.399680505 0.002969789733 . 1 . . . . . 83 ASP H . 52153 1
269 . 1 . 1 87 87 ASP CA C 13 54.81109911 0.052 . 1 . . . . . 83 ASP CA . 52153 1
270 . 1 . 1 87 87 ASP N N 15 129.0949263 0.01261250447 . 1 . . . . . 83 ASP N . 52153 1
271 . 1 . 1 88 88 SER H H 1 8.213305716 0.001034794726 . 1 . . . . . 84 SER H . 52153 1
272 . 1 . 1 88 88 SER CA C 13 57.66425401 0.0608649783 . 1 . . . . . 84 SER CA . 52153 1
273 . 1 . 1 88 88 SER CB C 13 61.89181109 0 . 1 . . . . . 84 SER CB . 52153 1
274 . 1 . 1 88 88 SER N N 15 109.2491594 0.070111783 . 1 . . . . . 84 SER N . 52153 1
275 . 1 . 1 89 89 TRP H H 1 7.704674543 0.0008386261427 . 1 . . . . . 85 TRP H . 52153 1
276 . 1 . 1 89 89 TRP C C 13 175.5008768 0 . 1 . . . . . 85 TRP C . 52153 1
277 . 1 . 1 89 89 TRP CA C 13 57.50578582 0.0917374824 . 1 . . . . . 85 TRP CA . 52153 1
278 . 1 . 1 89 89 TRP CB C 13 29.71052529 0 . 1 . . . . . 85 TRP CB . 52153 1
279 . 1 . 1 89 89 TRP N N 15 120.096605 0.04156365833 . 1 . . . . . 85 TRP N . 52153 1
280 . 1 . 1 90 90 GLY H H 1 9.333942364 0.001833938159 . 1 . . . . . 86 GLY H . 52153 1
281 . 1 . 1 90 90 GLY CA C 13 44.98292405 0 . 1 . . . . . 86 GLY CA . 52153 1
282 . 1 . 1 90 90 GLY N N 15 111.3739855 0.06754730997 . 1 . . . . . 86 GLY N . 52153 1
283 . 1 . 1 91 91 THR H H 1 8.053430215 0.002737441062 . 1 . . . . . 87 THR H . 52153 1
284 . 1 . 1 91 91 THR C C 13 175.6474422 0 . 1 . . . . . 87 THR C . 52153 1
285 . 1 . 1 91 91 THR CA C 13 63.61674408 0.1219587767 . 1 . . . . . 87 THR CA . 52153 1
286 . 1 . 1 91 91 THR CB C 13 68.91282945 0 . 1 . . . . . 87 THR CB . 52153 1
287 . 1 . 1 91 91 THR N N 15 118.4741657 0.07416249741 . 1 . . . . . 87 THR N . 52153 1
288 . 1 . 1 92 92 TYR H H 1 8.175360695 0.003047505052 . 1 . . . . . 88 TYR H . 52153 1
289 . 1 . 1 92 92 TYR CA C 13 56.77430869 0.06428590462 . 1 . . . . . 88 TYR CA . 52153 1
290 . 1 . 1 92 92 TYR CB C 13 41.01352315 0 . 1 . . . . . 88 TYR CB . 52153 1
291 . 1 . 1 92 92 TYR N N 15 122.7260734 0.05698538655 . 1 . . . . . 88 TYR N . 52153 1
292 . 1 . 1 93 93 ARG H H 1 8.066552183 0.00329542206 . 1 . . . . . 89 ARG H . 52153 1
293 . 1 . 1 93 93 ARG CA C 13 51.98497202 0.1648981943 . 1 . . . . . 89 ARG CA . 52153 1
294 . 1 . 1 93 93 ARG CB C 13 30.71719162 0 . 1 . . . . . 89 ARG CB . 52153 1
295 . 1 . 1 93 93 ARG N N 15 133.0378766 0.1348236107 . 1 . . . . . 89 ARG N . 52153 1
296 . 1 . 1 95 95 THR H H 1 6.001506621 0.001331452568 . 1 . . . . . 91 THR H . 52153 1
297 . 1 . 1 95 95 THR CA C 13 58.70305896 0.00000095 . 1 . . . . . 91 THR CA . 52153 1
298 . 1 . 1 95 95 THR N N 15 106.112431 0.05178718388 . 1 . . . . . 91 THR N . 52153 1
299 . 1 . 1 96 96 GLY H H 1 5.202404392 0 . 1 . . . . . 92 GLY H . 52153 1
300 . 1 . 1 96 96 GLY N N 15 107.5675149 0 . 1 . . . . . 92 GLY N . 52153 1
301 . 1 . 1 97 97 THR H H 1 8.950139134 0.002060737019 . 1 . . . . . 93 THR H . 52153 1
302 . 1 . 1 97 97 THR C C 13 174.6916812 0 . 1 . . . . . 93 THR C . 52153 1
303 . 1 . 1 97 97 THR CA C 13 64.173262 0 . 1 . . . . . 93 THR CA . 52153 1
304 . 1 . 1 97 97 THR CB C 13 68.50676116 0 . 1 . . . . . 93 THR CB . 52153 1
305 . 1 . 1 97 97 THR N N 15 124.9705135 0.02724376798 . 1 . . . . . 93 THR N . 52153 1
306 . 1 . 1 98 98 TYR H H 1 9.088886585 0.002018405008 . 1 . . . . . 94 TYR H . 52153 1
307 . 1 . 1 98 98 TYR C C 13 176.3993961 0 . 1 . . . . . 94 TYR C . 52153 1
308 . 1 . 1 98 98 TYR CA C 13 59.826588 0.03736469722 . 1 . . . . . 94 TYR CA . 52153 1
309 . 1 . 1 98 98 TYR N N 15 131.130327 0.03326440202 . 1 . . . . . 94 TYR N . 52153 1
310 . 1 . 1 99 99 LYS H H 1 8.448853612 0.001846856808 . 1 . . . . . 95 LYS H . 52153 1
311 . 1 . 1 99 99 LYS CA C 13 53.6804314 0 . 1 . . . . . 95 LYS CA . 52153 1
312 . 1 . 1 99 99 LYS N N 15 124.9837392 0.03220931047 . 1 . . . . . 95 LYS N . 52153 1
313 . 1 . 1 100 100 GLY H H 1 5.589999438 0.001988373529 . 1 . . . . . 96 GLY H . 52153 1
314 . 1 . 1 100 100 GLY C C 13 177.9169475 0 . 1 . . . . . 96 GLY C . 52153 1
315 . 1 . 1 100 100 GLY CA C 13 44.6585582 0.0299780703 . 1 . . . . . 96 GLY CA . 52153 1
316 . 1 . 1 100 100 GLY N N 15 103.5895846 0.04288705217 . 1 . . . . . 96 GLY N . 52153 1
317 . 1 . 1 101 101 THR H H 1 8.133876073 0.001450018633 . 1 . . . . . 97 THR H . 52153 1
318 . 1 . 1 101 101 THR C C 13 174.4111173 0 . 1 . . . . . 97 THR C . 52153 1
