data_25974
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25974
_Entry.PDB_ID 2NBF
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 25974
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 LYS N N 2 119.918 119.918 122.176 -2.258 25974
2 1 1 . 1 1 2 2 LYS HA H 2 5.230 5.230 3.955 1.275 25974
3 1 1 . 1 1 2 2 LYS H H 2 8.167 8.167 8.187 -0.020 25974
4 1 1 . 1 1 3 3 TYR N N 3 122.493 122.493 123.107 -0.614 25974
5 1 1 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.603 0.206 25974
6 1 1 . 1 1 3 3 TYR H H 3 8.939 8.939 8.145 0.794 25974
7 1 1 . 1 1 4 4 THR N N 4 117.297 117.297 117.673 -0.376 25974
8 1 1 . 1 1 4 4 THR HA H 4 5.042 5.042 4.660 0.382 25974
9 1 1 . 1 1 4 4 THR H H 4 8.885 8.885 8.538 0.347 25974
10 1 1 . 1 1 5 5 GLY N N 5 115.452 115.452 112.902 2.550 25974
11 1 1 . 1 1 5 5 GLY H H 5 9.135 9.135 9.073 0.062 25974
12 1 1 . 1 1 6 6 LYS N N 6 121.001 121.001 117.005 3.996 25974
13 1 1 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.174 0.204 25974
14 1 1 . 1 1 6 6 LYS H H 6 8.422 8.422 8.133 0.289 25974
15 1 1 . 1 1 7 7 CYS N N 7 122.647 122.647 117.505 5.142 25974
16 1 1 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.250 1.047 25974
17 1 1 . 1 1 7 7 CYS H H 7 9.767 9.767 8.880 0.887 25974
18 1 1 . 1 1 8 8 THR N N 8 113.493 113.493 113.459 0.034 25974
19 1 1 . 1 1 8 8 THR HA H 8 4.704 4.704 4.988 -0.284 25974
20 1 1 . 1 1 8 8 THR H H 8 8.716 8.716 8.016 0.700 25974
21 1 1 . 1 1 9 9 LYS N N 9 127.640 127.640 125.870 1.770 25974
22 1 1 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.095 -0.602 25974
23 1 1 . 1 1 9 9 LYS H H 9 8.947 8.947 8.561 0.386 25974
24 1 1 . 1 1 10 10 SER N N 10 116.726 116.726 115.285 1.441 25974
25 1 1 . 1 1 10 10 SER HA H 10 4.006 4.006 4.193 -0.187 25974
26 1 1 . 1 1 10 10 SER H H 10 9.484 9.484 7.772 1.712 25974
27 1 1 . 1 1 11 11 LYS N N 11 116.973 116.973 117.100 -0.127 25974
28 1 1 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.446 -0.293 25974
29 1 1 . 1 1 11 11 LYS H H 11 7.051 7.051 7.754 -0.703 25974
30 1 1 . 1 1 12 12 ASN N N 12 120.652 120.652 118.772 1.880 25974
31 1 1 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.397 0.169 25974
32 1 1 . 1 1 12 12 ASN H H 12 7.590 7.590 8.306 -0.716 25974
33 1 1 . 1 1 13 13 GLU N N 13 115.322 115.322 123.015 -7.693 25974
34 1 1 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.425 0.471 25974
35 1 1 . 1 1 13 13 GLU H H 13 7.290 7.290 8.337 -1.047 25974
36 1 1 . 1 1 14 14 CYS N N 14 123.345 123.345 126.115 -2.770 25974
37 1 1 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.474 0.165 25974
38 1 1 . 1 1 14 14 CYS H H 14 9.588 9.588 8.944 0.644 25974
39 1 1 . 1 1 15 15 LYS N N 15 110.722 110.722 130.634 -19.912 25974
40 1 1 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.544 -0.598 25974
41 1 1 . 1 1 15 15 LYS H H 15 8.636 8.636 8.659 -0.023 25974
42 1 1 . 1 1 16 16 TYR N N 16 126.630 126.630 119.993 6.637 25974
43 1 1 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.864 0.035 25974
44 1 1 . 1 1 16 16 TYR H H 16 8.998 8.998 9.168 -0.170 25974
45 1 1 . 1 1 17 17 LYS N N 17 120.977 120.977 117.920 3.057 25974
46 1 1 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.723 -0.317 25974
47 1 1 . 1 1 17 17 LYS H H 17 8.421 8.421 8.147 0.274 25974
48 1 1 . 1 1 18 18 ASN N N 18 122.224 122.224 120.170 2.054 25974
49 1 1 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.318 -0.216 25974
50 1 1 . 1 1 18 18 ASN H H 18 7.735 7.735 8.134 -0.399 25974
51 1 1 . 1 1 19 19 ASP N N 19 117.436 117.436 119.184 -1.748 25974
52 1 1 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.571 -0.187 25974
53 1 1 . 1 1 19 19 ASP H H 19 8.238 8.238 8.140 0.098 25974
54 1 1 . 1 1 20 20 ALA N N 20 120.895 120.895 120.222 0.673 25974
55 1 1 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.460 -0.051 25974
56 1 1 . 1 1 20 20 ALA H H 20 7.419 7.419 7.933 -0.514 25974
57 1 1 . 1 1 21 21 GLY N N 21 127.668 127.668 107.324 20.344 25974
58 1 1 . 1 1 21 21 GLY H H 21 8.170 8.170 8.108 0.062 25974
59 1 1 . 1 1 22 22 LYS N N 22 120.354 120.354 122.373 -2.019 25974
60 1 1 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.184 0.125 25974
61 1 1 . 1 1 22 22 LYS H H 22 7.682 7.682 7.855 -0.173 25974
62 1 1 . 1 1 23 23 ASP N N 23 126.398 126.398 127.201 -0.803 25974
63 1 1 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.505 -0.249 25974
64 1 1 . 1 1 23 23 ASP H H 23 8.610 8.610 8.456 0.154 25974
65 1 1 . 1 1 24 24 THR N N 24 122.770 122.770 119.281 3.489 25974
66 1 1 . 1 1 24 24 THR HA H 24 4.012 4.012 4.203 -0.191 25974
67 1 1 . 1 1 24 24 THR H H 24 8.782 8.782 8.635 0.147 25974
68 1 1 . 1 1 25 25 PHE N N 25 122.423 122.423 124.414 -1.991 25974
69 1 1 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.251 0.153 25974
70 1 1 . 1 1 25 25 PHE H H 25 8.328 8.328 8.284 0.044 25974
71 1 1 . 1 1 26 26 ILE N N 26 123.029 123.029 120.874 2.155 25974
72 1 1 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.502 0.112 25974
73 1 1 . 1 1 26 26 ILE H H 26 9.138 9.138 8.888 0.250 25974
74 1 1 . 1 1 27 27 LYS N N 27 127.077 127.077 127.548 -0.471 25974
75 1 1 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.265 -0.102 25974
76 1 1 . 1 1 27 27 LYS H H 27 8.335 8.335 8.289 0.046 25974
77 1 1 . 1 1 28 28 CYS N N 28 120.248 120.248 119.773 0.475 25974
78 1 1 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.892 -0.233 25974
79 1 1 . 1 1 28 28 CYS H H 28 8.618 8.618 8.799 -0.181 25974
80 1 1 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.293 0.133 25974
81 1 1 . 1 1 30 30 LYS N N 30 115.643 115.643 119.521 -3.878 25974
82 1 1 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.867 0.082 25974
83 1 1 . 1 1 30 30 LYS H H 30 8.002 8.002 8.324 -0.322 25974
84 1 1 . 1 1 31 31 PHE N N 31 116.470 116.470 117.535 -1.065 25974
85 1 1 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.664 -0.160 25974
86 1 1 . 1 1 31 31 PHE H H 31 6.308 6.308 7.624 -1.316 25974
87 1 1 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.400 -0.256 25974
88 1 1 . 1 1 33 33 ASN N N 33 113.110 113.110 116.295 -3.185 25974
89 1 1 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.753 -0.080 25974
90 1 1 . 1 1 33 33 ASN H H 33 8.564 8.564 8.126 0.438 25974
91 1 1 . 1 1 34 34 LYS N N 34 120.347 120.347 118.530 1.817 25974
92 1 1 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.493 0.491 25974
93 1 1 . 1 1 34 34 LYS H H 34 7.914 7.914 8.018 -0.104 25974
94 1 1 . 1 1 35 35 LYS N N 35 117.863 117.863 118.243 -0.380 25974
95 1 1 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.298 0.310 25974
96 1 1 . 1 1 35 35 LYS H H 35 7.005 7.005 7.551 -0.546 25974
97 1 1 . 1 1 36 36 CYS N N 36 118.915 118.915 119.683 -0.768 25974
98 1 1 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.349 0.508 25974
99 1 1 . 1 1 36 36 CYS H H 36 8.817 8.817 8.518 0.299 25974
100 1 1 . 1 1 37 37 THR N N 37 121.008 121.008 114.571 6.437 25974
101 1 1 . 1 1 37 37 THR HA H 37 4.300 4.300 4.438 -0.138 25974
102 1 1 . 1 1 37 37 THR H H 37 9.980 9.980 8.718 1.262 25974
103 1 1 . 1 1 38 38 LYS N N 38 122.326 122.326 121.742 0.584 25974
104 1 1 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.540 -0.403 25974
105 1 1 . 1 1 38 38 LYS H H 38 7.287 7.287 7.514 -0.227 25974
106 1 1 . 1 1 39 39 ASP N N 39 125.238 125.238 121.584 3.654 25974
107 1 1 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.581 -0.003 25974
108 1 1 . 1 1 39 39 ASP H H 39 8.817 8.817 8.479 0.338 25974
109 1 1 . 1 1 40 40 ASN N N 40 114.713 114.713 120.838 -6.125 25974
110 1 1 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.257 0.015 25974
111 1 1 . 1 1 40 40 ASN H H 40 9.532 9.532 8.851 0.681 25974
112 1 1 . 1 1 41 41 ASN N N 41 120.080 120.080 117.031 3.049 25974
113 1 1 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.604 0.113 25974
114 1 1 . 1 1 41 41 ASN H H 41 7.742 7.742 7.781 -0.039 25974
115 1 1 . 1 1 42 42 LYS N N 42 118.956 118.956 119.728 -0.772 25974
116 1 1 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.659 -0.313 25974
117 1 1 . 1 1 42 42 LYS H H 42 8.397 8.397 8.323 0.074 25974
118 1 1 . 1 1 43 43 CYS N N 43 112.235 112.235 120.829 -8.594 25974
119 1 1 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.374 -0.039 25974
120 1 1 . 1 1 43 43 CYS H H 43 7.397 7.397 8.850 -1.453 25974
121 1 1 . 1 1 44 44 THR N N 44 112.586 112.586 115.776 -3.190 25974
122 1 1 . 1 1 44 44 THR HA H 44 5.221 5.221 5.076 0.145 25974
123 1 1 . 1 1 44 44 THR H H 44 8.674 8.674 8.357 0.317 25974
124 1 1 . 1 1 45 45 VAL N N 45 121.814 121.814 123.380 -1.566 25974
125 1 1 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.146 0.284 25974
126 1 1 . 1 1 45 45 VAL H H 45 8.555 8.555 8.628 -0.073 25974
127 1 1 . 1 1 46 46 ASP N N 46 126.626 126.626 127.907 -1.281 25974
128 1 1 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.006 0.328 25974
129 1 1 . 1 1 46 46 ASP H H 46 8.519 8.519 8.199 0.320 25974
130 1 1 . 1 1 47 47 THR N N 47 114.334 114.334 113.989 0.345 25974
131 1 1 . 1 1 47 47 THR HA H 47 4.187 4.187 4.126 0.061 25974
132 1 1 . 1 1 47 47 THR H H 47 9.116 9.116 8.545 0.571 25974
133 1 1 . 1 1 48 48 TYR N N 48 124.010 124.010 123.105 0.905 25974
134 1 1 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.252 0.122 25974
135 1 1 . 1 1 48 48 TYR H H 48 8.803 8.803 8.382 0.421 25974
136 1 1 . 1 1 49 49 ASN N N 49 113.668 113.668 113.697 -0.029 25974
137 1 1 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.616 -0.141 25974
138 1 1 . 1 1 49 49 ASN H H 49 7.433 7.433 7.730 -0.297 25974
139 1 1 . 1 1 50 50 ASN N N 50 117.403 117.403 119.249 -1.846 25974
140 1 1 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.319 -0.120 25974
141 1 1 . 1 1 50 50 ASN H H 50 7.863 7.863 8.011 -0.148 25974
142 1 1 . 1 1 51 51 ALA N N 51 121.102 121.102 125.420 -4.318 25974
143 1 1 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.370 0.067 25974
144 1 1 . 1 1 51 51 ALA H H 51 7.853 7.853 7.534 0.319 25974
145 1 1 . 1 1 52 52 VAL N N 52 126.326 126.326 121.748 4.578 25974
146 1 1 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.555 0.320 25974
147 1 1 . 1 1 52 52 VAL H H 52 8.297 8.297 8.277 0.020 25974
148 1 1 . 1 1 53 53 ASP N N 53 125.100 125.100 126.800 -1.700 25974
149 1 1 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.210 -0.415 25974
150 1 1 . 1 1 53 53 ASP H H 53 8.519 8.519 8.466 0.053 25974
151 1 1 . 1 1 54 54 CYS N N 54 126.377 126.377 119.332 7.045 25974
152 1 1 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.316 0.362 25974
153 1 1 . 1 1 54 54 CYS H H 54 8.609 8.609 8.205 0.404 25974
154 1 2 . 1 1 2 2 LYS N N 2 119.918 119.918 120.866 -0.948 25974
155 1 2 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.640 0.590 25974
156 1 2 . 1 1 2 2 LYS H H 2 8.167 8.167 7.844 0.323 25974
157 1 2 . 1 1 3 3 TYR N N 3 122.493 122.493 126.017 -3.524 25974
158 1 2 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.723 0.086 25974
159 1 2 . 1 1 3 3 TYR H H 3 8.939 8.939 9.197 -0.258 25974
160 1 2 . 1 1 4 4 THR N N 4 117.297 117.297 115.440 1.857 25974
161 1 2 . 1 1 4 4 THR HA H 4 5.042 5.042 4.672 0.370 25974
162 1 2 . 1 1 4 4 THR H H 4 8.885 8.885 8.469 0.416 25974
163 1 2 . 1 1 5 5 GLY N N 5 115.452 115.452 112.038 3.414 25974
164 1 2 . 1 1 5 5 GLY H H 5 9.135 9.135 9.149 -0.014 25974
165 1 2 . 1 1 6 6 LYS N N 6 121.001 121.001 117.310 3.691 25974
166 1 2 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.243 0.135 25974
167 1 2 . 1 1 6 6 LYS H H 6 8.422 8.422 8.012 0.410 25974
168 1 2 . 1 1 7 7 CYS N N 7 122.647 122.647 116.998 5.649 25974
169 1 2 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.176 1.121 25974
170 1 2 . 1 1 7 7 CYS H H 7 9.767 9.767 8.923 0.844 25974
171 1 2 . 1 1 8 8 THR N N 8 113.493 113.493 113.249 0.244 25974
172 1 2 . 1 1 8 8 THR HA H 8 4.704 4.704 4.898 -0.194 25974
173 1 2 . 1 1 8 8 THR H H 8 8.716 8.716 8.088 0.628 25974
174 1 2 . 1 1 9 9 LYS N N 9 127.640 127.640 125.546 2.094 25974
175 1 2 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.093 -0.600 25974
176 1 2 . 1 1 9 9 LYS H H 9 8.947 8.947 8.392 0.555 25974
177 1 2 . 1 1 10 10 SER N N 10 116.726 116.726 117.071 -0.345 25974
178 1 2 . 1 1 10 10 SER HA H 10 4.006 4.006 4.213 -0.207 25974
179 1 2 . 1 1 10 10 SER H H 10 9.484 9.484 7.860 1.624 25974
180 1 2 . 1 1 11 11 LYS N N 11 116.973 116.973 117.114 -0.141 25974
181 1 2 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.471 -0.318 25974
182 1 2 . 1 1 11 11 LYS H H 11 7.051 7.051 8.302 -1.251 25974
183 1 2 . 1 1 12 12 ASN N N 12 120.652 120.652 118.676 1.976 25974
184 1 2 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.500 0.066 25974
185 1 2 . 1 1 12 12 ASN H H 12 7.590 7.590 8.156 -0.566 25974
186 1 2 . 1 1 13 13 GLU N N 13 115.322 115.322 123.840 -8.518 25974
187 1 2 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.438 0.458 25974
188 1 2 . 1 1 13 13 GLU H H 13 7.290 7.290 8.388 -1.098 25974
189 1 2 . 1 1 14 14 CYS N N 14 123.345 123.345 125.487 -2.142 25974
190 1 2 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.714 -0.075 25974
191 1 2 . 1 1 14 14 CYS H H 14 9.588 9.588 8.731 0.857 25974
192 1 2 . 1 1 15 15 LYS N N 15 110.722 110.722 129.075 -18.353 25974
193 1 2 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.568 -0.622 25974
194 1 2 . 1 1 15 15 LYS H H 15 8.636 8.636 8.452 0.184 25974
195 1 2 . 1 1 16 16 TYR N N 16 126.630 126.630 120.169 6.461 25974
196 1 2 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.891 0.008 25974
197 1 2 . 1 1 16 16 TYR H H 16 8.998 8.998 9.246 -0.248 25974
198 1 2 . 1 1 17 17 LYS N N 17 120.977 120.977 118.767 2.210 25974
199 1 2 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.667 -0.261 25974
200 1 2 . 1 1 17 17 LYS H H 17 8.421 8.421 8.264 0.157 25974
201 1 2 . 1 1 18 18 ASN N N 18 122.224 122.224 118.749 3.475 25974
202 1 2 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.126 -0.024 25974
203 1 2 . 1 1 18 18 ASN H H 18 7.735 7.735 8.120 -0.385 25974
204 1 2 . 1 1 19 19 ASP N N 19 117.436 117.436 120.024 -2.588 25974
205 1 2 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.491 -0.107 25974
206 1 2 . 1 1 19 19 ASP H H 19 8.238 8.238 8.468 -0.230 25974
207 1 2 . 1 1 20 20 ALA N N 20 120.895 120.895 119.163 1.732 25974
208 1 2 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.370 0.038 25974
209 1 2 . 1 1 20 20 ALA H H 20 7.419 7.419 7.619 -0.200 25974
210 1 2 . 1 1 21 21 GLY N N 21 127.668 127.668 106.546 21.122 25974
211 1 2 . 1 1 21 21 GLY H H 21 8.170 8.170 8.153 0.017 25974
212 1 2 . 1 1 22 22 LYS N N 22 120.354 120.354 123.691 -3.337 25974
213 1 2 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.156 0.153 25974
214 1 2 . 1 1 22 22 LYS H H 22 7.682 7.682 7.842 -0.160 25974
215 1 2 . 1 1 23 23 ASP N N 23 126.398 126.398 125.557 0.841 25974
216 1 2 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.519 -0.263 25974
217 1 2 . 1 1 23 23 ASP H H 23 8.610 8.610 8.350 0.260 25974
218 1 2 . 1 1 24 24 THR N N 24 122.770 122.770 119.268 3.502 25974
219 1 2 . 1 1 24 24 THR HA H 24 4.012 4.012 4.200 -0.188 25974
220 1 2 . 1 1 24 24 THR H H 24 8.782 8.782 8.518 0.264 25974
221 1 2 . 1 1 25 25 PHE N N 25 122.423 122.423 125.995 -3.572 25974
222 1 2 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.754 0.650 25974
223 1 2 . 1 1 25 25 PHE H H 25 8.328 8.328 8.355 -0.027 25974
224 1 2 . 1 1 26 26 ILE N N 26 123.029 123.029 124.984 -1.955 25974
225 1 2 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.599 0.015 25974
226 1 2 . 1 1 26 26 ILE H H 26 9.138 9.138 9.129 0.009 25974
227 1 2 . 1 1 27 27 LYS N N 27 127.077 127.077 126.976 0.101 25974
228 1 2 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.226 -0.063 25974
229 1 2 . 1 1 27 27 LYS H H 27 8.335 8.335 8.358 -0.023 25974
230 1 2 . 1 1 28 28 CYS N N 28 120.248 120.248 121.203 -0.955 25974
231 1 2 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.906 -0.247 25974
232 1 2 . 1 1 28 28 CYS H H 28 8.618 8.618 8.525 0.093 25974
233 1 2 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.297 0.129 25974
234 1 2 . 1 1 30 30 LYS N N 30 115.643 115.643 118.173 -2.530 25974
235 1 2 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.920 0.029 25974
236 1 2 . 1 1 30 30 LYS H H 30 8.002 8.002 8.288 -0.286 25974
237 1 2 . 1 1 31 31 PHE N N 31 116.470 116.470 116.629 -0.159 25974
238 1 2 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.662 -0.158 25974
239 1 2 . 1 1 31 31 PHE H H 31 6.308 6.308 7.435 -1.127 25974
240 1 2 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.734 -0.590 25974
241 1 2 . 1 1 33 33 ASN N N 33 113.110 113.110 117.406 -4.296 25974
242 1 2 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.847 -0.174 25974
243 1 2 . 1 1 33 33 ASN H H 33 8.564 8.564 8.222 0.342 25974
244 1 2 . 1 1 34 34 LYS N N 34 120.347 120.347 117.610 2.737 25974
245 1 2 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.451 0.533 25974
246 1 2 . 1 1 34 34 LYS H H 34 7.914 7.914 8.360 -0.446 25974
247 1 2 . 1 1 35 35 LYS N N 35 117.863 117.863 118.871 -1.008 25974
248 1 2 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.238 0.370 25974
249 1 2 . 1 1 35 35 LYS H H 35 7.005 7.005 7.573 -0.568 25974
250 1 2 . 1 1 36 36 CYS N N 36 118.915 118.915 119.274 -0.359 25974
251 1 2 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.336 0.521 25974
252 1 2 . 1 1 36 36 CYS H H 36 8.817 8.817 8.516 0.301 25974
253 1 2 . 1 1 37 37 THR N N 37 121.008 121.008 114.424 6.584 25974
254 1 2 . 1 1 37 37 THR HA H 37 4.300 4.300 4.447 -0.147 25974
255 1 2 . 1 1 37 37 THR H H 37 9.980 9.980 8.506 1.474 25974
256 1 2 . 1 1 38 38 LYS N N 38 122.326 122.326 120.812 1.514 25974
257 1 2 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.434 -0.297 25974
258 1 2 . 1 1 38 38 LYS H H 38 7.287 7.287 7.457 -0.170 25974
259 1 2 . 1 1 39 39 ASP N N 39 125.238 125.238 120.843 4.395 25974
260 1 2 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.627 -0.049 25974
261 1 2 . 1 1 39 39 ASP H H 39 8.817 8.817 8.486 0.331 25974
262 1 2 . 1 1 40 40 ASN N N 40 114.713 114.713 121.325 -6.612 25974
263 1 2 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.306 -0.034 25974
264 1 2 . 1 1 40 40 ASN H H 40 9.532 9.532 8.975 0.557 25974
265 1 2 . 1 1 41 41 ASN N N 41 120.080 120.080 115.935 4.145 25974
266 1 2 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.631 0.086 25974
267 1 2 . 1 1 41 41 ASN H H 41 7.742 7.742 7.811 -0.069 25974
268 1 2 . 1 1 42 42 LYS N N 42 118.956 118.956 119.770 -0.814 25974
269 1 2 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.643 -0.297 25974
270 1 2 . 1 1 42 42 LYS H H 42 8.397 8.397 8.452 -0.055 25974
271 1 2 . 1 1 43 43 CYS N N 43 112.235 112.235 120.203 -7.968 25974
272 1 2 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.448 -0.113 25974
273 1 2 . 1 1 43 43 CYS H H 43 7.397 7.397 8.824 -1.427 25974
274 1 2 . 1 1 44 44 THR N N 44 112.586 112.586 116.771 -4.185 25974
275 1 2 . 1 1 44 44 THR HA H 44 5.221 5.221 5.053 0.168 25974
276 1 2 . 1 1 44 44 THR H H 44 8.674 8.674 8.140 0.534 25974
277 1 2 . 1 1 45 45 VAL N N 45 121.814 121.814 124.956 -3.142 25974
278 1 2 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.044 0.386 25974
279 1 2 . 1 1 45 45 VAL H H 45 8.555 8.555 8.384 0.171 25974
280 1 2 . 1 1 46 46 ASP N N 46 126.626 126.626 125.780 0.846 25974
281 1 2 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.302 0.032 25974
282 1 2 . 1 1 46 46 ASP H H 46 8.519 8.519 8.195 0.324 25974
283 1 2 . 1 1 47 47 THR N N 47 114.334 114.334 120.222 -5.888 25974
284 1 2 . 1 1 47 47 THR HA H 47 4.187 4.187 4.198 -0.011 25974
285 1 2 . 1 1 47 47 THR H H 47 9.116 9.116 8.447 0.669 25974
286 1 2 . 1 1 48 48 TYR N N 48 124.010 124.010 121.759 2.251 25974
287 1 2 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.278 0.096 25974
288 1 2 . 1 1 48 48 TYR H H 48 8.803 8.803 8.347 0.456 25974
289 1 2 . 1 1 49 49 ASN N N 49 113.668 113.668 113.002 0.666 25974
290 1 2 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.541 -0.066 25974
291 1 2 . 1 1 49 49 ASN H H 49 7.433 7.433 7.614 -0.181 25974
292 1 2 . 1 1 50 50 ASN N N 50 117.403 117.403 119.112 -1.709 25974
293 1 2 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.318 -0.119 25974
294 1 2 . 1 1 50 50 ASN H H 50 7.863 7.863 8.049 -0.186 25974
295 1 2 . 1 1 51 51 ALA N N 51 121.102 121.102 124.730 -3.628 25974
296 1 2 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.357 0.080 25974
297 1 2 . 1 1 51 51 ALA H H 51 7.853 7.853 7.834 0.019 25974
298 1 2 . 1 1 52 52 VAL N N 52 126.326 126.326 122.446 3.880 25974
299 1 2 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.682 0.193 25974
300 1 2 . 1 1 52 52 VAL H H 52 8.297 8.297 8.302 -0.005 25974
301 1 2 . 1 1 53 53 ASP N N 53 125.100 125.100 130.014 -4.914 25974
302 1 2 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.939 -0.144 25974
303 1 2 . 1 1 53 53 ASP H H 53 8.519 8.519 8.529 -0.010 25974
304 1 2 . 1 1 54 54 CYS N N 54 126.377 126.377 120.135 6.242 25974
305 1 2 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.250 0.428 25974
306 1 2 . 1 1 54 54 CYS H H 54 8.609 8.609 8.137 0.472 25974
307 1 3 . 1 1 2 2 LYS N N 2 119.918 119.918 119.773 0.145 25974
308 1 3 . 1 1 2 2 LYS HA H 2 5.230 5.230 3.780 1.450 25974
309 1 3 . 1 1 2 2 LYS H H 2 8.167 8.167 7.957 0.210 25974
310 1 3 . 1 1 3 3 TYR N N 3 122.493 122.493 119.526 2.967 25974
311 1 3 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.759 0.050 25974
312 1 3 . 1 1 3 3 TYR H H 3 8.939 8.939 8.640 0.299 25974
313 1 3 . 1 1 4 4 THR N N 4 117.297 117.297 113.184 4.113 25974
314 1 3 . 1 1 4 4 THR HA H 4 5.042 5.042 4.703 0.339 25974
315 1 3 . 1 1 4 4 THR H H 4 8.885 8.885 8.300 0.585 25974
316 1 3 . 1 1 5 5 GLY N N 5 115.452 115.452 109.585 5.867 25974
317 1 3 . 1 1 5 5 GLY H H 5 9.135 9.135 8.821 0.314 25974
318 1 3 . 1 1 6 6 LYS N N 6 121.001 121.001 117.455 3.546 25974
319 1 3 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.331 0.047 25974
320 1 3 . 1 1 6 6 LYS H H 6 8.422 8.422 7.920 0.502 25974
321 1 3 . 1 1 7 7 CYS N N 7 122.647 122.647 118.042 4.605 25974
322 1 3 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.026 1.271 25974
323 1 3 . 1 1 7 7 CYS H H 7 9.767 9.767 9.241 0.526 25974
324 1 3 . 1 1 8 8 THR N N 8 113.493 113.493 113.001 0.492 25974
325 1 3 . 1 1 8 8 THR HA H 8 4.704 4.704 4.830 -0.126 25974
326 1 3 . 1 1 8 8 THR H H 8 8.716 8.716 8.478 0.238 25974
327 1 3 . 1 1 9 9 LYS N N 9 127.640 127.640 124.837 2.803 25974
328 1 3 . 1 1 9 9 LYS HA H 9 3.493 3.493 3.901 -0.408 25974
329 1 3 . 1 1 9 9 LYS H H 9 8.947 8.947 8.237 0.710 25974
330 1 3 . 1 1 10 10 SER N N 10 116.726 116.726 114.865 1.861 25974
331 1 3 . 1 1 10 10 SER HA H 10 4.006 4.006 4.253 -0.247 25974
332 1 3 . 1 1 10 10 SER H H 10 9.484 9.484 8.118 1.366 25974
333 1 3 . 1 1 11 11 LYS N N 11 116.973 116.973 118.178 -1.205 25974
334 1 3 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.407 -0.254 25974
335 1 3 . 1 1 11 11 LYS H H 11 7.051 7.051 7.580 -0.529 25974
336 1 3 . 1 1 12 12 ASN N N 12 120.652 120.652 118.434 2.218 25974
337 1 3 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.450 0.116 25974
338 1 3 . 1 1 12 12 ASN H H 12 7.590 7.590 8.708 -1.118 25974
339 1 3 . 1 1 13 13 GLU N N 13 115.322 115.322 120.621 -5.299 25974
340 1 3 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.479 0.417 25974
341 1 3 . 1 1 13 13 GLU H H 13 7.290 7.290 8.387 -1.097 25974
342 1 3 . 1 1 14 14 CYS N N 14 123.345 123.345 125.760 -2.415 25974
343 1 3 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.943 -0.304 25974
344 1 3 . 1 1 14 14 CYS H H 14 9.588 9.588 9.052 0.536 25974
345 1 3 . 1 1 15 15 LYS N N 15 110.722 110.722 128.849 -18.127 25974
346 1 3 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.721 0.226 25974
347 1 3 . 1 1 15 15 LYS H H 15 8.636 8.636 7.990 0.646 25974
348 1 3 . 1 1 16 16 TYR N N 16 126.630 126.630 120.870 5.760 25974
349 1 3 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.766 0.133 25974
350 1 3 . 1 1 16 16 TYR H H 16 8.998 8.998 8.429 0.569 25974
351 1 3 . 1 1 17 17 LYS N N 17 120.977 120.977 119.824 1.153 25974
352 1 3 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.588 -0.182 25974
353 1 3 . 1 1 17 17 LYS H H 17 8.421 8.421 8.268 0.153 25974
354 1 3 . 1 1 18 18 ASN N N 18 122.224 122.224 121.163 1.061 25974
355 1 3 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.333 -0.231 25974
356 1 3 . 1 1 18 18 ASN H H 18 7.735 7.735 7.939 -0.204 25974
357 1 3 . 1 1 19 19 ASP N N 19 117.436 117.436 119.504 -2.068 25974
358 1 3 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.543 -0.159 25974
359 1 3 . 1 1 19 19 ASP H H 19 8.238 8.238 8.440 -0.202 25974
360 1 3 . 1 1 20 20 ALA N N 20 120.895 120.895 118.847 2.048 25974
361 1 3 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.440 -0.031 25974
362 1 3 . 1 1 20 20 ALA H H 20 7.419 7.419 7.656 -0.237 25974
363 1 3 . 1 1 21 21 GLY N N 21 127.668 127.668 107.328 20.340 25974
364 1 3 . 1 1 21 21 GLY H H 21 8.170 8.170 8.120 0.050 25974
365 1 3 . 1 1 22 22 LYS N N 22 120.354 120.354 121.856 -1.502 25974
366 1 3 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.194 0.115 25974
367 1 3 . 1 1 22 22 LYS H H 22 7.682 7.682 7.832 -0.150 25974
368 1 3 . 1 1 23 23 ASP N N 23 126.398 126.398 126.143 0.255 25974
369 1 3 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.575 -0.320 25974
370 1 3 . 1 1 23 23 ASP H H 23 8.610 8.610 8.383 0.227 25974
371 1 3 . 1 1 24 24 THR N N 24 122.770 122.770 120.401 2.369 25974
372 1 3 . 1 1 24 24 THR HA H 24 4.012 4.012 4.666 -0.654 25974
373 1 3 . 1 1 24 24 THR H H 24 8.782 8.782 8.473 0.309 25974
374 1 3 . 1 1 25 25 PHE N N 25 122.423 122.423 126.833 -4.410 25974
375 1 3 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.741 0.663 25974
376 1 3 . 1 1 25 25 PHE H H 25 8.328 8.328 9.037 -0.709 25974
377 1 3 . 1 1 26 26 ILE N N 26 123.029 123.029 122.014 1.015 25974
378 1 3 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.532 0.082 25974
379 1 3 . 1 1 26 26 ILE H H 26 9.138 9.138 8.062 1.076 25974
380 1 3 . 1 1 27 27 LYS N N 27 127.077 127.077 128.012 -0.935 25974
381 1 3 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.253 -0.090 25974
382 1 3 . 1 1 27 27 LYS H H 27 8.335 8.335 8.273 0.062 25974
383 1 3 . 1 1 28 28 CYS N N 28 120.248 120.248 119.902 0.346 25974
384 1 3 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.748 -0.089 25974
385 1 3 . 1 1 28 28 CYS H H 28 8.618 8.618 8.554 0.064 25974
386 1 3 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.299 0.127 25974
387 1 3 . 1 1 30 30 LYS N N 30 115.643 115.643 119.134 -3.491 25974
388 1 3 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.815 0.134 25974
389 1 3 . 1 1 30 30 LYS H H 30 8.002 8.002 8.210 -0.208 25974
390 1 3 . 1 1 31 31 PHE N N 31 116.470 116.470 115.170 1.300 25974
391 1 3 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.558 -0.054 25974
392 1 3 . 1 1 31 31 PHE H H 31 6.308 6.308 7.278 -0.970 25974
393 1 3 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.634 -0.490 25974
394 1 3 . 1 1 33 33 ASN N N 33 113.110 113.110 115.997 -2.887 25974
395 1 3 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.833 -0.160 25974
396 1 3 . 1 1 33 33 ASN H H 33 8.564 8.564 8.106 0.458 25974
397 1 3 . 1 1 34 34 LYS N N 34 120.347 120.347 118.832 1.515 25974
398 1 3 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.404 0.580 25974
399 1 3 . 1 1 34 34 LYS H H 34 7.914 7.914 8.035 -0.121 25974
400 1 3 . 1 1 35 35 LYS N N 35 117.863 117.863 118.191 -0.328 25974
401 1 3 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.456 0.152 25974
402 1 3 . 1 1 35 35 LYS H H 35 7.005 7.005 7.657 -0.652 25974
403 1 3 . 1 1 36 36 CYS N N 36 118.915 118.915 119.138 -0.223 25974
404 1 3 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.408 0.449 25974
405 1 3 . 1 1 36 36 CYS H H 36 8.817 8.817 8.758 0.059 25974
406 1 3 . 1 1 37 37 THR N N 37 121.008 121.008 111.706 9.302 25974
407 1 3 . 1 1 37 37 THR HA H 37 4.300 4.300 4.320 -0.020 25974
408 1 3 . 1 1 37 37 THR H H 37 9.980 9.980 8.221 1.759 25974
409 1 3 . 1 1 38 38 LYS N N 38 122.326 122.326 119.937 2.389 25974
410 1 3 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.501 -0.364 25974
411 1 3 . 1 1 38 38 LYS H H 38 7.287 7.287 7.563 -0.276 25974
412 1 3 . 1 1 39 39 ASP N N 39 125.238 125.238 118.648 6.590 25974
413 1 3 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.631 -0.053 25974
414 1 3 . 1 1 39 39 ASP H H 39 8.817 8.817 8.433 0.384 25974
415 1 3 . 1 1 40 40 ASN N N 40 114.713 114.713 119.534 -4.821 25974
416 1 3 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.319 -0.047 25974
417 1 3 . 1 1 40 40 ASN H H 40 9.532 9.532 9.007 0.525 25974
418 1 3 . 1 1 41 41 ASN N N 41 120.080 120.080 115.472 4.608 25974
419 1 3 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.677 0.040 25974
