data_18002
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18002
_Entry.PDB_ID 2LKO
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 18002
_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 3 3 HIS HA H 365 4.125 4.125 4.865 -0.740 18002
2 1 1 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.291 -1.276 18002
3 1 1 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.754 1.175 18002
4 1 1 . 1 1 4 4 MET N N 366 120.431 120.431 120.091 0.340 18002
5 1 1 . 1 1 4 4 MET HA H 366 4.345 4.345 4.590 -0.245 18002
6 1 1 . 1 1 4 4 MET CA C 366 55.337 55.337 56.106 -0.769 18002
7 1 1 . 1 1 4 4 MET CB C 366 32.668 32.668 32.524 0.144 18002
8 1 1 . 1 1 4 4 MET H H 366 8.373 8.373 8.462 -0.089 18002
9 1 1 . 1 1 5 5 GLY N N 367 109.318 109.318 105.499 3.819 18002
10 1 1 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.496 0.961 18002
11 1 1 . 1 1 5 5 GLY H H 367 8.224 8.224 7.925 0.299 18002
12 1 1 . 1 1 6 6 ASP N N 368 120.307 120.307 116.381 3.926 18002
13 1 1 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.255 0.345 18002
14 1 1 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.936 -0.423 18002
15 1 1 . 1 1 6 6 ASP CB C 368 41.326 41.326 40.051 1.275 18002
16 1 1 . 1 1 6 6 ASP H H 368 8.199 8.199 8.694 -0.495 18002
17 1 1 . 1 1 7 7 ILE N N 369 120.668 120.668 116.584 4.084 18002
18 1 1 . 1 1 7 7 ILE HA H 369 4.218 4.218 3.875 0.343 18002
19 1 1 . 1 1 7 7 ILE CA C 369 61.584 61.584 63.958 -2.374 18002
20 1 1 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.707 1.061 18002
21 1 1 . 1 1 7 7 ILE H H 369 8.138 8.138 8.352 -0.214 18002
22 1 1 . 1 1 8 8 THR N N 370 117.564 117.564 109.763 7.801 18002
23 1 1 . 1 1 8 8 THR HA H 370 4.322 4.322 4.473 -0.151 18002
24 1 1 . 1 1 8 8 THR CA C 370 62.332 62.332 60.310 2.022 18002
25 1 1 . 1 1 8 8 THR CB C 370 69.946 69.946 70.706 -0.760 18002
26 1 1 . 1 1 8 8 THR H H 370 8.230 8.230 7.570 0.660 18002
27 1 1 . 1 1 9 9 SER N N 371 118.467 118.467 115.995 2.472 18002
28 1 1 . 1 1 9 9 SER HA H 371 4.445 4.445 4.841 -0.396 18002
29 1 1 . 1 1 9 9 SER CA C 371 58.274 58.274 57.901 0.373 18002
30 1 1 . 1 1 9 9 SER CB C 371 63.996 63.996 62.486 1.510 18002
31 1 1 . 1 1 9 9 SER H H 371 8.158 8.158 8.416 -0.258 18002
32 1 1 . 1 1 10 10 ILE N N 372 123.959 123.959 120.616 3.343 18002
33 1 1 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.058 -4.342 18002
34 1 1 . 1 1 10 10 ILE CB C 372 38.919 38.919 35.992 2.927 18002
35 1 1 . 1 1 10 10 ILE H H 372 8.112 8.112 8.009 0.103 18002
36 1 1 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.463 -0.111 18002
37 1 1 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.893 1.288 18002
38 1 1 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.409 1.298 18002
39 1 1 . 1 1 12 12 GLU N N 374 119.349 119.349 122.099 -2.750 18002
40 1 1 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.440 0.347 18002
41 1 1 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.466 -0.149 18002
42 1 1 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.915 2.676 18002
43 1 1 . 1 1 12 12 GLU H H 374 8.017 8.017 8.202 -0.185 18002
44 1 1 . 1 1 13 13 LEU N N 375 122.288 122.288 125.223 -2.935 18002
45 1 1 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.678 -0.200 18002
46 1 1 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.920 -0.990 18002
47 1 1 . 1 1 13 13 LEU CB C 375 44.656 44.656 44.549 0.107 18002