319 . 1 . 1 101 101 THR CA C 13 60.00053169 0 . 1 . . . . . 97 THR CA . 52153 1
320 . 1 . 1 101 101 THR CB C 13 74.45308381 0 . 1 . . . . . 97 THR CB . 52153 1
321 . 1 . 1 101 101 THR N N 15 109.861376 0.04858387046 . 1 . . . . . 97 THR N . 52153 1
322 . 1 . 1 102 102 VAL H H 1 9.268706079 0.001280484818 . 1 . . . . . 98 VAL H . 52153 1
323 . 1 . 1 102 102 VAL CA C 13 59.86828033 0.05695259721 . 1 . . . . . 98 VAL CA . 52153 1
324 . 1 . 1 102 102 VAL CB C 13 34.79241124 0 . 1 . . . . . 98 VAL CB . 52153 1
325 . 1 . 1 102 102 VAL N N 15 120.2524739 0.05512773694 . 1 . . . . . 98 VAL N . 52153 1
326 . 1 . 1 103 103 LYS H H 1 8.507371525 0.001897178672 . 1 . . . . . 99 LYS H . 52153 1
327 . 1 . 1 103 103 LYS C C 13 176.5224099 0 . 1 . . . . . 99 LYS C . 52153 1
328 . 1 . 1 103 103 LYS CA C 13 55.11213187 0.1074282219 . 1 . . . . . 99 LYS CA . 52153 1
329 . 1 . 1 103 103 LYS CB C 13 33.26754221 0 . 1 . . . . . 99 LYS CB . 52153 1
330 . 1 . 1 103 103 LYS N N 15 129.4609551 0.07159489672 . 1 . . . . . 99 LYS N . 52153 1
331 . 1 . 1 104 104 SER H H 1 8.760867828 0.0005876157816 . 1 . . . . . 100 SER H . 52153 1
332 . 1 . 1 104 104 SER CA C 13 59.36173455 0.05293700143 . 1 . . . . . 100 SER CA . 52153 1
333 . 1 . 1 104 104 SER CB C 13 64.49350275 0 . 1 . . . . . 100 SER CB . 52153 1
334 . 1 . 1 104 104 SER N N 15 117.3517325 0.02705850853 . 1 . . . . . 100 SER N . 52153 1
335 . 1 . 1 105 105 ASP H H 1 9.65792963 0.002853336121 . 1 . . . . . 101 ASP H . 52153 1
336 . 1 . 1 105 105 ASP CA C 13 55.80613995 0 . 1 . . . . . 101 ASP CA . 52153 1
337 . 1 . 1 105 105 ASP CB C 13 41.67734405 0 . 1 . . . . . 101 ASP CB . 52153 1
338 . 1 . 1 105 105 ASP N N 15 124.9583147 0.0447850669 . 1 . . . . . 101 ASP N . 52153 1
339 . 1 . 1 106 106 GLY H H 1 8.8433004 0.001729200523 . 1 . . . . . 102 GLY H . 52153 1
340 . 1 . 1 106 106 GLY CA C 13 46.17155279 0.08369647223 . 1 . . . . . 102 GLY CA . 52153 1
341 . 1 . 1 106 106 GLY N N 15 106.4349664 0.01893040602 . 1 . . . . . 102 GLY N . 52153 1
342 . 1 . 1 107 107 GLY H H 1 8.198963372 0.001274871763 . 1 . . . . . 103 GLY H . 52153 1
343 . 1 . 1 107 107 GLY C C 13 172.7343052 0 . 1 . . . . . 103 GLY C . 52153 1
344 . 1 . 1 107 107 GLY CA C 13 43.35748735 0.05778490678 . 1 . . . . . 103 GLY CA . 52153 1
345 . 1 . 1 107 107 GLY N N 15 109.6530482 0.03269718884 . 1 . . . . . 103 GLY N . 52153 1
346 . 1 . 1 108 108 THR H H 1 8.231162684 0.0008906364326 . 1 . . . . . 104 THR H . 52153 1
347 . 1 . 1 108 108 THR CA C 13 62.73892338 0.06010082731 . 1 . . . . . 104 THR CA . 52153 1
348 . 1 . 1 108 108 THR CB C 13 69.93388074 0 . 1 . . . . . 104 THR CB . 52153 1
349 . 1 . 1 108 108 THR N N 15 117.3330054 0.05627536466 . 1 . . . . . 104 THR N . 52153 1
350 . 1 . 1 109 109 TYR H H 1 9.781696058 0.001782058637 . 1 . . . . . 105 TYR H . 52153 1
351 . 1 . 1 109 109 TYR C C 13 175.7115387 0.132 . 1 . . . . . 105 TYR C . 52153 1
352 . 1 . 1 109 109 TYR CA C 13 56.13926738 0.1045550536 . 1 . . . . . 105 TYR CA . 52153 1
353 . 1 . 1 109 109 TYR CB C 13 39.54716312 0 . 1 . . . . . 105 TYR CB . 52153 1
354 . 1 . 1 109 109 TYR N N 15 126.5344873 0.03260010463 . 1 . . . . . 105 TYR N . 52153 1
355 . 1 . 1 110 110 ASP H H 1 8.796642961 0.0035719496 . 1 . . . . . 106 ASP H . 52153 1
356 . 1 . 1 110 110 ASP C C 13 175.9109595 0 . 1 . . . . . 106 ASP C . 52153 1
357 . 1 . 1 110 110 ASP CA C 13 54.53149466 0.0419392679 . 1 . . . . . 106 ASP CA . 52153 1
358 . 1 . 1 110 110 ASP CB C 13 45.14324129 0 . 1 . . . . . 106 ASP CB . 52153 1
359 . 1 . 1 110 110 ASP N N 15 122.4344103 0.07815775279 . 1 . . . . . 106 ASP N . 52153 1
360 . 1 . 1 111 111 ILE H H 1 8.421578301 0.003178292752 . 1 . . . . . 107 ILE H . 52153 1
361 . 1 . 1 111 111 ILE C C 13 175.2709337 0 . 1 . . . . . 107 ILE C . 52153 1
362 . 1 . 1 111 111 ILE CA C 13 59.41357563 0 . 1 . . . . . 107 ILE CA . 52153 1
363 . 1 . 1 111 111 ILE CB C 13 39.53437697 0 . 1 . . . . . 107 ILE CB . 52153 1
364 . 1 . 1 111 111 ILE N N 15 122.2265258 0.07813420182 . 1 . . . . . 107 ILE N . 52153 1
365 . 1 . 1 112 112 TYR H H 1 9.160640857 0.004287613089 . 1 . . . . . 108 TYR H . 52153 1
366 . 1 . 1 112 112 TYR C C 13 175.5418514 0 . 1 . . . . . 108 TYR C . 52153 1
367 . 1 . 1 112 112 TYR CA C 13 54.67376632 0.02441542839 . 1 . . . . . 108 TYR CA . 52153 1