420 1 3 . 1 1 41 41 ASN H H 41 7.742 7.742 8.185 -0.443 25974
421 1 3 . 1 1 42 42 LYS N N 42 118.956 118.956 120.724 -1.768 25974
422 1 3 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.418 -0.072 25974
423 1 3 . 1 1 42 42 LYS H H 42 8.397 8.397 8.388 0.009 25974
424 1 3 . 1 1 43 43 CYS N N 43 112.235 112.235 121.680 -9.445 25974
425 1 3 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.323 0.012 25974
426 1 3 . 1 1 43 43 CYS H H 43 7.397 7.397 8.427 -1.030 25974
427 1 3 . 1 1 44 44 THR N N 44 112.586 112.586 115.102 -2.516 25974
428 1 3 . 1 1 44 44 THR HA H 44 5.221 5.221 4.623 0.598 25974
429 1 3 . 1 1 44 44 THR H H 44 8.674 8.674 8.253 0.421 25974
430 1 3 . 1 1 45 45 VAL N N 45 121.814 121.814 123.886 -2.072 25974
431 1 3 . 1 1 45 45 VAL HA H 45 4.430 4.430 3.913 0.517 25974
432 1 3 . 1 1 45 45 VAL H H 45 8.555 8.555 8.624 -0.070 25974
433 1 3 . 1 1 46 46 ASP N N 46 126.626 126.626 125.828 0.798 25974
434 1 3 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.887 0.447 25974
435 1 3 . 1 1 46 46 ASP H H 46 8.519 8.519 7.965 0.554 25974
436 1 3 . 1 1 47 47 THR N N 47 114.334 114.334 119.860 -5.526 25974
437 1 3 . 1 1 47 47 THR HA H 47 4.187 4.187 4.585 -0.398 25974
438 1 3 . 1 1 47 47 THR H H 47 9.116 9.116 8.839 0.277 25974
439 1 3 . 1 1 48 48 TYR N N 48 124.010 124.010 121.843 2.167 25974
440 1 3 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.751 -0.377 25974
441 1 3 . 1 1 48 48 TYR H H 48 8.803 8.803 7.803 1.000 25974
442 1 3 . 1 1 49 49 ASN N N 49 113.668 113.668 116.248 -2.580 25974
443 1 3 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.648 -0.173 25974
444 1 3 . 1 1 49 49 ASN H H 49 7.433 7.433 7.948 -0.515 25974
445 1 3 . 1 1 50 50 ASN N N 50 117.403 117.403 117.700 -0.297 25974
446 1 3 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.306 -0.107 25974
447 1 3 . 1 1 50 50 ASN H H 50 7.863 7.863 8.053 -0.191 25974
448 1 3 . 1 1 51 51 ALA N N 51 121.102 121.102 123.808 -2.706 25974
449 1 3 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.446 -0.009 25974
450 1 3 . 1 1 51 51 ALA H H 51 7.853 7.853 7.645 0.208 25974
451 1 3 . 1 1 52 52 VAL N N 52 126.326 126.326 121.800 4.526 25974
452 1 3 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.259 0.616 25974
453 1 3 . 1 1 52 52 VAL H H 52 8.297 8.297 7.928 0.369 25974
454 1 3 . 1 1 53 53 ASP N N 53 125.100 125.100 129.324 -4.224 25974
455 1 3 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.059 -0.264 25974
456 1 3 . 1 1 53 53 ASP H H 53 8.519 8.519 8.438 0.081 25974
457 1 3 . 1 1 54 54 CYS N N 54 126.377 126.377 119.158 7.219 25974
458 1 3 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.269 0.409 25974
459 1 3 . 1 1 54 54 CYS H H 54 8.609 8.609 7.927 0.682 25974
460 1 4 . 1 1 2 2 LYS N N 2 119.918 119.918 123.195 -3.277 25974
461 1 4 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.321 0.909 25974
462 1 4 . 1 1 2 2 LYS H H 2 8.167 8.167 7.870 0.297 25974
463 1 4 . 1 1 3 3 TYR N N 3 122.493 122.493 120.514 1.979 25974
464 1 4 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.843 -0.034 25974
465 1 4 . 1 1 3 3 TYR H H 3 8.939 8.939 9.165 -0.226 25974
466 1 4 . 1 1 4 4 THR N N 4 117.297 117.297 117.589 -0.292 25974
467 1 4 . 1 1 4 4 THR HA H 4 5.042 5.042 4.610 0.432 25974
468 1 4 . 1 1 4 4 THR H H 4 8.885 8.885 8.559 0.326 25974
469 1 4 . 1 1 5 5 GLY N N 5 115.452 115.452 111.845 3.607 25974
470 1 4 . 1 1 5 5 GLY H H 5 9.135 9.135 8.894 0.241 25974
471 1 4 . 1 1 6 6 LYS N N 6 121.001 121.001 117.330 3.671 25974
472 1 4 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.157 0.221 25974
473 1 4 . 1 1 6 6 LYS H H 6 8.422 8.422 7.890 0.532 25974
474 1 4 . 1 1 7 7 CYS N N 7 122.647 122.647 117.580 5.067 25974
475 1 4 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.181 1.116 25974
476 1 4 . 1 1 7 7 CYS H H 7 9.767 9.767 8.994 0.773 25974
477 1 4 . 1 1 8 8 THR N N 8 113.493 113.493 113.602 -0.109 25974
478 1 4 . 1 1 8 8 THR HA H 8 4.704 4.704 4.771 -0.068 25974
479 1 4 . 1 1 8 8 THR H H 8 8.716 8.716 8.011 0.705 25974
480 1 4 . 1 1 9 9 LYS N N 9 127.640 127.640 126.281 1.359 25974
481 1 4 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.084 -0.591 25974
482 1 4 . 1 1 9 9 LYS H H 9 8.947 8.947 8.350 0.597 25974
483 1 4 . 1 1 10 10 SER N N 10 116.726 116.726 116.982 -0.256 25974
484 1 4 . 1 1 10 10 SER HA H 10 4.006 4.006 4.219 -0.213 25974
485 1 4 . 1 1 10 10 SER H H 10 9.484 9.484 8.001 1.483 25974
486 1 4 . 1 1 11 11 LYS N N 11 116.973 116.973 117.740 -0.767 25974
487 1 4 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.472 -0.319 25974
488 1 4 . 1 1 11 11 LYS H H 11 7.051 7.051 8.168 -1.117 25974
489 1 4 . 1 1 12 12 ASN N N 12 120.652 120.652 118.905 1.747 25974
490 1 4 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.380 0.186 25974
491 1 4 . 1 1 12 12 ASN H H 12 7.590 7.590 8.209 -0.619 25974
492 1 4 . 1 1 13 13 GLU N N 13 115.322 115.322 123.120 -7.798 25974
493 1 4 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.471 0.425 25974
494 1 4 . 1 1 13 13 GLU H H 13 7.290 7.290 8.294 -1.004 25974
495 1 4 . 1 1 14 14 CYS N N 14 123.345 123.345 126.251 -2.906 25974
496 1 4 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.602 0.037 25974
497 1 4 . 1 1 14 14 CYS H H 14 9.588 9.588 8.690 0.898 25974
498 1 4 . 1 1 15 15 LYS N N 15 110.722 110.722 131.726 -21.004 25974
499 1 4 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.375 -0.429 25974
500 1 4 . 1 1 15 15 LYS H H 15 8.636 8.636 8.926 -0.290 25974
501 1 4 . 1 1 16 16 TYR N N 16 126.630 126.630 123.683 2.947 25974
502 1 4 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.975 -0.076 25974
503 1 4 . 1 1 16 16 TYR H H 16 8.998 8.998 9.417 -0.419 25974
504 1 4 . 1 1 17 17 LYS N N 17 120.977 120.977 119.092 1.885 25974
505 1 4 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.561 -0.155 25974
506 1 4 . 1 1 17 17 LYS H H 17 8.421 8.421 8.197 0.224 25974
507 1 4 . 1 1 18 18 ASN N N 18 122.224 122.224 120.846 1.378 25974
508 1 4 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.314 -0.212 25974
509 1 4 . 1 1 18 18 ASN H H 18 7.735 7.735 7.954 -0.219 25974
510 1 4 . 1 1 19 19 ASP N N 19 117.436 117.436 120.178 -2.742 25974
511 1 4 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.613 -0.229 25974
512 1 4 . 1 1 19 19 ASP H H 19 8.238 8.238 7.877 0.361 25974
513 1 4 . 1 1 20 20 ALA N N 20 120.895 120.895 119.572 1.323 25974
514 1 4 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.060 0.349 25974
515 1 4 . 1 1 20 20 ALA H H 20 7.419 7.419 7.874 -0.455 25974
516 1 4 . 1 1 21 21 GLY N N 21 127.668 127.668 103.164 24.504 25974
517 1 4 . 1 1 21 21 GLY H H 21 8.170 8.170 7.963 0.207 25974
518 1 4 . 1 1 22 22 LYS N N 22 120.354 120.354 123.019 -2.665 25974
519 1 4 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.114 0.195 25974
520 1 4 . 1 1 22 22 LYS H H 22 7.682 7.682 7.866 -0.184 25974
521 1 4 . 1 1 23 23 ASP N N 23 126.398 126.398 124.215 2.183 25974
522 1 4 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.507 -0.251 25974
523 1 4 . 1 1 23 23 ASP H H 23 8.610 8.610 8.306 0.304 25974
524 1 4 . 1 1 24 24 THR N N 24 122.770 122.770 118.772 3.998 25974
525 1 4 . 1 1 24 24 THR HA H 24 4.012 4.012 4.186 -0.174 25974
526 1 4 . 1 1 24 24 THR H H 24 8.782 8.782 8.239 0.543 25974
527 1 4 . 1 1 25 25 PHE N N 25 122.423 122.423 125.092 -2.669 25974
528 1 4 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.243 0.161 25974
529 1 4 . 1 1 25 25 PHE H H 25 8.328 8.328 8.321 0.007 25974
530 1 4 . 1 1 26 26 ILE N N 26 123.029 123.029 124.368 -1.339 25974
531 1 4 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.566 0.048 25974
532 1 4 . 1 1 26 26 ILE H H 26 9.138 9.138 9.187 -0.049 25974
533 1 4 . 1 1 27 27 LYS N N 27 127.077 127.077 127.767 -0.690 25974
534 1 4 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.190 -0.027 25974
535 1 4 . 1 1 27 27 LYS H H 27 8.335 8.335 8.423 -0.088 25974
536 1 4 . 1 1 28 28 CYS N N 28 120.248 120.248 121.809 -1.561 25974
537 1 4 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.798 -0.140 25974
538 1 4 . 1 1 28 28 CYS H H 28 8.618 8.618 8.688 -0.070 25974
539 1 4 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.336 0.090 25974
540 1 4 . 1 1 30 30 LYS N N 30 115.643 115.643 118.687 -3.044 25974
541 1 4 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.769 0.180 25974
542 1 4 . 1 1 30 30 LYS H H 30 8.002 8.002 8.143 -0.141 25974
543 1 4 . 1 1 31 31 PHE N N 31 116.470 116.470 116.195 0.275 25974
544 1 4 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.610 -0.106 25974
545 1 4 . 1 1 31 31 PHE H H 31 6.308 6.308 7.217 -0.909 25974
546 1 4 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.745 -0.601 25974
547 1 4 . 1 1 33 33 ASN N N 33 113.110 113.110 115.719 -2.609 25974
548 1 4 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.880 -0.207 25974
549 1 4 . 1 1 33 33 ASN H H 33 8.564 8.564 8.297 0.267 25974
550 1 4 . 1 1 34 34 LYS N N 34 120.347 120.347 118.037 2.310 25974
551 1 4 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.522 0.462 25974
552 1 4 . 1 1 34 34 LYS H H 34 7.914 7.914 8.047 -0.133 25974
553 1 4 . 1 1 35 35 LYS N N 35 117.863 117.863 119.385 -1.522 25974
554 1 4 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.195 0.413 25974
555 1 4 . 1 1 35 35 LYS H H 35 7.005 7.005 7.546 -0.541 25974
556 1 4 . 1 1 36 36 CYS N N 36 118.915 118.915 120.431 -1.516 25974
557 1 4 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.374 0.483 25974
558 1 4 . 1 1 36 36 CYS H H 36 8.817 8.817 8.477 0.340 25974
559 1 4 . 1 1 37 37 THR N N 37 121.008 121.008 116.155 4.853 25974
560 1 4 . 1 1 37 37 THR HA H 37 4.300 4.300 4.441 -0.141 25974
561 1 4 . 1 1 37 37 THR H H 37 9.980 9.980 8.294 1.686 25974
562 1 4 . 1 1 38 38 LYS N N 38 122.326 122.326 120.687 1.639 25974
563 1 4 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.503 -0.366 25974
564 1 4 . 1 1 38 38 LYS H H 38 7.287 7.287 7.599 -0.312 25974
565 1 4 . 1 1 39 39 ASP N N 39 125.238 125.238 121.664 3.574 25974
566 1 4 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.603 -0.025 25974
567 1 4 . 1 1 39 39 ASP H H 39 8.817 8.817 8.523 0.294 25974
568 1 4 . 1 1 40 40 ASN N N 40 114.713 114.713 120.906 -6.193 25974
569 1 4 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.259 0.013 25974
570 1 4 . 1 1 40 40 ASN H H 40 9.532 9.532 8.813 0.719 25974
571 1 4 . 1 1 41 41 ASN N N 41 120.080 120.080 116.560 3.520 25974
572 1 4 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.630 0.087 25974
573 1 4 . 1 1 41 41 ASN H H 41 7.742 7.742 7.909 -0.167 25974
574 1 4 . 1 1 42 42 LYS N N 42 118.956 118.956 121.090 -2.134 25974
575 1 4 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.529 -0.183 25974
576 1 4 . 1 1 42 42 LYS H H 42 8.397 8.397 8.349 0.048 25974
577 1 4 . 1 1 43 43 CYS N N 43 112.235 112.235 121.988 -9.753 25974
578 1 4 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.371 -0.036 25974
579 1 4 . 1 1 43 43 CYS H H 43 7.397 7.397 8.633 -1.236 25974
580 1 4 . 1 1 44 44 THR N N 44 112.586 112.586 117.939 -5.353 25974
581 1 4 . 1 1 44 44 THR HA H 44 5.221 5.221 4.878 0.343 25974
582 1 4 . 1 1 44 44 THR H H 44 8.674 8.674 8.342 0.332 25974
583 1 4 . 1 1 45 45 VAL N N 45 121.814 121.814 124.190 -2.376 25974
584 1 4 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.030 0.400 25974
585 1 4 . 1 1 45 45 VAL H H 45 8.555 8.555 8.422 0.133 25974
586 1 4 . 1 1 46 46 ASP N N 46 126.626 126.626 126.972 -0.346 25974
587 1 4 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.020 0.314 25974
588 1 4 . 1 1 46 46 ASP H H 46 8.519 8.519 8.248 0.271 25974
589 1 4 . 1 1 47 47 THR N N 47 114.334 114.334 119.346 -5.012 25974
590 1 4 . 1 1 47 47 THR HA H 47 4.187 4.187 4.561 -0.374 25974
591 1 4 . 1 1 47 47 THR H H 47 9.116 9.116 8.866 0.250 25974
592 1 4 . 1 1 48 48 TYR N N 48 124.010 124.010 120.557 3.453 25974
593 1 4 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.658 -0.284 25974
594 1 4 . 1 1 48 48 TYR H H 48 8.803 8.803 8.230 0.573 25974
595 1 4 . 1 1 49 49 ASN N N 49 113.668 113.668 114.753 -1.085 25974
596 1 4 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.601 -0.126 25974
597 1 4 . 1 1 49 49 ASN H H 49 7.433 7.433 7.957 -0.524 25974
598 1 4 . 1 1 50 50 ASN N N 50 117.403 117.403 119.332 -1.929 25974
599 1 4 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.314 -0.115 25974
600 1 4 . 1 1 50 50 ASN H H 50 7.863 7.863 8.196 -0.333 25974
601 1 4 . 1 1 51 51 ALA N N 51 121.102 121.102 124.207 -3.105 25974
602 1 4 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.516 -0.079 25974
603 1 4 . 1 1 51 51 ALA H H 51 7.853 7.853 7.643 0.210 25974
604 1 4 . 1 1 52 52 VAL N N 52 126.326 126.326 121.531 4.795 25974
605 1 4 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.794 0.081 25974
606 1 4 . 1 1 52 52 VAL H H 52 8.297 8.297 8.232 0.065 25974
607 1 4 . 1 1 53 53 ASP N N 53 125.100 125.100 127.302 -2.202 25974
608 1 4 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.995 -0.200 25974
609 1 4 . 1 1 53 53 ASP H H 53 8.519 8.519 8.484 0.035 25974
610 1 4 . 1 1 54 54 CYS N N 54 126.377 126.377 118.110 8.267 25974
611 1 4 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.431 0.247 25974
612 1 4 . 1 1 54 54 CYS H H 54 8.609 8.609 8.044 0.565 25974
613 1 5 . 1 1 2 2 LYS N N 2 119.918 119.918 117.787 2.131 25974
614 1 5 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.194 1.036 25974
615 1 5 . 1 1 2 2 LYS H H 2 8.167 8.167 7.547 0.620 25974
616 1 5 . 1 1 3 3 TYR N N 3 122.493 122.493 117.807 4.686 25974
617 1 5 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.843 -0.034 25974
618 1 5 . 1 1 3 3 TYR H H 3 8.939 8.939 8.972 -0.033 25974
619 1 5 . 1 1 4 4 THR N N 4 117.297 117.297 116.401 0.896 25974
620 1 5 . 1 1 4 4 THR HA H 4 5.042 5.042 4.618 0.424 25974
621 1 5 . 1 1 4 4 THR H H 4 8.885 8.885 8.580 0.305 25974
622 1 5 . 1 1 5 5 GLY N N 5 115.452 115.452 112.405 3.047 25974
623 1 5 . 1 1 5 5 GLY H H 5 9.135 9.135 9.137 -0.002 25974
624 1 5 . 1 1 6 6 LYS N N 6 121.001 121.001 117.440 3.561 25974
625 1 5 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.268 0.110 25974
626 1 5 . 1 1 6 6 LYS H H 6 8.422 8.422 8.037 0.385 25974
627 1 5 . 1 1 7 7 CYS N N 7 122.647 122.647 117.145 5.502 25974
628 1 5 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.199 1.098 25974
629 1 5 . 1 1 7 7 CYS H H 7 9.767 9.767 8.967 0.800 25974
630 1 5 . 1 1 8 8 THR N N 8 113.493 113.493 114.977 -1.484 25974
631 1 5 . 1 1 8 8 THR HA H 8 4.704 4.704 4.796 -0.092 25974
632 1 5 . 1 1 8 8 THR H H 8 8.716 8.716 8.238 0.478 25974
633 1 5 . 1 1 9 9 LYS N N 9 127.640 127.640 125.941 1.699 25974
634 1 5 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.067 -0.574 25974
635 1 5 . 1 1 9 9 LYS H H 9 8.947 8.947 8.586 0.361 25974
636 1 5 . 1 1 10 10 SER N N 10 116.726 116.726 116.702 0.024 25974
637 1 5 . 1 1 10 10 SER HA H 10 4.006 4.006 4.259 -0.253 25974
638 1 5 . 1 1 10 10 SER H H 10 9.484 9.484 8.300 1.183 25974
639 1 5 . 1 1 11 11 LYS N N 11 116.973 116.973 117.535 -0.562 25974
640 1 5 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.501 -0.348 25974
641 1 5 . 1 1 11 11 LYS H H 11 7.051 7.051 8.319 -1.268 25974
642 1 5 . 1 1 12 12 ASN N N 12 120.652 120.652 118.560 2.092 25974
643 1 5 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.543 0.023 25974
644 1 5 . 1 1 12 12 ASN H H 12 7.590 7.590 8.138 -0.548 25974
645 1 5 . 1 1 13 13 GLU N N 13 115.322 115.322 123.325 -8.003 25974
646 1 5 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.377 0.519 25974
647 1 5 . 1 1 13 13 GLU H H 13 7.290 7.290 8.288 -0.998 25974
648 1 5 . 1 1 14 14 CYS N N 14 123.345 123.345 125.365 -2.020 25974
649 1 5 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.670 -0.031 25974
650 1 5 . 1 1 14 14 CYS H H 14 9.588 9.588 8.708 0.880 25974
651 1 5 . 1 1 15 15 LYS N N 15 110.722 110.722 128.764 -18.042 25974
652 1 5 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.723 0.223 25974
653 1 5 . 1 1 15 15 LYS H H 15 8.636 8.636 8.179 0.457 25974
654 1 5 . 1 1 16 16 TYR N N 16 126.630 126.630 121.345 5.285 25974
655 1 5 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.804 0.095 25974
656 1 5 . 1 1 16 16 TYR H H 16 8.998 8.998 8.607 0.391 25974
657 1 5 . 1 1 17 17 LYS N N 17 120.977 120.977 120.716 0.261 25974
658 1 5 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.705 -0.299 25974
659 1 5 . 1 1 17 17 LYS H H 17 8.421 8.421 8.219 0.202 25974
660 1 5 . 1 1 18 18 ASN N N 18 122.224 122.224 120.351 1.873 25974
661 1 5 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.628 -0.526 25974
662 1 5 . 1 1 18 18 ASN H H 18 7.735 7.735 8.040 -0.305 25974
663 1 5 . 1 1 19 19 ASP N N 19 117.436 117.436 121.400 -3.964 25974
664 1 5 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.250 0.134 25974
665 1 5 . 1 1 19 19 ASP H H 19 8.238 8.238 9.015 -0.777 25974
666 1 5 . 1 1 20 20 ALA N N 20 120.895 120.895 121.736 -0.841 25974
667 1 5 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.505 -0.096 25974
668 1 5 . 1 1 20 20 ALA H H 20 7.419 7.419 8.028 -0.609 25974
669 1 5 . 1 1 21 21 GLY N N 21 127.668 127.668 107.563 20.105 25974
670 1 5 . 1 1 21 21 GLY H H 21 8.170 8.170 7.766 0.404 25974
671 1 5 . 1 1 22 22 LYS N N 22 120.354 120.354 122.043 -1.689 25974
672 1 5 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.215 0.094 25974
673 1 5 . 1 1 22 22 LYS H H 22 7.682 7.682 7.809 -0.127 25974
674 1 5 . 1 1 23 23 ASP N N 23 126.398 126.398 124.137 2.261 25974
675 1 5 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.690 -0.434 25974
676 1 5 . 1 1 23 23 ASP H H 23 8.610 8.610 8.392 0.218 25974
677 1 5 . 1 1 24 24 THR N N 24 122.770 122.770 119.514 3.256 25974
678 1 5 . 1 1 24 24 THR HA H 24 4.012 4.012 4.599 -0.587 25974
679 1 5 . 1 1 24 24 THR H H 24 8.782 8.782 8.034 0.748 25974
680 1 5 . 1 1 25 25 PHE N N 25 122.423 122.423 126.004 -3.581 25974
681 1 5 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.762 0.642 25974
682 1 5 . 1 1 25 25 PHE H H 25 8.328 8.328 8.877 -0.549 25974
683 1 5 . 1 1 26 26 ILE N N 26 123.029 123.029 123.381 -0.352 25974
684 1 5 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.573 0.041 25974
685 1 5 . 1 1 26 26 ILE H H 26 9.138 9.138 8.381 0.757 25974
686 1 5 . 1 1 27 27 LYS N N 27 127.077 127.077 126.528 0.549 25974
687 1 5 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.462 -0.299 25974
688 1 5 . 1 1 27 27 LYS H H 27 8.335 8.335 8.148 0.187 25974
689 1 5 . 1 1 28 28 CYS N N 28 120.248 120.248 123.650 -3.402 25974
690 1 5 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.452 0.207 25974
691 1 5 . 1 1 28 28 CYS H H 28 8.618 8.618 8.800 -0.182 25974
692 1 5 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.306 0.120 25974
693 1 5 . 1 1 30 30 LYS N N 30 115.643 115.643 119.090 -3.447 25974
694 1 5 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.853 0.096 25974
695 1 5 . 1 1 30 30 LYS H H 30 8.002 8.002 8.235 -0.233 25974
696 1 5 . 1 1 31 31 PHE N N 31 116.470 116.470 116.284 0.186 25974
697 1 5 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.538 -0.034 25974
698 1 5 . 1 1 31 31 PHE H H 31 6.308 6.308 7.955 -1.647 25974
699 1 5 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.665 -0.521 25974
700 1 5 . 1 1 33 33 ASN N N 33 113.110 113.110 116.575 -3.465 25974
701 1 5 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.806 -0.133 25974
702 1 5 . 1 1 33 33 ASN H H 33 8.564 8.564 8.286 0.278 25974
703 1 5 . 1 1 34 34 LYS N N 34 120.347 120.347 119.136 1.211 25974
704 1 5 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.400 0.584 25974
705 1 5 . 1 1 34 34 LYS H H 34 7.914 7.914 8.329 -0.415 25974
706 1 5 . 1 1 35 35 LYS N N 35 117.863 117.863 118.152 -0.289 25974
707 1 5 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.387 0.221 25974
708 1 5 . 1 1 35 35 LYS H H 35 7.005 7.005 7.498 -0.493 25974
709 1 5 . 1 1 36 36 CYS N N 36 118.915 118.915 119.485 -0.570 25974
710 1 5 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.430 0.427 25974
711 1 5 . 1 1 36 36 CYS H H 36 8.817 8.817 8.658 0.159 25974
712 1 5 . 1 1 37 37 THR N N 37 121.008 121.008 116.766 4.242 25974
713 1 5 . 1 1 37 37 THR HA H 37 4.300 4.300 4.486 -0.186 25974
714 1 5 . 1 1 37 37 THR H H 37 9.980 9.980 8.455 1.525 25974
715 1 5 . 1 1 38 38 LYS N N 38 122.326 122.326 121.067 1.259 25974
716 1 5 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.470 -0.333 25974
717 1 5 . 1 1 38 38 LYS H H 38 7.287 7.287 7.683 -0.396 25974
718 1 5 . 1 1 39 39 ASP N N 39 125.238 125.238 120.477 4.761 25974
719 1 5 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.507 0.071 25974
720 1 5 . 1 1 39 39 ASP H H 39 8.817 8.817 8.404 0.413 25974
721 1 5 . 1 1 40 40 ASN N N 40 114.713 114.713 122.167 -7.454 25974
722 1 5 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.255 0.017 25974
723 1 5 . 1 1 40 40 ASN H H 40 9.532 9.532 8.868 0.664 25974
724 1 5 . 1 1 41 41 ASN N N 41 120.080 120.080 115.125 4.955 25974
725 1 5 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.616 0.101 25974
726 1 5 . 1 1 41 41 ASN H H 41 7.742 7.742 7.967 -0.225 25974
727 1 5 . 1 1 42 42 LYS N N 42 118.956 118.956 121.227 -2.271 25974
728 1 5 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.479 -0.133 25974
729 1 5 . 1 1 42 42 LYS H H 42 8.397 8.397 8.375 0.022 25974
730 1 5 . 1 1 43 43 CYS N N 43 112.235 112.235 120.480 -8.245 25974
731 1 5 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.401 -0.066 25974
732 1 5 . 1 1 43 43 CYS H H 43 7.397 7.397 8.498 -1.101 25974
733 1 5 . 1 1 44 44 THR N N 44 112.586 112.586 116.068 -3.482 25974
734 1 5 . 1 1 44 44 THR HA H 44 5.221 5.221 4.967 0.254 25974
735 1 5 . 1 1 44 44 THR H H 44 8.674 8.674 8.407 0.267 25974
736 1 5 . 1 1 45 45 VAL N N 45 121.814 121.814 125.706 -3.892 25974
737 1 5 . 1 1 45 45 VAL HA H 45 4.430 4.430 3.965 0.465 25974
738 1 5 . 1 1 45 45 VAL H H 45 8.555 8.555 8.481 0.074 25974
739 1 5 . 1 1 46 46 ASP N N 46 126.626 126.626 127.013 -0.387 25974
740 1 5 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.880 0.454 25974
741 1 5 . 1 1 46 46 ASP H H 46 8.519 8.519 7.998 0.521 25974
742 1 5 . 1 1 47 47 THR N N 47 114.334 114.334 120.909 -6.575 25974
743 1 5 . 1 1 47 47 THR HA H 47 4.187 4.187 4.523 -0.336 25974
744 1 5 . 1 1 47 47 THR H H 47 9.116 9.116 8.737 0.379 25974
745 1 5 . 1 1 48 48 TYR N N 48 124.010 124.010 122.418 1.592 25974
746 1 5 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.724 -0.350 25974
747 1 5 . 1 1 48 48 TYR H H 48 8.803 8.803 7.769 1.034 25974
748 1 5 . 1 1 49 49 ASN N N 49 113.668 113.668 115.619 -1.951 25974
749 1 5 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.539 -0.064 25974
750 1 5 . 1 1 49 49 ASN H H 49 7.433 7.433 7.978 -0.545 25974
751 1 5 . 1 1 50 50 ASN N N 50 117.403 117.403 120.062 -2.659 25974
752 1 5 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.173 0.026 25974
753 1 5 . 1 1 50 50 ASN H H 50 7.863 7.863 8.197 -0.334 25974
754 1 5 . 1 1 51 51 ALA N N 51 121.102 121.102 124.233 -3.131 25974
755 1 5 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.526 -0.089 25974
756 1 5 . 1 1 51 51 ALA H H 51 7.853 7.853 7.595 0.258 25974
757 1 5 . 1 1 52 52 VAL N N 52 126.326 126.326 122.915 3.411 25974
758 1 5 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.550 0.325 25974
759 1 5 . 1 1 52 52 VAL H H 52 8.297 8.297 8.176 0.121 25974
760 1 5 . 1 1 53 53 ASP N N 53 125.100 125.100 130.382 -5.282 25974
761 1 5 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.737 0.058 25974
762 1 5 . 1 1 53 53 ASP H H 53 8.519 8.519 8.407 0.112 25974
763 1 5 . 1 1 54 54 CYS N N 54 126.377 126.377 118.161 8.216 25974
764 1 5 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.482 0.196 25974
765 1 5 . 1 1 54 54 CYS H H 54 8.609 8.609 8.094 0.515 25974
766 1 6 . 1 1 2 2 LYS N N 2 119.918 119.918 120.242 -0.324 25974
767 1 6 . 1 1 2 2 LYS HA H 2 5.230 5.230 3.897 1.333 25974
768 1 6 . 1 1 2 2 LYS H H 2 8.167 8.167 8.142 0.025 25974
769 1 6 . 1 1 3 3 TYR N N 3 122.493 122.493 123.127 -0.634 25974
770 1 6 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.629 0.180 25974
771 1 6 . 1 1 3 3 TYR H H 3 8.939 8.939 8.297 0.642 25974
772 1 6 . 1 1 4 4 THR N N 4 117.297 117.297 119.911 -2.614 25974
773 1 6 . 1 1 4 4 THR HA H 4 5.042 5.042 4.520 0.522 25974
774 1 6 . 1 1 4 4 THR H H 4 8.885 8.885 8.638 0.247 25974
775 1 6 . 1 1 5 5 GLY N N 5 115.452 115.452 112.844 2.608 25974
776 1 6 . 1 1 5 5 GLY H H 5 9.135 9.135 8.990 0.145 25974
777 1 6 . 1 1 6 6 LYS N N 6 121.001 121.001 116.874 4.127 25974
778 1 6 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.168 0.210 25974
779 1 6 . 1 1 6 6 LYS H H 6 8.422 8.422 7.929 0.493 25974
780 1 6 . 1 1 7 7 CYS N N 7 122.647 122.647 116.464 6.183 25974
781 1 6 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.347 0.950 25974
782 1 6 . 1 1 7 7 CYS H H 7 9.767 9.767 8.769 0.998 25974
783 1 6 . 1 1 8 8 THR N N 8 113.493 113.493 114.518 -1.025 25974
784 1 6 . 1 1 8 8 THR HA H 8 4.704 4.704 4.812 -0.108 25974
785 1 6 . 1 1 8 8 THR H H 8 8.716 8.716 8.310 0.406 25974
786 1 6 . 1 1 9 9 LYS N N 9 127.640 127.640 126.730 0.910 25974
787 1 6 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.052 -0.559 25974
788 1 6 . 1 1 9 9 LYS H H 9 8.947 8.947 8.649 0.298 25974
789 1 6 . 1 1 10 10 SER N N 10 116.726 116.726 114.879 1.847 25974
790 1 6 . 1 1 10 10 SER HA H 10 4.006 4.006 4.255 -0.249 25974
791 1 6 . 1 1 10 10 SER H H 10 9.484 9.484 8.189 1.295 25974
792 1 6 . 1 1 11 11 LYS N N 11 116.973 116.973 116.658 0.315 25974
793 1 6 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.490 -0.337 25974
794 1 6 . 1 1 11 11 LYS H H 11 7.051 7.051 7.673 -0.622 25974
795 1 6 . 1 1 12 12 ASN N N 12 120.652 120.652 118.728 1.924 25974
796 1 6 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.504 0.062 25974
797 1 6 . 1 1 12 12 ASN H H 12 7.590 7.590 8.397 -0.807 25974
798 1 6 . 1 1 13 13 GLU N N 13 115.322 115.322 124.255 -8.933 25974
799 1 6 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.530 0.366 25974
800 1 6 . 1 1 13 13 GLU H H 13 7.290 7.290 8.425 -1.135 25974
801 1 6 . 1 1 14 14 CYS N N 14 123.345 123.345 125.531 -2.186 25974
802 1 6 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.584 0.055 25974
803 1 6 . 1 1 14 14 CYS H H 14 9.588 9.588 8.738 0.850 25974
804 1 6 . 1 1 15 15 LYS N N 15 110.722 110.722 130.355 -19.633 25974
805 1 6 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.763 0.183 25974
806 1 6 . 1 1 15 15 LYS H H 15 8.636 8.636 8.925 -0.289 25974
807 1 6 . 1 1 16 16 TYR N N 16 126.630 126.630 120.612 6.018 25974
808 1 6 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.808 0.091 25974
809 1 6 . 1 1 16 16 TYR H H 16 8.998 8.998 8.532 0.466 25974
810 1 6 . 1 1 17 17 LYS N N 17 120.977 120.977 119.631 1.346 25974
811 1 6 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.504 -0.098 25974
812 1 6 . 1 1 17 17 LYS H H 17 8.421 8.421 8.104 0.317 25974
813 1 6 . 1 1 18 18 ASN N N 18 122.224 122.224 120.996 1.228 25974
814 1 6 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.369 -0.267 25974
815 1 6 . 1 1 18 18 ASN H H 18 7.735 7.735 8.439 -0.704 25974
816 1 6 . 1 1 19 19 ASP N N 19 117.436 117.436 121.901 -4.465 25974
817 1 6 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.452 -0.068 25974
818 1 6 . 1 1 19 19 ASP H H 19 8.238 8.238 8.493 -0.255 25974
819 1 6 . 1 1 20 20 ALA N N 20 120.895 120.895 119.036 1.859 25974
820 1 6 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.393 0.016 25974
821 1 6 . 1 1 20 20 ALA H H 20 7.419 7.419 7.874 -0.455 25974
822 1 6 . 1 1 21 21 GLY N N 21 127.668 127.668 106.522 21.146 25974
823 1 6 . 1 1 21 21 GLY H H 21 8.170 8.170 8.071 0.099 25974
824 1 6 . 1 1 22 22 LYS N N 22 120.354 120.354 122.811 -2.457 25974
825 1 6 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.078 0.231 25974
826 1 6 . 1 1 22 22 LYS H H 22 7.682 7.682 7.884 -0.202 25974
827 1 6 . 1 1 23 23 ASP N N 23 126.398 126.398 123.916 2.482 25974
828 1 6 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.276 -0.020 25974
829 1 6 . 1 1 23 23 ASP H H 23 8.610 8.610 8.219 0.391 25974
830 1 6 . 1 1 24 24 THR N N 24 122.770 122.770 119.722 3.048 25974
831 1 6 . 1 1 24 24 THR HA H 24 4.012 4.012 4.551 -0.539 25974
832 1 6 . 1 1 24 24 THR H H 24 8.782 8.782 8.110 0.672 25974
833 1 6 . 1 1 25 25 PHE N N 25 122.423 122.423 126.749 -4.326 25974
834 1 6 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.008 0.396 25974
835 1 6 . 1 1 25 25 PHE H H 25 8.328 8.328 8.904 -0.576 25974
836 1 6 . 1 1 26 26 ILE N N 26 123.029 123.029 125.085 -2.056 25974
837 1 6 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.557 0.057 25974
838 1 6 . 1 1 26 26 ILE H H 26 9.138 9.138 9.252 -0.114 25974
839 1 6 . 1 1 27 27 LYS N N 27 127.077 127.077 127.966 -0.889 25974
840 1 6 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.278 -0.115 25974