48 1 1 . 1 1 13 13 LEU H H 375 8.036 8.036 8.492 -0.456 18002
49 1 1 . 1 1 14 14 ALA N N 376 125.461 125.461 126.503 -1.042 18002
50 1 1 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.136 0.110 18002
51 1 1 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.528 0.217 18002
52 1 1 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.394 -0.808 18002
53 1 1 . 1 1 14 14 ALA H H 376 8.181 8.181 8.163 0.018 18002
54 1 1 . 1 1 15 15 ASP N N 377 122.242 122.242 120.445 1.797 18002
55 1 1 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.978 -0.659 18002
56 1 1 . 1 1 15 15 ASP CA C 377 53.752 53.752 54.249 -0.497 18002
57 1 1 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.761 1.878 18002
58 1 1 . 1 1 15 15 ASP H H 377 8.326 8.326 8.976 -0.650 18002
59 1 1 . 1 1 16 16 TYR N N 378 118.961 118.961 117.783 1.178 18002
60 1 1 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.267 0.124 18002
61 1 1 . 1 1 16 16 TYR CA C 378 59.581 59.581 55.864 3.717 18002
62 1 1 . 1 1 16 16 TYR CB C 378 39.023 39.023 40.103 -1.080 18002
63 1 1 . 1 1 16 16 TYR H H 378 8.869 8.869 8.117 0.752 18002
64 1 1 . 1 1 17 17 ILE N N 379 125.214 125.214 117.826 7.388 18002
65 1 1 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.643 -0.313 18002
66 1 1 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.581 0.151 18002
67 1 1 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.894 -0.918 18002
68 1 1 . 1 1 17 17 ILE H H 379 8.608 8.608 7.844 0.764 18002
69 1 1 . 1 1 18 18 LYS N N 380 122.917 122.917 119.737 3.180 18002
70 1 1 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.881 0.231 18002
71 1 1 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.488 1.348 18002
72 1 1 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.421 1.604 18002
73 1 1 . 1 1 18 18 LYS H H 380 7.424 7.424 8.625 -1.201 18002
74 1 1 . 1 1 19 19 VAL N N 381 122.839 122.839 121.134 1.705 18002
75 1 1 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.562 0.701 18002
76 1 1 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.657 0.859 18002
77 1 1 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.875 -0.727 18002
78 1 1 . 1 1 19 19 VAL H H 381 9.223 9.223 7.867 1.356 18002
79 1 1 . 1 1 20 20 PHE N N 382 129.509 129.509 127.710 1.799 18002
80 1 1 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.843 -0.000 18002
81 1 1 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.647 -1.142 18002
82 1 1 . 1 1 20 20 PHE CB C 382 42.862 42.862 42.325 0.537 18002
83 1 1 . 1 1 20 20 PHE H H 382 9.451 9.451 8.072 1.379 18002
84 1 1 . 1 1 21 21 LYS N N 383 126.417 126.417 126.352 0.065 18002
85 1 1 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.240 0.601 18002
86 1 1 . 1 1 21 21 LYS CB C 383 33.219 33.219 33.634 -0.415 18002
87 1 1 . 1 1 21 21 LYS H H 383 7.582 7.582 8.368 -0.786 18002
88 1 1 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.495 0.202 18002
89 1 1 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.079 -0.110 18002
90 1 1 . 1 1 23 23 LYS N N 385 118.026 118.026 116.394 1.632 18002
91 1 1 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.006 0.209 18002
92 1 1 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.663 -0.318 18002
93 1 1 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.922 1.111 18002
94 1 1 . 1 1 23 23 LYS H H 385 8.138 8.138 8.066 0.072 18002
95 1 1 . 1 1 24 24 LYS N N 386 120.816 120.816 121.394 -0.578 18002