368 . 1 . 1 112 112 TYR CB C 13 43.56273045 0 . 1 . . . . . 108 TYR CB . 52153 1
369 . 1 . 1 112 112 TYR N N 15 123.4153789 0.06573250166 . 1 . . . . . 108 TYR N . 52153 1
370 . 1 . 1 113 113 THR H H 1 8.330113109 0.002099387792 . 1 . . . . . 109 THR H . 52153 1
371 . 1 . 1 113 113 THR CA C 13 60.03215696 0.09845586527 . 1 . . . . . 109 THR CA . 52153 1
372 . 1 . 1 113 113 THR CB C 13 72.07165945 0 . 1 . . . . . 109 THR CB . 52153 1
373 . 1 . 1 113 113 THR N N 15 109.6254236 0.06123941338 . 1 . . . . . 109 THR N . 52153 1
374 . 1 . 1 114 114 THR H H 1 8.804299715 0.001210319835 . 1 . . . . . 110 THR H . 52153 1
375 . 1 . 1 114 114 THR CA C 13 61.72158998 0 . 1 . . . . . 110 THR CA . 52153 1
376 . 1 . 1 114 114 THR CB C 13 73.18897748 0 . 1 . . . . . 110 THR CB . 52153 1
377 . 1 . 1 114 114 THR N N 15 115.6998337 0.03133791914 . 1 . . . . . 110 THR N . 52153 1
378 . 1 . 1 115 115 THR H H 1 8.512134093 0.001396709235 . 1 . . . . . 111 THR H . 52153 1
379 . 1 . 1 115 115 THR C C 13 172.9520954 0 . 1 . . . . . 111 THR C . 52153 1
380 . 1 . 1 115 115 THR CA C 13 62.46821992 0.05787341281 . 1 . . . . . 111 THR CA . 52153 1
381 . 1 . 1 115 115 THR CB C 13 71.22218829 0 . 1 . . . . . 111 THR CB . 52153 1
382 . 1 . 1 115 115 THR N N 15 117.9764366 0.07608200859 . 1 . . . . . 111 THR N . 52153 1
383 . 1 . 1 116 116 ARG H H 1 8.290286055 0.002108098435 . 1 . . . . . 112 ARG H . 52153 1
384 . 1 . 1 116 116 ARG C C 13 173.2299771 0 . 1 . . . . . 112 ARG C . 52153 1
385 . 1 . 1 116 116 ARG CA C 13 53.40801472 0.05826084477 . 1 . . . . . 112 ARG CA . 52153 1
386 . 1 . 1 116 116 ARG CB C 13 30.72627546 0 . 1 . . . . . 112 ARG CB . 52153 1
387 . 1 . 1 116 116 ARG N N 15 126.1731312 0.03414357962 . 1 . . . . . 112 ARG N . 52153 1
388 . 1 . 1 117 117 TYR H H 1 8.097093223 0.001851668409 . 1 . . . . . 113 TYR H . 52153 1
389 . 1 . 1 117 117 TYR C C 13 173.3820127 0 . 1 . . . . . 113 TYR C . 52153 1
390 . 1 . 1 117 117 TYR CA C 13 56.54889324 0.05828444069 . 1 . . . . . 113 TYR CA . 52153 1
391 . 1 . 1 117 117 TYR N N 15 119.6874957 0.08013202914 . 1 . . . . . 113 TYR N . 52153 1
392 . 1 . 1 118 118 ASN H H 1 8.213678615 0.00156713865 . 1 . . . . . 114 ASN H . 52153 1
393 . 1 . 1 118 118 ASN C C 13 174.4408201 0 . 1 . . . . . 114 ASN C . 52153 1
394 . 1 . 1 118 118 ASN CA C 13 54.85562455 0.06933147468 . 1 . . . . . 114 ASN CA . 52153 1
395 . 1 . 1 118 118 ASN N N 15 119.5533842 0.04570399982 . 1 . . . . . 114 ASN N . 52153 1
396 . 1 . 1 119 119 ALA H H 1 9.40007039 0.001161254103 . 1 . . . . . 115 ALA H . 52153 1
397 . 1 . 1 119 119 ALA CA C 13 50.07918789 0.007864208783 . 1 . . . . . 115 ALA CA . 52153 1
398 . 1 . 1 119 119 ALA CB C 13 22.24032395 0 . 1 . . . . . 115 ALA CB . 52153 1
399 . 1 . 1 119 119 ALA N N 15 122.778782 0.0483051174 . 1 . . . . . 115 ALA N . 52153 1
400 . 1 . 1 121 121 SER H H 1 8.859424954 0.001700816432 . 1 . . . . . 117 SER H . 52153 1
401 . 1 . 1 121 121 SER CA C 13 56.23935963 0 . 1 . . . . . 117 SER CA . 52153 1
402 . 1 . 1 121 121 SER CB C 13 68.71372426 0 . 1 . . . . . 117 SER CB . 52153 1
403 . 1 . 1 121 121 SER N N 15 115.6216859 0.02354557848 . 1 . . . . . 117 SER N . 52153 1
404 . 1 . 1 123 123 ASP H H 1 7.235713692 0.002327520536 . 1 . . . . . 119 ASP H . 52153 1
405 . 1 . 1 123 123 ASP CA C 13 54.11268355 0 . 1 . . . . . 119 ASP CA . 52153 1
406 . 1 . 1 123 123 ASP CB C 13 42.00729169 0 . 1 . . . . . 119 ASP CB . 52153 1
407 . 1 . 1 123 123 ASP N N 15 120.3326466 0.09019583462 . 1 . . . . . 119 ASP N . 52153 1
408 . 1 . 1 124 124 GLY H H 1 7.094995838 0.00208087175 . 1 . . . . . 120 GLY H . 52153 1
409 . 1 . 1 124 124 GLY C C 13 172.5127364 0 . 1 . . . . . 120 GLY C . 52153 1
410 . 1 . 1 124 124 GLY CA C 13 44.90240607 0.005825684874 . 1 . . . . . 120 GLY CA . 52153 1
411 . 1 . 1 124 124 GLY N N 15 109.1818965 0.02091814633 . 1 . . . . . 120 GLY N . 52153 1
412 . 1 . 1 125 125 ASP H H 1 8.229458754 0.0007969892337 . 1 . . . . . 121 ASP H . 52153 1
413 . 1 . 1 125 125 ASP CA C 13 55.62709665 0.0509222941 . 1 . . . . . 121 ASP CA . 52153 1
414 . 1 . 1 125 125 ASP CB C 13 41.55199699 0 . 1 . . . . . 121 ASP CB . 52153 1
415 . 1 . 1 125 125 ASP N N 15 118.6513355 0.04660504927 . 1 . . . . . 121 ASP N . 52153 1