841 1 6 . 1 1 27 27 LYS H H 27 8.335 8.335 8.376 -0.041 25974
842 1 6 . 1 1 28 28 CYS N N 28 120.248 120.248 121.683 -1.435 25974
843 1 6 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.770 -0.111 25974
844 1 6 . 1 1 28 28 CYS H H 28 8.618 8.618 8.533 0.085 25974
845 1 6 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.338 0.088 25974
846 1 6 . 1 1 30 30 LYS N N 30 115.643 115.643 118.976 -3.333 25974
847 1 6 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.798 0.151 25974
848 1 6 . 1 1 30 30 LYS H H 30 8.002 8.002 8.067 -0.065 25974
849 1 6 . 1 1 31 31 PHE N N 31 116.470 116.470 117.508 -1.038 25974
850 1 6 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.662 -0.158 25974
851 1 6 . 1 1 31 31 PHE H H 31 6.308 6.308 7.170 -0.862 25974
852 1 6 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.543 -0.399 25974
853 1 6 . 1 1 33 33 ASN N N 33 113.110 113.110 116.540 -3.430 25974
854 1 6 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.813 -0.140 25974
855 1 6 . 1 1 33 33 ASN H H 33 8.564 8.564 8.272 0.292 25974
856 1 6 . 1 1 34 34 LYS N N 34 120.347 120.347 118.307 2.040 25974
857 1 6 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.583 0.401 25974
858 1 6 . 1 1 34 34 LYS H H 34 7.914 7.914 8.287 -0.373 25974
859 1 6 . 1 1 35 35 LYS N N 35 117.863 117.863 116.548 1.315 25974
860 1 6 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.398 0.210 25974
861 1 6 . 1 1 35 35 LYS H H 35 7.005 7.005 7.595 -0.590 25974
862 1 6 . 1 1 36 36 CYS N N 36 118.915 118.915 120.465 -1.550 25974
863 1 6 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.344 0.513 25974
864 1 6 . 1 1 36 36 CYS H H 36 8.817 8.817 8.500 0.317 25974
865 1 6 . 1 1 37 37 THR N N 37 121.008 121.008 118.628 2.380 25974
866 1 6 . 1 1 37 37 THR HA H 37 4.300 4.300 4.406 -0.106 25974
867 1 6 . 1 1 37 37 THR H H 37 9.980 9.980 8.311 1.669 25974
868 1 6 . 1 1 38 38 LYS N N 38 122.326 122.326 120.847 1.479 25974
869 1 6 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.412 -0.275 25974
870 1 6 . 1 1 38 38 LYS H H 38 7.287 7.287 7.577 -0.290 25974
871 1 6 . 1 1 39 39 ASP N N 39 125.238 125.238 119.656 5.582 25974
872 1 6 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.634 -0.056 25974
873 1 6 . 1 1 39 39 ASP H H 39 8.817 8.817 8.559 0.258 25974
874 1 6 . 1 1 40 40 ASN N N 40 114.713 114.713 119.556 -4.843 25974
875 1 6 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.331 -0.059 25974
876 1 6 . 1 1 40 40 ASN H H 40 9.532 9.532 8.827 0.705 25974
877 1 6 . 1 1 41 41 ASN N N 41 120.080 120.080 116.355 3.725 25974
878 1 6 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.617 0.100 25974
879 1 6 . 1 1 41 41 ASN H H 41 7.742 7.742 7.840 -0.098 25974
880 1 6 . 1 1 42 42 LYS N N 42 118.956 118.956 121.828 -2.872 25974
881 1 6 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.404 -0.058 25974
882 1 6 . 1 1 42 42 LYS H H 42 8.397 8.397 8.283 0.114 25974
883 1 6 . 1 1 43 43 CYS N N 43 112.235 112.235 120.597 -8.362 25974
884 1 6 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.435 -0.100 25974
885 1 6 . 1 1 43 43 CYS H H 43 7.397 7.397 8.653 -1.256 25974
886 1 6 . 1 1 44 44 THR N N 44 112.586 112.586 114.373 -1.787 25974
887 1 6 . 1 1 44 44 THR HA H 44 5.221 5.221 5.338 -0.117 25974
888 1 6 . 1 1 44 44 THR H H 44 8.674 8.674 8.206 0.468 25974
889 1 6 . 1 1 45 45 VAL N N 45 121.814 121.814 119.600 2.214 25974
890 1 6 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.446 -0.016 25974
891 1 6 . 1 1 45 45 VAL H H 45 8.555 8.555 8.839 -0.284 25974
892 1 6 . 1 1 46 46 ASP N N 46 126.626 126.626 128.282 -1.656 25974
893 1 6 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.980 0.354 25974
894 1 6 . 1 1 46 46 ASP H H 46 8.519 8.519 8.628 -0.109 25974
895 1 6 . 1 1 47 47 THR N N 47 114.334 114.334 119.072 -4.738 25974
896 1 6 . 1 1 47 47 THR HA H 47 4.187 4.187 4.507 -0.320 25974
897 1 6 . 1 1 47 47 THR H H 47 9.116 9.116 8.911 0.205 25974
898 1 6 . 1 1 48 48 TYR N N 48 124.010 124.010 121.096 2.914 25974
899 1 6 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.723 -0.349 25974
900 1 6 . 1 1 48 48 TYR H H 48 8.803 8.803 8.101 0.702 25974
901 1 6 . 1 1 49 49 ASN N N 49 113.668 113.668 115.450 -1.782 25974
902 1 6 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.718 -0.243 25974
903 1 6 . 1 1 49 49 ASN H H 49 7.433 7.433 8.003 -0.570 25974
904 1 6 . 1 1 50 50 ASN N N 50 117.403 117.403 118.328 -0.925 25974
905 1 6 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.482 -0.283 25974
906 1 6 . 1 1 50 50 ASN H H 50 7.863 7.863 7.974 -0.111 25974
907 1 6 . 1 1 51 51 ALA N N 51 121.102 121.102 123.349 -2.247 25974
908 1 6 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.601 -0.164 25974
909 1 6 . 1 1 51 51 ALA H H 51 7.853 7.853 7.444 0.409 25974
910 1 6 . 1 1 52 52 VAL N N 52 126.326 126.326 122.916 3.410 25974
911 1 6 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.927 -0.052 25974
912 1 6 . 1 1 52 52 VAL H H 52 8.297 8.297 8.220 0.077 25974
913 1 6 . 1 1 53 53 ASP N N 53 125.100 125.100 127.636 -2.536 25974
914 1 6 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.918 -0.123 25974
915 1 6 . 1 1 53 53 ASP H H 53 8.519 8.519 8.375 0.144 25974
916 1 6 . 1 1 54 54 CYS N N 54 126.377 126.377 117.988 8.389 25974
917 1 6 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.545 0.133 25974
918 1 6 . 1 1 54 54 CYS H H 54 8.609 8.609 8.474 0.135 25974
919 1 7 . 1 1 2 2 LYS N N 2 119.918 119.918 123.290 -3.372 25974
920 1 7 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.322 0.908 25974
921 1 7 . 1 1 2 2 LYS H H 2 8.167 8.167 7.874 0.293 25974
922 1 7 . 1 1 3 3 TYR N N 3 122.493 122.493 120.461 2.032 25974
923 1 7 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.821 -0.012 25974
924 1 7 . 1 1 3 3 TYR H H 3 8.939 8.939 8.742 0.197 25974
925 1 7 . 1 1 4 4 THR N N 4 117.297 117.297 117.267 0.030 25974
926 1 7 . 1 1 4 4 THR HA H 4 5.042 5.042 4.830 0.212 25974
927 1 7 . 1 1 4 4 THR H H 4 8.885 8.885 8.612 0.273 25974
928 1 7 . 1 1 5 5 GLY N N 5 115.452 115.452 112.646 2.806 25974
929 1 7 . 1 1 5 5 GLY H H 5 9.135 9.135 8.601 0.534 25974
930 1 7 . 1 1 6 6 LYS N N 6 121.001 121.001 116.895 4.106 25974
931 1 7 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.116 0.262 25974
932 1 7 . 1 1 6 6 LYS H H 6 8.422 8.422 8.434 -0.012 25974
933 1 7 . 1 1 7 7 CYS N N 7 122.647 122.647 117.604 5.043 25974
934 1 7 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.329 0.968 25974
935 1 7 . 1 1 7 7 CYS H H 7 9.767 9.767 9.064 0.703 25974
936 1 7 . 1 1 8 8 THR N N 8 113.493 113.493 113.766 -0.273 25974
937 1 7 . 1 1 8 8 THR HA H 8 4.704 4.704 4.841 -0.137 25974
938 1 7 . 1 1 8 8 THR H H 8 8.716 8.716 8.321 0.395 25974
939 1 7 . 1 1 9 9 LYS N N 9 127.640 127.640 126.516 1.124 25974
940 1 7 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.087 -0.594 25974
941 1 7 . 1 1 9 9 LYS H H 9 8.947 8.947 8.572 0.375 25974
942 1 7 . 1 1 10 10 SER N N 10 116.726 116.726 116.345 0.381 25974
943 1 7 . 1 1 10 10 SER HA H 10 4.006 4.006 4.236 -0.230 25974
944 1 7 . 1 1 10 10 SER H H 10 9.484 9.484 8.179 1.305 25974
945 1 7 . 1 1 11 11 LYS N N 11 116.973 116.973 118.600 -1.627 25974
946 1 7 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.410 -0.257 25974
947 1 7 . 1 1 11 11 LYS H H 11 7.051 7.051 8.247 -1.196 25974
948 1 7 . 1 1 12 12 ASN N N 12 120.652 120.652 118.570 2.082 25974
949 1 7 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.597 -0.031 25974
950 1 7 . 1 1 12 12 ASN H H 12 7.590 7.590 8.216 -0.626 25974
951 1 7 . 1 1 13 13 GLU N N 13 115.322 115.322 122.679 -7.357 25974
952 1 7 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.437 0.459 25974
953 1 7 . 1 1 13 13 GLU H H 13 7.290 7.290 8.378 -1.088 25974
954 1 7 . 1 1 14 14 CYS N N 14 123.345 123.345 126.025 -2.680 25974
955 1 7 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.636 0.003 25974
956 1 7 . 1 1 14 14 CYS H H 14 9.588 9.588 9.034 0.554 25974
957 1 7 . 1 1 15 15 LYS N N 15 110.722 110.722 130.062 -19.340 25974
958 1 7 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.106 -0.160 25974
959 1 7 . 1 1 15 15 LYS H H 15 8.636 8.636 8.931 -0.295 25974
960 1 7 . 1 1 16 16 TYR N N 16 126.630 126.630 118.126 8.504 25974
961 1 7 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.729 0.170 25974
962 1 7 . 1 1 16 16 TYR H H 16 8.998 8.998 8.367 0.631 25974
963 1 7 . 1 1 17 17 LYS N N 17 120.977 120.977 120.385 0.592 25974
964 1 7 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.751 -0.345 25974
965 1 7 . 1 1 17 17 LYS H H 17 8.421 8.421 8.205 0.216 25974
966 1 7 . 1 1 18 18 ASN N N 18 122.224 122.224 120.497 1.727 25974
967 1 7 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.652 -0.550 25974
968 1 7 . 1 1 18 18 ASN H H 18 7.735 7.735 8.171 -0.436 25974
969 1 7 . 1 1 19 19 ASP N N 19 117.436 117.436 120.393 -2.957 25974
970 1 7 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.246 0.138 25974
971 1 7 . 1 1 19 19 ASP H H 19 8.238 8.238 9.037 -0.799 25974
972 1 7 . 1 1 20 20 ALA N N 20 120.895 120.895 122.322 -1.427 25974
973 1 7 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.508 -0.099 25974
974 1 7 . 1 1 20 20 ALA H H 20 7.419 7.419 8.083 -0.664 25974
975 1 7 . 1 1 21 21 GLY N N 21 127.668 127.668 107.726 19.942 25974
976 1 7 . 1 1 21 21 GLY H H 21 8.170 8.170 7.747 0.423 25974
977 1 7 . 1 1 22 22 LYS N N 22 120.354 120.354 121.778 -1.424 25974
978 1 7 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.158 0.151 25974
979 1 7 . 1 1 22 22 LYS H H 22 7.682 7.682 7.784 -0.102 25974
980 1 7 . 1 1 23 23 ASP N N 23 126.398 126.398 125.458 0.940 25974
981 1 7 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.666 -0.410 25974
982 1 7 . 1 1 23 23 ASP H H 23 8.610 8.610 8.376 0.234 25974
983 1 7 . 1 1 24 24 THR N N 24 122.770 122.770 118.554 4.216 25974
984 1 7 . 1 1 24 24 THR HA H 24 4.012 4.012 4.397 -0.385 25974
985 1 7 . 1 1 24 24 THR H H 24 8.782 8.782 7.914 0.868 25974
986 1 7 . 1 1 25 25 PHE N N 25 122.423 122.423 122.247 0.176 25974
987 1 7 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.251 0.153 25974
988 1 7 . 1 1 25 25 PHE H H 25 8.328 8.328 8.615 -0.287 25974
989 1 7 . 1 1 26 26 ILE N N 26 123.029 123.029 123.784 -0.755 25974
990 1 7 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.670 -0.056 25974
991 1 7 . 1 1 26 26 ILE H H 26 9.138 9.138 9.225 -0.087 25974
992 1 7 . 1 1 27 27 LYS N N 27 127.077 127.077 129.012 -1.935 25974
993 1 7 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.247 -0.084 25974
994 1 7 . 1 1 27 27 LYS H H 27 8.335 8.335 8.415 -0.080 25974
995 1 7 . 1 1 28 28 CYS N N 28 120.248 120.248 120.781 -0.533 25974
996 1 7 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.809 -0.150 25974
997 1 7 . 1 1 28 28 CYS H H 28 8.618 8.618 8.710 -0.092 25974
998 1 7 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.336 0.090 25974
999 1 7 . 1 1 30 30 LYS N N 30 115.643 115.643 118.550 -2.907 25974
1000 1 7 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.828 0.121 25974
1001 1 7 . 1 1 30 30 LYS H H 30 8.002 8.002 8.148 -0.146 25974
1002 1 7 . 1 1 31 31 PHE N N 31 116.470 116.470 115.985 0.485 25974
1003 1 7 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.551 -0.047 25974
1004 1 7 . 1 1 31 31 PHE H H 31 6.308 6.308 7.544 -1.236 25974
1005 1 7 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.716 -0.572 25974
1006 1 7 . 1 1 33 33 ASN N N 33 113.110 113.110 116.317 -3.207 25974
1007 1 7 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.877 -0.204 25974
1008 1 7 . 1 1 33 33 ASN H H 33 8.564 8.564 8.049 0.515 25974
1009 1 7 . 1 1 34 34 LYS N N 34 120.347 120.347 118.367 1.980 25974
1010 1 7 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.455 0.529 25974
1011 1 7 . 1 1 34 34 LYS H H 34 7.914 7.914 8.146 -0.232 25974
1012 1 7 . 1 1 35 35 LYS N N 35 117.863 117.863 118.049 -0.186 25974
1013 1 7 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.370 0.238 25974
1014 1 7 . 1 1 35 35 LYS H H 35 7.005 7.005 7.647 -0.642 25974
1015 1 7 . 1 1 36 36 CYS N N 36 118.915 118.915 120.033 -1.118 25974
1016 1 7 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.679 0.178 25974
1017 1 7 . 1 1 36 36 CYS H H 36 8.817 8.817 8.606 0.211 25974
1018 1 7 . 1 1 37 37 THR N N 37 121.008 121.008 117.164 3.844 25974
1019 1 7 . 1 1 37 37 THR HA H 37 4.300 4.300 4.520 -0.220 25974
1020 1 7 . 1 1 37 37 THR H H 37 9.980 9.980 8.408 1.572 25974
1021 1 7 . 1 1 38 38 LYS N N 38 122.326 122.326 121.218 1.108 25974
1022 1 7 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.528 -0.391 25974
1023 1 7 . 1 1 38 38 LYS H H 38 7.287 7.287 7.655 -0.368 25974
1024 1 7 . 1 1 39 39 ASP N N 39 125.238 125.238 120.576 4.662 25974
1025 1 7 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.546 0.031 25974
1026 1 7 . 1 1 39 39 ASP H H 39 8.817 8.817 8.467 0.350 25974
1027 1 7 . 1 1 40 40 ASN N N 40 114.713 114.713 119.947 -5.234 25974
1028 1 7 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.279 -0.007 25974
1029 1 7 . 1 1 40 40 ASN H H 40 9.532 9.532 8.915 0.617 25974
1030 1 7 . 1 1 41 41 ASN N N 41 120.080 120.080 117.234 2.846 25974
1031 1 7 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.582 0.135 25974
1032 1 7 . 1 1 41 41 ASN H H 41 7.742 7.742 7.954 -0.212 25974
1033 1 7 . 1 1 42 42 LYS N N 42 118.956 118.956 120.067 -1.111 25974
1034 1 7 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.607 -0.261 25974
1035 1 7 . 1 1 42 42 LYS H H 42 8.397 8.397 8.403 -0.006 25974
1036 1 7 . 1 1 43 43 CYS N N 43 112.235 112.235 120.872 -8.637 25974
1037 1 7 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.765 -0.430 25974
1038 1 7 . 1 1 43 43 CYS H H 43 7.397 7.397 8.995 -1.598 25974
1039 1 7 . 1 1 44 44 THR N N 44 112.586 112.586 113.249 -0.663 25974
1040 1 7 . 1 1 44 44 THR HA H 44 5.221 5.221 4.844 0.377 25974
1041 1 7 . 1 1 44 44 THR H H 44 8.674 8.674 8.288 0.386 25974
1042 1 7 . 1 1 45 45 VAL N N 45 121.814 121.814 124.412 -2.598 25974
1043 1 7 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.294 0.136 25974
1044 1 7 . 1 1 45 45 VAL H H 45 8.555 8.555 8.614 -0.059 25974
1045 1 7 . 1 1 46 46 ASP N N 46 126.626 126.626 126.127 0.499 25974
1046 1 7 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.968 0.366 25974
1047 1 7 . 1 1 46 46 ASP H H 46 8.519 8.519 8.919 -0.400 25974
1048 1 7 . 1 1 47 47 THR N N 47 114.334 114.334 119.368 -5.034 25974
1049 1 7 . 1 1 47 47 THR HA H 47 4.187 4.187 4.467 -0.280 25974
1050 1 7 . 1 1 47 47 THR H H 47 9.116 9.116 8.664 0.452 25974
1051 1 7 . 1 1 48 48 TYR N N 48 124.010 124.010 120.765 3.245 25974
1052 1 7 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.689 -0.315 25974
1053 1 7 . 1 1 48 48 TYR H H 48 8.803 8.803 7.995 0.808 25974
1054 1 7 . 1 1 49 49 ASN N N 49 113.668 113.668 114.831 -1.163 25974
1055 1 7 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.659 -0.184 25974
1056 1 7 . 1 1 49 49 ASN H H 49 7.433 7.433 8.074 -0.641 25974
1057 1 7 . 1 1 50 50 ASN N N 50 117.403 117.403 118.739 -1.336 25974
1058 1 7 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.300 -0.101 25974
1059 1 7 . 1 1 50 50 ASN H H 50 7.863 7.863 8.141 -0.278 25974
1060 1 7 . 1 1 51 51 ALA N N 51 121.102 121.102 122.604 -1.502 25974
1061 1 7 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.534 -0.097 25974
1062 1 7 . 1 1 51 51 ALA H H 51 7.853 7.853 7.830 0.023 25974
1063 1 7 . 1 1 52 52 VAL N N 52 126.326 126.326 119.092 7.234 25974
1064 1 7 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.867 0.008 25974
1065 1 7 . 1 1 52 52 VAL H H 52 8.297 8.297 8.121 0.176 25974
1066 1 7 . 1 1 53 53 ASP N N 53 125.100 125.100 128.855 -3.755 25974
1067 1 7 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.059 -0.264 25974
1068 1 7 . 1 1 53 53 ASP H H 53 8.519 8.519 8.740 -0.221 25974
1069 1 7 . 1 1 54 54 CYS N N 54 126.377 126.377 123.836 2.541 25974
1070 1 7 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.461 0.217 25974
1071 1 7 . 1 1 54 54 CYS H H 54 8.609 8.609 8.425 0.184 25974
1072 1 8 . 1 1 2 2 LYS N N 2 119.918 119.918 121.227 -1.309 25974
1073 1 8 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.421 0.809 25974
1074 1 8 . 1 1 2 2 LYS H H 2 8.167 8.167 7.905 0.262 25974
1075 1 8 . 1 1 3 3 TYR N N 3 122.493 122.493 124.940 -2.447 25974
1076 1 8 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.787 0.022 25974
1077 1 8 . 1 1 3 3 TYR H H 3 8.939 8.939 9.212 -0.273 25974
1078 1 8 . 1 1 4 4 THR N N 4 117.297 117.297 116.667 0.630 25974
1079 1 8 . 1 1 4 4 THR HA H 4 5.042 5.042 4.557 0.485 25974
1080 1 8 . 1 1 4 4 THR H H 4 8.885 8.885 8.550 0.335 25974
1081 1 8 . 1 1 5 5 GLY N N 5 115.452 115.452 112.458 2.994 25974
1082 1 8 . 1 1 5 5 GLY H H 5 9.135 9.135 9.152 -0.017 25974
1083 1 8 . 1 1 6 6 LYS N N 6 121.001 121.001 117.441 3.560 25974
1084 1 8 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.031 0.347 25974
1085 1 8 . 1 1 6 6 LYS H H 6 8.422 8.422 8.090 0.332 25974
1086 1 8 . 1 1 7 7 CYS N N 7 122.647 122.647 116.314 6.333 25974
1087 1 8 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.605 0.692 25974
1088 1 8 . 1 1 7 7 CYS H H 7 9.767 9.767 8.913 0.854 25974
1089 1 8 . 1 1 8 8 THR N N 8 113.493 113.493 115.113 -1.620 25974
1090 1 8 . 1 1 8 8 THR HA H 8 4.704 4.704 5.015 -0.311 25974
1091 1 8 . 1 1 8 8 THR H H 8 8.716 8.716 8.137 0.579 25974
1092 1 8 . 1 1 9 9 LYS N N 9 127.640 127.640 126.703 0.937 25974
1093 1 8 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.068 -0.575 25974
1094 1 8 . 1 1 9 9 LYS H H 9 8.947 8.947 9.076 -0.129 25974
1095 1 8 . 1 1 10 10 SER N N 10 116.726 116.726 117.315 -0.589 25974
1096 1 8 . 1 1 10 10 SER HA H 10 4.006 4.006 4.229 -0.223 25974
1097 1 8 . 1 1 10 10 SER H H 10 9.484 9.484 8.212 1.272 25974
1098 1 8 . 1 1 11 11 LYS N N 11 116.973 116.973 118.739 -1.766 25974
1099 1 8 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.399 -0.246 25974
1100 1 8 . 1 1 11 11 LYS H H 11 7.051 7.051 8.113 -1.062 25974
1101 1 8 . 1 1 12 12 ASN N N 12 120.652 120.652 115.012 5.640 25974
1102 1 8 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.418 0.148 25974
1103 1 8 . 1 1 12 12 ASN H H 12 7.590 7.590 8.382 -0.792 25974
1104 1 8 . 1 1 13 13 GLU N N 13 115.322 115.322 119.057 -3.735 25974
1105 1 8 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.556 0.340 25974
1106 1 8 . 1 1 13 13 GLU H H 13 7.290 7.290 7.934 -0.644 25974
1107 1 8 . 1 1 14 14 CYS N N 14 123.345 123.345 127.015 -3.670 25974
1108 1 8 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.798 -0.159 25974
1109 1 8 . 1 1 14 14 CYS H H 14 9.588 9.588 8.743 0.845 25974
1110 1 8 . 1 1 15 15 LYS N N 15 110.722 110.722 128.058 -17.336 25974
1111 1 8 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.986 -0.040 25974
1112 1 8 . 1 1 15 15 LYS H H 15 8.636 8.636 8.684 -0.048 25974
1113 1 8 . 1 1 16 16 TYR N N 16 126.630 126.630 119.958 6.672 25974
1114 1 8 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.768 0.131 25974
1115 1 8 . 1 1 16 16 TYR H H 16 8.998 8.998 8.829 0.169 25974
1116 1 8 . 1 1 17 17 LYS N N 17 120.977 120.977 120.178 0.799 25974
1117 1 8 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.754 -0.348 25974
1118 1 8 . 1 1 17 17 LYS H H 17 8.421 8.421 8.216 0.205 25974
1119 1 8 . 1 1 18 18 ASN N N 18 122.224 122.224 120.675 1.549 25974
1120 1 8 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.530 -0.428 25974
1121 1 8 . 1 1 18 18 ASN H H 18 7.735 7.735 7.959 -0.224 25974
1122 1 8 . 1 1 19 19 ASP N N 19 117.436 117.436 121.166 -3.730 25974
1123 1 8 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.279 0.105 25974
1124 1 8 . 1 1 19 19 ASP H H 19 8.238 8.238 9.118 -0.880 25974
1125 1 8 . 1 1 20 20 ALA N N 20 120.895 120.895 121.202 -0.307 25974
1126 1 8 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.528 -0.119 25974
1127 1 8 . 1 1 20 20 ALA H H 20 7.419 7.419 8.185 -0.766 25974
1128 1 8 . 1 1 21 21 GLY N N 21 127.668 127.668 107.637 20.031 25974
1129 1 8 . 1 1 21 21 GLY H H 21 8.170 8.170 7.712 0.458 25974
1130 1 8 . 1 1 22 22 LYS N N 22 120.354 120.354 122.020 -1.666 25974
1131 1 8 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.192 0.117 25974
1132 1 8 . 1 1 22 22 LYS H H 22 7.682 7.682 7.858 -0.176 25974
1133 1 8 . 1 1 23 23 ASP N N 23 126.398 126.398 126.147 0.251 25974
1134 1 8 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.718 -0.462 25974
1135 1 8 . 1 1 23 23 ASP H H 23 8.610 8.610 8.439 0.171 25974
1136 1 8 . 1 1 24 24 THR N N 24 122.770 122.770 119.626 3.144 25974
1137 1 8 . 1 1 24 24 THR HA H 24 4.012 4.012 4.571 -0.559 25974
1138 1 8 . 1 1 24 24 THR H H 24 8.782 8.782 8.379 0.403 25974
1139 1 8 . 1 1 25 25 PHE N N 25 122.423 122.423 124.976 -2.553 25974
1140 1 8 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.885 0.519 25974
1141 1 8 . 1 1 25 25 PHE H H 25 8.328 8.328 8.794 -0.466 25974
1142 1 8 . 1 1 26 26 ILE N N 26 123.029 123.029 123.519 -0.490 25974
1143 1 8 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.606 0.008 25974
1144 1 8 . 1 1 26 26 ILE H H 26 9.138 9.138 8.931 0.207 25974
1145 1 8 . 1 1 27 27 LYS N N 27 127.077 127.077 127.588 -0.511 25974
1146 1 8 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.432 -0.269 25974
1147 1 8 . 1 1 27 27 LYS H H 27 8.335 8.335 8.347 -0.012 25974
1148 1 8 . 1 1 28 28 CYS N N 28 120.248 120.248 121.106 -0.858 25974
1149 1 8 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.836 -0.177 25974
1150 1 8 . 1 1 28 28 CYS H H 28 8.618 8.618 8.836 -0.218 25974
1151 1 8 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.396 0.030 25974
1152 1 8 . 1 1 30 30 LYS N N 30 115.643 115.643 118.465 -2.822 25974
1153 1 8 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.883 0.066 25974
1154 1 8 . 1 1 30 30 LYS H H 30 8.002 8.002 8.421 -0.419 25974
1155 1 8 . 1 1 31 31 PHE N N 31 116.470 116.470 117.743 -1.273 25974
1156 1 8 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.699 -0.195 25974
1157 1 8 . 1 1 31 31 PHE H H 31 6.308 6.308 7.523 -1.215 25974
1158 1 8 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.479 -0.335 25974
1159 1 8 . 1 1 33 33 ASN N N 33 113.110 113.110 115.072 -1.962 25974
1160 1 8 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.772 -0.099 25974
1161 1 8 . 1 1 33 33 ASN H H 33 8.564 8.564 8.164 0.400 25974
1162 1 8 . 1 1 34 34 LYS N N 34 120.347 120.347 118.963 1.384 25974
1163 1 8 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.535 0.449 25974
1164 1 8 . 1 1 34 34 LYS H H 34 7.914 7.914 8.042 -0.128 25974
1165 1 8 . 1 1 35 35 LYS N N 35 117.863 117.863 117.820 0.043 25974
1166 1 8 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.366 0.242 25974
1167 1 8 . 1 1 35 35 LYS H H 35 7.005 7.005 7.695 -0.690 25974
1168 1 8 . 1 1 36 36 CYS N N 36 118.915 118.915 120.243 -1.328 25974
1169 1 8 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.436 0.421 25974
1170 1 8 . 1 1 36 36 CYS H H 36 8.817 8.817 8.565 0.252 25974
1171 1 8 . 1 1 37 37 THR N N 37 121.008 121.008 115.909 5.099 25974
1172 1 8 . 1 1 37 37 THR HA H 37 4.300 4.300 4.472 -0.172 25974
1173 1 8 . 1 1 37 37 THR H H 37 9.980 9.980 8.419 1.561 25974
1174 1 8 . 1 1 38 38 LYS N N 38 122.326 122.326 120.545 1.781 25974
1175 1 8 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.475 -0.338 25974
1176 1 8 . 1 1 38 38 LYS H H 38 7.287 7.287 7.647 -0.360 25974
1177 1 8 . 1 1 39 39 ASP N N 39 125.238 125.238 121.650 3.588 25974
1178 1 8 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.914 -0.336 25974
1179 1 8 . 1 1 39 39 ASP H H 39 8.817 8.817 8.556 0.261 25974
1180 1 8 . 1 1 40 40 ASN N N 40 114.713 114.713 120.341 -5.628 25974
1181 1 8 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.236 0.036 25974
1182 1 8 . 1 1 40 40 ASN H H 40 9.532 9.532 8.681 0.851 25974
1183 1 8 . 1 1 41 41 ASN N N 41 120.080 120.080 117.997 2.083 25974
1184 1 8 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.579 0.138 25974
1185 1 8 . 1 1 41 41 ASN H H 41 7.742 7.742 7.663 0.079 25974
1186 1 8 . 1 1 42 42 LYS N N 42 118.956 118.956 120.329 -1.373 25974
1187 1 8 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.508 -0.162 25974
1188 1 8 . 1 1 42 42 LYS H H 42 8.397 8.397 8.368 0.029 25974
1189 1 8 . 1 1 43 43 CYS N N 43 112.235 112.235 121.447 -9.212 25974
1190 1 8 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.499 -0.164 25974
1191 1 8 . 1 1 43 43 CYS H H 43 7.397 7.397 8.768 -1.371 25974
1192 1 8 . 1 1 44 44 THR N N 44 112.586 112.586 116.478 -3.892 25974
1193 1 8 . 1 1 44 44 THR HA H 44 5.221 5.221 5.049 0.172 25974
1194 1 8 . 1 1 44 44 THR H H 44 8.674 8.674 8.255 0.419 25974
1195 1 8 . 1 1 45 45 VAL N N 45 121.814 121.814 125.456 -3.642 25974
1196 1 8 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.328 0.102 25974
1197 1 8 . 1 1 45 45 VAL H H 45 8.555 8.555 8.515 0.040 25974
1198 1 8 . 1 1 46 46 ASP N N 46 126.626 126.626 125.185 1.441 25974
1199 1 8 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.125 0.209 25974
1200 1 8 . 1 1 46 46 ASP H H 46 8.519 8.519 8.804 -0.285 25974
1201 1 8 . 1 1 47 47 THR N N 47 114.334 114.334 120.606 -6.272 25974
1202 1 8 . 1 1 47 47 THR HA H 47 4.187 4.187 4.425 -0.238 25974
1203 1 8 . 1 1 47 47 THR H H 47 9.116 9.116 9.067 0.049 25974
1204 1 8 . 1 1 48 48 TYR N N 48 124.010 124.010 121.105 2.905 25974
1205 1 8 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.392 -0.018 25974
1206 1 8 . 1 1 48 48 TYR H H 48 8.803 8.803 8.516 0.287 25974
1207 1 8 . 1 1 49 49 ASN N N 49 113.668 113.668 115.135 -1.467 25974
1208 1 8 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.686 -0.211 25974
1209 1 8 . 1 1 49 49 ASN H H 49 7.433 7.433 7.987 -0.554 25974
1210 1 8 . 1 1 50 50 ASN N N 50 117.403 117.403 117.361 0.042 25974
1211 1 8 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.388 -0.189 25974
1212 1 8 . 1 1 50 50 ASN H H 50 7.863 7.863 7.957 -0.094 25974
1213 1 8 . 1 1 51 51 ALA N N 51 121.102 121.102 122.867 -1.765 25974
1214 1 8 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.431 0.006 25974
1215 1 8 . 1 1 51 51 ALA H H 51 7.853 7.853 8.227 -0.374 25974
1216 1 8 . 1 1 52 52 VAL N N 52 126.326 126.326 117.811 8.515 25974
1217 1 8 . 1 1 52 52 VAL HA H 52 4.875 4.875 5.050 -0.175 25974
1218 1 8 . 1 1 52 52 VAL H H 52 8.297 8.297 8.161 0.136 25974
1219 1 8 . 1 1 53 53 ASP N N 53 125.100 125.100 127.435 -2.335 25974
1220 1 8 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.121 -0.326 25974
1221 1 8 . 1 1 53 53 ASP H H 53 8.519 8.519 8.558 -0.039 25974
1222 1 8 . 1 1 54 54 CYS N N 54 126.377 126.377 120.065 6.312 25974
1223 1 8 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.317 0.361 25974
1224 1 8 . 1 1 54 54 CYS H H 54 8.609 8.609 8.527 0.082 25974
1225 1 9 . 1 1 2 2 LYS N N 2 119.918 119.918 118.342 1.576 25974
1226 1 9 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.287 0.943 25974
1227 1 9 . 1 1 2 2 LYS H H 2 8.167 8.167 8.012 0.155 25974
1228 1 9 . 1 1 3 3 TYR N N 3 122.493 122.493 119.722 2.771 25974
1229 1 9 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.741 0.068 25974
1230 1 9 . 1 1 3 3 TYR H H 3 8.939 8.939 8.956 -0.017 25974
1231 1 9 . 1 1 4 4 THR N N 4 117.297 117.297 116.600 0.697 25974
1232 1 9 . 1 1 4 4 THR HA H 4 5.042 5.042 4.574 0.468 25974
1233 1 9 . 1 1 4 4 THR H H 4 8.885 8.885 8.527 0.358 25974
1234 1 9 . 1 1 5 5 GLY N N 5 115.452 115.452 112.691 2.761 25974
1235 1 9 . 1 1 5 5 GLY H H 5 9.135 9.135 9.085 0.050 25974
1236 1 9 . 1 1 6 6 LYS N N 6 121.001 121.001 117.171 3.830 25974
1237 1 9 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.187 0.191 25974
1238 1 9 . 1 1 6 6 LYS H H 6 8.422 8.422 7.935 0.487 25974
1239 1 9 . 1 1 7 7 CYS N N 7 122.647 122.647 117.156 5.491 25974
1240 1 9 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.404 0.893 25974
1241 1 9 . 1 1 7 7 CYS H H 7 9.767 9.767 8.920 0.847 25974
1242 1 9 . 1 1 8 8 THR N N 8 113.493 113.493 114.384 -0.891 25974
1243 1 9 . 1 1 8 8 THR HA H 8 4.704 4.704 4.864 -0.160 25974
1244 1 9 . 1 1 8 8 THR H H 8 8.716 8.716 8.181 0.535 25974
1245 1 9 . 1 1 9 9 LYS N N 9 127.640 127.640 125.996 1.644 25974
1246 1 9 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.258 -0.765 25974
1247 1 9 . 1 1 9 9 LYS H H 9 8.947 8.947 8.631 0.316 25974
1248 1 9 . 1 1 10 10 SER N N 10 116.726 116.726 115.482 1.244 25974
1249 1 9 . 1 1 10 10 SER HA H 10 4.006 4.006 4.218 -0.212 25974
1250 1 9 . 1 1 10 10 SER H H 10 9.484 9.484 7.998 1.486 25974
1251 1 9 . 1 1 11 11 LYS N N 11 116.973 116.973 119.131 -2.158 25974
1252 1 9 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.382 -0.229 25974
1253 1 9 . 1 1 11 11 LYS H H 11 7.051 7.051 8.225 -1.174 25974
1254 1 9 . 1 1 12 12 ASN N N 12 120.652 120.652 118.714 1.938 25974
1255 1 9 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.470 0.096 25974