96 1 1 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.164 0.022 18002
97 1 1 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.747 -0.885 18002
98 1 1 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.657 0.170 18002
99 1 1 . 1 1 24 24 LYS H H 386 7.727 7.727 8.463 -0.736 18002
100 1 1 . 1 1 25 25 LEU N N 387 121.214 121.214 119.882 1.332 18002
101 1 1 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.440 -0.272 18002
102 1 1 . 1 1 25 25 LEU CA C 387 56.508 56.508 57.297 -0.790 18002
103 1 1 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.608 -0.966 18002
104 1 1 . 1 1 25 25 LEU H H 387 8.241 8.241 8.272 -0.031 18002
105 1 1 . 1 1 26 26 THR N N 388 112.798 112.798 109.311 3.487 18002
106 1 1 . 1 1 26 26 THR HA H 388 4.313 4.313 4.282 0.031 18002
107 1 1 . 1 1 26 26 THR CA C 388 61.795 61.795 61.940 -0.145 18002
108 1 1 . 1 1 26 26 THR CB C 388 69.875 69.875 69.247 0.628 18002
109 1 1 . 1 1 26 26 THR H H 388 7.700 7.700 7.722 -0.022 18002
110 1 1 . 1 1 27 27 LEU N N 389 124.091 124.091 120.869 3.222 18002
111 1 1 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.056 0.298 18002
112 1 1 . 1 1 27 27 LEU CA C 389 55.533 55.533 56.645 -1.112 18002
113 1 1 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.002 0.296 18002
114 1 1 . 1 1 27 27 LEU H H 389 8.260 8.260 7.938 0.322 18002
115 1 1 . 1 1 28 28 LYS N N 390 121.153 121.153 117.931 3.222 18002
116 1 1 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.447 -0.127 18002
117 1 1 . 1 1 28 28 LYS CA C 390 56.211 56.211 55.868 0.342 18002
118 1 1 . 1 1 28 28 LYS CB C 390 33.675 33.675 33.468 0.207 18002
119 1 1 . 1 1 28 28 LYS H H 390 8.202 8.202 8.323 -0.121 18002
120 1 1 . 1 1 29 29 GLY N N 391 107.270 107.270 109.313 -2.043 18002
121 1 1 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.548 -0.673 18002
122 1 1 . 1 1 29 29 GLY H H 391 7.876 7.876 7.765 0.111 18002
123 1 1 . 1 1 30 30 TYR N N 392 118.471 118.471 118.416 0.055 18002
124 1 1 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.187 0.259 18002
125 1 1 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.499 -0.452 18002
126 1 1 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.947 2.878 18002
127 1 1 . 1 1 30 30 TYR H H 392 8.183 8.183 8.411 -0.228 18002
128 1 1 . 1 1 31 31 LYS N N 393 122.833 122.833 123.543 -0.710 18002
129 1 1 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.661 -0.146 18002
130 1 1 . 1 1 31 31 LYS CA C 393 55.174 55.174 55.539 -0.366 18002
131 1 1 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.329 -0.609 18002
132 1 1 . 1 1 31 31 LYS H H 393 8.731 8.731 7.691 1.040 18002
133 1 1 . 1 1 32 32 GLN N N 394 124.759 124.759 124.744 0.015 18002
134 1 1 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.704 -0.026 18002
135 1 1 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.950 1.657 18002
136 1 1 . 1 1 32 32 GLN CB C 394 31.048 31.048 28.965 2.083 18002
137 1 1 . 1 1 32 32 GLN H H 394 8.776 8.776 8.540 0.236 18002
138 1 1 . 1 1 33 33 TYR N N 395 125.112 125.112 122.486 2.626 18002
139 1 1 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.431 0.643 18002
140 1 1 . 1 1 33 33 TYR CA C 395 57.164 57.164 54.895 2.269 18002
141 1 1 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.489 2.183 18002
142 1 1 . 1 1 33 33 TYR H H 395 8.774 8.774 7.850 0.924 18002
143 1 1 . 1 1 34 34 TRP N N 396 122.638 122.638 122.179 0.459 18002