416 . 1 . 1 126 126 ASP H H 1 8.239468013 0.001112977976 . 1 . . . . . 122 ASP H . 52153 1
417 . 1 . 1 126 126 ASP C C 13 175.5529237 0 . 1 . . . . . 122 ASP C . 52153 1
418 . 1 . 1 126 126 ASP CA C 13 53.50710778 0 . 1 . . . . . 122 ASP CA . 52153 1
419 . 1 . 1 126 126 ASP CB C 13 40.67578681 0 . 1 . . . . . 122 ASP CB . 52153 1
420 . 1 . 1 126 126 ASP N N 15 120.4324805 0.04612078387 . 1 . . . . . 122 ASP N . 52153 1
421 . 1 . 1 127 127 THR H H 1 8.721013598 0.0006598036138 . 1 . . . . . 123 THR H . 52153 1
422 . 1 . 1 127 127 THR CA C 13 60.63891343 0 . 1 . . . . . 123 THR CA . 52153 1
423 . 1 . 1 127 127 THR CB C 13 73.15121304 0 . 1 . . . . . 123 THR CB . 52153 1
424 . 1 . 1 127 127 THR N N 15 114.1981376 0.03553354629 . 1 . . . . . 123 THR N . 52153 1
425 . 1 . 1 128 128 THR H H 1 8.210738155 0.001783671022 . 1 . . . . . 124 THR H . 52153 1
426 . 1 . 1 128 128 THR CA C 13 60.62973819 0.04577950703 . 1 . . . . . 124 THR CA . 52153 1
427 . 1 . 1 128 128 THR CB C 13 71.51305849 0 . 1 . . . . . 124 THR CB . 52153 1
428 . 1 . 1 128 128 THR N N 15 117.8619936 0.04087927328 . 1 . . . . . 124 THR N . 52153 1
429 . 1 . 1 129 129 PHE H H 1 8.088856873 0.00137042122 . 1 . . . . . 125 PHE H . 52153 1
430 . 1 . 1 129 129 PHE C C 13 172.8230681 0 . 1 . . . . . 125 PHE C . 52153 1
431 . 1 . 1 129 129 PHE CA C 13 56.15375307 0.08611472548 . 1 . . . . . 125 PHE CA . 52153 1
432 . 1 . 1 129 129 PHE CB C 13 39.62911857 0 . 1 . . . . . 125 PHE CB . 52153 1
433 . 1 . 1 129 129 PHE N N 15 122.2998664 0.03789137258 . 1 . . . . . 125 PHE N . 52153 1
434 . 1 . 1 130 130 THR H H 1 7.379815545 0.001878517291 . 1 . . . . . 126 THR H . 52153 1
435 . 1 . 1 130 130 THR CA C 13 62.33750178 0.02406065103 . 1 . . . . . 126 THR CA . 52153 1
436 . 1 . 1 130 130 THR CB C 13 70.34722971 0 . 1 . . . . . 126 THR CB . 52153 1
437 . 1 . 1 130 130 THR N N 15 117.3004183 0.05864963059 . 1 . . . . . 126 THR N . 52153 1
438 . 1 . 1 131 131 GLN H H 1 8.989976602 0.00190786376 . 1 . . . . . 127 GLN H . 52153 1
439 . 1 . 1 131 131 GLN C C 13 175.958873 0 . 1 . . . . . 127 GLN C . 52153 1
440 . 1 . 1 131 131 GLN CA C 13 53.36678862 0.2161922989 . 1 . . . . . 127 GLN CA . 52153 1
441 . 1 . 1 131 131 GLN CB C 13 31.73744351 0 . 1 . . . . . 127 GLN CB . 52153 1
442 . 1 . 1 131 131 GLN N N 15 122.3861382 0.06251991598 . 1 . . . . . 127 GLN N . 52153 1
443 . 1 . 1 132 132 TYR H H 1 8.066324719 0.002925036202 . 1 . . . . . 128 TYR H . 52153 1
444 . 1 . 1 132 132 TYR CA C 13 52.00574068 0 . 1 . . . . . 128 TYR CA . 52153 1
445 . 1 . 1 132 132 TYR N N 15 122.7809383 0.03029157897 . 1 . . . . . 128 TYR N . 52153 1
446 . 1 . 1 133 133 TRP H H 1 8.601046548 0.0009204844157 . 1 . . . . . 129 TRP H . 52153 1
447 . 1 . 1 133 133 TRP C C 13 177.5361741 0 . 1 . . . . . 129 TRP C . 52153 1
448 . 1 . 1 133 133 TRP CA C 13 55.97654274 0.04475038295 . 1 . . . . . 129 TRP CA . 52153 1
449 . 1 . 1 133 133 TRP CB C 13 32.61321602 0 . 1 . . . . . 129 TRP CB . 52153 1
450 . 1 . 1 133 133 TRP N N 15 118.4145049 0.0538665532 . 1 . . . . . 129 TRP N . 52153 1
451 . 1 . 1 134 134 SER H H 1 9.040588103 0.001985994124 . 1 . . . . . 130 SER H . 52153 1
452 . 1 . 1 134 134 SER CA C 13 58.4951455 0.1099127702 . 1 . . . . . 130 SER CA . 52153 1
453 . 1 . 1 134 134 SER N N 15 120.6593503 0.02185760605 . 1 . . . . . 130 SER N . 52153 1
454 . 1 . 1 135 135 VAL H H 1 10.26758254 0.002037139234 . 1 . . . . . 131 VAL H . 52153 1
455 . 1 . 1 135 135 VAL C C 13 176.1712347 0 . 1 . . . . . 131 VAL C . 52153 1
456 . 1 . 1 135 135 VAL CA C 13 61.44348112 0 . 1 . . . . . 131 VAL CA . 52153 1
457 . 1 . 1 135 135 VAL CB C 13 35.41030106 0.132 . 1 . . . . . 131 VAL CB . 52153 1
458 . 1 . 1 135 135 VAL N N 15 124.9666371 0.03919478839 . 1 . . . . . 131 VAL N . 52153 1
459 . 1 . 1 136 136 ARG H H 1 9.026127426 0.005704439405 . 1 . . . . . 132 ARG H . 52153 1
460 . 1 . 1 136 136 ARG C C 13 177.9721104 0 . 1 . . . . . 132 ARG C . 52153 1
461 . 1 . 1 136 136 ARG CA C 13 59.12341094 0.1470246281 . 1 . . . . . 132 ARG CA . 52153 1
462 . 1 . 1 136 136 ARG N N 15 137.0002498 0.06693723566 . 1 . . . . . 132 ARG N . 52153 1
463 . 1 . 1 137 137 GLN H H 1 9.00930084 0.002578460004 . 1 . . . . . 133 GLN H . 52153 1
464 . 1 . 1 137 137 GLN C C 13 176.6718339 0 . 1 . . . . . 133 GLN C . 52153 1