1256 1 9 . 1 1 12 12 ASN H H 12 7.590 7.590 8.106 -0.516 25974
1257 1 9 . 1 1 13 13 GLU N N 13 115.322 115.322 122.741 -7.419 25974
1258 1 9 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.443 0.453 25974
1259 1 9 . 1 1 13 13 GLU H H 13 7.290 7.290 8.374 -1.084 25974
1260 1 9 . 1 1 14 14 CYS N N 14 123.345 123.345 126.167 -2.822 25974
1261 1 9 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.652 -0.013 25974
1262 1 9 . 1 1 14 14 CYS H H 14 9.588 9.588 8.909 0.679 25974
1263 1 9 . 1 1 15 15 LYS N N 15 110.722 110.722 130.483 -19.761 25974
1264 1 9 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.212 -0.266 25974
1265 1 9 . 1 1 15 15 LYS H H 15 8.636 8.636 9.019 -0.383 25974
1266 1 9 . 1 1 16 16 TYR N N 16 126.630 126.630 120.133 6.497 25974
1267 1 9 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.816 0.083 25974
1268 1 9 . 1 1 16 16 TYR H H 16 8.998 8.998 8.697 0.301 25974
1269 1 9 . 1 1 17 17 LYS N N 17 120.977 120.977 119.832 1.145 25974
1270 1 9 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.679 -0.273 25974
1271 1 9 . 1 1 17 17 LYS H H 17 8.421 8.421 8.087 0.334 25974
1272 1 9 . 1 1 18 18 ASN N N 18 122.224 122.224 120.720 1.504 25974
1273 1 9 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.645 -0.543 25974
1274 1 9 . 1 1 18 18 ASN H H 18 7.735 7.735 8.109 -0.374 25974
1275 1 9 . 1 1 19 19 ASP N N 19 117.436 117.436 119.783 -2.347 25974
1276 1 9 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.318 0.066 25974
1277 1 9 . 1 1 19 19 ASP H H 19 8.238 8.238 8.986 -0.748 25974
1278 1 9 . 1 1 20 20 ALA N N 20 120.895 120.895 122.123 -1.228 25974
1279 1 9 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.520 -0.111 25974
1280 1 9 . 1 1 20 20 ALA H H 20 7.419 7.419 8.344 -0.925 25974
1281 1 9 . 1 1 21 21 GLY N N 21 127.668 127.668 107.318 20.350 25974
1282 1 9 . 1 1 21 21 GLY H H 21 8.170 8.170 7.829 0.341 25974
1283 1 9 . 1 1 22 22 LYS N N 22 120.354 120.354 122.434 -2.080 25974
1284 1 9 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.065 0.244 25974
1285 1 9 . 1 1 22 22 LYS H H 22 7.682 7.682 7.795 -0.113 25974
1286 1 9 . 1 1 23 23 ASP N N 23 126.398 126.398 125.603 0.795 25974
1287 1 9 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.725 -0.469 25974
1288 1 9 . 1 1 23 23 ASP H H 23 8.610 8.610 8.484 0.126 25974
1289 1 9 . 1 1 24 24 THR N N 24 122.770 122.770 120.142 2.628 25974
1290 1 9 . 1 1 24 24 THR HA H 24 4.012 4.012 4.357 -0.345 25974
1291 1 9 . 1 1 24 24 THR H H 24 8.782 8.782 8.254 0.528 25974
1292 1 9 . 1 1 25 25 PHE N N 25 122.423 122.423 123.061 -0.638 25974
1293 1 9 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.408 -0.004 25974
1294 1 9 . 1 1 25 25 PHE H H 25 8.328 8.328 8.556 -0.228 25974
1295 1 9 . 1 1 26 26 ILE N N 26 123.029 123.029 122.184 0.845 25974
1296 1 9 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.557 0.057 25974
1297 1 9 . 1 1 26 26 ILE H H 26 9.138 9.138 9.089 0.049 25974
1298 1 9 . 1 1 27 27 LYS N N 27 127.077 127.077 128.587 -1.510 25974
1299 1 9 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.260 -0.097 25974
1300 1 9 . 1 1 27 27 LYS H H 27 8.335 8.335 8.345 -0.010 25974
1301 1 9 . 1 1 28 28 CYS N N 28 120.248 120.248 121.605 -1.357 25974
1302 1 9 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.741 -0.082 25974
1303 1 9 . 1 1 28 28 CYS H H 28 8.618 8.618 8.438 0.180 25974
1304 1 9 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.370 0.056 25974
1305 1 9 . 1 1 30 30 LYS N N 30 115.643 115.643 119.054 -3.411 25974
1306 1 9 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.862 0.087 25974
1307 1 9 . 1 1 30 30 LYS H H 30 8.002 8.002 8.327 -0.325 25974
1308 1 9 . 1 1 31 31 PHE N N 31 116.470 116.470 116.198 0.272 25974
1309 1 9 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.585 -0.081 25974
1310 1 9 . 1 1 31 31 PHE H H 31 6.308 6.308 7.319 -1.011 25974
1311 1 9 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.797 -0.653 25974
1312 1 9 . 1 1 33 33 ASN N N 33 113.110 113.110 115.856 -2.746 25974
1313 1 9 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.835 -0.162 25974
1314 1 9 . 1 1 33 33 ASN H H 33 8.564 8.564 8.544 0.020 25974
1315 1 9 . 1 1 34 34 LYS N N 34 120.347 120.347 118.517 1.830 25974
1316 1 9 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.466 0.518 25974
1317 1 9 . 1 1 34 34 LYS H H 34 7.914 7.914 8.274 -0.360 25974
1318 1 9 . 1 1 35 35 LYS N N 35 117.863 117.863 119.279 -1.416 25974
1319 1 9 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.193 0.415 25974
1320 1 9 . 1 1 35 35 LYS H H 35 7.005 7.005 7.700 -0.695 25974
1321 1 9 . 1 1 36 36 CYS N N 36 118.915 118.915 120.597 -1.682 25974
1322 1 9 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.304 0.553 25974
1323 1 9 . 1 1 36 36 CYS H H 36 8.817 8.817 8.607 0.210 25974
1324 1 9 . 1 1 37 37 THR N N 37 121.008 121.008 120.574 0.434 25974
1325 1 9 . 1 1 37 37 THR HA H 37 4.300 4.300 4.416 -0.116 25974
1326 1 9 . 1 1 37 37 THR H H 37 9.980 9.980 8.884 1.096 25974
1327 1 9 . 1 1 38 38 LYS N N 38 122.326 122.326 120.259 2.067 25974
1328 1 9 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.464 -0.327 25974
1329 1 9 . 1 1 38 38 LYS H H 38 7.287 7.287 7.665 -0.378 25974
1330 1 9 . 1 1 39 39 ASP N N 39 125.238 125.238 120.216 5.022 25974
1331 1 9 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.564 0.014 25974
1332 1 9 . 1 1 39 39 ASP H H 39 8.817 8.817 8.560 0.257 25974
1333 1 9 . 1 1 40 40 ASN N N 40 114.713 114.713 119.690 -4.977 25974
1334 1 9 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.315 -0.043 25974
1335 1 9 . 1 1 40 40 ASN H H 40 9.532 9.532 8.868 0.664 25974
1336 1 9 . 1 1 41 41 ASN N N 41 120.080 120.080 117.069 3.011 25974
1337 1 9 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.597 0.120 25974
1338 1 9 . 1 1 41 41 ASN H H 41 7.742 7.742 7.985 -0.243 25974
1339 1 9 . 1 1 42 42 LYS N N 42 118.956 118.956 120.989 -2.033 25974
1340 1 9 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.556 -0.210 25974
1341 1 9 . 1 1 42 42 LYS H H 42 8.397 8.397 8.372 0.025 25974
1342 1 9 . 1 1 43 43 CYS N N 43 112.235 112.235 122.109 -9.874 25974
1343 1 9 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.389 -0.054 25974
1344 1 9 . 1 1 43 43 CYS H H 43 7.397 7.397 8.638 -1.241 25974
1345 1 9 . 1 1 44 44 THR N N 44 112.586 112.586 116.598 -4.012 25974
1346 1 9 . 1 1 44 44 THR HA H 44 5.221 5.221 4.996 0.225 25974
1347 1 9 . 1 1 44 44 THR H H 44 8.674 8.674 8.322 0.352 25974
1348 1 9 . 1 1 45 45 VAL N N 45 121.814 121.814 122.137 -0.323 25974
1349 1 9 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.465 -0.035 25974
1350 1 9 . 1 1 45 45 VAL H H 45 8.555 8.555 8.771 -0.216 25974
1351 1 9 . 1 1 46 46 ASP N N 46 126.626 126.626 124.903 1.723 25974
1352 1 9 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.037 0.297 25974
1353 1 9 . 1 1 46 46 ASP H H 46 8.519 8.519 8.771 -0.252 25974
1354 1 9 . 1 1 47 47 THR N N 47 114.334 114.334 119.307 -4.973 25974
1355 1 9 . 1 1 47 47 THR HA H 47 4.187 4.187 4.599 -0.412 25974
1356 1 9 . 1 1 47 47 THR H H 47 9.116 9.116 8.783 0.333 25974
1357 1 9 . 1 1 48 48 TYR N N 48 124.010 124.010 121.141 2.869 25974
1358 1 9 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.603 -0.229 25974
1359 1 9 . 1 1 48 48 TYR H H 48 8.803 8.803 7.961 0.842 25974
1360 1 9 . 1 1 49 49 ASN N N 49 113.668 113.668 117.945 -4.277 25974
1361 1 9 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.668 -0.193 25974
1362 1 9 . 1 1 49 49 ASN H H 49 7.433 7.433 8.290 -0.857 25974
1363 1 9 . 1 1 50 50 ASN N N 50 117.403 117.403 117.532 -0.129 25974
1364 1 9 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.433 -0.234 25974
1365 1 9 . 1 1 50 50 ASN H H 50 7.863 7.863 8.297 -0.434 25974
1366 1 9 . 1 1 51 51 ALA N N 51 121.102 121.102 122.586 -1.484 25974
1367 1 9 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.651 -0.214 25974
1368 1 9 . 1 1 51 51 ALA H H 51 7.853 7.853 7.379 0.474 25974
1369 1 9 . 1 1 52 52 VAL N N 52 126.326 126.326 119.608 6.718 25974
1370 1 9 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.938 -0.063 25974
1371 1 9 . 1 1 52 52 VAL H H 52 8.297 8.297 8.317 -0.020 25974
1372 1 9 . 1 1 53 53 ASP N N 53 125.100 125.100 125.565 -0.465 25974
1373 1 9 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.056 -0.261 25974
1374 1 9 . 1 1 53 53 ASP H H 53 8.519 8.519 8.774 -0.255 25974
1375 1 9 . 1 1 54 54 CYS N N 54 126.377 126.377 118.364 8.013 25974
1376 1 9 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.439 0.239 25974
1377 1 9 . 1 1 54 54 CYS H H 54 8.609 8.609 8.164 0.445 25974
1378 1 10 . 1 1 2 2 LYS N N 2 119.918 119.918 119.830 0.088 25974
1379 1 10 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.394 0.836 25974
1380 1 10 . 1 1 2 2 LYS H H 2 8.167 8.167 7.552 0.615 25974
1381 1 10 . 1 1 3 3 TYR N N 3 122.493 122.493 123.592 -1.099 25974
1382 1 10 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.566 0.243 25974
1383 1 10 . 1 1 3 3 TYR H H 3 8.939 8.939 8.062 0.877 25974
1384 1 10 . 1 1 4 4 THR N N 4 117.297 117.297 120.181 -2.884 25974
1385 1 10 . 1 1 4 4 THR HA H 4 5.042 5.042 4.467 0.575 25974
1386 1 10 . 1 1 4 4 THR H H 4 8.885 8.885 8.685 0.200 25974
1387 1 10 . 1 1 5 5 GLY N N 5 115.452 115.452 114.069 1.383 25974
1388 1 10 . 1 1 5 5 GLY H H 5 9.135 9.135 8.834 0.301 25974
1389 1 10 . 1 1 6 6 LYS N N 6 121.001 121.001 116.892 4.109 25974
1390 1 10 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.171 0.207 25974
1391 1 10 . 1 1 6 6 LYS H H 6 8.422 8.422 7.984 0.438 25974
1392 1 10 . 1 1 7 7 CYS N N 7 122.647 122.647 117.420 5.227 25974
1393 1 10 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.310 0.987 25974
1394 1 10 . 1 1 7 7 CYS H H 7 9.767 9.767 8.794 0.973 25974
1395 1 10 . 1 1 8 8 THR N N 8 113.493 113.493 114.514 -1.021 25974
1396 1 10 . 1 1 8 8 THR HA H 8 4.704 4.704 4.787 -0.083 25974
1397 1 10 . 1 1 8 8 THR H H 8 8.716 8.716 8.311 0.405 25974
1398 1 10 . 1 1 9 9 LYS N N 9 127.640 127.640 126.543 1.097 25974
1399 1 10 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.092 -0.599 25974
1400 1 10 . 1 1 9 9 LYS H H 9 8.947 8.947 8.619 0.328 25974
1401 1 10 . 1 1 10 10 SER N N 10 116.726 116.726 115.931 0.795 25974
1402 1 10 . 1 1 10 10 SER HA H 10 4.006 4.006 4.243 -0.237 25974
1403 1 10 . 1 1 10 10 SER H H 10 9.484 9.484 8.175 1.309 25974
1404 1 10 . 1 1 11 11 LYS N N 11 116.973 116.973 117.896 -0.923 25974
1405 1 10 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.480 -0.327 25974
1406 1 10 . 1 1 11 11 LYS H H 11 7.051 7.051 8.300 -1.249 25974
1407 1 10 . 1 1 12 12 ASN N N 12 120.652 120.652 118.343 2.309 25974
1408 1 10 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.590 -0.024 25974
1409 1 10 . 1 1 12 12 ASN H H 12 7.590 7.590 8.248 -0.658 25974
1410 1 10 . 1 1 13 13 GLU N N 13 115.322 115.322 122.635 -7.313 25974
1411 1 10 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.482 0.414 25974
1412 1 10 . 1 1 13 13 GLU H H 13 7.290 7.290 8.464 -1.174 25974
1413 1 10 . 1 1 14 14 CYS N N 14 123.345 123.345 125.232 -1.887 25974
1414 1 10 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.667 -0.028 25974
1415 1 10 . 1 1 14 14 CYS H H 14 9.588 9.588 8.833 0.755 25974
1416 1 10 . 1 1 15 15 LYS N N 15 110.722 110.722 130.405 -19.683 25974
1417 1 10 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.827 0.119 25974
1418 1 10 . 1 1 15 15 LYS H H 15 8.636 8.636 8.985 -0.349 25974
1419 1 10 . 1 1 16 16 TYR N N 16 126.630 126.630 118.987 7.643 25974
1420 1 10 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.758 0.141 25974
1421 1 10 . 1 1 16 16 TYR H H 16 8.998 8.998 8.597 0.401 25974
1422 1 10 . 1 1 17 17 LYS N N 17 120.977 120.977 120.798 0.179 25974
1423 1 10 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.197 0.209 25974
1424 1 10 . 1 1 17 17 LYS H H 17 8.421 8.421 8.374 0.047 25974
1425 1 10 . 1 1 18 18 ASN N N 18 122.224 122.224 121.092 1.132 25974
1426 1 10 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.403 -0.301 25974
1427 1 10 . 1 1 18 18 ASN H H 18 7.735 7.735 8.235 -0.500 25974
1428 1 10 . 1 1 19 19 ASP N N 19 117.436 117.436 122.944 -5.508 25974
1429 1 10 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.371 0.013 25974
1430 1 10 . 1 1 19 19 ASP H H 19 8.238 8.238 8.587 -0.349 25974
1431 1 10 . 1 1 20 20 ALA N N 20 120.895 120.895 117.735 3.160 25974
1432 1 10 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.398 0.011 25974
1433 1 10 . 1 1 20 20 ALA H H 20 7.419 7.419 7.959 -0.540 25974
1434 1 10 . 1 1 21 21 GLY N N 21 127.668 127.668 105.648 22.020 25974
1435 1 10 . 1 1 21 21 GLY H H 21 8.170 8.170 7.857 0.313 25974
1436 1 10 . 1 1 22 22 LYS N N 22 120.354 120.354 122.425 -2.071 25974
1437 1 10 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.350 -0.041 25974
1438 1 10 . 1 1 22 22 LYS H H 22 7.682 7.682 7.811 -0.129 25974
1439 1 10 . 1 1 23 23 ASP N N 23 126.398 126.398 127.430 -1.032 25974
1440 1 10 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.510 -0.254 25974
1441 1 10 . 1 1 23 23 ASP H H 23 8.610 8.610 8.521 0.089 25974
1442 1 10 . 1 1 24 24 THR N N 24 122.770 122.770 119.184 3.586 25974
1443 1 10 . 1 1 24 24 THR HA H 24 4.012 4.012 4.517 -0.505 25974
1444 1 10 . 1 1 24 24 THR H H 24 8.782 8.782 7.886 0.896 25974
1445 1 10 . 1 1 25 25 PHE N N 25 122.423 122.423 124.413 -1.990 25974
1446 1 10 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.079 0.325 25974
1447 1 10 . 1 1 25 25 PHE H H 25 8.328 8.328 8.757 -0.429 25974
1448 1 10 . 1 1 26 26 ILE N N 26 123.029 123.029 124.037 -1.008 25974
1449 1 10 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.644 -0.030 25974
1450 1 10 . 1 1 26 26 ILE H H 26 9.138 9.138 9.227 -0.089 25974
1451 1 10 . 1 1 27 27 LYS N N 27 127.077 127.077 126.927 0.150 25974
1452 1 10 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.230 -0.067 25974
1453 1 10 . 1 1 27 27 LYS H H 27 8.335 8.335 8.401 -0.066 25974
1454 1 10 . 1 1 28 28 CYS N N 28 120.248 120.248 121.364 -1.116 25974
1455 1 10 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.699 -0.040 25974
1456 1 10 . 1 1 28 28 CYS H H 28 8.618 8.618 8.755 -0.137 25974
1457 1 10 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.315 0.111 25974
1458 1 10 . 1 1 30 30 LYS N N 30 115.643 115.643 117.912 -2.269 25974
1459 1 10 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.895 0.054 25974
1460 1 10 . 1 1 30 30 LYS H H 30 8.002 8.002 8.276 -0.274 25974
1461 1 10 . 1 1 31 31 PHE N N 31 116.470 116.470 117.076 -0.606 25974
1462 1 10 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.605 -0.101 25974
1463 1 10 . 1 1 31 31 PHE H H 31 6.308 6.308 7.560 -1.252 25974
1464 1 10 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.698 -0.554 25974
1465 1 10 . 1 1 33 33 ASN N N 33 113.110 113.110 116.727 -3.617 25974
1466 1 10 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.827 -0.154 25974
1467 1 10 . 1 1 33 33 ASN H H 33 8.564 8.564 8.079 0.485 25974
1468 1 10 . 1 1 34 34 LYS N N 34 120.347 120.347 119.803 0.544 25974
1469 1 10 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.381 0.603 25974
1470 1 10 . 1 1 34 34 LYS H H 34 7.914 7.914 8.191 -0.277 25974
1471 1 10 . 1 1 35 35 LYS N N 35 117.863 117.863 117.643 0.220 25974
1472 1 10 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.333 0.275 25974
1473 1 10 . 1 1 35 35 LYS H H 35 7.005 7.005 7.634 -0.629 25974
1474 1 10 . 1 1 36 36 CYS N N 36 118.915 118.915 120.042 -1.127 25974
1475 1 10 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.348 0.509 25974
1476 1 10 . 1 1 36 36 CYS H H 36 8.817 8.817 8.548 0.269 25974
1477 1 10 . 1 1 37 37 THR N N 37 121.008 121.008 116.338 4.670 25974
1478 1 10 . 1 1 37 37 THR HA H 37 4.300 4.300 4.397 -0.097 25974
1479 1 10 . 1 1 37 37 THR H H 37 9.980 9.980 8.306 1.674 25974
1480 1 10 . 1 1 38 38 LYS N N 38 122.326 122.326 120.283 2.043 25974
1481 1 10 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.460 -0.323 25974
1482 1 10 . 1 1 38 38 LYS H H 38 7.287 7.287 7.684 -0.397 25974
1483 1 10 . 1 1 39 39 ASP N N 39 125.238 125.238 120.836 4.402 25974
1484 1 10 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.535 0.043 25974
1485 1 10 . 1 1 39 39 ASP H H 39 8.817 8.817 8.485 0.332 25974
1486 1 10 . 1 1 40 40 ASN N N 40 114.713 114.713 120.620 -5.907 25974
1487 1 10 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.296 -0.024 25974
1488 1 10 . 1 1 40 40 ASN H H 40 9.532 9.532 8.921 0.610 25974
1489 1 10 . 1 1 41 41 ASN N N 41 120.080 120.080 116.439 3.641 25974
1490 1 10 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.697 0.020 25974
1491 1 10 . 1 1 41 41 ASN H H 41 7.742 7.742 7.990 -0.248 25974
1492 1 10 . 1 1 42 42 LYS N N 42 118.956 118.956 118.991 -0.035 25974
1493 1 10 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.628 -0.282 25974
1494 1 10 . 1 1 42 42 LYS H H 42 8.397 8.397 8.350 0.047 25974
1495 1 10 . 1 1 43 43 CYS N N 43 112.235 112.235 119.384 -7.149 25974
1496 1 10 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.421 -0.087 25974
1497 1 10 . 1 1 43 43 CYS H H 43 7.397 7.397 8.808 -1.411 25974
1498 1 10 . 1 1 44 44 THR N N 44 112.586 112.586 114.895 -2.309 25974
1499 1 10 . 1 1 44 44 THR HA H 44 5.221 5.221 5.365 -0.144 25974
1500 1 10 . 1 1 44 44 THR H H 44 8.674 8.674 7.876 0.798 25974
1501 1 10 . 1 1 45 45 VAL N N 45 121.814 121.814 118.118 3.696 25974
1502 1 10 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.475 -0.045 25974
1503 1 10 . 1 1 45 45 VAL H H 45 8.555 8.555 8.610 -0.055 25974
1504 1 10 . 1 1 46 46 ASP N N 46 126.626 126.626 126.187 0.439 25974
1505 1 10 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.001 0.333 25974
1506 1 10 . 1 1 46 46 ASP H H 46 8.519 8.519 8.769 -0.250 25974
1507 1 10 . 1 1 47 47 THR N N 47 114.334 114.334 121.895 -7.561 25974
1508 1 10 . 1 1 47 47 THR HA H 47 4.187 4.187 4.400 -0.213 25974
1509 1 10 . 1 1 47 47 THR H H 47 9.116 9.116 8.913 0.203 25974
1510 1 10 . 1 1 48 48 TYR N N 48 124.010 124.010 122.870 1.140 25974
1511 1 10 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.449 -0.075 25974
1512 1 10 . 1 1 48 48 TYR H H 48 8.803 8.803 8.046 0.757 25974
1513 1 10 . 1 1 49 49 ASN N N 49 113.668 113.668 113.774 -0.106 25974
1514 1 10 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.695 -0.220 25974
1515 1 10 . 1 1 49 49 ASN H H 49 7.433 7.433 7.983 -0.550 25974
1516 1 10 . 1 1 50 50 ASN N N 50 117.403 117.403 119.047 -1.644 25974
1517 1 10 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.393 -0.194 25974
1518 1 10 . 1 1 50 50 ASN H H 50 7.863 7.863 8.171 -0.308 25974
1519 1 10 . 1 1 51 51 ALA N N 51 121.102 121.102 122.671 -1.569 25974
1520 1 10 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.697 -0.260 25974
1521 1 10 . 1 1 51 51 ALA H H 51 7.853 7.853 7.651 0.202 25974
1522 1 10 . 1 1 52 52 VAL N N 52 126.326 126.326 122.637 3.689 25974
1523 1 10 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.579 0.296 25974
1524 1 10 . 1 1 52 52 VAL H H 52 8.297 8.297 8.582 -0.285 25974
1525 1 10 . 1 1 53 53 ASP N N 53 125.100 125.100 129.355 -4.255 25974
1526 1 10 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.994 -0.199 25974
1527 1 10 . 1 1 53 53 ASP H H 53 8.519 8.519 8.309 0.210 25974
1528 1 10 . 1 1 54 54 CYS N N 54 126.377 126.377 119.301 7.076 25974
1529 1 10 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.324 0.354 25974
1530 1 10 . 1 1 54 54 CYS H H 54 8.609 8.609 8.117 0.492 25974
1531 1 11 . 1 1 2 2 LYS N N 2 119.918 119.918 120.146 -0.228 25974
1532 1 11 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.658 0.572 25974
1533 1 11 . 1 1 2 2 LYS H H 2 8.167 8.167 7.830 0.337 25974
1534 1 11 . 1 1 3 3 TYR N N 3 122.493 122.493 120.054 2.439 25974
1535 1 11 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.780 0.029 25974
1536 1 11 . 1 1 3 3 TYR H H 3 8.939 8.939 9.102 -0.163 25974
1537 1 11 . 1 1 4 4 THR N N 4 117.297 117.297 116.129 1.168 25974
1538 1 11 . 1 1 4 4 THR HA H 4 5.042 5.042 4.657 0.385 25974
1539 1 11 . 1 1 4 4 THR H H 4 8.885 8.885 8.555 0.330 25974
1540 1 11 . 1 1 5 5 GLY N N 5 115.452 115.452 112.547 2.905 25974
1541 1 11 . 1 1 5 5 GLY H H 5 9.135 9.135 8.990 0.145 25974
1542 1 11 . 1 1 6 6 LYS N N 6 121.001 121.001 117.089 3.912 25974
1543 1 11 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.166 0.212 25974
1544 1 11 . 1 1 6 6 LYS H H 6 8.422 8.422 8.049 0.373 25974
1545 1 11 . 1 1 7 7 CYS N N 7 122.647 122.647 117.384 5.263 25974
1546 1 11 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.225 1.072 25974
1547 1 11 . 1 1 7 7 CYS H H 7 9.767 9.767 8.868 0.899 25974
1548 1 11 . 1 1 8 8 THR N N 8 113.493 113.493 114.399 -0.906 25974
1549 1 11 . 1 1 8 8 THR HA H 8 4.704 4.704 4.818 -0.114 25974
1550 1 11 . 1 1 8 8 THR H H 8 8.716 8.716 8.283 0.433 25974
1551 1 11 . 1 1 9 9 LYS N N 9 127.640 127.640 126.100 1.540 25974
1552 1 11 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.046 -0.553 25974
1553 1 11 . 1 1 9 9 LYS H H 9 8.947 8.947 8.550 0.397 25974
1554 1 11 . 1 1 10 10 SER N N 10 116.726 116.726 115.985 0.741 25974
1555 1 11 . 1 1 10 10 SER HA H 10 4.006 4.006 4.215 -0.209 25974
1556 1 11 . 1 1 10 10 SER H H 10 9.484 9.484 8.126 1.358 25974
1557 1 11 . 1 1 11 11 LYS N N 11 116.973 116.973 118.744 -1.771 25974
1558 1 11 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.372 -0.219 25974
1559 1 11 . 1 1 11 11 LYS H H 11 7.051 7.051 8.058 -1.007 25974
1560 1 11 . 1 1 12 12 ASN N N 12 120.652 120.652 118.677 1.975 25974
1561 1 11 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.439 0.127 25974
1562 1 11 . 1 1 12 12 ASN H H 12 7.590 7.590 8.182 -0.592 25974
1563 1 11 . 1 1 13 13 GLU N N 13 115.322 115.322 124.371 -9.049 25974
1564 1 11 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.331 0.565 25974
1565 1 11 . 1 1 13 13 GLU H H 13 7.290 7.290 8.205 -0.915 25974
1566 1 11 . 1 1 14 14 CYS N N 14 123.345 123.345 124.520 -1.175 25974
1567 1 11 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.705 -0.066 25974
1568 1 11 . 1 1 14 14 CYS H H 14 9.588 9.588 8.704 0.884 25974
1569 1 11 . 1 1 15 15 LYS N N 15 110.722 110.722 129.393 -18.671 25974
1570 1 11 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.123 -0.177 25974
1571 1 11 . 1 1 15 15 LYS H H 15 8.636 8.636 8.996 -0.360 25974
1572 1 11 . 1 1 16 16 TYR N N 16 126.630 126.630 121.124 5.506 25974
1573 1 11 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.896 0.003 25974
1574 1 11 . 1 1 16 16 TYR H H 16 8.998 8.998 8.743 0.255 25974
1575 1 11 . 1 1 17 17 LYS N N 17 120.977 120.977 119.411 1.566 25974
1576 1 11 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.531 -0.125 25974
1577 1 11 . 1 1 17 17 LYS H H 17 8.421 8.421 8.237 0.184 25974
1578 1 11 . 1 1 18 18 ASN N N 18 122.224 122.224 119.877 2.347 25974
1579 1 11 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.479 -0.377 25974
1580 1 11 . 1 1 18 18 ASN H H 18 7.735 7.735 8.187 -0.452 25974
1581 1 11 . 1 1 19 19 ASP N N 19 117.436 117.436 120.979 -3.543 25974
1582 1 11 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.633 -0.249 25974
1583 1 11 . 1 1 19 19 ASP H H 19 8.238 8.238 8.107 0.131 25974
1584 1 11 . 1 1 20 20 ALA N N 20 120.895 120.895 120.555 0.340 25974
1585 1 11 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.083 0.326 25974
1586 1 11 . 1 1 20 20 ALA H H 20 7.419 7.419 7.899 -0.480 25974
1587 1 11 . 1 1 21 21 GLY N N 21 127.668 127.668 104.360 23.308 25974
1588 1 11 . 1 1 21 21 GLY H H 21 8.170 8.170 8.022 0.148 25974
1589 1 11 . 1 1 22 22 LYS N N 22 120.354 120.354 123.239 -2.885 25974
1590 1 11 . 1 1 22 22 LYS HA H 22 4.309 4.309 3.985 0.324 25974
1591 1 11 . 1 1 22 22 LYS H H 22 7.682 7.682 8.013 -0.331 25974
1592 1 11 . 1 1 23 23 ASP N N 23 126.398 126.398 125.625 0.773 25974
1593 1 11 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.499 -0.243 25974
1594 1 11 . 1 1 23 23 ASP H H 23 8.610 8.610 8.129 0.481 25974
1595 1 11 . 1 1 24 24 THR N N 24 122.770 122.770 119.026 3.744 25974
1596 1 11 . 1 1 24 24 THR HA H 24 4.012 4.012 4.122 -0.110 25974
1597 1 11 . 1 1 24 24 THR H H 24 8.782 8.782 7.965 0.817 25974
1598 1 11 . 1 1 25 25 PHE N N 25 122.423 122.423 123.318 -0.895 25974
1599 1 11 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.034 0.370 25974
1600 1 11 . 1 1 25 25 PHE H H 25 8.328 8.328 8.167 0.161 25974
1601 1 11 . 1 1 26 26 ILE N N 26 123.029 123.029 123.336 -0.307 25974
1602 1 11 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.526 0.088 25974
1603 1 11 . 1 1 26 26 ILE H H 26 9.138 9.138 8.700 0.438 25974
1604 1 11 . 1 1 27 27 LYS N N 27 127.077 127.077 128.376 -1.299 25974
1605 1 11 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.217 -0.054 25974
1606 1 11 . 1 1 27 27 LYS H H 27 8.335 8.335 8.377 -0.042 25974
1607 1 11 . 1 1 28 28 CYS N N 28 120.248 120.248 120.739 -0.491 25974
1608 1 11 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.738 -0.079 25974
1609 1 11 . 1 1 28 28 CYS H H 28 8.618 8.618 8.557 0.061 25974
1610 1 11 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.313 0.113 25974
1611 1 11 . 1 1 30 30 LYS N N 30 115.643 115.643 119.186 -3.543 25974
1612 1 11 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.819 0.130 25974
1613 1 11 . 1 1 30 30 LYS H H 30 8.002 8.002 8.270 -0.268 25974
1614 1 11 . 1 1 31 31 PHE N N 31 116.470 116.470 115.617 0.853 25974
1615 1 11 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.762 -0.258 25974
1616 1 11 . 1 1 31 31 PHE H H 31 6.308 6.308 7.812 -1.504 25974
1617 1 11 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.543 -0.399 25974
1618 1 11 . 1 1 33 33 ASN N N 33 113.110 113.110 115.709 -2.599 25974
1619 1 11 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.889 -0.216 25974
1620 1 11 . 1 1 33 33 ASN H H 33 8.564 8.564 8.399 0.165 25974
1621 1 11 . 1 1 34 34 LYS N N 34 120.347 120.347 118.226 2.121 25974
1622 1 11 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.513 0.471 25974
1623 1 11 . 1 1 34 34 LYS H H 34 7.914 7.914 7.618 0.296 25974
1624 1 11 . 1 1 35 35 LYS N N 35 117.863 117.863 118.194 -0.331 25974
1625 1 11 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.292 0.316 25974
1626 1 11 . 1 1 35 35 LYS H H 35 7.005 7.005 7.780 -0.775 25974
1627 1 11 . 1 1 36 36 CYS N N 36 118.915 118.915 121.133 -2.218 25974
1628 1 11 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.343 0.514 25974
1629 1 11 . 1 1 36 36 CYS H H 36 8.817 8.817 8.588 0.229 25974
1630 1 11 . 1 1 37 37 THR N N 37 121.008 121.008 116.046 4.962 25974
1631 1 11 . 1 1 37 37 THR HA H 37 4.300 4.300 4.431 -0.131 25974
1632 1 11 . 1 1 37 37 THR H H 37 9.980 9.980 8.505 1.475 25974
1633 1 11 . 1 1 38 38 LYS N N 38 122.326 122.326 121.448 0.878 25974
1634 1 11 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.472 -0.335 25974
1635 1 11 . 1 1 38 38 LYS H H 38 7.287 7.287 7.577 -0.290 25974
1636 1 11 . 1 1 39 39 ASP N N 39 125.238 125.238 120.081 5.157 25974
1637 1 11 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.577 0.001 25974
1638 1 11 . 1 1 39 39 ASP H H 39 8.817 8.817 8.413 0.404 25974
1639 1 11 . 1 1 40 40 ASN N N 40 114.713 114.713 120.158 -5.445 25974
1640 1 11 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.269 0.003 25974
1641 1 11 . 1 1 40 40 ASN H H 40 9.532 9.532 8.757 0.775 25974
1642 1 11 . 1 1 41 41 ASN N N 41 120.080 120.080 116.130 3.950 25974
1643 1 11 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.616 0.101 25974
1644 1 11 . 1 1 41 41 ASN H H 41 7.742 7.742 7.846 -0.104 25974
1645 1 11 . 1 1 42 42 LYS N N 42 118.956 118.956 121.483 -2.527 25974
1646 1 11 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.513 -0.167 25974
1647 1 11 . 1 1 42 42 LYS H H 42 8.397 8.397 8.081 0.317 25974
1648 1 11 . 1 1 43 43 CYS N N 43 112.235 112.235 122.138 -9.903 25974
1649 1 11 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.409 -0.074 25974
1650 1 11 . 1 1 43 43 CYS H H 43 7.397 7.397 8.752 -1.355 25974
1651 1 11 . 1 1 44 44 THR N N 44 112.586 112.586 115.377 -2.791 25974
1652 1 11 . 1 1 44 44 THR HA H 44 5.221 5.221 5.110 0.111 25974
1653 1 11 . 1 1 44 44 THR H H 44 8.674 8.674 8.367 0.307 25974
1654 1 11 . 1 1 45 45 VAL N N 45 121.814 121.814 123.953 -2.139 25974
1655 1 11 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.245 0.185 25974
1656 1 11 . 1 1 45 45 VAL H H 45 8.555 8.555 8.814 -0.259 25974
1657 1 11 . 1 1 46 46 ASP N N 46 126.626 126.626 127.153 -0.527 25974
1658 1 11 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.018 0.316 25974
1659 1 11 . 1 1 46 46 ASP H H 46 8.519 8.519 8.905 -0.386 25974
1660 1 11 . 1 1 47 47 THR N N 47 114.334 114.334 120.661 -6.327 25974
1661 1 11 . 1 1 47 47 THR HA H 47 4.187 4.187 4.468 -0.281 25974
1662 1 11 . 1 1 47 47 THR H H 47 9.116 9.116 8.774 0.342 25974
1663 1 11 . 1 1 48 48 TYR N N 48 124.010 124.010 120.854 3.156 25974
1664 1 11 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.691 -0.317 25974
1665 1 11 . 1 1 48 48 TYR H H 48 8.803 8.803 8.066 0.737 25974
1666 1 11 . 1 1 49 49 ASN N N 49 113.668 113.668 115.029 -1.361 25974
1667 1 11 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.669 -0.194 25974
1668 1 11 . 1 1 49 49 ASN H H 49 7.433 7.433 8.077 -0.644 25974
1669 1 11 . 1 1 50 50 ASN N N 50 117.403 117.403 117.399 0.004 25974
1670 1 11 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.285 -0.086 25974
1671 1 11 . 1 1 50 50 ASN H H 50 7.863 7.863 8.122 -0.259 25974
1672 1 11 . 1 1 51 51 ALA N N 51 121.102 121.102 120.251 0.851 25974
1673 1 11 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.529 -0.092 25974
1674 1 11 . 1 1 51 51 ALA H H 51 7.853 7.853 7.853 -0.000 25974
1675 1 11 . 1 1 52 52 VAL N N 52 126.326 126.326 118.369 7.957 25974
1676 1 11 . 1 1 52 52 VAL HA H 52 4.875 4.875 5.134 -0.259 25974
1677 1 11 . 1 1 52 52 VAL H H 52 8.297 8.297 8.218 0.079 25974
1678 1 11 . 1 1 53 53 ASP N N 53 125.100 125.100 128.582 -3.482 25974
1679 1 11 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.080 -0.285 25974
1680 1 11 . 1 1 53 53 ASP H H 53 8.519 8.519 8.701 -0.182 25974
1681 1 11 . 1 1 54 54 CYS N N 54 126.377 126.377 119.364 7.013 25974
1682 1 11 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.345 0.333 25974
1683 1 11 . 1 1 54 54 CYS H H 54 8.609 8.609 7.994 0.615 25974
1684 1 12 . 1 1 2 2 LYS N N 2 119.918 119.918 120.948 -1.030 25974
1685 1 12 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.620 0.610 25974
1686 1 12 . 1 1 2 2 LYS H H 2 8.167 8.167 7.857 0.310 25974
1687 1 12 . 1 1 3 3 TYR N N 3 122.493 122.493 126.328 -3.835 25974
1688 1 12 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.674 0.135 25974
1689 1 12 . 1 1 3 3 TYR H H 3 8.939 8.939 8.888 0.051 25974
1690 1 12 . 1 1 4 4 THR N N 4 117.297 117.297 115.743 1.554 25974
1691 1 12 . 1 1 4 4 THR HA H 4 5.042 5.042 4.583 0.459 25974
1692 1 12 . 1 1 4 4 THR H H 4 8.885 8.885 8.500 0.385 25974
1693 1 12 . 1 1 5 5 GLY N N 5 115.452 115.452 112.781 2.671 25974
1694 1 12 . 1 1 5 5 GLY H H 5 9.135 9.135 9.071 0.064 25974
1695 1 12 . 1 1 6 6 LYS N N 6 121.001 121.001 116.908 4.093 25974
1696 1 12 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.133 0.245 25974
1697 1 12 . 1 1 6 6 LYS H H 6 8.422 8.422 8.118 0.304 25974
1698 1 12 . 1 1 7 7 CYS N N 7 122.647 122.647 118.193 4.454 25974
1699 1 12 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.217 1.080 25974
1700 1 12 . 1 1 7 7 CYS H H 7 9.767 9.767 8.622 1.145 25974
1701 1 12 . 1 1 8 8 THR N N 8 113.493 113.493 114.818 -1.325 25974
1702 1 12 . 1 1 8 8 THR HA H 8 4.704 4.704 4.699 0.005 25974
1703 1 12 . 1 1 8 8 THR H H 8 8.716 8.716 8.578 0.138 25974
1704 1 12 . 1 1 9 9 LYS N N 9 127.640 127.640 126.176 1.464 25974
1705 1 12 . 1 1 9 9 LYS HA H 9 3.493 3.493 3.993 -0.500 25974
1706 1 12 . 1 1 9 9 LYS H H 9 8.947 8.947 8.756 0.191 25974
1707 1 12 . 1 1 10 10 SER N N 10 116.726 116.726 116.293 0.433 25974
1708 1 12 . 1 1 10 10 SER HA H 10 4.006 4.006 4.210 -0.204 25974
1709 1 12 . 1 1 10 10 SER H H 10 9.484 9.484 8.250 1.234 25974
1710 1 12 . 1 1 11 11 LYS N N 11 116.973 116.973 118.372 -1.399 25974
1711 1 12 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.439 -0.286 25974
1712 1 12 . 1 1 11 11 LYS H H 11 7.051 7.051 7.832 -0.781 25974
1713 1 12 . 1 1 12 12 ASN N N 12 120.652 120.652 120.448 0.204 25974
1714 1 12 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.285 0.281 25974
1715 1 12 . 1 1 12 12 ASN H H 12 7.590 7.590 8.504 -0.914 25974
1716 1 12 . 1 1 13 13 GLU N N 13 115.322 115.322 123.987 -8.665 25974
1717 1 12 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.330 0.566 25974
1718 1 12 . 1 1 13 13 GLU H H 13 7.290 7.290 8.554 -1.264 25974
1719 1 12 . 1 1 14 14 CYS N N 14 123.345 123.345 125.826 -2.481 25974
1720 1 12 . 1 1 14 14 CYS HA H 14 4.639 4.639 5.200 -0.561 25974
1721 1 12 . 1 1 14 14 CYS H H 14 9.588 9.588 8.700 0.888 25974
1722 1 12 . 1 1 15 15 LYS N N 15 110.722 110.722 127.699 -16.977 25974
1723 1 12 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.238 -0.292 25974
1724 1 12 . 1 1 15 15 LYS H H 15 8.636 8.636 8.516 0.120 25974
1725 1 12 . 1 1 16 16 TYR N N 16 126.630 126.630 120.328 6.302 25974
1726 1 12 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.869 0.030 25974
1727 1 12 . 1 1 16 16 TYR H H 16 8.998 8.998 8.084 0.914 25974
1728 1 12 . 1 1 17 17 LYS N N 17 120.977 120.977 118.462 2.515 25974
1729 1 12 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.486 -0.080 25974
1730 1 12 . 1 1 17 17 LYS H H 17 8.421 8.421 8.260 0.161 25974
1731 1 12 . 1 1 18 18 ASN N N 18 122.224 122.224 119.373 2.851 25974
1732 1 12 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.325 -0.223 25974
1733 1 12 . 1 1 18 18 ASN H H 18 7.735 7.735 7.947 -0.212 25974
1734 1 12 . 1 1 19 19 ASP N N 19 117.436 117.436 121.847 -4.411 25974
1735 1 12 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.439 -0.055 25974
1736 1 12 . 1 1 19 19 ASP H H 19 8.238 8.238 8.599 -0.361 25974
1737 1 12 . 1 1 20 20 ALA N N 20 120.895 120.895 121.213 -0.318 25974
1738 1 12 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.468 -0.059 25974
1739 1 12 . 1 1 20 20 ALA H H 20 7.419 7.419 8.085 -0.666 25974
1740 1 12 . 1 1 21 21 GLY N N 21 127.668 127.668 106.875 20.793 25974
1741 1 12 . 1 1 21 21 GLY H H 21 8.170 8.170 8.138 0.032 25974
1742 1 12 . 1 1 22 22 LYS N N 22 120.354 120.354 121.648 -1.294 25974
1743 1 12 . 1 1 22 22 LYS HA H 22 4.309 4.309 3.989 0.320 25974
1744 1 12 . 1 1 22 22 LYS H H 22 7.682 7.682 7.915 -0.233 25974
1745 1 12 . 1 1 23 23 ASP N N 23 126.398 126.398 125.384 1.014 25974
1746 1 12 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.656 -0.400 25974
1747 1 12 . 1 1 23 23 ASP H H 23 8.610 8.610 8.137 0.473 25974
1748 1 12 . 1 1 24 24 THR N N 24 122.770 122.770 119.907 2.863 25974
1749 1 12 . 1 1 24 24 THR HA H 24 4.012 4.012 4.204 -0.192 25974
1750 1 12 . 1 1 24 24 THR H H 24 8.782 8.782 8.052 0.730 25974
1751 1 12 . 1 1 25 25 PHE N N 25 122.423 122.423 127.536 -5.113 25974
1752 1 12 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.634 0.770 25974
1753 1 12 . 1 1 25 25 PHE H H 25 8.328 8.328 8.140 0.188 25974
1754 1 12 . 1 1 26 26 ILE N N 26 123.029 123.029 126.060 -3.031 25974
1755 1 12 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.611 0.003 25974
1756 1 12 . 1 1 26 26 ILE H H 26 9.138 9.138 9.199 -0.061 25974
1757 1 12 . 1 1 27 27 LYS N N 27 127.077 127.077 128.284 -1.207 25974
1758 1 12 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.255 -0.092 25974
1759 1 12 . 1 1 27 27 LYS H H 27 8.335 8.335 8.432 -0.097 25974
1760 1 12 . 1 1 28 28 CYS N N 28 120.248 120.248 119.114 1.134 25974
1761 1 12 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.797 -0.138 25974
1762 1 12 . 1 1 28 28 CYS H H 28 8.618 8.618 8.777 -0.159 25974
1763 1 12 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.520 -0.094 25974
1764 1 12 . 1 1 30 30 LYS N N 30 115.643 115.643 119.397 -3.754 25974
1765 1 12 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.836 0.113 25974
1766 1 12 . 1 1 30 30 LYS H H 30 8.002 8.002 8.146 -0.144 25974
1767 1 12 . 1 1 31 31 PHE N N 31 116.470 116.470 115.972 0.498 25974
1768 1 12 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.771 -0.268 25974
1769 1 12 . 1 1 31 31 PHE H H 31 6.308 6.308 7.624 -1.316 25974
1770 1 12 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.584 -0.440 25974
1771 1 12 . 1 1 33 33 ASN N N 33 113.110 113.110 115.557 -2.447 25974
1772 1 12 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.874 -0.201 25974
1773 1 12 . 1 1 33 33 ASN H H 33 8.564 8.564 8.378 0.186 25974
1774 1 12 . 1 1 34 34 LYS N N 34 120.347 120.347 118.976 1.371 25974
1775 1 12 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.467 0.517 25974
1776 1 12 . 1 1 34 34 LYS H H 34 7.914 7.914 7.581 0.333 25974
1777 1 12 . 1 1 35 35 LYS N N 35 117.863 117.863 118.284 -0.421 25974
1778 1 12 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.295 0.313 25974
1779 1 12 . 1 1 35 35 LYS H H 35 7.005 7.005 7.760 -0.755 25974
1780 1 12 . 1 1 36 36 CYS N N 36 118.915 118.915 118.151 0.764 25974
1781 1 12 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.610 0.247 25974
1782 1 12 . 1 1 36 36 CYS H H 36 8.817 8.817 8.878 -0.061 25974
1783 1 12 . 1 1 37 37 THR N N 37 121.008 121.008 111.406 9.602 25974
1784 1 12 . 1 1 37 37 THR HA H 37 4.300 4.300 4.366 -0.066 25974
1785 1 12 . 1 1 37 37 THR H H 37 9.980 9.980 8.423 1.557 25974
1786 1 12 . 1 1 38 38 LYS N N 38 122.326 122.326 121.015 1.311 25974
1787 1 12 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.482 -0.345 25974
1788 1 12 . 1 1 38 38 LYS H H 38 7.287 7.287 7.632 -0.345 25974
1789 1 12 . 1 1 39 39 ASP N N 39 125.238 125.238 121.748 3.490 25974
1790 1 12 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.553 0.025 25974
1791 1 12 . 1 1 39 39 ASP H H 39 8.817 8.817 8.536 0.281 25974
1792 1 12 . 1 1 40 40 ASN N N 40 114.713 114.713 121.763 -7.050 25974
1793 1 12 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.304 -0.032 25974
1794 1 12 . 1 1 40 40 ASN H H 40 9.532 9.532 8.907 0.625 25974
1795 1 12 . 1 1 41 41 ASN N N 41 120.080 120.080 115.960 4.120 25974
1796 1 12 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.690 0.027 25974
1797 1 12 . 1 1 41 41 ASN H H 41 7.742 7.742 7.933 -0.191 25974
1798 1 12 . 1 1 42 42 LYS N N 42 118.956 118.956 119.476 -0.520 25974
1799 1 12 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.529 -0.183 25974
1800 1 12 . 1 1 42 42 LYS H H 42 8.397 8.397 8.306 0.091 25974
1801 1 12 . 1 1 43 43 CYS N N 43 112.235 112.235 120.060 -7.825 25974
1802 1 12 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.361 -0.026 25974
1803 1 12 . 1 1 43 43 CYS H H 43 7.397 7.397 8.553 -1.155 25974
1804 1 12 . 1 1 44 44 THR N N 44 112.586 112.586 115.591 -3.005 25974
1805 1 12 . 1 1 44 44 THR HA H 44 5.221 5.221 5.016 0.205 25974
1806 1 12 . 1 1 44 44 THR H H 44 8.674 8.674 8.289 0.385 25974
1807 1 12 . 1 1 45 45 VAL N N 45 121.814 121.814 124.365 -2.551 25974
1808 1 12 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.083 0.347 25974
1809 1 12 . 1 1 45 45 VAL H H 45 8.555 8.555 8.116 0.439 25974
1810 1 12 . 1 1 46 46 ASP N N 46 126.626 126.626 126.728 -0.102 25974
1811 1 12 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.491 -0.157 25974
1812 1 12 . 1 1 46 46 ASP H H 46 8.519 8.519 8.769 -0.250 25974
1813 1 12 . 1 1 47 47 THR N N 47 114.334 114.334 118.483 -4.149 25974
1814 1 12 . 1 1 47 47 THR HA H 47 4.187 4.187 4.122 0.065 25974
1815 1 12 . 1 1 47 47 THR H H 47 9.116 9.116 8.495 0.621 25974
1816 1 12 . 1 1 48 48 TYR N N 48 124.010 124.010 122.929 1.081 25974
1817 1 12 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.277 0.097 25974
1818 1 12 . 1 1 48 48 TYR H H 48 8.803 8.803 8.199 0.604 25974
1819 1 12 . 1 1 49 49 ASN N N 49 113.668 113.668 112.595 1.073 25974
1820 1 12 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.576 -0.101 25974
1821 1 12 . 1 1 49 49 ASN H H 49 7.433 7.433 7.598 -0.165 25974
1822 1 12 . 1 1 50 50 ASN N N 50 117.403 117.403 117.525 -0.122 25974
1823 1 12 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.338 -0.139 25974
1824 1 12 . 1 1 50 50 ASN H H 50 7.863 7.863 7.924 -0.061 25974
1825 1 12 . 1 1 51 51 ALA N N 51 121.102 121.102 123.084 -1.982 25974
1826 1 12 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.400 0.037 25974
1827 1 12 . 1 1 51 51 ALA H H 51 7.853 7.853 7.674 0.179 25974
1828 1 12 . 1 1 52 52 VAL N N 52 126.326 126.326 121.647 4.679 25974
1829 1 12 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.372 0.503 25974
1830 1 12 . 1 1 52 52 VAL H H 52 8.297 8.297 8.114 0.183 25974
1831 1 12 . 1 1 53 53 ASP N N 53 125.100 125.100 126.656 -1.556 25974
1832 1 12 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.192 -0.397 25974
1833 1 12 . 1 1 53 53 ASP H H 53 8.519 8.519 8.329 0.190 25974
1834 1 12 . 1 1 54 54 CYS N N 54 126.377 126.377 118.820 7.557 25974
1835 1 12 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.298 0.380 25974
1836 1 12 . 1 1 54 54 CYS H H 54 8.609 8.609 8.094 0.515 25974
1837 1 13 . 1 1 2 2 LYS N N 2 119.918 119.918 121.940 -2.022 25974
1838 1 13 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.389 0.841 25974
1839 1 13 . 1 1 2 2 LYS H H 2 8.167 8.167 7.864 0.303 25974
1840 1 13 . 1 1 3 3 TYR N N 3 122.493 122.493 123.506 -1.013 25974
1841 1 13 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.769 0.040 25974
1842 1 13 . 1 1 3 3 TYR H H 3 8.939 8.939 8.556 0.383 25974
1843 1 13 . 1 1 4 4 THR N N 4 117.297 117.297 116.807 0.490 25974
1844 1 13 . 1 1 4 4 THR HA H 4 5.042 5.042 4.669 0.373 25974
1845 1 13 . 1 1 4 4 THR H H 4 8.885 8.885 8.621 0.264 25974
1846 1 13 . 1 1 5 5 GLY N N 5 115.452 115.452 112.547 2.905 25974
1847 1 13 . 1 1 5 5 GLY H H 5 9.135 9.135 9.266 -0.131 25974
1848 1 13 . 1 1 6 6 LYS N N 6 121.001 121.001 116.965 4.036 25974
1849 1 13 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.215 0.163 25974
1850 1 13 . 1 1 6 6 LYS H H 6 8.422 8.422 8.121 0.301 25974
1851 1 13 . 1 1 7 7 CYS N N 7 122.647 122.647 115.498 7.149 25974
1852 1 13 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.212 1.085 25974
1853 1 13 . 1 1 7 7 CYS H H 7 9.767 9.767 8.633 1.134 25974
1854 1 13 . 1 1 8 8 THR N N 8 113.493 113.493 114.975 -1.482 25974
1855 1 13 . 1 1 8 8 THR HA H 8 4.704 4.704 4.861 -0.157 25974
1856 1 13 . 1 1 8 8 THR H H 8 8.716 8.716 8.178 0.538 25974
1857 1 13 . 1 1 9 9 LYS N N 9 127.640 127.640 126.510 1.130 25974
1858 1 13 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.053 -0.560 25974
1859 1 13 . 1 1 9 9 LYS H H 9 8.947 8.947 8.682 0.265 25974
1860 1 13 . 1 1 10 10 SER N N 10 116.726 116.726 115.349 1.377 25974
1861 1 13 . 1 1 10 10 SER HA H 10 4.006 4.006 4.230 -0.224 25974
1862 1 13 . 1 1 10 10 SER H H 10 9.484 9.484 8.065 1.419 25974
1863 1 13 . 1 1 11 11 LYS N N 11 116.973 116.973 118.749 -1.776 25974
1864 1 13 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.460 -0.307 25974
1865 1 13 . 1 1 11 11 LYS H H 11 7.051 7.051 8.199 -1.148 25974
1866 1 13 . 1 1 12 12 ASN N N 12 120.652 120.652 118.250 2.402 25974
1867 1 13 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.511 0.055 25974
1868 1 13 . 1 1 12 12 ASN H H 12 7.590 7.590 8.093 -0.503 25974
1869 1 13 . 1 1 13 13 GLU N N 13 115.322 115.322 122.976 -7.654 25974
1870 1 13 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.384 0.512 25974
1871 1 13 . 1 1 13 13 GLU H H 13 7.290 7.290 8.381 -1.091 25974
1872 1 13 . 1 1 14 14 CYS N N 14 123.345 123.345 125.040 -1.695 25974
1873 1 13 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.724 -0.085 25974
1874 1 13 . 1 1 14 14 CYS H H 14 9.588 9.588 8.785 0.803 25974
1875 1 13 . 1 1 15 15 LYS N N 15 110.722 110.722 128.870 -18.148 25974
1876 1 13 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.482 -0.536 25974
1877 1 13 . 1 1 15 15 LYS H H 15 8.636 8.636 8.709 -0.073 25974
1878 1 13 . 1 1 16 16 TYR N N 16 126.630 126.630 119.227 7.403 25974
1879 1 13 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.853 0.046 25974
1880 1 13 . 1 1 16 16 TYR H H 16 8.998 8.998 8.783 0.215 25974
1881 1 13 . 1 1 17 17 LYS N N 17 120.977 120.977 117.952 3.025 25974
1882 1 13 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.613 -0.207 25974
1883 1 13 . 1 1 17 17 LYS H H 17 8.421 8.421 8.105 0.316 25974
1884 1 13 . 1 1 18 18 ASN N N 18 122.224 122.224 118.553 3.671 25974
1885 1 13 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.451 -0.349 25974
1886 1 13 . 1 1 18 18 ASN H H 18 7.735 7.735 7.926 -0.191 25974
1887 1 13 . 1 1 19 19 ASP N N 19 117.436 117.436 121.484 -4.048 25974
1888 1 13 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.590 -0.206 25974
1889 1 13 . 1 1 19 19 ASP H H 19 8.238 8.238 8.003 0.235 25974
1890 1 13 . 1 1 20 20 ALA N N 20 120.895 120.895 120.163 0.732 25974
1891 1 13 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.089 0.320 25974
1892 1 13 . 1 1 20 20 ALA H H 20 7.419 7.419 7.831 -0.412 25974
1893 1 13 . 1 1 21 21 GLY N N 21 127.668 127.668 104.001 23.667 25974
1894 1 13 . 1 1 21 21 GLY H H 21 8.170 8.170 8.001 0.169 25974
1895 1 13 . 1 1 22 22 LYS N N 22 120.354 120.354 123.510 -3.156 25974
1896 1 13 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.033 0.276 25974
1897 1 13 . 1 1 22 22 LYS H H 22 7.682 7.682 7.950 -0.268 25974
1898 1 13 . 1 1 23 23 ASP N N 23 126.398 126.398 124.199 2.199 25974
1899 1 13 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.440 -0.184 25974
1900 1 13 . 1 1 23 23 ASP H H 23 8.610 8.610 8.067 0.543 25974
1901 1 13 . 1 1 24 24 THR N N 24 122.770 122.770 118.623 4.147 25974
1902 1 13 . 1 1 24 24 THR HA H 24 4.012 4.012 4.179 -0.167 25974
1903 1 13 . 1 1 24 24 THR H H 24 8.782 8.782 7.938 0.844 25974
1904 1 13 . 1 1 25 25 PHE N N 25 122.423 122.423 125.830 -3.407 25974
1905 1 13 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.657 0.747 25974
1906 1 13 . 1 1 25 25 PHE H H 25 8.328 8.328 8.282 0.046 25974
1907 1 13 . 1 1 26 26 ILE N N 26 123.029 123.029 125.728 -2.699 25974
1908 1 13 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.574 0.040 25974
1909 1 13 . 1 1 26 26 ILE H H 26 9.138 9.138 8.908 0.230 25974
1910 1 13 . 1 1 27 27 LYS N N 27 127.077 127.077 127.730 -0.653 25974
1911 1 13 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.326 -0.163 25974
1912 1 13 . 1 1 27 27 LYS H H 27 8.335 8.335 8.383 -0.048 25974
1913 1 13 . 1 1 28 28 CYS N N 28 120.248 120.248 120.520 -0.272 25974
1914 1 13 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.734 -0.075 25974
1915 1 13 . 1 1 28 28 CYS H H 28 8.618 8.618 8.567 0.051 25974
1916 1 13 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.665 -0.239 25974
1917 1 13 . 1 1 30 30 LYS N N 30 115.643 115.643 117.813 -2.170 25974
1918 1 13 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.825 0.124 25974
1919 1 13 . 1 1 30 30 LYS H H 30 8.002 8.002 8.181 -0.179 25974
1920 1 13 . 1 1 31 31 PHE N N 31 116.470 116.470 115.103 1.367 25974
1921 1 13 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.598 -0.094 25974
1922 1 13 . 1 1 31 31 PHE H H 31 6.308 6.308 7.626 -1.318 25974
1923 1 13 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.296 -0.152 25974
1924 1 13 . 1 1 33 33 ASN N N 33 113.110 113.110 115.304 -2.194 25974
1925 1 13 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.814 -0.141 25974
1926 1 13 . 1 1 33 33 ASN H H 33 8.564 8.564 8.702 -0.138 25974
1927 1 13 . 1 1 34 34 LYS N N 34 120.347 120.347 119.838 0.509 25974
1928 1 13 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.339 0.645 25974
1929 1 13 . 1 1 34 34 LYS H H 34 7.914 7.914 8.235 -0.321 25974
1930 1 13 . 1 1 35 35 LYS N N 35 117.863 117.863 117.716 0.147 25974
1931 1 13 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.215 0.393 25974
1932 1 13 . 1 1 35 35 LYS H H 35 7.005 7.005 7.610 -0.605 25974
1933 1 13 . 1 1 36 36 CYS N N 36 118.915 118.915 120.387 -1.472 25974
1934 1 13 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.415 0.442 25974
1935 1 13 . 1 1 36 36 CYS H H 36 8.817 8.817 8.689 0.128 25974
1936 1 13 . 1 1 37 37 THR N N 37 121.008 121.008 115.446 5.562 25974
1937 1 13 . 1 1 37 37 THR HA H 37 4.300 4.300 4.486 -0.186 25974
1938 1 13 . 1 1 37 37 THR H H 37 9.980 9.980 8.710 1.270 25974
1939 1 13 . 1 1 38 38 LYS N N 38 122.326 122.326 120.980 1.346 25974
1940 1 13 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.512 -0.375 25974
1941 1 13 . 1 1 38 38 LYS H H 38 7.287 7.287 7.560 -0.273 25974
1942 1 13 . 1 1 39 39 ASP N N 39 125.238 125.238 119.941 5.297 25974
1943 1 13 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.617 -0.039 25974
1944 1 13 . 1 1 39 39 ASP H H 39 8.817 8.817 8.419 0.398 25974
1945 1 13 . 1 1 40 40 ASN N N 40 114.713 114.713 119.884 -5.171 25974
1946 1 13 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.238 0.034 25974
1947 1 13 . 1 1 40 40 ASN H H 40 9.532 9.532 8.987 0.545 25974
1948 1 13 . 1 1 41 41 ASN N N 41 120.080 120.080 115.908 4.172 25974
1949 1 13 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.573 0.144 25974
1950 1 13 . 1 1 41 41 ASN H H 41 7.742 7.742 7.743 -0.001 25974
1951 1 13 . 1 1 42 42 LYS N N 42 118.956 118.956 121.808 -2.852 25974
1952 1 13 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.583 -0.237 25974
1953 1 13 . 1 1 42 42 LYS H H 42 8.397 8.397 8.812 -0.415 25974
1954 1 13 . 1 1 43 43 CYS N N 43 112.235 112.235 122.523 -10.288 25974
1955 1 13 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.372 -0.037 25974
1956 1 13 . 1 1 43 43 CYS H H 43 7.397 7.397 8.847 -1.450 25974
1957 1 13 . 1 1 44 44 THR N N 44 112.586 112.586 116.581 -3.995 25974
1958 1 13 . 1 1 44 44 THR HA H 44 5.221 5.221 5.037 0.184 25974
1959 1 13 . 1 1 44 44 THR H H 44 8.674 8.674 8.325 0.349 25974
1960 1 13 . 1 1 45 45 VAL N N 45 121.814 121.814 124.707 -2.893 25974
1961 1 13 . 1 1 45 45 VAL HA H 45 4.430 4.430 3.979 0.451 25974
1962 1 13 . 1 1 45 45 VAL H H 45 8.555 8.555 8.392 0.163 25974
1963 1 13 . 1 1 46 46 ASP N N 46 126.626 126.626 126.560 0.066 25974
1964 1 13 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.998 0.336 25974
1965 1 13 . 1 1 46 46 ASP H H 46 8.519 8.519 8.026 0.493 25974
1966 1 13 . 1 1 47 47 THR N N 47 114.334 114.334 115.757 -1.423 25974
1967 1 13 . 1 1 47 47 THR HA H 47 4.187 4.187 4.122 0.065 25974
1968 1 13 . 1 1 47 47 THR H H 47 9.116 9.116 8.608 0.508 25974
1969 1 13 . 1 1 48 48 TYR N N 48 124.010 124.010 123.005 1.005 25974
1970 1 13 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.253 0.121 25974
1971 1 13 . 1 1 48 48 TYR H H 48 8.803 8.803 8.208 0.595 25974
1972 1 13 . 1 1 49 49 ASN N N 49 113.668 113.668 113.194 0.474 25974
1973 1 13 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.716 -0.241 25974
1974 1 13 . 1 1 49 49 ASN H H 49 7.433 7.433 7.742 -0.309 25974
1975 1 13 . 1 1 50 50 ASN N N 50 117.403 117.403 118.263 -0.860 25974
1976 1 13 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.273 -0.074 25974
1977 1 13 . 1 1 50 50 ASN H H 50 7.863 7.863 8.037 -0.174 25974
1978 1 13 . 1 1 51 51 ALA N N 51 121.102 121.102 120.869 0.233 25974
1979 1 13 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.462 -0.025 25974
1980 1 13 . 1 1 51 51 ALA H H 51 7.853 7.853 7.637 0.216 25974
1981 1 13 . 1 1 52 52 VAL N N 52 126.326 126.326 122.098 4.228 25974
1982 1 13 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.129 0.746 25974
1983 1 13 . 1 1 52 52 VAL H H 52 8.297 8.297 8.513 -0.216 25974
1984 1 13 . 1 1 53 53 ASP N N 53 125.100 125.100 129.714 -4.614 25974
1985 1 13 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.888 -0.093 25974
1986 1 13 . 1 1 53 53 ASP H H 53 8.519 8.519 8.389 0.130 25974
1987 1 13 . 1 1 54 54 CYS N N 54 126.377 126.377 117.424 8.953 25974
1988 1 13 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.391 0.287 25974
1989 1 13 . 1 1 54 54 CYS H H 54 8.609 8.609 7.833 0.776 25974
1990 1 14 . 1 1 2 2 LYS N N 2 119.918 119.918 121.902 -1.984 25974
1991 1 14 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.309 0.921 25974
1992 1 14 . 1 1 2 2 LYS H H 2 8.167 8.167 7.725 0.442 25974
1993 1 14 . 1 1 3 3 TYR N N 3 122.493 122.493 127.979 -5.486 25974
1994 1 14 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.748 0.061 25974
1995 1 14 . 1 1 3 3 TYR H H 3 8.939 8.939 9.139 -0.200 25974
1996 1 14 . 1 1 4 4 THR N N 4 117.297 117.297 117.342 -0.045 25974
1997 1 14 . 1 1 4 4 THR HA H 4 5.042 5.042 4.604 0.438 25974
1998 1 14 . 1 1 4 4 THR H H 4 8.885 8.885 8.624 0.261 25974
1999 1 14 . 1 1 5 5 GLY N N 5 115.452 115.452 113.028 2.424 25974
2000 1 14 . 1 1 5 5 GLY H H 5 9.135 9.135 9.007 0.128 25974
2001 1 14 . 1 1 6 6 LYS N N 6 121.001 121.001 117.151 3.850 25974
2002 1 14 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.181 0.197 25974
2003 1 14 . 1 1 6 6 LYS H H 6 8.422 8.422 7.984 0.438 25974
2004 1 14 . 1 1 7 7 CYS N N 7 122.647 122.647 117.050 5.597 25974
2005 1 14 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.349 0.948 25974
2006 1 14 . 1 1 7 7 CYS H H 7 9.767 9.767 8.930 0.837 25974
2007 1 14 . 1 1 8 8 THR N N 8 113.493 113.493 114.034 -0.541 25974
2008 1 14 . 1 1 8 8 THR HA H 8 4.704 4.704 4.874 -0.170 25974
2009 1 14 . 1 1 8 8 THR H H 8 8.716 8.716 8.134 0.582 25974
2010 1 14 . 1 1 9 9 LYS N N 9 127.640 127.640 125.395 2.245 25974
2011 1 14 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.097 -0.604 25974
2012 1 14 . 1 1 9 9 LYS H H 9 8.947 8.947 8.782 0.165 25974
2013 1 14 . 1 1 10 10 SER N N 10 116.726 116.726 115.474 1.252 25974
2014 1 14 . 1 1 10 10 SER HA H 10 4.006 4.006 4.206 -0.200 25974
2015 1 14 . 1 1 10 10 SER H H 10 9.484 9.484 8.023 1.461 25974
2016 1 14 . 1 1 11 11 LYS N N 11 116.973 116.973 119.171 -2.198 25974
2017 1 14 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.339 -0.186 25974
2018 1 14 . 1 1 11 11 LYS H H 11 7.051 7.051 8.133 -1.082 25974
2019 1 14 . 1 1 12 12 ASN N N 12 120.652 120.652 119.331 1.321 25974
2020 1 14 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.432 0.134 25974
2021 1 14 . 1 1 12 12 ASN H H 12 7.590 7.590 8.243 -0.653 25974
2022 1 14 . 1 1 13 13 GLU N N 13 115.322 115.322 122.507 -7.185 25974
2023 1 14 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.469 0.427 25974
2024 1 14 . 1 1 13 13 GLU H H 13 7.290 7.290 8.316 -1.026 25974
2025 1 14 . 1 1 14 14 CYS N N 14 123.345 123.345 126.600 -3.255 25974
2026 1 14 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.639 0.000 25974
2027 1 14 . 1 1 14 14 CYS H H 14 9.588 9.588 8.956 0.632 25974
2028 1 14 . 1 1 15 15 LYS N N 15 110.722 110.722 131.287 -20.565 25974
2029 1 14 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.110 -0.164 25974
2030 1 14 . 1 1 15 15 LYS H H 15 8.636 8.636 9.029 -0.393 25974
2031 1 14 . 1 1 16 16 TYR N N 16 126.630 126.630 121.259 5.371 25974
2032 1 14 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.900 -0.001 25974
2033 1 14 . 1 1 16 16 TYR H H 16 8.998 8.998 8.159 0.839 25974
2034 1 14 . 1 1 17 17 LYS N N 17 120.977 120.977 117.910 3.067 25974
2035 1 14 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.607 -0.201 25974
2036 1 14 . 1 1 17 17 LYS H H 17 8.421 8.421 8.310 0.111 25974
2037 1 14 . 1 1 18 18 ASN N N 18 122.224 122.224 118.852 3.372 25974
2038 1 14 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.394 -0.292 25974
2039 1 14 . 1 1 18 18 ASN H H 18 7.735 7.735 8.122 -0.387 25974
2040 1 14 . 1 1 19 19 ASP N N 19 117.436 117.436 121.268 -3.832 25974
2041 1 14 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.625 -0.241 25974
2042 1 14 . 1 1 19 19 ASP H H 19 8.238 8.238 8.107 0.131 25974
2043 1 14 . 1 1 20 20 ALA N N 20 120.895 120.895 120.475 0.420 25974
2044 1 14 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.090 0.319 25974
2045 1 14 . 1 1 20 20 ALA H H 20 7.419 7.419 7.889 -0.470 25974
2046 1 14 . 1 1 21 21 GLY N N 21 127.668 127.668 104.675 22.993 25974
2047 1 14 . 1 1 21 21 GLY H H 21 8.170 8.170 8.036 0.134 25974
2048 1 14 . 1 1 22 22 LYS N N 22 120.354 120.354 123.686 -3.332 25974
2049 1 14 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.019 0.290 25974
2050 1 14 . 1 1 22 22 LYS H H 22 7.682 7.682 7.987 -0.305 25974
2051 1 14 . 1 1 23 23 ASP N N 23 126.398 126.398 124.386 2.012 25974
2052 1 14 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.340 -0.084 25974
2053 1 14 . 1 1 23 23 ASP H H 23 8.610 8.610 8.083 0.527 25974
2054 1 14 . 1 1 24 24 THR N N 24 122.770 122.770 119.137 3.633 25974
2055 1 14 . 1 1 24 24 THR HA H 24 4.012 4.012 4.171 -0.159 25974
2056 1 14 . 1 1 24 24 THR H H 24 8.782 8.782 7.779 1.003 25974
2057 1 14 . 1 1 25 25 PHE N N 25 122.423 122.423 126.440 -4.017 25974
2058 1 14 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.918 0.486 25974
2059 1 14 . 1 1 25 25 PHE H H 25 8.328 8.328 8.431 -0.103 25974
2060 1 14 . 1 1 26 26 ILE N N 26 123.029 123.029 125.207 -2.178 25974
2061 1 14 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.645 -0.031 25974
2062 1 14 . 1 1 26 26 ILE H H 26 9.138 9.138 8.884 0.254 25974
2063 1 14 . 1 1 27 27 LYS N N 27 127.077 127.077 128.831 -1.754 25974
2064 1 14 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.214 -0.051 25974
2065 1 14 . 1 1 27 27 LYS H H 27 8.335 8.335 8.502 -0.167 25974
2066 1 14 . 1 1 28 28 CYS N N 28 120.248 120.248 121.790 -1.542 25974
2067 1 14 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.880 -0.221 25974
2068 1 14 . 1 1 28 28 CYS H H 28 8.618 8.618 8.567 0.051 25974
2069 1 14 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.358 0.068 25974
2070 1 14 . 1 1 30 30 LYS N N 30 115.643 115.643 118.456 -2.813 25974
2071 1 14 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.860 0.089 25974
2072 1 14 . 1 1 30 30 LYS H H 30 8.002 8.002 8.300 -0.298 25974