465 . 1 . 1 137 137 GLN CA C 13 59.84458979 0.1302232484 . 1 . . . . . 133 GLN CA . 52153 1
466 . 1 . 1 137 137 GLN N N 15 122.723639 0.06421416638 . 1 . . . . . 133 GLN N . 52153 1
467 . 1 . 1 138 138 SER H H 1 7.659775873 0.0006619242142 . 1 . . . . . 134 SER H . 52153 1
468 . 1 . 1 138 138 SER C C 13 174.4341716 0.0000019 . 1 . . . . . 134 SER C . 52153 1
469 . 1 . 1 138 138 SER CA C 13 56.39610967 0.005568160435 . 1 . . . . . 134 SER CA . 52153 1
470 . 1 . 1 138 138 SER CB C 13 65.69258532 0 . 1 . . . . . 134 SER CB . 52153 1
471 . 1 . 1 138 138 SER N N 15 110.5877873 0.03868760654 . 1 . . . . . 134 SER N . 52153 1
472 . 1 . 1 139 139 LYS H H 1 8.699467274 0.001131059599 . 1 . . . . . 135 LYS H . 52153 1
473 . 1 . 1 139 139 LYS C C 13 177.1174618 0 . 1 . . . . . 135 LYS C . 52153 1
474 . 1 . 1 139 139 LYS CA C 13 58.77266046 0.1353663849 . 1 . . . . . 135 LYS CA . 52153 1
475 . 1 . 1 139 139 LYS CB C 13 32.76379148 0 . 1 . . . . . 135 LYS CB . 52153 1
476 . 1 . 1 139 139 LYS N N 15 125.5078494 0.08852677679 . 1 . . . . . 135 LYS N . 52153 1
477 . 1 . 1 140 140 ARG H H 1 9.024480672 0.002512840105 . 1 . . . . . 136 ARG H . 52153 1
478 . 1 . 1 140 140 ARG CA C 13 55.14709411 0 . 1 . . . . . 136 ARG CA . 52153 1
479 . 1 . 1 140 140 ARG N N 15 127.6907064 0.05373886998 . 1 . . . . . 136 ARG N . 52153 1
480 . 1 . 1 142 142 THR H H 1 8.535401794 0.0005791926101 . 1 . . . . . 138 THR H . 52153 1
481 . 1 . 1 142 142 THR CA C 13 60.54889593 0 . 1 . . . . . 138 THR CA . 52153 1
482 . 1 . 1 142 142 THR CB C 13 70.36703081 0 . 1 . . . . . 138 THR CB . 52153 1
483 . 1 . 1 142 142 THR N N 15 114.7877712 0.05359021428 . 1 . . . . . 138 THR N . 52153 1
484 . 1 . 1 143 143 GLY H H 1 9.105663634 0.002590504999 . 1 . . . . . 139 GLY H . 52153 1
485 . 1 . 1 143 143 GLY CA C 13 45.75259961 0.02280805366 . 1 . . . . . 139 GLY CA . 52153 1
486 . 1 . 1 143 143 GLY N N 15 114.1079811 0.0347199819 . 1 . . . . . 139 GLY N . 52153 1
487 . 1 . 1 144 144 SER H H 1 7.494157624 0.001131021896 . 1 . . . . . 140 SER H . 52153 1
488 . 1 . 1 144 144 SER CA C 13 56.37993936 0.07277771947 . 1 . . . . . 140 SER CA . 52153 1
489 . 1 . 1 144 144 SER CB C 13 65.34939489 0 . 1 . . . . . 140 SER CB . 52153 1
490 . 1 . 1 144 144 SER N N 15 113.9504079 0.02634200027 . 1 . . . . . 140 SER N . 52153 1
491 . 1 . 1 145 145 ASN H H 1 8.741873904 0.001954890902 . 1 . . . . . 141 ASN H . 52153 1
492 . 1 . 1 145 145 ASN C C 13 174.7710368 0.0000019 . 1 . . . . . 141 ASN C . 52153 1
493 . 1 . 1 145 145 ASN CA C 13 54.53479003 0.005108389391 . 1 . . . . . 141 ASN CA . 52153 1
494 . 1 . 1 145 145 ASN CB C 13 37.13314018 0 . 1 . . . . . 141 ASN CB . 52153 1
495 . 1 . 1 145 145 ASN N N 15 122.5798286 0.01593931317 . 1 . . . . . 141 ASN N . 52153 1
496 . 1 . 1 146 146 ALA H H 1 9.409248396 0.003263980002 . 1 . . . . . 142 ALA H . 52153 1
497 . 1 . 1 146 146 ALA C C 13 176.2512953 0 . 1 . . . . . 142 ALA C . 52153 1
498 . 1 . 1 146 146 ALA CA C 13 51.39353726 0.1963196181 . 1 . . . . . 142 ALA CA . 52153 1
499 . 1 . 1 146 146 ALA CB C 13 21.26307959 0 . 1 . . . . . 142 ALA CB . 52153 1
500 . 1 . 1 146 146 ALA N N 15 130.5426903 0.06246799217 . 1 . . . . . 142 ALA N . 52153 1
501 . 1 . 1 147 147 THR H H 1 7.299265207 0.001899703204 . 1 . . . . . 143 THR H . 52153 1
502 . 1 . 1 147 147 THR C C 13 176.1123014 0 . 1 . . . . . 143 THR C . 52153 1
503 . 1 . 1 147 147 THR CA C 13 60.71957382 0.0390470992 . 1 . . . . . 143 THR CA . 52153 1
504 . 1 . 1 147 147 THR CB C 13 72.43563908 0 . 1 . . . . . 143 THR CB . 52153 1
505 . 1 . 1 147 147 THR N N 15 111.8586121 0.03148268004 . 1 . . . . . 143 THR N . 52153 1
506 . 1 . 1 148 148 ILE H H 1 9.473814357 0.001421007749 . 1 . . . . . 144 ILE H . 52153 1
507 . 1 . 1 148 148 ILE C C 13 175.9536448 0 . 1 . . . . . 144 ILE C . 52153 1
508 . 1 . 1 148 148 ILE CA C 13 61.27825168 0.1179145963 . 1 . . . . . 144 ILE CA . 52153 1
509 . 1 . 1 148 148 ILE CB C 13 41.17951522 0 . 1 . . . . . 144 ILE CB . 52153 1
510 . 1 . 1 148 148 ILE N N 15 125.1381877 0.07583649836 . 1 . . . . . 144 ILE N . 52153 1
511 . 1 . 1 149 149 THR H H 1 10.59340185 0.001334550898 . 1 . . . . . 145 THR H . 52153 1
512 . 1 . 1 149 149 THR CA C 13 61.57426473 0 . 1 . . . . . 145 THR CA . 52153 1
513 . 1 . 1 149 149 THR N N 15 131.9384148 0.04128284869 . 1 . . . . . 145 THR N . 52153 1