2073 1 14 . 1 1 31 31 PHE N N 31 116.470 116.470 115.136 1.334 25974
2074 1 14 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.618 -0.114 25974
2075 1 14 . 1 1 31 31 PHE H H 31 6.308 6.308 7.397 -1.089 25974
2076 1 14 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.706 -0.562 25974
2077 1 14 . 1 1 33 33 ASN N N 33 113.110 113.110 118.098 -4.988 25974
2078 1 14 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.834 -0.161 25974
2079 1 14 . 1 1 33 33 ASN H H 33 8.564 8.564 8.209 0.355 25974
2080 1 14 . 1 1 34 34 LYS N N 34 120.347 120.347 117.209 3.138 25974
2081 1 14 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.434 0.550 25974
2082 1 14 . 1 1 34 34 LYS H H 34 7.914 7.914 8.330 -0.416 25974
2083 1 14 . 1 1 35 35 LYS N N 35 117.863 117.863 117.794 0.069 25974
2084 1 14 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.226 0.383 25974
2085 1 14 . 1 1 35 35 LYS H H 35 7.005 7.005 7.555 -0.550 25974
2086 1 14 . 1 1 36 36 CYS N N 36 118.915 118.915 120.383 -1.468 25974
2087 1 14 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.371 0.486 25974
2088 1 14 . 1 1 36 36 CYS H H 36 8.817 8.817 8.716 0.101 25974
2089 1 14 . 1 1 37 37 THR N N 37 121.008 121.008 118.640 2.368 25974
2090 1 14 . 1 1 37 37 THR HA H 37 4.300 4.300 4.409 -0.109 25974
2091 1 14 . 1 1 37 37 THR H H 37 9.980 9.980 8.439 1.541 25974
2092 1 14 . 1 1 38 38 LYS N N 38 122.326 122.326 120.660 1.666 25974
2093 1 14 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.400 -0.263 25974
2094 1 14 . 1 1 38 38 LYS H H 38 7.287 7.287 7.558 -0.271 25974
2095 1 14 . 1 1 39 39 ASP N N 39 125.238 125.238 122.022 3.216 25974
2096 1 14 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.581 -0.003 25974
2097 1 14 . 1 1 39 39 ASP H H 39 8.817 8.817 8.528 0.289 25974
2098 1 14 . 1 1 40 40 ASN N N 40 114.713 114.713 120.877 -6.164 25974
2099 1 14 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.280 -0.008 25974
2100 1 14 . 1 1 40 40 ASN H H 40 9.532 9.532 9.041 0.491 25974
2101 1 14 . 1 1 41 41 ASN N N 41 120.080 120.080 116.733 3.347 25974
2102 1 14 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.671 0.046 25974
2103 1 14 . 1 1 41 41 ASN H H 41 7.742 7.742 7.979 -0.237 25974
2104 1 14 . 1 1 42 42 LYS N N 42 118.956 118.956 119.295 -0.339 25974
2105 1 14 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.586 -0.240 25974
2106 1 14 . 1 1 42 42 LYS H H 42 8.397 8.397 8.316 0.081 25974
2107 1 14 . 1 1 43 43 CYS N N 43 112.235 112.235 119.518 -7.283 25974
2108 1 14 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.383 -0.048 25974
2109 1 14 . 1 1 43 43 CYS H H 43 7.397 7.397 8.683 -1.286 25974
2110 1 14 . 1 1 44 44 THR N N 44 112.586 112.586 115.747 -3.161 25974
2111 1 14 . 1 1 44 44 THR HA H 44 5.221 5.221 5.119 0.102 25974
2112 1 14 . 1 1 44 44 THR H H 44 8.674 8.674 8.030 0.644 25974
2113 1 14 . 1 1 45 45 VAL N N 45 121.814 121.814 125.286 -3.472 25974
2114 1 14 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.194 0.236 25974
2115 1 14 . 1 1 45 45 VAL H H 45 8.555 8.555 8.619 -0.064 25974
2116 1 14 . 1 1 46 46 ASP N N 46 126.626 126.626 126.661 -0.035 25974
2117 1 14 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.099 0.235 25974
2118 1 14 . 1 1 46 46 ASP H H 46 8.519 8.519 8.284 0.235 25974
2119 1 14 . 1 1 47 47 THR N N 47 114.334 114.334 114.931 -0.597 25974
2120 1 14 . 1 1 47 47 THR HA H 47 4.187 4.187 4.132 0.055 25974
2121 1 14 . 1 1 47 47 THR H H 47 9.116 9.116 8.535 0.581 25974
2122 1 14 . 1 1 48 48 TYR N N 48 124.010 124.010 122.962 1.048 25974
2123 1 14 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.271 0.103 25974
2124 1 14 . 1 1 48 48 TYR H H 48 8.803 8.803 8.334 0.469 25974
2125 1 14 . 1 1 49 49 ASN N N 49 113.668 113.668 113.583 0.085 25974
2126 1 14 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.711 -0.236 25974
2127 1 14 . 1 1 49 49 ASN H H 49 7.433 7.433 7.698 -0.265 25974
2128 1 14 . 1 1 50 50 ASN N N 50 117.403 117.403 117.117 0.286 25974
2129 1 14 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.311 -0.112 25974
2130 1 14 . 1 1 50 50 ASN H H 50 7.863 7.863 7.981 -0.118 25974
2131 1 14 . 1 1 51 51 ALA N N 51 121.102 121.102 123.000 -1.898 25974
2132 1 14 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.357 0.080 25974
2133 1 14 . 1 1 51 51 ALA H H 51 7.853 7.853 7.875 -0.022 25974
2134 1 14 . 1 1 52 52 VAL N N 52 126.326 126.326 121.221 5.105 25974
2135 1 14 . 1 1 52 52 VAL HA H 52 4.875 4.875 5.002 -0.127 25974
2136 1 14 . 1 1 52 52 VAL H H 52 8.297 8.297 8.314 -0.017 25974
2137 1 14 . 1 1 53 53 ASP N N 53 125.100 125.100 129.095 -3.995 25974
2138 1 14 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.960 -0.165 25974
2139 1 14 . 1 1 53 53 ASP H H 53 8.519 8.519 8.445 0.074 25974
2140 1 14 . 1 1 54 54 CYS N N 54 126.377 126.377 119.361 7.016 25974
2141 1 14 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.332 0.346 25974
2142 1 14 . 1 1 54 54 CYS H H 54 8.609 8.609 8.287 0.322 25974
2143 1 15 . 1 1 2 2 LYS N N 2 119.918 119.918 120.683 -0.765 25974
2144 1 15 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.389 0.841 25974
2145 1 15 . 1 1 2 2 LYS H H 2 8.167 8.167 8.034 0.133 25974
2146 1 15 . 1 1 3 3 TYR N N 3 122.493 122.493 118.805 3.688 25974
2147 1 15 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.728 0.081 25974
2148 1 15 . 1 1 3 3 TYR H H 3 8.939 8.939 8.308 0.631 25974
2149 1 15 . 1 1 4 4 THR N N 4 117.297 117.297 116.171 1.126 25974
2150 1 15 . 1 1 4 4 THR HA H 4 5.042 5.042 4.700 0.342 25974
2151 1 15 . 1 1 4 4 THR H H 4 8.885 8.885 8.504 0.381 25974
2152 1 15 . 1 1 5 5 GLY N N 5 115.452 115.452 112.806 2.646 25974
2153 1 15 . 1 1 5 5 GLY H H 5 9.135 9.135 9.188 -0.053 25974
2154 1 15 . 1 1 6 6 LYS N N 6 121.001 121.001 117.102 3.899 25974
2155 1 15 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.075 0.303 25974
2156 1 15 . 1 1 6 6 LYS H H 6 8.422 8.422 8.186 0.236 25974
2157 1 15 . 1 1 7 7 CYS N N 7 122.647 122.647 118.958 3.689 25974
2158 1 15 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.060 1.237 25974
2159 1 15 . 1 1 7 7 CYS H H 7 9.767 9.767 8.490 1.277 25974
2160 1 15 . 1 1 8 8 THR N N 8 113.493 113.493 116.285 -2.792 25974
2161 1 15 . 1 1 8 8 THR HA H 8 4.704 4.704 4.706 -0.002 25974
2162 1 15 . 1 1 8 8 THR H H 8 8.716 8.716 8.056 0.660 25974
2163 1 15 . 1 1 9 9 LYS N N 9 127.640 127.640 125.574 2.066 25974
2164 1 15 . 1 1 9 9 LYS HA H 9 3.493 3.493 3.986 -0.493 25974
2165 1 15 . 1 1 9 9 LYS H H 9 8.947 8.947 8.066 0.881 25974
2166 1 15 . 1 1 10 10 SER N N 10 116.726 116.726 115.622 1.104 25974
2167 1 15 . 1 1 10 10 SER HA H 10 4.006 4.006 4.216 -0.210 25974
2168 1 15 . 1 1 10 10 SER H H 10 9.484 9.484 8.252 1.232 25974
2169 1 15 . 1 1 11 11 LYS N N 11 116.973 116.973 117.890 -0.917 25974
2170 1 15 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.399 -0.246 25974
2171 1 15 . 1 1 11 11 LYS H H 11 7.051 7.051 7.759 -0.708 25974
2172 1 15 . 1 1 12 12 ASN N N 12 120.652 120.652 119.339 1.313 25974
2173 1 15 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.354 0.212 25974
2174 1 15 . 1 1 12 12 ASN H H 12 7.590 7.590 8.476 -0.886 25974
2175 1 15 . 1 1 13 13 GLU N N 13 115.322 115.322 123.397 -8.075 25974
2176 1 15 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.372 0.524 25974
2177 1 15 . 1 1 13 13 GLU H H 13 7.290 7.290 8.352 -1.062 25974
2178 1 15 . 1 1 14 14 CYS N N 14 123.345 123.345 127.102 -3.757 25974
2179 1 15 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.896 -0.257 25974
2180 1 15 . 1 1 14 14 CYS H H 14 9.588 9.588 8.759 0.829 25974
2181 1 15 . 1 1 15 15 LYS N N 15 110.722 110.722 130.280 -19.558 25974
2182 1 15 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.361 -0.415 25974
2183 1 15 . 1 1 15 15 LYS H H 15 8.636 8.636 8.330 0.306 25974
2184 1 15 . 1 1 16 16 TYR N N 16 126.630 126.630 119.835 6.795 25974
2185 1 15 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.807 0.092 25974
2186 1 15 . 1 1 16 16 TYR H H 16 8.998 8.998 8.426 0.572 25974
2187 1 15 . 1 1 17 17 LYS N N 17 120.977 120.977 119.437 1.540 25974
2188 1 15 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.635 -0.229 25974
2189 1 15 . 1 1 17 17 LYS H H 17 8.421 8.421 8.172 0.249 25974
2190 1 15 . 1 1 18 18 ASN N N 18 122.224 122.224 120.083 2.141 25974
2191 1 15 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.378 -0.276 25974
2192 1 15 . 1 1 18 18 ASN H H 18 7.735 7.735 8.194 -0.459 25974
2193 1 15 . 1 1 19 19 ASP N N 19 117.436 117.436 122.610 -5.174 25974
2194 1 15 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.505 -0.121 25974
2195 1 15 . 1 1 19 19 ASP H H 19 8.238 8.238 8.708 -0.470 25974
2196 1 15 . 1 1 20 20 ALA N N 20 120.895 120.895 120.699 0.196 25974
2197 1 15 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.515 -0.106 25974
2198 1 15 . 1 1 20 20 ALA H H 20 7.419 7.419 8.147 -0.728 25974
2199 1 15 . 1 1 21 21 GLY N N 21 127.668 127.668 107.512 20.156 25974
2200 1 15 . 1 1 21 21 GLY H H 21 8.170 8.170 8.214 -0.044 25974
2201 1 15 . 1 1 22 22 LYS N N 22 120.354 120.354 121.622 -1.268 25974
2202 1 15 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.006 0.303 25974
2203 1 15 . 1 1 22 22 LYS H H 22 7.682 7.682 7.783 -0.101 25974
2204 1 15 . 1 1 23 23 ASP N N 23 126.398 126.398 125.458 0.940 25974
2205 1 15 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.587 -0.331 25974
2206 1 15 . 1 1 23 23 ASP H H 23 8.610 8.610 8.208 0.402 25974
2207 1 15 . 1 1 24 24 THR N N 24 122.770 122.770 119.645 3.125 25974
2208 1 15 . 1 1 24 24 THR HA H 24 4.012 4.012 4.152 -0.140 25974
2209 1 15 . 1 1 24 24 THR H H 24 8.782 8.782 8.145 0.637 25974
2210 1 15 . 1 1 25 25 PHE N N 25 122.423 122.423 125.228 -2.805 25974
2211 1 15 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.104 0.300 25974
2212 1 15 . 1 1 25 25 PHE H H 25 8.328 8.328 8.192 0.136 25974
2213 1 15 . 1 1 26 26 ILE N N 26 123.029 123.029 124.608 -1.579 25974
2214 1 15 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.609 0.005 25974
2215 1 15 . 1 1 26 26 ILE H H 26 9.138 9.138 9.314 -0.176 25974
2216 1 15 . 1 1 27 27 LYS N N 27 127.077 127.077 128.663 -1.586 25974
2217 1 15 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.216 -0.053 25974
2218 1 15 . 1 1 27 27 LYS H H 27 8.335 8.335 8.398 -0.063 25974
2219 1 15 . 1 1 28 28 CYS N N 28 120.248 120.248 119.823 0.425 25974
2220 1 15 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.769 -0.110 25974
2221 1 15 . 1 1 28 28 CYS H H 28 8.618 8.618 8.482 0.136 25974
2222 1 15 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.294 0.132 25974
2223 1 15 . 1 1 30 30 LYS N N 30 115.643 115.643 119.470 -3.827 25974
2224 1 15 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.864 0.085 25974
2225 1 15 . 1 1 30 30 LYS H H 30 8.002 8.002 8.352 -0.350 25974
2226 1 15 . 1 1 31 31 PHE N N 31 116.470 116.470 117.700 -1.230 25974
2227 1 15 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.654 -0.150 25974
2228 1 15 . 1 1 31 31 PHE H H 31 6.308 6.308 7.671 -1.363 25974
2229 1 15 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.461 -0.317 25974
2230 1 15 . 1 1 33 33 ASN N N 33 113.110 113.110 115.354 -2.244 25974
2231 1 15 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.776 -0.103 25974
2232 1 15 . 1 1 33 33 ASN H H 33 8.564 8.564 8.508 0.056 25974
2233 1 15 . 1 1 34 34 LYS N N 34 120.347 120.347 118.306 2.041 25974
2234 1 15 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.532 0.452 25974
2235 1 15 . 1 1 34 34 LYS H H 34 7.914 7.914 8.166 -0.252 25974
2236 1 15 . 1 1 35 35 LYS N N 35 117.863 117.863 119.298 -1.435 25974
2237 1 15 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.379 0.229 25974
2238 1 15 . 1 1 35 35 LYS H H 35 7.005 7.005 7.550 -0.545 25974
2239 1 15 . 1 1 36 36 CYS N N 36 118.915 118.915 119.070 -0.155 25974
2240 1 15 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.389 0.468 25974
2241 1 15 . 1 1 36 36 CYS H H 36 8.817 8.817 8.808 0.009 25974
2242 1 15 . 1 1 37 37 THR N N 37 121.008 121.008 113.334 7.674 25974
2243 1 15 . 1 1 37 37 THR HA H 37 4.300 4.300 4.367 -0.067 25974
2244 1 15 . 1 1 37 37 THR H H 37 9.980 9.980 8.361 1.619 25974
2245 1 15 . 1 1 38 38 LYS N N 38 122.326 122.326 120.863 1.463 25974
2246 1 15 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.548 -0.411 25974
2247 1 15 . 1 1 38 38 LYS H H 38 7.287 7.287 7.514 -0.227 25974
2248 1 15 . 1 1 39 39 ASP N N 39 125.238 125.238 119.130 6.108 25974
2249 1 15 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.892 -0.314 25974
2250 1 15 . 1 1 39 39 ASP H H 39 8.817 8.817 8.395 0.422 25974
2251 1 15 . 1 1 40 40 ASN N N 40 114.713 114.713 122.282 -7.569 25974
2252 1 15 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.234 0.038 25974
2253 1 15 . 1 1 40 40 ASN H H 40 9.532 9.532 9.007 0.525 25974
2254 1 15 . 1 1 41 41 ASN N N 41 120.080 120.080 116.040 4.040 25974
2255 1 15 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.569 0.148 25974
2256 1 15 . 1 1 41 41 ASN H H 41 7.742 7.742 7.619 0.123 25974
2257 1 15 . 1 1 42 42 LYS N N 42 118.956 118.956 120.021 -1.065 25974
2258 1 15 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.561 -0.215 25974
2259 1 15 . 1 1 42 42 LYS H H 42 8.397 8.397 8.019 0.378 25974
2260 1 15 . 1 1 43 43 CYS N N 43 112.235 112.235 119.304 -7.069 25974
2261 1 15 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.391 -0.056 25974
2262 1 15 . 1 1 43 43 CYS H H 43 7.397 7.397 8.568 -1.171 25974
2263 1 15 . 1 1 44 44 THR N N 44 112.586 112.586 115.263 -2.677 25974
2264 1 15 . 1 1 44 44 THR HA H 44 5.221 5.221 4.855 0.366 25974
2265 1 15 . 1 1 44 44 THR H H 44 8.674 8.674 8.244 0.430 25974
2266 1 15 . 1 1 45 45 VAL N N 45 121.814 121.814 122.473 -0.659 25974
2267 1 15 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.170 0.260 25974
2268 1 15 . 1 1 45 45 VAL H H 45 8.555 8.555 8.375 0.180 25974
2269 1 15 . 1 1 46 46 ASP N N 46 126.626 126.626 125.498 1.128 25974
2270 1 15 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.008 0.326 25974
2271 1 15 . 1 1 46 46 ASP H H 46 8.519 8.519 8.261 0.258 25974
2272 1 15 . 1 1 47 47 THR N N 47 114.334 114.334 120.052 -5.718 25974
2273 1 15 . 1 1 47 47 THR HA H 47 4.187 4.187 4.595 -0.408 25974
2274 1 15 . 1 1 47 47 THR H H 47 9.116 9.116 8.821 0.295 25974
2275 1 15 . 1 1 48 48 TYR N N 48 124.010 124.010 122.491 1.519 25974
2276 1 15 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.736 -0.362 25974
2277 1 15 . 1 1 48 48 TYR H H 48 8.803 8.803 7.920 0.883 25974
2278 1 15 . 1 1 49 49 ASN N N 49 113.668 113.668 116.077 -2.409 25974
2279 1 15 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.615 -0.140 25974
2280 1 15 . 1 1 49 49 ASN H H 49 7.433 7.433 7.917 -0.484 25974
2281 1 15 . 1 1 50 50 ASN N N 50 117.403 117.403 117.793 -0.390 25974
2282 1 15 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.310 -0.111 25974
2283 1 15 . 1 1 50 50 ASN H H 50 7.863 7.863 8.057 -0.194 25974
2284 1 15 . 1 1 51 51 ALA N N 51 121.102 121.102 123.801 -2.699 25974
2285 1 15 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.585 -0.148 25974
2286 1 15 . 1 1 51 51 ALA H H 51 7.853 7.853 7.714 0.139 25974
2287 1 15 . 1 1 52 52 VAL N N 52 126.326 126.326 122.865 3.461 25974
2288 1 15 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.679 0.196 25974
2289 1 15 . 1 1 52 52 VAL H H 52 8.297 8.297 8.358 -0.061 25974
2290 1 15 . 1 1 53 53 ASP N N 53 125.100 125.100 126.070 -0.970 25974
2291 1 15 . 1 1 53 53 ASP HA H 53 4.795 4.795 5.130 -0.335 25974
2292 1 15 . 1 1 53 53 ASP H H 53 8.519 8.519 8.423 0.096 25974
2293 1 15 . 1 1 54 54 CYS N N 54 126.377 126.377 119.925 6.452 25974
2294 1 15 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.311 0.367 25974
2295 1 15 . 1 1 54 54 CYS H H 54 8.609 8.609 8.277 0.332 25974
2296 1 16 . 1 1 2 2 LYS N N 2 119.918 119.918 122.160 -2.242 25974
2297 1 16 . 1 1 2 2 LYS HA H 2 5.230 5.230 3.735 1.495 25974
2298 1 16 . 1 1 2 2 LYS H H 2 8.167 8.167 7.883 0.284 25974
2299 1 16 . 1 1 3 3 TYR N N 3 122.493 122.493 122.184 0.309 25974
2300 1 16 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.802 0.007 25974
2301 1 16 . 1 1 3 3 TYR H H 3 8.939 8.939 8.400 0.539 25974
2302 1 16 . 1 1 4 4 THR N N 4 117.297 117.297 120.491 -3.194 25974
2303 1 16 . 1 1 4 4 THR HA H 4 5.042 5.042 4.584 0.458 25974
2304 1 16 . 1 1 4 4 THR H H 4 8.885 8.885 8.917 -0.032 25974
2305 1 16 . 1 1 5 5 GLY N N 5 115.452 115.452 113.095 2.357 25974
2306 1 16 . 1 1 5 5 GLY H H 5 9.135 9.135 9.010 0.125 25974
2307 1 16 . 1 1 6 6 LYS N N 6 121.001 121.001 116.937 4.064 25974
2308 1 16 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.168 0.210 25974
2309 1 16 . 1 1 6 6 LYS H H 6 8.422 8.422 8.109 0.313 25974
2310 1 16 . 1 1 7 7 CYS N N 7 122.647 122.647 117.095 5.552 25974
2311 1 16 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.207 1.090 25974
2312 1 16 . 1 1 7 7 CYS H H 7 9.767 9.767 8.924 0.843 25974
2313 1 16 . 1 1 8 8 THR N N 8 113.493 113.493 114.539 -1.046 25974
2314 1 16 . 1 1 8 8 THR HA H 8 4.704 4.704 4.860 -0.156 25974
2315 1 16 . 1 1 8 8 THR H H 8 8.716 8.716 8.107 0.609 25974
2316 1 16 . 1 1 9 9 LYS N N 9 127.640 127.640 126.399 1.241 25974
2317 1 16 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.053 -0.560 25974
2318 1 16 . 1 1 9 9 LYS H H 9 8.947 8.947 8.637 0.310 25974
2319 1 16 . 1 1 10 10 SER N N 10 116.726 116.726 114.388 2.338 25974
2320 1 16 . 1 1 10 10 SER HA H 10 4.006 4.006 4.221 -0.215 25974
2321 1 16 . 1 1 10 10 SER H H 10 9.484 9.484 8.075 1.409 25974
2322 1 16 . 1 1 11 11 LYS N N 11 116.973 116.973 117.107 -0.134 25974
2323 1 16 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.414 -0.261 25974
2324 1 16 . 1 1 11 11 LYS H H 11 7.051 7.051 7.910 -0.859 25974
2325 1 16 . 1 1 12 12 ASN N N 12 120.652 120.652 119.241 1.411 25974
2326 1 16 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.450 0.116 25974
2327 1 16 . 1 1 12 12 ASN H H 12 7.590 7.590 8.363 -0.773 25974
2328 1 16 . 1 1 13 13 GLU N N 13 115.322 115.322 123.984 -8.662 25974
2329 1 16 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.460 0.436 25974
2330 1 16 . 1 1 13 13 GLU H H 13 7.290 7.290 8.398 -1.108 25974
2331 1 16 . 1 1 14 14 CYS N N 14 123.345 123.345 125.622 -2.277 25974
2332 1 16 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.530 0.109 25974
2333 1 16 . 1 1 14 14 CYS H H 14 9.588 9.588 8.798 0.790 25974
2334 1 16 . 1 1 15 15 LYS N N 15 110.722 110.722 130.916 -20.194 25974
2335 1 16 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.154 -0.208 25974
2336 1 16 . 1 1 15 15 LYS H H 15 8.636 8.636 8.965 -0.329 25974
2337 1 16 . 1 1 16 16 TYR N N 16 126.630 126.630 121.475 5.155 25974
2338 1 16 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.783 0.116 25974
2339 1 16 . 1 1 16 16 TYR H H 16 8.998 8.998 8.537 0.461 25974
2340 1 16 . 1 1 17 17 LYS N N 17 120.977 120.977 119.555 1.422 25974
2341 1 16 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.716 -0.310 25974
2342 1 16 . 1 1 17 17 LYS H H 17 8.421 8.421 8.098 0.323 25974
2343 1 16 . 1 1 18 18 ASN N N 18 122.224 122.224 119.656 2.568 25974
2344 1 16 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.485 -0.383 25974
2345 1 16 . 1 1 18 18 ASN H H 18 7.735 7.735 8.300 -0.565 25974
2346 1 16 . 1 1 19 19 ASP N N 19 117.436 117.436 119.365 -1.929 25974
2347 1 16 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.530 -0.146 25974
2348 1 16 . 1 1 19 19 ASP H H 19 8.238 8.238 8.126 0.112 25974
2349 1 16 . 1 1 20 20 ALA N N 20 120.895 120.895 117.978 2.917 25974
2350 1 16 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.371 0.038 25974
2351 1 16 . 1 1 20 20 ALA H H 20 7.419 7.419 7.747 -0.328 25974
2352 1 16 . 1 1 21 21 GLY N N 21 127.668 127.668 107.104 20.564 25974
2353 1 16 . 1 1 21 21 GLY H H 21 8.170 8.170 8.063 0.107 25974
2354 1 16 . 1 1 22 22 LYS N N 22 120.354 120.354 122.712 -2.358 25974
2355 1 16 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.130 0.179 25974
2356 1 16 . 1 1 22 22 LYS H H 22 7.682 7.682 7.846 -0.164 25974
2357 1 16 . 1 1 23 23 ASP N N 23 126.398 126.398 127.705 -1.307 25974
2358 1 16 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.607 -0.351 25974
2359 1 16 . 1 1 23 23 ASP H H 23 8.610 8.610 8.378 0.232 25974
2360 1 16 . 1 1 24 24 THR N N 24 122.770 122.770 119.138 3.632 25974
2361 1 16 . 1 1 24 24 THR HA H 24 4.012 4.012 4.217 -0.205 25974
2362 1 16 . 1 1 24 24 THR H H 24 8.782 8.782 8.341 0.441 25974
2363 1 16 . 1 1 25 25 PHE N N 25 122.423 122.423 124.210 -1.787 25974
2364 1 16 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.251 0.153 25974
2365 1 16 . 1 1 25 25 PHE H H 25 8.328 8.328 8.250 0.078 25974
2366 1 16 . 1 1 26 26 ILE N N 26 123.029 123.029 123.412 -0.383 25974
2367 1 16 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.608 0.006 25974
2368 1 16 . 1 1 26 26 ILE H H 26 9.138 9.138 9.181 -0.043 25974
2369 1 16 . 1 1 27 27 LYS N N 27 127.077 127.077 127.397 -0.320 25974
2370 1 16 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.192 -0.029 25974
2371 1 16 . 1 1 27 27 LYS H H 27 8.335 8.335 8.417 -0.082 25974
2372 1 16 . 1 1 28 28 CYS N N 28 120.248 120.248 122.148 -1.900 25974
2373 1 16 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.831 -0.172 25974
2374 1 16 . 1 1 28 28 CYS H H 28 8.618 8.618 8.692 -0.074 25974
2375 1 16 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.345 0.081 25974
2376 1 16 . 1 1 30 30 LYS N N 30 115.643 115.643 118.456 -2.813 25974
2377 1 16 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.821 0.128 25974
2378 1 16 . 1 1 30 30 LYS H H 30 8.002 8.002 8.184 -0.182 25974
2379 1 16 . 1 1 31 31 PHE N N 31 116.470 116.470 115.186 1.284 25974
2380 1 16 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.634 -0.130 25974
2381 1 16 . 1 1 31 31 PHE H H 31 6.308 6.308 7.507 -1.199 25974
2382 1 16 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.702 -0.558 25974
2383 1 16 . 1 1 33 33 ASN N N 33 113.110 113.110 117.581 -4.471 25974
2384 1 16 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.799 -0.126 25974
2385 1 16 . 1 1 33 33 ASN H H 33 8.564 8.564 8.257 0.307 25974
2386 1 16 . 1 1 34 34 LYS N N 34 120.347 120.347 118.249 2.098 25974
2387 1 16 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.474 0.510 25974
2388 1 16 . 1 1 34 34 LYS H H 34 7.914 7.914 8.166 -0.252 25974
2389 1 16 . 1 1 35 35 LYS N N 35 117.863 117.863 118.345 -0.482 25974
2390 1 16 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.250 0.358 25974
2391 1 16 . 1 1 35 35 LYS H H 35 7.005 7.005 7.737 -0.732 25974
2392 1 16 . 1 1 36 36 CYS N N 36 118.915 118.915 120.688 -1.773 25974
2393 1 16 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.320 0.537 25974
2394 1 16 . 1 1 36 36 CYS H H 36 8.817 8.817 8.633 0.184 25974
2395 1 16 . 1 1 37 37 THR N N 37 121.008 121.008 117.700 3.308 25974
2396 1 16 . 1 1 37 37 THR HA H 37 4.300 4.300 4.339 -0.039 25974
2397 1 16 . 1 1 37 37 THR H H 37 9.980 9.980 8.199 1.781 25974
2398 1 16 . 1 1 38 38 LYS N N 38 122.326 122.326 120.218 2.108 25974
2399 1 16 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.410 -0.273 25974
2400 1 16 . 1 1 38 38 LYS H H 38 7.287 7.287 7.497 -0.210 25974
2401 1 16 . 1 1 39 39 ASP N N 39 125.238 125.238 120.074 5.164 25974
2402 1 16 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.553 0.025 25974
2403 1 16 . 1 1 39 39 ASP H H 39 8.817 8.817 8.411 0.406 25974
2404 1 16 . 1 1 40 40 ASN N N 40 114.713 114.713 120.088 -5.375 25974
2405 1 16 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.251 0.021 25974
2406 1 16 . 1 1 40 40 ASN H H 40 9.532 9.532 8.914 0.618 25974
2407 1 16 . 1 1 41 41 ASN N N 41 120.080 120.080 115.518 4.562 25974
2408 1 16 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.646 0.071 25974
2409 1 16 . 1 1 41 41 ASN H H 41 7.742 7.742 7.853 -0.111 25974
2410 1 16 . 1 1 42 42 LYS N N 42 118.956 118.956 120.519 -1.563 25974
2411 1 16 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.566 -0.220 25974
2412 1 16 . 1 1 42 42 LYS H H 42 8.397 8.397 8.263 0.134 25974
2413 1 16 . 1 1 43 43 CYS N N 43 112.235 112.235 121.499 -9.264 25974
2414 1 16 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.522 -0.187 25974
2415 1 16 . 1 1 43 43 CYS H H 43 7.397 7.397 8.770 -1.373 25974
2416 1 16 . 1 1 44 44 THR N N 44 112.586 112.586 117.146 -4.560 25974
2417 1 16 . 1 1 44 44 THR HA H 44 5.221 5.221 5.293 -0.072 25974
2418 1 16 . 1 1 44 44 THR H H 44 8.674 8.674 8.111 0.563 25974
2419 1 16 . 1 1 45 45 VAL N N 45 121.814 121.814 125.688 -3.874 25974
2420 1 16 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.120 0.310 25974
2421 1 16 . 1 1 45 45 VAL H H 45 8.555 8.555 9.142 -0.587 25974
2422 1 16 . 1 1 46 46 ASP N N 46 126.626 126.626 126.801 -0.175 25974
2423 1 16 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.953 0.381 25974
2424 1 16 . 1 1 46 46 ASP H H 46 8.519 8.519 8.493 0.026 25974
2425 1 16 . 1 1 47 47 THR N N 47 114.334 114.334 119.464 -5.130 25974
2426 1 16 . 1 1 47 47 THR HA H 47 4.187 4.187 4.556 -0.369 25974
2427 1 16 . 1 1 47 47 THR H H 47 9.116 9.116 8.805 0.311 25974
2428 1 16 . 1 1 48 48 TYR N N 48 124.010 124.010 121.298 2.712 25974
2429 1 16 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.686 -0.312 25974
2430 1 16 . 1 1 48 48 TYR H H 48 8.803 8.803 7.776 1.027 25974
2431 1 16 . 1 1 49 49 ASN N N 49 113.668 113.668 114.697 -1.029 25974
2432 1 16 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.598 -0.123 25974
2433 1 16 . 1 1 49 49 ASN H H 49 7.433 7.433 7.971 -0.538 25974
2434 1 16 . 1 1 50 50 ASN N N 50 117.403 117.403 117.881 -0.478 25974
2435 1 16 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.344 -0.145 25974
2436 1 16 . 1 1 50 50 ASN H H 50 7.863 7.863 8.030 -0.167 25974
2437 1 16 . 1 1 51 51 ALA N N 51 121.102 121.102 123.198 -2.096 25974
2438 1 16 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.313 0.124 25974
2439 1 16 . 1 1 51 51 ALA H H 51 7.853 7.853 8.046 -0.193 25974
2440 1 16 . 1 1 52 52 VAL N N 52 126.326 126.326 121.120 5.206 25974
2441 1 16 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.904 -0.029 25974
2442 1 16 . 1 1 52 52 VAL H H 52 8.297 8.297 8.291 0.006 25974
2443 1 16 . 1 1 53 53 ASP N N 53 125.100 125.100 128.649 -3.549 25974
2444 1 16 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.942 -0.147 25974
2445 1 16 . 1 1 53 53 ASP H H 53 8.519 8.519 8.344 0.175 25974
2446 1 16 . 1 1 54 54 CYS N N 54 126.377 126.377 120.739 5.638 25974
2447 1 16 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.245 0.433 25974
2448 1 16 . 1 1 54 54 CYS H H 54 8.609 8.609 8.364 0.245 25974
2449 1 17 . 1 1 2 2 LYS N N 2 119.918 119.918 122.295 -2.377 25974
2450 1 17 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.395 0.835 25974
2451 1 17 . 1 1 2 2 LYS H H 2 8.167 8.167 7.988 0.179 25974
2452 1 17 . 1 1 3 3 TYR N N 3 122.493 122.493 124.698 -2.205 25974
2453 1 17 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.631 0.178 25974
2454 1 17 . 1 1 3 3 TYR H H 3 8.939 8.939 8.748 0.191 25974
2455 1 17 . 1 1 4 4 THR N N 4 117.297 117.297 119.195 -1.898 25974
2456 1 17 . 1 1 4 4 THR HA H 4 5.042 5.042 4.548 0.494 25974
2457 1 17 . 1 1 4 4 THR H H 4 8.885 8.885 8.655 0.230 25974
2458 1 17 . 1 1 5 5 GLY N N 5 115.452 115.452 112.885 2.567 25974
2459 1 17 . 1 1 5 5 GLY H H 5 9.135 9.135 8.920 0.215 25974
2460 1 17 . 1 1 6 6 LYS N N 6 121.001 121.001 117.043 3.958 25974
2461 1 17 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.215 0.163 25974
2462 1 17 . 1 1 6 6 LYS H H 6 8.422 8.422 8.040 0.382 25974
2463 1 17 . 1 1 7 7 CYS N N 7 122.647 122.647 115.564 7.083 25974
2464 1 17 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.297 1.000 25974
2465 1 17 . 1 1 7 7 CYS H H 7 9.767 9.767 8.802 0.965 25974
2466 1 17 . 1 1 8 8 THR N N 8 113.493 113.493 113.792 -0.299 25974
2467 1 17 . 1 1 8 8 THR HA H 8 4.704 4.704 4.936 -0.232 25974
2468 1 17 . 1 1 8 8 THR H H 8 8.716 8.716 8.063 0.653 25974
2469 1 17 . 1 1 9 9 LYS N N 9 127.640 127.640 124.412 3.228 25974
2470 1 17 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.004 -0.511 25974
2471 1 17 . 1 1 9 9 LYS H H 9 8.947 8.947 8.395 0.552 25974
2472 1 17 . 1 1 10 10 SER N N 10 116.726 116.726 115.981 0.745 25974
2473 1 17 . 1 1 10 10 SER HA H 10 4.006 4.006 4.258 -0.252 25974
2474 1 17 . 1 1 10 10 SER H H 10 9.484 9.484 7.852 1.632 25974
2475 1 17 . 1 1 11 11 LYS N N 11 116.973 116.973 123.989 -7.016 25974
2476 1 17 . 1 1 11 11 LYS HA H 11 4.153 4.153 3.989 0.164 25974
2477 1 17 . 1 1 11 11 LYS H H 11 7.051 7.051 8.606 -1.555 25974
2478 1 17 . 1 1 12 12 ASN N N 12 120.652 120.652 115.871 4.781 25974
2479 1 17 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.490 0.076 25974
2480 1 17 . 1 1 12 12 ASN H H 12 7.590 7.590 7.702 -0.112 25974
2481 1 17 . 1 1 13 13 GLU N N 13 115.322 115.322 122.541 -7.219 25974
2482 1 17 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.356 0.540 25974
2483 1 17 . 1 1 13 13 GLU H H 13 7.290 7.290 8.364 -1.074 25974
2484 1 17 . 1 1 14 14 CYS N N 14 123.345 123.345 125.326 -1.981 25974
2485 1 17 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.624 0.015 25974
2486 1 17 . 1 1 14 14 CYS H H 14 9.588 9.588 8.697 0.891 25974
2487 1 17 . 1 1 15 15 LYS N N 15 110.722 110.722 130.043 -19.321 25974
2488 1 17 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.430 -0.484 25974
2489 1 17 . 1 1 15 15 LYS H H 15 8.636 8.636 9.069 -0.433 25974
2490 1 17 . 1 1 16 16 TYR N N 16 126.630 126.630 122.482 4.148 25974
2491 1 17 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.947 -0.048 25974
2492 1 17 . 1 1 16 16 TYR H H 16 8.998 8.998 9.010 -0.012 25974
2493 1 17 . 1 1 17 17 LYS N N 17 120.977 120.977 120.026 0.951 25974
2494 1 17 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.642 -0.236 25974
2495 1 17 . 1 1 17 17 LYS H H 17 8.421 8.421 8.067 0.354 25974
2496 1 17 . 1 1 18 18 ASN N N 18 122.224 122.224 120.723 1.501 25974
2497 1 17 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.534 -0.432 25974
2498 1 17 . 1 1 18 18 ASN H H 18 7.735 7.735 8.082 -0.347 25974
2499 1 17 . 1 1 19 19 ASP N N 19 117.436 117.436 119.422 -1.986 25974
2500 1 17 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.253 0.131 25974
2501 1 17 . 1 1 19 19 ASP H H 19 8.238 8.238 8.966 -0.728 25974
2502 1 17 . 1 1 20 20 ALA N N 20 120.895 120.895 121.323 -0.428 25974
2503 1 17 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.484 -0.075 25974
2504 1 17 . 1 1 20 20 ALA H H 20 7.419 7.419 8.091 -0.672 25974
2505 1 17 . 1 1 21 21 GLY N N 21 127.668 127.668 107.575 20.093 25974
2506 1 17 . 1 1 21 21 GLY H H 21 8.170 8.170 7.823 0.347 25974
2507 1 17 . 1 1 22 22 LYS N N 22 120.354 120.354 122.154 -1.800 25974
2508 1 17 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.228 0.081 25974
2509 1 17 . 1 1 22 22 LYS H H 22 7.682 7.682 7.751 -0.069 25974
2510 1 17 . 1 1 23 23 ASP N N 23 126.398 126.398 125.302 1.096 25974
2511 1 17 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.986 -0.730 25974
2512 1 17 . 1 1 23 23 ASP H H 23 8.610 8.610 8.439 0.171 25974
2513 1 17 . 1 1 24 24 THR N N 24 122.770 122.770 119.239 3.531 25974
2514 1 17 . 1 1 24 24 THR HA H 24 4.012 4.012 4.256 -0.244 25974
2515 1 17 . 1 1 24 24 THR H H 24 8.782 8.782 8.316 0.466 25974
2516 1 17 . 1 1 25 25 PHE N N 25 122.423 122.423 123.551 -1.128 25974
2517 1 17 . 1 1 25 25 PHE HA H 25 5.404 5.404 5.382 0.022 25974
2518 1 17 . 1 1 25 25 PHE H H 25 8.328 8.328 8.175 0.153 25974
2519 1 17 . 1 1 26 26 ILE N N 26 123.029 123.029 120.644 2.385 25974
2520 1 17 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.457 0.157 25974
2521 1 17 . 1 1 26 26 ILE H H 26 9.138 9.138 8.775 0.363 25974
2522 1 17 . 1 1 27 27 LYS N N 27 127.077 127.077 128.373 -1.296 25974
2523 1 17 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.306 -0.143 25974
2524 1 17 . 1 1 27 27 LYS H H 27 8.335 8.335 8.285 0.050 25974
2525 1 17 . 1 1 28 28 CYS N N 28 120.248 120.248 121.604 -1.356 25974
2526 1 17 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.718 -0.059 25974
2527 1 17 . 1 1 28 28 CYS H H 28 8.618 8.618 8.607 0.011 25974
2528 1 17 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.337 0.089 25974
2529 1 17 . 1 1 30 30 LYS N N 30 115.643 115.643 119.093 -3.450 25974
2530 1 17 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.842 0.107 25974
2531 1 17 . 1 1 30 30 LYS H H 30 8.002 8.002 8.182 -0.180 25974
2532 1 17 . 1 1 31 31 PHE N N 31 116.470 116.470 115.400 1.070 25974
2533 1 17 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.614 -0.110 25974
2534 1 17 . 1 1 31 31 PHE H H 31 6.308 6.308 7.331 -1.023 25974
2535 1 17 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.718 -0.574 25974
2536 1 17 . 1 1 33 33 ASN N N 33 113.110 113.110 116.415 -3.305 25974
2537 1 17 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.853 -0.180 25974
2538 1 17 . 1 1 33 33 ASN H H 33 8.564 8.564 8.425 0.139 25974
2539 1 17 . 1 1 34 34 LYS N N 34 120.347 120.347 118.228 2.119 25974
2540 1 17 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.465 0.518 25974
2541 1 17 . 1 1 34 34 LYS H H 34 7.914 7.914 8.122 -0.208 25974
2542 1 17 . 1 1 35 35 LYS N N 35 117.863 117.863 119.982 -2.119 25974
2543 1 17 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.351 0.257 25974
2544 1 17 . 1 1 35 35 LYS H H 35 7.005 7.005 7.716 -0.711 25974
2545 1 17 . 1 1 36 36 CYS N N 36 118.915 118.915 119.798 -0.883 25974
2546 1 17 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.452 0.405 25974
2547 1 17 . 1 1 36 36 CYS H H 36 8.817 8.817 8.856 -0.039 25974
2548 1 17 . 1 1 37 37 THR N N 37 121.008 121.008 116.345 4.663 25974
2549 1 17 . 1 1 37 37 THR HA H 37 4.300 4.300 4.368 -0.068 25974
2550 1 17 . 1 1 37 37 THR H H 37 9.980 9.980 8.061 1.919 25974
2551 1 17 . 1 1 38 38 LYS N N 38 122.326 122.326 120.090 2.236 25974
2552 1 17 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.335 -0.198 25974
2553 1 17 . 1 1 38 38 LYS H H 38 7.287 7.287 7.576 -0.289 25974
2554 1 17 . 1 1 39 39 ASP N N 39 125.238 125.238 120.764 4.474 25974
2555 1 17 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.679 -0.101 25974
2556 1 17 . 1 1 39 39 ASP H H 39 8.817 8.817 8.459 0.358 25974
2557 1 17 . 1 1 40 40 ASN N N 40 114.713 114.713 121.570 -6.857 25974
2558 1 17 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.274 -0.002 25974
2559 1 17 . 1 1 40 40 ASN H H 40 9.532 9.532 8.893 0.639 25974
2560 1 17 . 1 1 41 41 ASN N N 41 120.080 120.080 115.584 4.496 25974
2561 1 17 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.638 0.079 25974
2562 1 17 . 1 1 41 41 ASN H H 41 7.742 7.742 7.840 -0.098 25974
2563 1 17 . 1 1 42 42 LYS N N 42 118.956 118.956 119.872 -0.916 25974
2564 1 17 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.620 -0.274 25974
2565 1 17 . 1 1 42 42 LYS H H 42 8.397 8.397 8.069 0.328 25974
2566 1 17 . 1 1 43 43 CYS N N 43 112.235 112.235 119.673 -7.438 25974
2567 1 17 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.258 0.077 25974
2568 1 17 . 1 1 43 43 CYS H H 43 7.397 7.397 9.075 -1.678 25974
2569 1 17 . 1 1 44 44 THR N N 44 112.586 112.586 114.088 -1.502 25974
2570 1 17 . 1 1 44 44 THR HA H 44 5.221 5.221 5.358 -0.137 25974
2571 1 17 . 1 1 44 44 THR H H 44 8.674 8.674 8.312 0.362 25974
2572 1 17 . 1 1 45 45 VAL N N 45 121.814 121.814 118.404 3.410 25974
2573 1 17 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.396 0.034 25974
2574 1 17 . 1 1 45 45 VAL H H 45 8.555 8.555 8.823 -0.268 25974
2575 1 17 . 1 1 46 46 ASP N N 46 126.626 126.626 127.322 -0.696 25974
2576 1 17 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.021 0.313 25974
2577 1 17 . 1 1 46 46 ASP H H 46 8.519 8.519 8.529 -0.010 25974
2578 1 17 . 1 1 47 47 THR N N 47 114.334 114.334 120.405 -6.071 25974
2579 1 17 . 1 1 47 47 THR HA H 47 4.187 4.187 4.511 -0.324 25974
2580 1 17 . 1 1 47 47 THR H H 47 9.116 9.116 8.898 0.218 25974
2581 1 17 . 1 1 48 48 TYR N N 48 124.010 124.010 121.147 2.863 25974
2582 1 17 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.671 -0.297 25974
2583 1 17 . 1 1 48 48 TYR H H 48 8.803 8.803 8.152 0.651 25974
2584 1 17 . 1 1 49 49 ASN N N 49 113.668 113.668 115.275 -1.607 25974
2585 1 17 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.741 -0.266 25974
2586 1 17 . 1 1 49 49 ASN H H 49 7.433 7.433 8.021 -0.589 25974
2587 1 17 . 1 1 50 50 ASN N N 50 117.403 117.403 118.408 -1.005 25974
2588 1 17 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.505 -0.306 25974
2589 1 17 . 1 1 50 50 ASN H H 50 7.863 7.863 7.996 -0.133 25974
2590 1 17 . 1 1 51 51 ALA N N 51 121.102 121.102 123.815 -2.713 25974
2591 1 17 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.661 -0.224 25974
2592 1 17 . 1 1 51 51 ALA H H 51 7.853 7.853 7.637 0.216 25974
2593 1 17 . 1 1 52 52 VAL N N 52 126.326 126.326 122.568 3.758 25974
2594 1 17 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.705 0.170 25974
2595 1 17 . 1 1 52 52 VAL H H 52 8.297 8.297 8.315 -0.018 25974
2596 1 17 . 1 1 53 53 ASP N N 53 125.100 125.100 127.606 -2.506 25974
2597 1 17 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.901 -0.106 25974
2598 1 17 . 1 1 53 53 ASP H H 53 8.519 8.519 8.304 0.215 25974
2599 1 17 . 1 1 54 54 CYS N N 54 126.377 126.377 118.190 8.187 25974
2600 1 17 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.528 0.150 25974
2601 1 17 . 1 1 54 54 CYS H H 54 8.609 8.609 8.408 0.201 25974
2602 1 18 . 1 1 2 2 LYS N N 2 119.918 119.918 119.558 0.360 25974
2603 1 18 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.308 0.922 25974
2604 1 18 . 1 1 2 2 LYS H H 2 8.167 8.167 7.468 0.699 25974
2605 1 18 . 1 1 3 3 TYR N N 3 122.493 122.493 123.536 -1.043 25974
2606 1 18 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.496 0.313 25974
2607 1 18 . 1 1 3 3 TYR H H 3 8.939 8.939 8.235 0.704 25974
2608 1 18 . 1 1 4 4 THR N N 4 117.297 117.297 116.619 0.678 25974
2609 1 18 . 1 1 4 4 THR HA H 4 5.042 5.042 4.607 0.435 25974
2610 1 18 . 1 1 4 4 THR H H 4 8.885 8.885 8.459 0.426 25974
2611 1 18 . 1 1 5 5 GLY N N 5 115.452 115.452 111.637 3.815 25974
2612 1 18 . 1 1 5 5 GLY H H 5 9.135 9.135 8.954 0.180 25974
2613 1 18 . 1 1 6 6 LYS N N 6 121.001 121.001 117.172 3.829 25974
2614 1 18 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.156 0.222 25974
2615 1 18 . 1 1 6 6 LYS H H 6 8.422 8.422 8.190 0.232 25974
2616 1 18 . 1 1 7 7 CYS N N 7 122.647 122.647 117.696 4.951 25974
2617 1 18 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.280 1.017 25974
2618 1 18 . 1 1 7 7 CYS H H 7 9.767 9.767 9.018 0.749 25974
2619 1 18 . 1 1 8 8 THR N N 8 113.493 113.493 113.704 -0.211 25974
2620 1 18 . 1 1 8 8 THR HA H 8 4.704 4.704 4.747 -0.043 25974
2621 1 18 . 1 1 8 8 THR H H 8 8.716 8.716 8.043 0.673 25974
2622 1 18 . 1 1 9 9 LYS N N 9 127.640 127.640 126.141 1.499 25974
2623 1 18 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.079 -0.586 25974
2624 1 18 . 1 1 9 9 LYS H H 9 8.947 8.947 8.336 0.611 25974
2625 1 18 . 1 1 10 10 SER N N 10 116.726 116.726 116.039 0.687 25974
2626 1 18 . 1 1 10 10 SER HA H 10 4.006 4.006 4.209 -0.203 25974
2627 1 18 . 1 1 10 10 SER H H 10 9.484 9.484 8.058 1.426 25974
2628 1 18 . 1 1 11 11 LYS N N 11 116.973 116.973 118.172 -1.199 25974
2629 1 18 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.380 -0.227 25974
2630 1 18 . 1 1 11 11 LYS H H 11 7.051 7.051 8.289 -1.238 25974
2631 1 18 . 1 1 12 12 ASN N N 12 120.652 120.652 118.939 1.713 25974
2632 1 18 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.524 0.042 25974
2633 1 18 . 1 1 12 12 ASN H H 12 7.590 7.590 8.229 -0.639 25974
2634 1 18 . 1 1 13 13 GLU N N 13 115.322 115.322 123.996 -8.674 25974
2635 1 18 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.565 0.331 25974
2636 1 18 . 1 1 13 13 GLU H H 13 7.290 7.290 8.379 -1.089 25974
2637 1 18 . 1 1 14 14 CYS N N 14 123.345 123.345 124.342 -0.997 25974
2638 1 18 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.618 0.021 25974
2639 1 18 . 1 1 14 14 CYS H H 14 9.588 9.588 8.842 0.746 25974
2640 1 18 . 1 1 15 15 LYS N N 15 110.722 110.722 128.921 -18.199 25974
2641 1 18 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.093 -0.147 25974
2642 1 18 . 1 1 15 15 LYS H H 15 8.636 8.636 8.404 0.232 25974
2643 1 18 . 1 1 16 16 TYR N N 16 126.630 126.630 120.572 6.058 25974
2644 1 18 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.880 0.019 25974
2645 1 18 . 1 1 16 16 TYR H H 16 8.998 8.998 8.129 0.869 25974
2646 1 18 . 1 1 17 17 LYS N N 17 120.977 120.977 118.418 2.559 25974
2647 1 18 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.529 -0.123 25974
2648 1 18 . 1 1 17 17 LYS H H 17 8.421 8.421 8.385 0.036 25974
2649 1 18 . 1 1 18 18 ASN N N 18 122.224 122.224 118.861 3.363 25974
2650 1 18 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.216 -0.114 25974
2651 1 18 . 1 1 18 18 ASN H H 18 7.735 7.735 7.888 -0.153 25974
2652 1 18 . 1 1 19 19 ASP N N 19 117.436 117.436 121.530 -4.094 25974
2653 1 18 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.395 -0.011 25974
2654 1 18 . 1 1 19 19 ASP H H 19 8.238 8.238 8.477 -0.239 25974
2655 1 18 . 1 1 20 20 ALA N N 20 120.895 120.895 121.094 -0.199 25974
2656 1 18 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.473 -0.064 25974
2657 1 18 . 1 1 20 20 ALA H H 20 7.419 7.419 8.104 -0.685 25974
2658 1 18 . 1 1 21 21 GLY N N 21 127.668 127.668 107.675 19.993 25974
2659 1 18 . 1 1 21 21 GLY H H 21 8.170 8.170 8.195 -0.025 25974
2660 1 18 . 1 1 22 22 LYS N N 22 120.354 120.354 121.890 -1.536 25974
2661 1 18 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.031 0.278 25974
2662 1 18 . 1 1 22 22 LYS H H 22 7.682 7.682 7.764 -0.082 25974
2663 1 18 . 1 1 23 23 ASP N N 23 126.398 126.398 124.140 2.258 25974
2664 1 18 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.543 -0.287 25974
2665 1 18 . 1 1 23 23 ASP H H 23 8.610 8.610 8.159 0.451 25974
2666 1 18 . 1 1 24 24 THR N N 24 122.770 122.770 119.575 3.195 25974
2667 1 18 . 1 1 24 24 THR HA H 24 4.012 4.012 4.219 -0.207 25974
2668 1 18 . 1 1 24 24 THR H H 24 8.782 8.782 8.196 0.586 25974
2669 1 18 . 1 1 25 25 PHE N N 25 122.423 122.423 127.011 -4.588 25974
2670 1 18 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.591 0.813 25974
2671 1 18 . 1 1 25 25 PHE H H 25 8.328 8.328 8.049 0.279 25974
2672 1 18 . 1 1 26 26 ILE N N 26 123.029 123.029 123.740 -0.711 25974
2673 1 18 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.586 0.028 25974
2674 1 18 . 1 1 26 26 ILE H H 26 9.138 9.138 8.513 0.625 25974
2675 1 18 . 1 1 27 27 LYS N N 27 127.077 127.077 126.156 0.921 25974
2676 1 18 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.289 -0.126 25974
2677 1 18 . 1 1 27 27 LYS H H 27 8.335 8.335 8.370 -0.035 25974
2678 1 18 . 1 1 28 28 CYS N N 28 120.248 120.248 121.884 -1.636 25974
2679 1 18 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.858 -0.199 25974
2680 1 18 . 1 1 28 28 CYS H H 28 8.618 8.618 8.666 -0.048 25974
2681 1 18 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.333 0.093 25974
2682 1 18 . 1 1 30 30 LYS N N 30 115.643 115.643 118.376 -2.733 25974
2683 1 18 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.888 0.061 25974
2684 1 18 . 1 1 30 30 LYS H H 30 8.002 8.002 8.272 -0.270 25974
2685 1 18 . 1 1 31 31 PHE N N 31 116.470 116.470 115.600 0.870 25974
2686 1 18 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.581 -0.077 25974
2687 1 18 . 1 1 31 31 PHE H H 31 6.308 6.308 7.240 -0.932 25974
2688 1 18 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.756 -0.612 25974
2689 1 18 . 1 1 33 33 ASN N N 33 113.110 113.110 116.698 -3.588 25974
2690 1 18 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.859 -0.186 25974
2691 1 18 . 1 1 33 33 ASN H H 33 8.564 8.564 8.262 0.302 25974
2692 1 18 . 1 1 34 34 LYS N N 34 120.347 120.347 119.266 1.081 25974
2693 1 18 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.346 0.638 25974
2694 1 18 . 1 1 34 34 LYS H H 34 7.914 7.914 8.268 -0.354 25974
2695 1 18 . 1 1 35 35 LYS N N 35 117.863 117.863 118.980 -1.117 25974
2696 1 18 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.258 0.350 25974
2697 1 18 . 1 1 35 35 LYS H H 35 7.005 7.005 7.687 -0.682 25974
2698 1 18 . 1 1 36 36 CYS N N 36 118.915 118.915 119.449 -0.534 25974
2699 1 18 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.374 0.483 25974
2700 1 18 . 1 1 36 36 CYS H H 36 8.817 8.817 8.756 0.061 25974
2701 1 18 . 1 1 37 37 THR N N 37 121.008 121.008 120.747 0.261 25974
2702 1 18 . 1 1 37 37 THR HA H 37 4.300 4.300 4.426 -0.126 25974
2703 1 18 . 1 1 37 37 THR H H 37 9.980 9.980 8.589 1.391 25974
2704 1 18 . 1 1 38 38 LYS N N 38 122.326 122.326 120.265 2.061 25974
2705 1 18 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.404 -0.267 25974
2706 1 18 . 1 1 38 38 LYS H H 38 7.287 7.287 7.682 -0.395 25974
2707 1 18 . 1 1 39 39 ASP N N 39 125.238 125.238 122.132 3.106 25974
2708 1 18 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.574 0.004 25974
2709 1 18 . 1 1 39 39 ASP H H 39 8.817 8.817 8.540 0.277 25974
2710 1 18 . 1 1 40 40 ASN N N 40 114.713 114.713 120.812 -6.099 25974
2711 1 18 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.265 0.007 25974
2712 1 18 . 1 1 40 40 ASN H H 40 9.532 9.532 8.649 0.883 25974
2713 1 18 . 1 1 41 41 ASN N N 41 120.080 120.080 117.000 3.080 25974
2714 1 18 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.618 0.099 25974
2715 1 18 . 1 1 41 41 ASN H H 41 7.742 7.742 7.826 -0.084 25974
2716 1 18 . 1 1 42 42 LYS N N 42 118.956 118.956 121.451 -2.495 25974
2717 1 18 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.507 -0.161 25974
2718 1 18 . 1 1 42 42 LYS H H 42 8.397 8.397 8.209 0.188 25974
2719 1 18 . 1 1 43 43 CYS N N 43 112.235 112.235 122.235 -10.000 25974
2720 1 18 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.438 -0.103 25974
2721 1 18 . 1 1 43 43 CYS H H 43 7.397 7.397 8.807 -1.410 25974
2722 1 18 . 1 1 44 44 THR N N 44 112.586 112.586 115.168 -2.582 25974
2723 1 18 . 1 1 44 44 THR HA H 44 5.221 5.221 4.849 0.372 25974
2724 1 18 . 1 1 44 44 THR H H 44 8.674 8.674 7.880 0.794 25974
2725 1 18 . 1 1 45 45 VAL N N 45 121.814 121.814 117.392 4.422 25974
2726 1 18 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.579 -0.149 25974
2727 1 18 . 1 1 45 45 VAL H H 45 8.555 8.555 8.839 -0.284 25974
2728 1 18 . 1 1 46 46 ASP N N 46 126.626 126.626 123.641 2.985 25974
2729 1 18 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.036 0.298 25974
2730 1 18 . 1 1 46 46 ASP H H 46 8.519 8.519 8.280 0.239 25974
2731 1 18 . 1 1 47 47 THR N N 47 114.334 114.334 121.328 -6.994 25974
2732 1 18 . 1 1 47 47 THR HA H 47 4.187 4.187 4.298 -0.111 25974
2733 1 18 . 1 1 47 47 THR H H 47 9.116 9.116 8.972 0.144 25974
2734 1 18 . 1 1 48 48 TYR N N 48 124.010 124.010 121.795 2.215 25974
2735 1 18 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.257 0.117 25974
2736 1 18 . 1 1 48 48 TYR H H 48 8.803 8.803 7.902 0.901 25974
2737 1 18 . 1 1 49 49 ASN N N 49 113.668 113.668 112.721 0.947 25974
2738 1 18 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.795 -0.320 25974
2739 1 18 . 1 1 49 49 ASN H H 49 7.433 7.433 7.742 -0.309 25974
2740 1 18 . 1 1 50 50 ASN N N 50 117.403 117.403 116.955 0.448 25974
2741 1 18 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.351 -0.152 25974
2742 1 18 . 1 1 50 50 ASN H H 50 7.863 7.863 8.218 -0.355 25974
2743 1 18 . 1 1 51 51 ALA N N 51 121.102 121.102 123.249 -2.147 25974
2744 1 18 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.618 -0.181 25974
2745 1 18 . 1 1 51 51 ALA H H 51 7.853 7.853 7.820 0.033 25974
2746 1 18 . 1 1 52 52 VAL N N 52 126.326 126.326 123.700 2.626 25974
2747 1 18 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.542 0.333 25974
2748 1 18 . 1 1 52 52 VAL H H 52 8.297 8.297 8.356 -0.059 25974
2749 1 18 . 1 1 53 53 ASP N N 53 125.100 125.100 130.164 -5.064 25974
2750 1 18 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.908 -0.113 25974
2751 1 18 . 1 1 53 53 ASP H H 53 8.519 8.519 8.205 0.314 25974
2752 1 18 . 1 1 54 54 CYS N N 54 126.377 126.377 119.779 6.598 25974
2753 1 18 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.288 0.390 25974
2754 1 18 . 1 1 54 54 CYS H H 54 8.609 8.609 8.085 0.524 25974
2755 1 19 . 1 1 2 2 LYS N N 2 119.918 119.918 121.223 -1.305 25974
2756 1 19 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.058 1.172 25974
2757 1 19 . 1 1 2 2 LYS H H 2 8.167 8.167 8.044 0.123 25974
2758 1 19 . 1 1 3 3 TYR N N 3 122.493 122.493 117.381 5.112 25974
2759 1 19 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.819 -0.010 25974
2760 1 19 . 1 1 3 3 TYR H H 3 8.939 8.939 8.538 0.401 25974
2761 1 19 . 1 1 4 4 THR N N 4 117.297 117.297 115.908 1.389 25974
2762 1 19 . 1 1 4 4 THR HA H 4 5.042 5.042 4.702 0.340 25974
2763 1 19 . 1 1 4 4 THR H H 4 8.885 8.885 8.571 0.314 25974
2764 1 19 . 1 1 5 5 GLY N N 5 115.452 115.452 112.166 3.286 25974
2765 1 19 . 1 1 5 5 GLY H H 5 9.135 9.135 9.200 -0.065 25974
2766 1 19 . 1 1 6 6 LYS N N 6 121.001 121.001 117.386 3.615 25974
2767 1 19 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.101 0.277 25974
2768 1 19 . 1 1 6 6 LYS H H 6 8.422 8.422 8.277 0.145 25974
2769 1 19 . 1 1 7 7 CYS N N 7 122.647 122.647 117.078 5.569 25974
2770 1 19 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.273 1.024 25974
2771 1 19 . 1 1 7 7 CYS H H 7 9.767 9.767 8.864 0.903 25974
2772 1 19 . 1 1 8 8 THR N N 8 113.493 113.493 114.463 -0.970 25974
2773 1 19 . 1 1 8 8 THR HA H 8 4.704 4.704 5.026 -0.322 25974
2774 1 19 . 1 1 8 8 THR H H 8 8.716 8.716 8.196 0.520 25974
2775 1 19 . 1 1 9 9 LYS N N 9 127.640 127.640 126.670 0.970 25974
2776 1 19 . 1 1 9 9 LYS HA H 9 3.493 3.493 3.972 -0.479 25974
2777 1 19 . 1 1 9 9 LYS H H 9 8.947 8.947 8.574 0.373 25974
2778 1 19 . 1 1 10 10 SER N N 10 116.726 116.726 116.394 0.332 25974
2779 1 19 . 1 1 10 10 SER HA H 10 4.006 4.006 4.187 -0.181 25974
2780 1 19 . 1 1 10 10 SER H H 10 9.484 9.484 7.873 1.611 25974
2781 1 19 . 1 1 11 11 LYS N N 11 116.973 116.973 117.483 -0.510 25974
2782 1 19 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.426 -0.273 25974
2783 1 19 . 1 1 11 11 LYS H H 11 7.051 7.051 8.063 -1.012 25974
2784 1 19 . 1 1 12 12 ASN N N 12 120.652 120.652 120.008 0.644 25974
2785 1 19 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.436 0.130 25974
2786 1 19 . 1 1 12 12 ASN H H 12 7.590 7.590 8.158 -0.568 25974
2787 1 19 . 1 1 13 13 GLU N N 13 115.322 115.322 122.707 -7.385 25974
2788 1 19 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.320 0.576 25974
2789 1 19 . 1 1 13 13 GLU H H 13 7.290 7.290 8.222 -0.932 25974
2790 1 19 . 1 1 14 14 CYS N N 14 123.345 123.345 125.126 -1.781 25974
2791 1 19 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.634 0.005 25974
2792 1 19 . 1 1 14 14 CYS H H 14 9.588 9.588 8.656 0.932 25974
2793 1 19 . 1 1 15 15 LYS N N 15 110.722 110.722 129.166 -18.444 25974
2794 1 19 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.060 -0.114 25974
2795 1 19 . 1 1 15 15 LYS H H 15 8.636 8.636 8.362 0.274 25974
2796 1 19 . 1 1 16 16 TYR N N 16 126.630 126.630 120.289 6.341 25974
2797 1 19 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.796 0.103 25974
2798 1 19 . 1 1 16 16 TYR H H 16 8.998 8.998 8.220 0.778 25974
2799 1 19 . 1 1 17 17 LYS N N 17 120.977 120.977 118.991 1.986 25974
2800 1 19 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.489 -0.083 25974
2801 1 19 . 1 1 17 17 LYS H H 17 8.421 8.421 8.214 0.207 25974
2802 1 19 . 1 1 18 18 ASN N N 18 122.224 122.224 119.546 2.678 25974
2803 1 19 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.423 -0.321 25974
2804 1 19 . 1 1 18 18 ASN H H 18 7.735 7.735 8.043 -0.308 25974
2805 1 19 . 1 1 19 19 ASP N N 19 117.436 117.436 120.636 -3.200 25974
2806 1 19 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.630 -0.246 25974
2807 1 19 . 1 1 19 19 ASP H H 19 8.238 8.238 7.957 0.281 25974
2808 1 19 . 1 1 20 20 ALA N N 20 120.895 120.895 119.382 1.513 25974
2809 1 19 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.045 0.364 25974
2810 1 19 . 1 1 20 20 ALA H H 20 7.419 7.419 7.833 -0.414 25974
2811 1 19 . 1 1 21 21 GLY N N 21 127.668 127.668 102.419 25.249 25974
2812 1 19 . 1 1 21 21 GLY H H 21 8.170 8.170 7.971 0.199 25974
2813 1 19 . 1 1 22 22 LYS N N 22 120.354 120.354 123.608 -3.254 25974
2814 1 19 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.113 0.196 25974
2815 1 19 . 1 1 22 22 LYS H H 22 7.682 7.682 7.971 -0.289 25974
2816 1 19 . 1 1 23 23 ASP N N 23 126.398 126.398 126.186 0.212 25974
2817 1 19 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.765 -0.509 25974
2818 1 19 . 1 1 23 23 ASP H H 23 8.610 8.610 8.163 0.447 25974
2819 1 19 . 1 1 24 24 THR N N 24 122.770 122.770 119.323 3.447 25974
2820 1 19 . 1 1 24 24 THR HA H 24 4.012 4.012 4.175 -0.163 25974
2821 1 19 . 1 1 24 24 THR H H 24 8.782 8.782 8.209 0.573 25974
2822 1 19 . 1 1 25 25 PHE N N 25 122.423 122.423 124.623 -2.200 25974
2823 1 19 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.911 0.493 25974
2824 1 19 . 1 1 25 25 PHE H H 25 8.328 8.328 8.133 0.195 25974
2825 1 19 . 1 1 26 26 ILE N N 26 123.029 123.029 119.247 3.782 25974
2826 1 19 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.378 0.236 25974
2827 1 19 . 1 1 26 26 ILE H H 26 9.138 9.138 8.412 0.726 25974
2828 1 19 . 1 1 27 27 LYS N N 27 127.077 127.077 127.627 -0.550 25974
2829 1 19 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.375 -0.212 25974
2830 1 19 . 1 1 27 27 LYS H H 27 8.335 8.335 8.192 0.143 25974
2831 1 19 . 1 1 28 28 CYS N N 28 120.248 120.248 124.214 -3.966 25974
2832 1 19 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.418 0.241 25974
2833 1 19 . 1 1 28 28 CYS H H 28 8.618 8.618 8.840 -0.222 25974
2834 1 19 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.286 0.140 25974
2835 1 19 . 1 1 30 30 LYS N N 30 115.643 115.643 118.056 -2.413 25974
2836 1 19 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.847 0.102 25974
2837 1 19 . 1 1 30 30 LYS H H 30 8.002 8.002 8.507 -0.505 25974
2838 1 19 . 1 1 31 31 PHE N N 31 116.470 116.470 117.235 -0.765 25974
2839 1 19 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.633 -0.129 25974
2840 1 19 . 1 1 31 31 PHE H H 31 6.308 6.308 7.421 -1.113 25974
2841 1 19 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.513 -0.369 25974
2842 1 19 . 1 1 33 33 ASN N N 33 113.110 113.110 117.060 -3.950 25974
2843 1 19 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.760 -0.087 25974
2844 1 19 . 1 1 33 33 ASN H H 33 8.564 8.564 8.286 0.278 25974
2845 1 19 . 1 1 34 34 LYS N N 34 120.347 120.347 118.965 1.382 25974
2846 1 19 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.414 0.570 25974
2847 1 19 . 1 1 34 34 LYS H H 34 7.914 7.914 8.079 -0.165 25974
2848 1 19 . 1 1 35 35 LYS N N 35 117.863 117.863 119.655 -1.792 25974
2849 1 19 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.298 0.310 25974
2850 1 19 . 1 1 35 35 LYS H H 35 7.005 7.005 7.396 -0.391 25974
2851 1 19 . 1 1 36 36 CYS N N 36 118.915 118.915 118.940 -0.025 25974
2852 1 19 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.428 0.429 25974
2853 1 19 . 1 1 36 36 CYS H H 36 8.817 8.817 8.690 0.127 25974
2854 1 19 . 1 1 37 37 THR N N 37 121.008 121.008 113.737 7.271 25974
2855 1 19 . 1 1 37 37 THR HA H 37 4.300 4.300 4.397 -0.097 25974
2856 1 19 . 1 1 37 37 THR H H 37 9.980 9.980 8.255 1.725 25974
2857 1 19 . 1 1 38 38 LYS N N 38 122.326 122.326 120.921 1.405 25974
2858 1 19 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.457 -0.320 25974
2859 1 19 . 1 1 38 38 LYS H H 38 7.287 7.287 7.510 -0.223 25974
2860 1 19 . 1 1 39 39 ASP N N 39 125.238 125.238 121.514 3.724 25974
2861 1 19 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.843 -0.265 25974
2862 1 19 . 1 1 39 39 ASP H H 39 8.817 8.817 8.503 0.314 25974
2863 1 19 . 1 1 40 40 ASN N N 40 114.713 114.713 120.703 -5.990 25974
2864 1 19 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.258 0.014 25974
2865 1 19 . 1 1 40 40 ASN H H 40 9.532 9.532 8.709 0.823 25974
2866 1 19 . 1 1 41 41 ASN N N 41 120.080 120.080 117.130 2.950 25974
2867 1 19 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.573 0.144 25974
2868 1 19 . 1 1 41 41 ASN H H 41 7.742 7.742 7.871 -0.129 25974
2869 1 19 . 1 1 42 42 LYS N N 42 118.956 118.956 120.994 -2.038 25974
2870 1 19 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.509 -0.163 25974
2871 1 19 . 1 1 42 42 LYS H H 42 8.397 8.397 8.354 0.043 25974
2872 1 19 . 1 1 43 43 CYS N N 43 112.235 112.235 120.992 -8.757 25974
2873 1 19 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.409 -0.074 25974
2874 1 19 . 1 1 43 43 CYS H H 43 7.397 7.397 8.675 -1.278 25974
2875 1 19 . 1 1 44 44 THR N N 44 112.586 112.586 116.767 -4.181 25974
2876 1 19 . 1 1 44 44 THR HA H 44 5.221 5.221 4.759 0.462 25974
2877 1 19 . 1 1 44 44 THR H H 44 8.674 8.674 8.384 0.290 25974
2878 1 19 . 1 1 45 45 VAL N N 45 121.814 121.814 125.024 -3.210 25974
2879 1 19 . 1 1 45 45 VAL HA H 45 4.430 4.430 3.914 0.516 25974
2880 1 19 . 1 1 45 45 VAL H H 45 8.555 8.555 8.786 -0.231 25974
2881 1 19 . 1 1 46 46 ASP N N 46 126.626 126.626 128.259 -1.633 25974
2882 1 19 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.913 0.421 25974
2883 1 19 . 1 1 46 46 ASP H H 46 8.519 8.519 8.022 0.497 25974
2884 1 19 . 1 1 47 47 THR N N 47 114.334 114.334 120.080 -5.746 25974
2885 1 19 . 1 1 47 47 THR HA H 47 4.187 4.187 4.230 -0.043 25974
2886 1 19 . 1 1 47 47 THR H H 47 9.116 9.116 8.825 0.291 25974
2887 1 19 . 1 1 48 48 TYR N N 48 124.010 124.010 121.775 2.235 25974
2888 1 19 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.252 0.122 25974