514 . 1 . 1 150 150 PHE H H 1 7.568321635 0.003087106423 . 1 . . . . . 146 PHE H . 52153 1
515 . 1 . 1 150 150 PHE CA C 13 59.93132672 0.01042804329 . 1 . . . . . 146 PHE CA . 52153 1
516 . 1 . 1 150 150 PHE CB C 13 39.52179075 0.052 . 1 . . . . . 146 PHE CB . 52153 1
517 . 1 . 1 150 150 PHE N N 15 128.6085836 0.01700185408 . 1 . . . . . 146 PHE N . 52153 1
518 . 1 . 1 151 151 SER H H 1 8.964013657 0.003321536035 . 1 . . . . . 147 SER H . 52153 1
519 . 1 . 1 151 151 SER CA C 13 61.10104518 0.1961249927 . 1 . . . . . 147 SER CA . 52153 1
520 . 1 . 1 151 151 SER CB C 13 62.30765097 0 . 1 . . . . . 147 SER CB . 52153 1
521 . 1 . 1 151 151 SER N N 15 115.0948499 0.08068524955 . 1 . . . . . 147 SER N . 52153 1
522 . 1 . 1 152 152 ASN H H 1 7.20791865 0.001382944838 . 1 . . . . . 148 ASN H . 52153 1
523 . 1 . 1 152 152 ASN C C 13 179.2421349 0 . 1 . . . . . 148 ASN C . 52153 1
524 . 1 . 1 152 152 ASN CA C 13 55.22164786 0.08202475638 . 1 . . . . . 148 ASN CA . 52153 1
525 . 1 . 1 152 152 ASN CB C 13 36.27651467 0 . 1 . . . . . 148 ASN CB . 52153 1
526 . 1 . 1 152 152 ASN N N 15 118.6919401 0.09074792169 . 1 . . . . . 148 ASN N . 52153 1
527 . 1 . 1 153 153 HIS H H 1 6.685294072 0.0009305811735 . 1 . . . . . 149 HIS H . 52153 1
528 . 1 . 1 153 153 HIS C C 13 174.8152432 0 . 1 . . . . . 149 HIS C . 52153 1
529 . 1 . 1 153 153 HIS CA C 13 59.60343447 0.02351917243 . 1 . . . . . 149 HIS CA . 52153 1
530 . 1 . 1 153 153 HIS N N 15 122.6897793 0.05143365062 . 1 . . . . . 149 HIS N . 52153 1
531 . 1 . 1 154 154 VAL H H 1 7.179803137 0.001602654096 . 1 . . . . . 150 VAL H . 52153 1
532 . 1 . 1 154 154 VAL C C 13 180.0330385 0 . 1 . . . . . 150 VAL C . 52153 1
533 . 1 . 1 154 154 VAL CA C 13 66.72780343 0.1596775986 . 1 . . . . . 150 VAL CA . 52153 1
534 . 1 . 1 154 154 VAL CB C 13 31.65472437 0 . 1 . . . . . 150 VAL CB . 52153 1
535 . 1 . 1 154 154 VAL N N 15 117.9718722 0.05907095449 . 1 . . . . . 150 VAL N . 52153 1
536 . 1 . 1 155 155 ASN H H 1 7.97289743 0.001127209407 . 1 . . . . . 151 ASN H . 52153 1
537 . 1 . 1 155 155 ASN CA C 13 56.1200281 0.07320131734 . 1 . . . . . 151 ASN CA . 52153 1
538 . 1 . 1 155 155 ASN CB C 13 37.79262588 0 . 1 . . . . . 151 ASN CB . 52153 1
539 . 1 . 1 155 155 ASN N N 15 117.0171645 0.05809765566 . 1 . . . . . 151 ASN N . 52153 1
540 . 1 . 1 156 156 ALA H H 1 7.325855113 0.001896107244 . 1 . . . . . 152 ALA H . 52153 1
541 . 1 . 1 156 156 ALA C C 13 181.4673067 0 . 1 . . . . . 152 ALA C . 52153 1
542 . 1 . 1 156 156 ALA CA C 13 55.10558371 0.1333431648 . 1 . . . . . 152 ALA CA . 52153 1
543 . 1 . 1 156 156 ALA CB C 13 18.45270096 0 . 1 . . . . . 152 ALA CB . 52153 1
544 . 1 . 1 156 156 ALA N N 15 125.5826983 0.03685296098 . 1 . . . . . 152 ALA N . 52153 1
545 . 1 . 1 157 157 TRP H H 1 9.248695566 0.0007957917622 . 1 . . . . . 153 TRP H . 52153 1
546 . 1 . 1 157 157 TRP CA C 13 58.6797948 0.07020061449 . 1 . . . . . 153 TRP CA . 52153 1
547 . 1 . 1 157 157 TRP CB C 13 27.61820358 0.000000337 . 1 . . . . . 153 TRP CB . 52153 1
548 . 1 . 1 157 157 TRP N N 15 122.876856 0.05411245152 . 1 . . . . . 153 TRP N . 52153 1
549 . 1 . 1 158 158 LYS H H 1 8.310882303 0.001986606776 . 1 . . . . . 154 LYS H . 52153 1
550 . 1 . 1 158 158 LYS C C 13 180.5844637 0.0000019 . 1 . . . . . 154 LYS C . 52153 1
551 . 1 . 1 158 158 LYS CA C 13 60.63175074 0 . 1 . . . . . 154 LYS CA . 52153 1
552 . 1 . 1 158 158 LYS CB C 13 32.40220316 0 . 1 . . . . . 154 LYS CB . 52153 1
553 . 1 . 1 158 158 LYS N N 15 122.5771677 0.00393190703 . 1 . . . . . 154 LYS N . 52153 1
554 . 1 . 1 159 159 SER H H 1 7.743638026 0.0007660611927 . 1 . . . . . 155 SER H . 52153 1
555 . 1 . 1 159 159 SER CA C 13 61.06680621 0.01509550033 . 1 . . . . . 155 SER CA . 52153 1
556 . 1 . 1 159 159 SER CB C 13 62.81682119 0 . 1 . . . . . 155 SER CB . 52153 1
557 . 1 . 1 159 159 SER N N 15 116.9340496 0.03959653573 . 1 . . . . . 155 SER N . 52153 1
558 . 1 . 1 160 160 HIS H H 1 7.497710092 0.001531634449 . 1 . . . . . 156 HIS H . 52153 1
559 . 1 . 1 160 160 HIS C C 13 174.7594861 0 . 1 . . . . . 156 HIS C . 52153 1
560 . 1 . 1 160 160 HIS CA C 13 55.44231206 0.02814758021 . 1 . . . . . 156 HIS CA . 52153 1
561 . 1 . 1 160 160 HIS CB C 13 28.97469917 0 . 1 . . . . . 156 HIS CB . 52153 1
562 . 1 . 1 160 160 HIS N N 15 118.9423027 0.01801298787 . 1 . . . . . 156 HIS N . 52153 1
563 . 1 . 1 161 161 GLY H H 1 7.817200706 0.001431854105 . 1 . . . . . 157 GLY H . 52153 1
564 . 1 . 1 161 161 GLY CA C 13 46.17922626 0.02019460602 . 1 . . . . . 157 GLY CA . 52153 1
565 . 1 . 1 161 161 GLY N N 15 108.2294794 0.04019545389 . 1 . . . . . 157 GLY N . 52153 1
566 . 1 . 1 162 162 MET H H 1 7.781472461 0.002586248397 . 1 . . . . . 158 MET H . 52153 1
567 . 1 . 1 162 162 MET C C 13 173.7831911 0 . 1 . . . . . 158 MET C . 52153 1
568 . 1 . 1 162 162 MET CA C 13 54.03831724 0.009549724518 . 1 . . . . . 158 MET CA . 52153 1
569 . 1 . 1 162 162 MET CB C 13 33.17327848 0 . 1 . . . . . 158 MET CB . 52153 1
570 . 1 . 1 162 162 MET N N 15 122.3407334 0.04073288682 . 1 . . . . . 158 MET N . 52153 1
571 . 1 . 1 163 163 ASN H H 1 8.083821155 0.002529871412 . 1 . . . . . 159 ASN H . 52153 1
572 . 1 . 1 163 163 ASN C C 13 177.0423273 0 . 1 . . . . . 159 ASN C . 52153 1
573 . 1 . 1 163 163 ASN CA C 13 52.94325821 0 . 1 . . . . . 159 ASN CA . 52153 1
574 . 1 . 1 163 163 ASN CB C 13 39.99877337 0 . 1 . . . . . 159 ASN CB . 52153 1
575 . 1 . 1 163 163 ASN N N 15 120.4797027 0.0603084078 . 1 . . . . . 159 ASN N . 52153 1
576 . 1 . 1 164 164 LEU H H 1 9.214938157 0.002497443609 . 1 . . . . . 160 LEU H . 52153 1
577 . 1 . 1 164 164 LEU CA C 13 54.59034913 0 . 1 . . . . . 160 LEU CA . 52153 1
578 . 1 . 1 164 164 LEU N N 15 129.5633979 0.03522080806 . 1 . . . . . 160 LEU N . 52153 1
579 . 1 . 1 165 165 GLY H H 1 7.063206204 0.003268414814 . 1 . . . . . 161 GLY H . 52153 1
580 . 1 . 1 165 165 GLY CA C 13 45.26709453 0.08386919468 . 1 . . . . . 161 GLY CA . 52153 1
581 . 1 . 1 165 165 GLY N N 15 106.3794308 0.03423884601 . 1 . . . . . 161 GLY N . 52153 1
582 . 1 . 1 166 166 SER H H 1 7.452870987 0.001578779441 . 1 . . . . . 162 SER H . 52153 1
583 . 1 . 1 166 166 SER CA C 13 58.78903401 0 . 1 . . . . . 162 SER CA . 52153 1
584 . 1 . 1 166 166 SER CB C 13 64.28763829 0 . 1 . . . . . 162 SER CB . 52153 1
585 . 1 . 1 166 166 SER N N 15 109.8321584 0.02901131678 . 1 . . . . . 162 SER N . 52153 1
586 . 1 . 1 167 167 ASN H H 1 7.716816543 0.002532609625 . 1 . . . . . 163 ASN H . 52153 1
587 . 1 . 1 167 167 ASN C C 13 174.8578935 0 . 1 . . . . . 163 ASN C . 52153 1
588 . 1 . 1 167 167 ASN CA C 13 51.70085929 0.04433602481 . 1 . . . . . 163 ASN CA . 52153 1
589 . 1 . 1 167 167 ASN CB C 13 40.06702269 0 . 1 . . . . . 163 ASN CB . 52153 1
590 . 1 . 1 167 167 ASN N N 15 121.7148317 0.03433294616 . 1 . . . . . 163 ASN N . 52153 1
591 . 1 . 1 168 168 TRP H H 1 9.101196106 0.001256702962 . 1 . . . . . 164 TRP H . 52153 1
592 . 1 . 1 168 168 TRP CA C 13 60.13152173 0 . 1 . . . . . 164 TRP CA . 52153 1
593 . 1 . 1 168 168 TRP N N 15 128.6806881 0.02765809239 . 1 . . . . . 164 TRP N . 52153 1
594 . 1 . 1 169 169 ALA H H 1 7.348533167 0.002310637552 . 1 . . . . . 165 ALA H . 52153 1
595 . 1 . 1 169 169 ALA C C 13 175.5272519 0.05629165123 . 1 . . . . . 165 ALA C . 52153 1
596 . 1 . 1 169 169 ALA CA C 13 49.8939071 0 . 1 . . . . . 165 ALA CA . 52153 1
597 . 1 . 1 169 169 ALA CB C 13 17.97614366 0 . 1 . . . . . 165 ALA CB . 52153 1
598 . 1 . 1 169 169 ALA N N 15 127.461548 0.08144682137 . 1 . . . . . 165 ALA N . 52153 1
599 . 1 . 1 170 170 TYR H H 1 6.102837791 0.002023301968 . 1 . . . . . 166 TYR H . 52153 1
600 . 1 . 1 170 170 TYR CA C 13 57.54304315 0.0984444109 . 1 . . . . . 166 TYR CA . 52153 1
601 . 1 . 1 170 170 TYR CB C 13 38.7606435 0 . 1 . . . . . 166 TYR CB . 52153 1
602 . 1 . 1 170 170 TYR N N 15 116.230197 0.06287131752 . 1 . . . . . 166 TYR N . 52153 1
603 . 1 . 1 171 171 GLN H H 1 8.552513148 0.002575209687 . 1 . . . . . 167 GLN H . 52153 1
604 . 1 . 1 171 171 GLN C C 13 175.9233019 0 . 1 . . . . . 167 GLN C . 52153 1
605 . 1 . 1 171 171 GLN CA C 13 55.15879569 0 . 1 . . . . . 167 GLN CA . 52153 1
606 . 1 . 1 171 171 GLN N N 15 123.5071886 0.09819377543 . 1 . . . . . 167 GLN N . 52153 1
607 . 1 . 1 172 172 VAL H H 1 10.06295566 0.002087675108 . 1 . . . . . 168 VAL H . 52153 1
608 . 1 . 1 172 172 VAL C C 13 173.7166062 0 . 1 . . . . . 168 VAL C . 52153 1
609 . 1 . 1 172 172 VAL CA C 13 59.08582663 0 . 1 . . . . . 168 VAL CA . 52153 1
610 . 1 . 1 172 172 VAL N N 15 120.1292637 0.06086686991 . 1 . . . . . 168 VAL N . 52153 1