2889 1 19 . 1 1 48 48 TYR H H 48 8.803 8.803 8.242 0.561 25974
2890 1 19 . 1 1 49 49 ASN N N 49 113.668 113.668 113.662 0.006 25974
2891 1 19 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.724 -0.249 25974
2892 1 19 . 1 1 49 49 ASN H H 49 7.433 7.433 7.778 -0.345 25974
2893 1 19 . 1 1 50 50 ASN N N 50 117.403 117.403 117.319 0.084 25974
2894 1 19 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.329 -0.130 25974
2895 1 19 . 1 1 50 50 ASN H H 50 7.863 7.863 8.009 -0.146 25974
2896 1 19 . 1 1 51 51 ALA N N 51 121.102 121.102 121.935 -0.833 25974
2897 1 19 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.473 -0.036 25974
2898 1 19 . 1 1 51 51 ALA H H 51 7.853 7.853 7.711 0.142 25974
2899 1 19 . 1 1 52 52 VAL N N 52 126.326 126.326 121.727 4.599 25974
2900 1 19 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.401 0.474 25974
2901 1 19 . 1 1 52 52 VAL H H 52 8.297 8.297 8.039 0.258 25974
2902 1 19 . 1 1 53 53 ASP N N 53 125.100 125.100 130.106 -5.006 25974
2903 1 19 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.828 -0.033 25974
2904 1 19 . 1 1 53 53 ASP H H 53 8.519 8.519 8.303 0.216 25974
2905 1 19 . 1 1 54 54 CYS N N 54 126.377 126.377 117.819 8.558 25974
2906 1 19 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.437 0.241 25974
2907 1 19 . 1 1 54 54 CYS H H 54 8.609 8.609 7.823 0.786 25974
2908 1 20 . 1 1 2 2 LYS N N 2 119.918 119.918 120.353 -0.435 25974
2909 1 20 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.533 0.697 25974
2910 1 20 . 1 1 2 2 LYS H H 2 8.167 8.167 7.592 0.575 25974
2911 1 20 . 1 1 3 3 TYR N N 3 122.493 122.493 126.549 -4.056 25974
2912 1 20 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.762 0.047 25974
2913 1 20 . 1 1 3 3 TYR H H 3 8.939 8.939 8.754 0.185 25974
2914 1 20 . 1 1 4 4 THR N N 4 117.297 117.297 120.424 -3.127 25974
2915 1 20 . 1 1 4 4 THR HA H 4 5.042 5.042 4.744 0.298 25974
2916 1 20 . 1 1 4 4 THR H H 4 8.885 8.885 8.893 -0.008 25974
2917 1 20 . 1 1 5 5 GLY N N 5 115.452 115.452 112.627 2.825 25974
2918 1 20 . 1 1 5 5 GLY H H 5 9.135 9.135 8.045 1.090 25974
2919 1 20 . 1 1 6 6 LYS N N 6 121.001 121.001 116.888 4.113 25974
2920 1 20 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.172 0.206 25974
2921 1 20 . 1 1 6 6 LYS H H 6 8.422 8.422 7.861 0.561 25974
2922 1 20 . 1 1 7 7 CYS N N 7 122.647 122.647 116.876 5.771 25974
2923 1 20 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.053 1.244 25974
2924 1 20 . 1 1 7 7 CYS H H 7 9.767 9.767 8.675 1.092 25974
2925 1 20 . 1 1 8 8 THR N N 8 113.493 113.493 112.899 0.594 25974
2926 1 20 . 1 1 8 8 THR HA H 8 4.704 4.704 4.718 -0.014 25974
2927 1 20 . 1 1 8 8 THR H H 8 8.716 8.716 8.050 0.666 25974
2928 1 20 . 1 1 9 9 LYS N N 9 127.640 127.640 125.731 1.909 25974
2929 1 20 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.013 -0.520 25974
2930 1 20 . 1 1 9 9 LYS H H 9 8.947 8.947 8.399 0.548 25974
2931 1 20 . 1 1 10 10 SER N N 10 116.726 116.726 117.277 -0.551 25974
2932 1 20 . 1 1 10 10 SER HA H 10 4.006 4.006 4.227 -0.221 25974
2933 1 20 . 1 1 10 10 SER H H 10 9.484 9.484 8.087 1.397 25974
2934 1 20 . 1 1 11 11 LYS N N 11 116.973 116.973 117.275 -0.302 25974
2935 1 20 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.444 -0.291 25974
2936 1 20 . 1 1 11 11 LYS H H 11 7.051 7.051 8.188 -1.137 25974
2937 1 20 . 1 1 12 12 ASN N N 12 120.652 120.652 119.542 1.110 25974
2938 1 20 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.458 0.108 25974
2939 1 20 . 1 1 12 12 ASN H H 12 7.590 7.590 8.319 -0.729 25974
2940 1 20 . 1 1 13 13 GLU N N 13 115.322 115.322 123.088 -7.766 25974
2941 1 20 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.594 0.302 25974
2942 1 20 . 1 1 13 13 GLU H H 13 7.290 7.290 8.296 -1.006 25974
2943 1 20 . 1 1 14 14 CYS N N 14 123.345 123.345 127.054 -3.709 25974
2944 1 20 . 1 1 14 14 CYS HA H 14 4.639 4.639 5.022 -0.383 25974
2945 1 20 . 1 1 14 14 CYS H H 14 9.588 9.588 9.125 0.463 25974
2946 1 20 . 1 1 15 15 LYS N N 15 110.722 110.722 130.219 -19.497 25974
2947 1 20 . 1 1 15 15 LYS HA H 15 4.946 4.946 4.689 0.257 25974
2948 1 20 . 1 1 15 15 LYS H H 15 8.636 8.636 8.532 0.104 25974
2949 1 20 . 1 1 16 16 TYR N N 16 126.630 126.630 120.965 5.665 25974
2950 1 20 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.793 0.106 25974
2951 1 20 . 1 1 16 16 TYR H H 16 8.998 8.998 8.014 0.984 25974
2952 1 20 . 1 1 17 17 LYS N N 17 120.977 120.977 120.405 0.572 25974
2953 1 20 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.352 0.054 25974
2954 1 20 . 1 1 17 17 LYS H H 17 8.421 8.421 8.228 0.193 25974
2955 1 20 . 1 1 18 18 ASN N N 18 122.224 122.224 122.582 -0.358 25974
2956 1 20 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.391 -0.289 25974
2957 1 20 . 1 1 18 18 ASN H H 18 7.735 7.735 8.342 -0.607 25974
2958 1 20 . 1 1 19 19 ASP N N 19 117.436 117.436 121.859 -4.423 25974
2959 1 20 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.439 -0.055 25974
2960 1 20 . 1 1 19 19 ASP H H 19 8.238 8.238 8.300 -0.062 25974
2961 1 20 . 1 1 20 20 ALA N N 20 120.895 120.895 119.024 1.871 25974
2962 1 20 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.403 0.006 25974
2963 1 20 . 1 1 20 20 ALA H H 20 7.419 7.419 7.839 -0.420 25974
2964 1 20 . 1 1 21 21 GLY N N 21 127.668 127.668 105.879 21.789 25974
2965 1 20 . 1 1 21 21 GLY H H 21 8.170 8.170 7.992 0.178 25974
2966 1 20 . 1 1 22 22 LYS N N 22 120.354 120.354 123.193 -2.839 25974
2967 1 20 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.093 0.216 25974
2968 1 20 . 1 1 22 22 LYS H H 22 7.682 7.682 7.985 -0.303 25974
2969 1 20 . 1 1 23 23 ASP N N 23 126.398 126.398 123.846 2.552 25974
2970 1 20 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.551 -0.295 25974
2971 1 20 . 1 1 23 23 ASP H H 23 8.610 8.610 8.264 0.346 25974
2972 1 20 . 1 1 24 24 THR N N 24 122.770 122.770 119.546 3.224 25974
2973 1 20 . 1 1 24 24 THR HA H 24 4.012 4.012 4.617 -0.605 25974
2974 1 20 . 1 1 24 24 THR H H 24 8.782 8.782 7.852 0.930 25974
2975 1 20 . 1 1 25 25 PHE N N 25 122.423 122.423 128.358 -5.935 25974
2976 1 20 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.687 0.717 25974
2977 1 20 . 1 1 25 25 PHE H H 25 8.328 8.328 9.065 -0.737 25974
2978 1 20 . 1 1 26 26 ILE N N 26 123.029 123.029 123.216 -0.187 25974
2979 1 20 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.627 -0.013 25974
2980 1 20 . 1 1 26 26 ILE H H 26 9.138 9.138 8.973 0.165 25974
2981 1 20 . 1 1 27 27 LYS N N 27 127.077 127.077 127.568 -0.491 25974
2982 1 20 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.397 -0.234 25974
2983 1 20 . 1 1 27 27 LYS H H 27 8.335 8.335 8.327 0.008 25974
2984 1 20 . 1 1 28 28 CYS N N 28 120.248 120.248 121.648 -1.400 25974
2985 1 20 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.882 -0.223 25974
2986 1 20 . 1 1 28 28 CYS H H 28 8.618 8.618 8.542 0.076 25974
2987 1 20 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.389 0.037 25974
2988 1 20 . 1 1 30 30 LYS N N 30 115.643 115.643 118.695 -3.052 25974
2989 1 20 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.774 0.175 25974
2990 1 20 . 1 1 30 30 LYS H H 30 8.002 8.002 8.207 -0.205 25974
2991 1 20 . 1 1 31 31 PHE N N 31 116.470 116.470 116.454 0.016 25974
2992 1 20 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.736 -0.232 25974
2993 1 20 . 1 1 31 31 PHE H H 31 6.308 6.308 7.294 -0.986 25974
2994 1 20 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.456 -0.312 25974
2995 1 20 . 1 1 33 33 ASN N N 33 113.110 113.110 115.710 -2.600 25974
2996 1 20 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.752 -0.079 25974
2997 1 20 . 1 1 33 33 ASN H H 33 8.564 8.564 8.156 0.408 25974
2998 1 20 . 1 1 34 34 LYS N N 34 120.347 120.347 118.308 2.039 25974
2999 1 20 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.446 0.538 25974
3000 1 20 . 1 1 34 34 LYS H H 34 7.914 7.914 7.991 -0.077 25974
3001 1 20 . 1 1 35 35 LYS N N 35 117.863 117.863 118.314 -0.451 25974
3002 1 20 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.342 0.266 25974
3003 1 20 . 1 1 35 35 LYS H H 35 7.005 7.005 7.450 -0.445 25974
3004 1 20 . 1 1 36 36 CYS N N 36 118.915 118.915 119.680 -0.765 25974
3005 1 20 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.366 0.491 25974
3006 1 20 . 1 1 36 36 CYS H H 36 8.817 8.817 8.869 -0.052 25974
3007 1 20 . 1 1 37 37 THR N N 37 121.008 121.008 113.365 7.643 25974
3008 1 20 . 1 1 37 37 THR HA H 37 4.300 4.300 4.484 -0.184 25974
3009 1 20 . 1 1 37 37 THR H H 37 9.980 9.980 8.562 1.418 25974
3010 1 20 . 1 1 38 38 LYS N N 38 122.326 122.326 120.491 1.835 25974
3011 1 20 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.499 -0.362 25974
3012 1 20 . 1 1 38 38 LYS H H 38 7.287 7.287 7.546 -0.259 25974
3013 1 20 . 1 1 39 39 ASP N N 39 125.238 125.238 120.592 4.646 25974
3014 1 20 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.637 -0.059 25974
3015 1 20 . 1 1 39 39 ASP H H 39 8.817 8.817 8.640 0.177 25974
3016 1 20 . 1 1 40 40 ASN N N 40 114.713 114.713 121.872 -7.159 25974
3017 1 20 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.378 -0.106 25974
3018 1 20 . 1 1 40 40 ASN H H 40 9.532 9.532 8.920 0.612 25974
3019 1 20 . 1 1 41 41 ASN N N 41 120.080 120.080 116.217 3.863 25974
3020 1 20 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.612 0.105 25974
3021 1 20 . 1 1 41 41 ASN H H 41 7.742 7.742 7.897 -0.155 25974
3022 1 20 . 1 1 42 42 LYS N N 42 118.956 118.956 119.969 -1.013 25974
3023 1 20 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.625 -0.279 25974
3024 1 20 . 1 1 42 42 LYS H H 42 8.397 8.397 8.182 0.215 25974
3025 1 20 . 1 1 43 43 CYS N N 43 112.235 112.235 119.458 -7.223 25974
3026 1 20 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.262 0.073 25974
3027 1 20 . 1 1 43 43 CYS H H 43 7.397 7.397 8.449 -1.052 25974
3028 1 20 . 1 1 44 44 THR N N 44 112.586 112.586 114.352 -1.766 25974
3029 1 20 . 1 1 44 44 THR HA H 44 5.221 5.221 4.998 0.223 25974
3030 1 20 . 1 1 44 44 THR H H 44 8.674 8.674 8.108 0.566 25974
3031 1 20 . 1 1 45 45 VAL N N 45 121.814 121.814 124.035 -2.221 25974
3032 1 20 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.098 0.332 25974
3033 1 20 . 1 1 45 45 VAL H H 45 8.555 8.555 9.088 -0.533 25974
3034 1 20 . 1 1 46 46 ASP N N 46 126.626 126.626 126.788 -0.162 25974
3035 1 20 . 1 1 46 46 ASP HA H 46 5.334 5.334 4.956 0.378 25974
3036 1 20 . 1 1 46 46 ASP H H 46 8.519 8.519 8.160 0.359 25974
3037 1 20 . 1 1 47 47 THR N N 47 114.334 114.334 119.726 -5.392 25974
3038 1 20 . 1 1 47 47 THR HA H 47 4.187 4.187 4.539 -0.352 25974
3039 1 20 . 1 1 47 47 THR H H 47 9.116 9.116 8.839 0.277 25974
3040 1 20 . 1 1 48 48 TYR N N 48 124.010 124.010 121.041 2.969 25974
3041 1 20 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.663 -0.289 25974
3042 1 20 . 1 1 48 48 TYR H H 48 8.803 8.803 8.084 0.719 25974
3043 1 20 . 1 1 49 49 ASN N N 49 113.668 113.668 116.365 -2.697 25974
3044 1 20 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.664 -0.189 25974
3045 1 20 . 1 1 49 49 ASN H H 49 7.433 7.433 7.994 -0.561 25974
3046 1 20 . 1 1 50 50 ASN N N 50 117.403 117.403 118.687 -1.284 25974
3047 1 20 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.391 -0.192 25974
3048 1 20 . 1 1 50 50 ASN H H 50 7.863 7.863 7.949 -0.086 25974
3049 1 20 . 1 1 51 51 ALA N N 51 121.102 121.102 125.555 -4.453 25974
3050 1 20 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.395 0.042 25974
3051 1 20 . 1 1 51 51 ALA H H 51 7.853 7.853 7.641 0.212 25974
3052 1 20 . 1 1 52 52 VAL N N 52 126.326 126.326 122.794 3.532 25974
3053 1 20 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.748 0.127 25974
3054 1 20 . 1 1 52 52 VAL H H 52 8.297 8.297 8.368 -0.071 25974
3055 1 20 . 1 1 53 53 ASP N N 53 125.100 125.100 130.241 -5.141 25974
3056 1 20 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.930 -0.135 25974
3057 1 20 . 1 1 53 53 ASP H H 53 8.519 8.519 8.726 -0.207 25974
3058 1 20 . 1 1 54 54 CYS N N 54 126.377 126.377 117.945 8.432 25974
3059 1 20 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.367 0.311 25974
3060 1 20 . 1 1 54 54 CYS H H 54 8.609 8.609 8.030 0.579 25974
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 51 5.136 -0.091 5.186 25974
2 1 1 "Average Difference" HA 55 0.345 -0.027 0.347 25974
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25974
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25974
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25974
6 1 1 "Average Difference" HN 51 0.565 -0.077 0.565 25974
7 1 2 "Average Difference" N 51 5.311 0.038 5.364 25974
8 1 2 "Average Difference" HA 55 0.329 -0.006 0.332 25974
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25974
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25974
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25974
12 1 2 "Average Difference" HN 51 0.578 -0.065 0.580 25974
13 1 3 "Average Difference" N 51 5.258 -0.481 5.288 25974
14 1 3 "Average Difference" HA 55 0.399 -0.048 0.399 25974
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25974
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25974
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25974
18 1 3 "Average Difference" HN 51 0.599 -0.128 0.591 25974
19 1 4 "Average Difference" N 51 5.678 0.155 5.732 25974
20 1 4 "Average Difference" HA 55 0.340 -0.007 0.343 25974
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25974
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25974
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25974
24 1 4 "Average Difference" HN 51 0.571 -0.083 0.571 25974
25 1 5 "Average Difference" N 51 5.241 0.196 5.289 25974
26 1 5 "Average Difference" HA 55 0.367 -0.032 0.369 25974
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25974
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25974
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25974
30 1 5 "Average Difference" HN 51 0.624 -0.077 0.626 25974
31 1 6 "Average Difference" N 51 5.299 0.070 5.351 25974
32 1 6 "Average Difference" HA 55 0.338 -0.009 0.340 25974
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25974
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25974
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25974
36 1 6 "Average Difference" HN 51 0.573 -0.061 0.575 25974
37 1 7 "Average Difference" N 51 5.075 -0.000 5.126 25974
38 1 7 "Average Difference" HA 55 0.321 0.016 0.324 25974
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25974
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25974
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25974
42 1 7 "Average Difference" HN 51 0.610 -0.010 0.616 25974
43 1 8 "Average Difference" N 51 5.055 -0.003 5.105 25974
44 1 8 "Average Difference" HA 55 0.311 0.023 0.313 25974
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25974
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25974
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25974
48 1 8 "Average Difference" HN 51 0.571 0.014 0.576 25974
49 1 9 "Average Difference" N 51 5.218 -0.072 5.270 25974
50 1 9 "Average Difference" HA 55 0.334 0.020 0.337 25974
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25974
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25974
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25974
54 1 9 "Average Difference" HN 51 0.579 0.007 0.585 25974
55 1 10 "Average Difference" N 51 5.328 0.025 5.381 25974
56 1 10 "Average Difference" HA 55 0.317 -0.013 0.320 25974
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25974
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25974
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25974
60 1 10 "Average Difference" HN 51 0.634 -0.047 0.638 25974
61 1 11 "Average Difference" N 51 5.500 -0.196 5.551 25974
62 1 11 "Average Difference" HA 55 0.305 -0.016 0.308 25974
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25974
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25974
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25974
66 1 11 "Average Difference" HN 51 0.598 -0.063 0.601 25974
67 1 12 "Average Difference" N 51 5.183 -0.026 5.235 25974
68 1 12 "Average Difference" HA 55 0.339 -0.018 0.341 25974
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25974
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25974
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25974
72 1 12 "Average Difference" HN 51 0.592 -0.085 0.592 25974
73 1 13 "Average Difference" N 51 5.553 -0.230 5.603 25974
74 1 13 "Average Difference" HA 55 0.350 -0.054 0.349 25974
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25974
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25974
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25974
78 1 13 "Average Difference" HN 51 0.587 -0.086 0.587 25974
79 1 14 "Average Difference" N 51 5.457 0.155 5.509 25974
80 1 14 "Average Difference" HA 55 0.311 -0.036 0.312 25974
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25974
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25974
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25974
84 1 14 "Average Difference" HN 51 0.579 -0.074 0.580 25974
85 1 15 "Average Difference" N 51 5.244 -0.007 5.296 25974
86 1 15 "Average Difference" HA 55 0.333 -0.014 0.336 25974
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25974
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25974
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25974
90 1 15 "Average Difference" HN 51 0.606 -0.099 0.604 25974
91 1 16 "Average Difference" N 51 5.292 0.172 5.342 25974
92 1 16 "Average Difference" HA 55 0.362 -0.019 0.365 25974
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25974
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25974
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25974
96 1 16 "Average Difference" HN 51 0.596 -0.056 0.600 25974
97 1 17 "Average Difference" N 51 5.270 -0.039 5.322 25974
98 1 17 "Average Difference" HA 55 0.330 0.016 0.332 25974
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25974
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25974
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25974
102 1 17 "Average Difference" HN 51 0.642 -0.055 0.646 25974
103 1 18 "Average Difference" N 51 5.136 -0.003 5.187 25974
104 1 18 "Average Difference" HA 55 0.331 -0.048 0.331 25974
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25974
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25974
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25974
108 1 18 "Average Difference" HN 51 0.619 -0.122 0.613 25974
109 1 19 "Average Difference" N 51 5.695 -0.165 5.749 25974
110 1 19 "Average Difference" HA 55 0.358 -0.065 0.355 25974
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25974
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25974
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25974
114 1 19 "Average Difference" HN 51 0.602 -0.140 0.591 25974
115 1 20 "Average Difference" N 51 5.505 0.264 5.554 25974
116 1 20 "Average Difference" HA 55 0.345 -0.011 0.348 25974
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25974
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25974
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25974
120 1 20 "Average Difference" HN 51 0.613 -0.106 0.610 25974
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 25974
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 LYS N N 2 119.918 119.918 120.897 -0.979 25974
2 1 . 1 1 2 2 LYS HA H 2 5.230 5.230 4.280 0.950 25974
3 1 . 1 1 2 2 LYS H H 2 8.167 8.167 7.859 0.308 25974
4 1 . 1 1 3 3 TYR N N 3 122.493 122.493 122.492 0.001 25974
5 1 . 1 1 3 3 TYR HA H 3 4.809 4.809 4.726 0.083 25974
6 1 . 1 1 3 3 TYR H H 3 8.939 8.939 8.703 0.236 25974
7 1 . 1 1 4 4 THR N N 4 117.297 117.297 117.287 0.010 25974
8 1 . 1 1 4 4 THR HA H 4 5.042 5.042 4.630 0.412 25974
9 1 . 1 1 4 4 THR H H 4 8.885 8.885 8.588 0.297 25974
10 1 . 1 1 5 5 GLY N N 5 115.452 115.452 112.480 2.972 25974
11 1 . 1 1 5 5 GLY H H 5 9.135 9.135 8.969 0.166 25974
12 1 . 1 1 6 6 LYS N N 6 121.001 121.001 117.123 3.878 25974
13 1 . 1 1 6 6 LYS HA H 6 5.378 5.378 5.171 0.207 25974
14 1 . 1 1 6 6 LYS H H 6 8.422 8.422 8.065 0.357 25974
15 1 . 1 1 7 7 CYS N N 7 122.647 122.647 117.181 5.466 25974
16 1 . 1 1 7 7 CYS HA H 7 6.297 6.297 5.250 1.047 25974
17 1 . 1 1 7 7 CYS H H 7 9.767 9.767 8.865 0.902 25974
18 1 . 1 1 8 8 THR N N 8 113.493 113.493 114.225 -0.732 25974
19 1 . 1 1 8 8 THR HA H 8 4.704 4.704 4.842 -0.138 25974
20 1 . 1 1 8 8 THR H H 8 8.716 8.716 8.189 0.527 25974
21 1 . 1 1 9 9 LYS N N 9 127.640 127.640 126.004 1.636 25974
22 1 . 1 1 9 9 LYS HA H 9 3.493 3.493 4.055 -0.562 25974
23 1 . 1 1 9 9 LYS H H 9 8.947 8.947 8.543 0.404 25974
24 1 . 1 1 10 10 SER N N 10 116.726 116.726 115.983 0.743 25974
25 1 . 1 1 10 10 SER HA H 10 4.006 4.006 4.225 -0.219 25974
26 1 . 1 1 10 10 SER H H 10 9.484 9.484 8.073 1.411 25974
27 1 . 1 1 11 11 LYS N N 11 116.973 116.973 118.282 -1.309 25974
28 1 . 1 1 11 11 LYS HA H 11 4.153 4.153 4.406 -0.253 25974
29 1 . 1 1 11 11 LYS H H 11 7.051 7.051 8.086 -1.035 25974
30 1 . 1 1 12 12 ASN N N 12 120.652 120.652 118.618 2.034 25974
31 1 . 1 1 12 12 ASN HA H 12 4.566 4.566 4.461 0.105 25974
32 1 . 1 1 12 12 ASN H H 12 7.590 7.590 8.257 -0.667 25974
33 1 . 1 1 13 13 GLU N N 13 115.322 115.322 122.942 -7.620 25974
34 1 . 1 1 13 13 GLU HA H 13 4.896 4.896 4.441 0.455 25974
35 1 . 1 1 13 13 GLU H H 13 7.290 7.290 8.337 -1.047 25974
36 1 . 1 1 14 14 CYS N N 14 123.345 123.345 125.775 -2.430 25974
37 1 . 1 1 14 14 CYS HA H 14 4.639 4.639 4.717 -0.078 25974
38 1 . 1 1 14 14 CYS H H 14 9.588 9.588 8.820 0.768 25974
39 1 . 1 1 15 15 LYS N N 15 110.722 110.722 129.760 -19.038 25974
40 1 . 1 1 15 15 LYS HA H 15 4.946 4.946 5.128 -0.182 25974
41 1 . 1 1 15 15 LYS H H 15 8.636 8.636 8.683 -0.047 25974
42 1 . 1 1 16 16 TYR N N 16 126.630 126.630 120.572 6.058 25974
43 1 . 1 1 16 16 TYR HA H 16 4.899 4.899 4.835 0.064 25974
44 1 . 1 1 16 16 TYR H H 16 8.998 8.998 8.600 0.398 25974
45 1 . 1 1 17 17 LYS N N 17 120.977 120.977 119.386 1.591 25974
46 1 . 1 1 17 17 LYS HA H 17 4.406 4.406 4.586 -0.180 25974
47 1 . 1 1 17 17 LYS H H 17 8.421 8.421 8.208 0.213 25974
48 1 . 1 1 18 18 ASN N N 18 122.224 122.224 120.168 2.056 25974
49 1 . 1 1 18 18 ASN HA H 18 4.102 4.102 4.420 -0.318 25974
50 1 . 1 1 18 18 ASN H H 18 7.735 7.735 8.107 -0.372 25974
51 1 . 1 1 19 19 ASP N N 19 117.436 117.436 120.874 -3.438 25974
52 1 . 1 1 19 19 ASP HA H 19 4.384 4.384 4.459 -0.075 25974
53 1 . 1 1 19 19 ASP H H 19 8.238 8.238 8.476 -0.238 25974
54 1 . 1 1 20 20 ALA N N 20 120.895 120.895 120.193 0.702 25974
55 1 . 1 1 20 20 ALA HA H 20 4.409 4.409 4.360 0.049 25974
56 1 . 1 1 20 20 ALA H H 20 7.419 7.419 7.951 -0.532 25974
57 1 . 1 1 21 21 GLY N N 21 127.668 127.668 106.243 21.425 25974
58 1 . 1 1 21 21 GLY H H 21 8.170 8.170 7.989 0.181 25974
59 1 . 1 1 22 22 LYS N N 22 120.354 120.354 122.586 -2.232 25974
60 1 . 1 1 22 22 LYS HA H 22 4.309 4.309 4.117 0.192 25974
61 1 . 1 1 22 22 LYS H H 22 7.682 7.682 7.865 -0.183 25974
62 1 . 1 1 23 23 ASP N N 23 126.398 126.398 125.402 0.996 25974
63 1 . 1 1 23 23 ASP HA H 23 4.256 4.256 4.583 -0.327 25974
64 1 . 1 1 23 23 ASP H H 23 8.610 8.610 8.298 0.312 25974
65 1 . 1 1 24 24 THR N N 24 122.770 122.770 119.381 3.389 25974
66 1 . 1 1 24 24 THR HA H 24 4.012 4.012 4.328 -0.316 25974
67 1 . 1 1 24 24 THR H H 24 8.782 8.782 8.162 0.620 25974
68 1 . 1 1 25 25 PHE N N 25 122.423 122.423 125.294 -2.871 25974
69 1 . 1 1 25 25 PHE HA H 25 5.404 5.404 4.978 0.426 25974
70 1 . 1 1 25 25 PHE H H 25 8.328 8.328 8.469 -0.141 25974
71 1 . 1 1 26 26 ILE N N 26 123.029 123.029 123.471 -0.442 25974
72 1 . 1 1 26 26 ILE HA H 26 4.614 4.614 4.571 0.043 25974
73 1 . 1 1 26 26 ILE H H 26 9.138 9.138 8.912 0.227 25974
74 1 . 1 1 27 27 LYS N N 27 127.077 127.077 127.796 -0.719 25974
75 1 . 1 1 27 27 LYS HA H 27 4.163 4.163 4.282 -0.119 25974
76 1 . 1 1 27 27 LYS H H 27 8.335 8.335 8.353 -0.018 25974
77 1 . 1 1 28 28 CYS N N 28 120.248 120.248 121.318 -1.070 25974
78 1 . 1 1 28 28 CYS HA H 28 4.659 4.659 4.764 -0.105 25974
79 1 . 1 1 28 28 CYS H H 28 8.618 8.618 8.647 -0.029 25974
80 1 . 1 1 29 29 PRO HA H 29 4.426 4.426 4.356 0.070 25974
81 1 . 1 1 30 30 LYS N N 30 115.643 115.643 118.728 -3.085 25974
82 1 . 1 1 30 30 LYS HA H 30 3.949 3.949 3.843 0.106 25974
83 1 . 1 1 30 30 LYS H H 30 8.002 8.002 8.252 -0.250 25974
84 1 . 1 1 31 31 PHE N N 31 116.470 116.470 116.286 0.184 25974
85 1 . 1 1 31 31 PHE HA H 31 4.504 4.504 4.637 -0.133 25974
86 1 . 1 1 31 31 PHE H H 31 6.308 6.308 7.477 -1.169 25974
87 1 . 1 1 32 32 ASP HA H 32 4.144 4.144 4.607 -0.463 25974
88 1 . 1 1 33 33 ASN N N 33 113.110 113.110 116.300 -3.190 25974
89 1 . 1 1 33 33 ASN HA H 33 4.673 4.673 4.823 -0.150 25974
90 1 . 1 1 33 33 ASN H H 33 8.564 8.564 8.286 0.278 25974
91 1 . 1 1 34 34 LYS N N 34 120.347 120.347 118.584 1.763 25974
92 1 . 1 1 34 34 LYS HA H 34 4.984 4.984 4.456 0.528 25974
93 1 . 1 1 34 34 LYS H H 34 7.914 7.914 8.114 -0.200 25974
94 1 . 1 1 35 35 LYS N N 35 117.863 117.863 118.437 -0.574 25974
95 1 . 1 1 35 35 LYS HA H 35 4.608 4.608 4.307 0.301 25974
96 1 . 1 1 35 35 LYS H H 35 7.005 7.005 7.617 -0.612 25974
97 1 . 1 1 36 36 CYS N N 36 118.915 118.915 119.853 -0.938 25974
98 1 . 1 1 36 36 CYS HA H 36 4.857 4.857 4.404 0.453 25974
99 1 . 1 1 36 36 CYS H H 36 8.817 8.817 8.662 0.155 25974
100 1 . 1 1 37 37 THR N N 37 121.008 121.008 115.950 5.058 25974
101 1 . 1 1 37 37 THR HA H 37 4.300 4.300 4.421 -0.121 25974
102 1 . 1 1 37 37 THR H H 37 9.980 9.980 8.431 1.549 25974
103 1 . 1 1 38 38 LYS N N 38 122.326 122.326 120.717 1.609 25974
104 1 . 1 1 38 38 LYS HA H 38 4.137 4.137 4.465 -0.328 25974
105 1 . 1 1 38 38 LYS H H 38 7.287 7.287 7.585 -0.298 25974
106 1 . 1 1 39 39 ASP N N 39 125.238 125.238 120.707 4.531 25974
107 1 . 1 1 39 39 ASP HA H 39 4.578 4.578 4.632 -0.054 25974
108 1 . 1 1 39 39 ASP H H 39 8.817 8.817 8.490 0.327 25974
109 1 . 1 1 40 40 ASN N N 40 114.713 114.713 120.747 -6.034 25974
110 1 . 1 1 40 40 ASN HA H 40 4.272 4.272 4.280 -0.008 25974
111 1 . 1 1 40 40 ASN H H 40 9.532 9.532 8.875 0.656 25974
112 1 . 1 1 41 41 ASN N N 41 120.080 120.080 116.372 3.708 25974
113 1 . 1 1 41 41 ASN HA H 41 4.717 4.717 4.622 0.095 25974
114 1 . 1 1 41 41 ASN H H 41 7.742 7.742 7.875 -0.133 25974
115 1 . 1 1 42 42 LYS N N 42 118.956 118.956 120.482 -1.526 25974
116 1 . 1 1 42 42 LYS HA H 42 4.346 4.346 4.552 -0.206 25974
117 1 . 1 1 42 42 LYS H H 42 8.397 8.397 8.314 0.083 25974
118 1 . 1 1 43 43 CYS N N 43 112.235 112.235 120.849 -8.614 25974
119 1 . 1 1 43 43 CYS HA H 43 5.335 5.335 5.412 -0.077 25974
120 1 . 1 1 43 43 CYS H H 43 7.397 7.397 8.714 -1.317 25974
121 1 . 1 1 44 44 THR N N 44 112.586 112.586 115.666 -3.080 25974
122 1 . 1 1 44 44 THR HA H 44 5.221 5.221 5.029 0.192 25974
123 1 . 1 1 44 44 THR H H 44 8.674 8.674 8.225 0.449 25974
124 1 . 1 1 45 45 VAL N N 45 121.814 121.814 123.158 -1.344 25974
125 1 . 1 1 45 45 VAL HA H 45 4.430 4.430 4.194 0.236 25974
126 1 . 1 1 45 45 VAL H H 45 8.555 8.555 8.644 -0.089 25974
127 1 . 1 1 46 46 ASP N N 46 126.626 126.626 126.480 0.146 25974
128 1 . 1 1 46 46 ASP HA H 46 5.334 5.334 5.035 0.299 25974
129 1 . 1 1 46 46 ASP H H 46 8.519 8.519 8.411 0.108 25974
130 1 . 1 1 47 47 THR N N 47 114.334 114.334 119.273 -4.939 25974
131 1 . 1 1 47 47 THR HA H 47 4.187 4.187 4.398 -0.211 25974
132 1 . 1 1 47 47 THR H H 47 9.116 9.116 8.767 0.349 25974
133 1 . 1 1 48 48 TYR N N 48 124.010 124.010 121.798 2.212 25974
134 1 . 1 1 48 48 TYR HA H 48 4.374 4.374 4.514 -0.140 25974
135 1 . 1 1 48 48 TYR H H 48 8.803 8.803 8.102 0.701 25974
136 1 . 1 1 49 49 ASN N N 49 113.668 113.668 114.683 -1.015 25974
137 1 . 1 1 49 49 ASN HA H 49 4.475 4.475 4.659 -0.184 25974
138 1 . 1 1 49 49 ASN H H 49 7.433 7.433 7.905 -0.472 25974
139 1 . 1 1 50 50 ASN N N 50 117.403 117.403 118.190 -0.787 25974
140 1 . 1 1 50 50 ASN HA H 50 4.199 4.199 4.343 -0.144 25974
141 1 . 1 1 50 50 ASN H H 50 7.863 7.863 8.068 -0.205 25974
142 1 . 1 1 51 51 ALA N N 51 121.102 121.102 123.262 -2.160 25974
143 1 . 1 1 51 51 ALA HA H 51 4.437 4.437 4.496 -0.059 25974
144 1 . 1 1 51 51 ALA H H 51 7.853 7.853 7.719 0.134 25974
145 1 . 1 1 52 52 VAL N N 52 126.326 126.326 121.531 4.795 25974
146 1 . 1 1 52 52 VAL HA H 52 4.875 4.875 4.691 0.184 25974
147 1 . 1 1 52 52 VAL H H 52 8.297 8.297 8.260 0.037 25974
148 1 . 1 1 53 53 ASP N N 53 125.100 125.100 128.478 -3.378 25974
149 1 . 1 1 53 53 ASP HA H 53 4.795 4.795 4.992 -0.197 25974
150 1 . 1 1 53 53 ASP H H 53 8.519 8.519 8.462 0.057 25974
151 1 . 1 1 54 54 CYS N N 54 126.377 126.377 119.191 7.186 25974
152 1 . 1 1 54 54 CYS HA H 54 4.678 4.678 4.369 0.309 25974
153 1 . 1 1 54 54 CYS H H 54 8.609 8.609 8.165 0.444 25974
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