611 . 1 . 1 173 173 MET H H 1 8.491738449 0.0005122191379 . 1 . . . . . 169 MET H . 52153 1
612 . 1 . 1 173 173 MET CA C 13 54.82348686 0.0000006743 . 1 . . . . . 169 MET CA . 52153 1
613 . 1 . 1 173 173 MET N N 15 123.0280584 0.03042341523 . 1 . . . . . 169 MET N . 52153 1
614 . 1 . 1 174 174 ALA H H 1 9.701799291 0.002209666513 . 1 . . . . . 170 ALA H . 52153 1
615 . 1 . 1 174 174 ALA C C 13 176.5293439 0 . 1 . . . . . 170 ALA C . 52153 1
616 . 1 . 1 174 174 ALA CA C 13 52.19120052 0.05261187994 . 1 . . . . . 170 ALA CA . 52153 1
617 . 1 . 1 174 174 ALA CB C 13 23.51428003 0 . 1 . . . . . 170 ALA CB . 52153 1
618 . 1 . 1 174 174 ALA N N 15 134.9093268 0.05599454127 . 1 . . . . . 170 ALA N . 52153 1
619 . 1 . 1 175 175 THR H H 1 9.017030902 0.002153232077 . 1 . . . . . 171 THR H . 52153 1
620 . 1 . 1 175 175 THR CA C 13 62.63582557 0.1235071152 . 1 . . . . . 171 THR CA . 52153 1
621 . 1 . 1 175 175 THR N N 15 114.6452651 0.04260067507 . 1 . . . . . 171 THR N . 52153 1
622 . 1 . 1 176 176 GLU H H 1 8.739432812 0.002123279662 . 1 . . . . . 172 GLU H . 52153 1
623 . 1 . 1 176 176 GLU C C 13 174.3664684 0 . 1 . . . . . 172 GLU C . 52153 1
624 . 1 . 1 176 176 GLU CA C 13 52.43465742 0.04896099681 . 1 . . . . . 172 GLU CA . 52153 1
625 . 1 . 1 176 176 GLU CB C 13 32.34813694 0 . 1 . . . . . 172 GLU CB . 52153 1
626 . 1 . 1 176 176 GLU N N 15 126.6177828 0.06933624279 . 1 . . . . . 172 GLU N . 52153 1
627 . 1 . 1 177 177 GLY H H 1 5.91285149 0 . 1 . . . . . 173 GLY H . 52153 1
628 . 1 . 1 177 177 GLY N N 15 107.8822916 0 . 1 . . . . . 173 GLY N . 52153 1
629 . 1 . 1 183 183 SER H H 1 6.351067848 0.00141861872 . 1 . . . . . 179 SER H . 52153 1
630 . 1 . 1 183 183 SER CA C 13 57.71425897 0.1225456041 . 1 . . . . . 179 SER CA . 52153 1
631 . 1 . 1 183 183 SER CB C 13 67.01571423 0 . 1 . . . . . 179 SER CB . 52153 1
632 . 1 . 1 183 183 SER N N 15 112.5037236 0.05514748094 . 1 . . . . . 179 SER N . 52153 1
633 . 1 . 1 184 184 SER H H 1 9.43427305 0.001451025163 . 1 . . . . . 180 SER H . 52153 1
634 . 1 . 1 184 184 SER CA C 13 57.07142826 0.0003113224488 . 1 . . . . . 180 SER CA . 52153 1
635 . 1 . 1 184 184 SER CB C 13 67.13912974 0 . 1 . . . . . 180 SER CB . 52153 1
636 . 1 . 1 184 184 SER N N 15 116.8847736 0.06873896343 . 1 . . . . . 180 SER N . 52153 1
637 . 1 . 1 185 185 ASN H H 1 9.144366683 0.00193303132 . 1 . . . . . 181 ASN H . 52153 1
638 . 1 . 1 185 185 ASN CA C 13 54.92596145 0 . 1 . . . . . 181 ASN CA . 52153 1
639 . 1 . 1 185 185 ASN N N 15 126.1099325 0.01427770723 . 1 . . . . . 181 ASN N . 52153 1
640 . 1 . 1 186 186 VAL H H 1 8.557184505 0.001052407331 . 1 . . . . . 182 VAL H . 52153 1
641 . 1 . 1 186 186 VAL C C 13 173.7854293 0 . 1 . . . . . 182 VAL C . 52153 1
642 . 1 . 1 186 186 VAL CA C 13 61.07061244 0.04881942567 . 1 . . . . . 182 VAL CA . 52153 1
643 . 1 . 1 186 186 VAL CB C 13 36.57581219 0 . 1 . . . . . 182 VAL CB . 52153 1
644 . 1 . 1 186 186 VAL N N 15 126.0995704 0.02656764564 . 1 . . . . . 182 VAL N . 52153 1
645 . 1 . 1 187 187 THR H H 1 8.508881618 0.004015170787 . 1 . . . . . 183 THR H . 52153 1
646 . 1 . 1 187 187 THR CA C 13 62.17900909 0 . 1 . . . . . 183 THR CA . 52153 1
647 . 1 . 1 187 187 THR CB C 13 70.69877714 0 . 1 . . . . . 183 THR CB . 52153 1
648 . 1 . 1 187 187 THR N N 15 123.3640412 0.06184892216 . 1 . . . . . 183 THR N . 52153 1
649 . 1 . 1 188 188 VAL H H 1 8.516686039 0.003409354357 . 1 . . . . . 184 VAL H . 52153 1
650 . 1 . 1 188 188 VAL C C 13 174.56049 0 . 1 . . . . . 184 VAL C . 52153 1
651 . 1 . 1 188 188 VAL CA C 13 61.48963422 0.1812307445 . 1 . . . . . 184 VAL CA . 52153 1
652 . 1 . 1 188 188 VAL CB C 13 35.89837448 0 . 1 . . . . . 184 VAL CB . 52153 1
653 . 1 . 1 188 188 VAL N N 15 128.9081444 0.09641773129 . 1 . . . . . 184 VAL N . 52153 1
654 . 1 . 1 189 189 TRP H H 1 9.36290629 0.001937818596 . 1 . . . . . 185 TRP H . 52153 1
655 . 1 . 1 189 189 TRP C C 13 178.5975347 0 . 1 . . . . . 185 TRP C . 52153 1
656 . 1 . 1 189 189 TRP CA C 13 60.5776535 0.1028259216 . 1 . . . . . 185 TRP CA . 52153 1
657 . 1 . 1 189 189 TRP CB C 13 30.64251574 0 . 1 . . . . . 185 TRP CB . 52153 1
658 . 1 . 1 189 189 TRP N N 15 132.2036181 0.04950478255 . 1 . . . . . 185 TRP N . 52153 1
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