144 1 1 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.508 -0.826 18002
145 1 1 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.540 3.678 18002
146 1 1 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.087 1.417 18002
147 1 1 . 1 1 34 34 TRP H H 396 8.975 8.975 7.242 1.733 18002
148 1 1 . 1 1 35 35 CYS N N 397 127.146 127.146 122.583 4.563 18002
149 1 1 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.511 -0.144 18002
150 1 1 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.313 1.393 18002
151 1 1 . 1 1 35 35 CYS H H 397 8.804 8.804 8.414 0.390 18002
152 1 1 . 1 1 36 36 THR N N 398 110.578 110.578 113.541 -2.963 18002
153 1 1 . 1 1 36 36 THR HA H 398 5.358 5.358 5.324 0.034 18002
154 1 1 . 1 1 36 36 THR CA C 398 58.704 58.704 60.512 -1.808 18002
155 1 1 . 1 1 36 36 THR CB C 398 71.833 71.833 71.971 -0.138 18002
156 1 1 . 1 1 36 36 THR H H 398 9.090 9.090 8.389 0.701 18002
157 1 1 . 1 1 37 37 PHE N N 399 127.322 127.322 126.877 0.445 18002
158 1 1 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.764 0.189 18002
159 1 1 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.221 -0.976 18002
160 1 1 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.294 1.891 18002
161 1 1 . 1 1 37 37 PHE H H 399 8.846 8.846 8.255 0.591 18002
162 1 1 . 1 1 38 38 LYS N N 400 125.391 125.391 126.849 -1.458 18002
163 1 1 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.496 0.031 18002
164 1 1 . 1 1 38 38 LYS CA C 400 55.977 55.977 56.055 -0.078 18002
165 1 1 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.934 1.981 18002
166 1 1 . 1 1 38 38 LYS H H 400 8.252 8.252 7.832 0.420 18002
167 1 1 . 1 1 39 39 ASP N N 401 125.083 125.083 117.199 7.884 18002
168 1 1 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.389 -0.311 18002
169 1 1 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.799 -0.316 18002
170 1 1 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.541 -1.020 18002
171 1 1 . 1 1 39 39 ASP H H 401 9.408 9.408 8.621 0.787 18002
172 1 1 . 1 1 40 40 THR N N 402 112.024 112.024 107.123 4.901 18002
173 1 1 . 1 1 40 40 THR HA H 402 4.767 4.767 4.545 0.222 18002
174 1 1 . 1 1 40 40 THR CA C 402 60.811 60.811 61.767 -0.956 18002
175 1 1 . 1 1 40 40 THR CB C 402 68.823 68.823 69.493 -0.670 18002
176 1 1 . 1 1 40 40 THR H H 402 8.224 8.224 8.048 0.176 18002
177 1 1 . 1 1 41 41 SER N N 403 116.142 116.142 114.732 1.410 18002
178 1 1 . 1 1 41 41 SER HA H 403 5.428 5.428 4.812 0.616 18002
179 1 1 . 1 1 41 41 SER CA C 403 58.297 58.297 56.978 1.319 18002
180 1 1 . 1 1 41 41 SER CB C 403 66.409 66.409 66.502 -0.093 18002
181 1 1 . 1 1 41 41 SER H H 403 8.197 8.197 7.519 0.678 18002
182 1 1 . 1 1 42 42 ILE N N 404 122.292 122.292 119.646 2.646 18002
183 1 1 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.718 0.211 18002
184 1 1 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.457 1.347 18002
185 1 1 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.768 1.652 18002
186 1 1 . 1 1 42 42 ILE H H 404 8.411 8.411 8.120 0.291 18002
187 1 1 . 1 1 43 43 SER N N 405 122.244 122.244 115.669 6.575 18002
188 1 1 . 1 1 43 43 SER HA H 405 4.966 4.966 5.018 -0.052 18002
189 1 1 . 1 1 43 43 SER CA C 405 57.735 57.735 57.856 -0.121 18002
190 1 1 . 1 1 43 43 SER CB C 405 65.388 65.388 66.329 -0.941 18002
191 1 1 . 1 1 43 43 SER H H 405 8.752 8.752 8.160 0.592 18002
192 1 1 . 1 1 44 44 CYS N N 406 120.004 120.004 120.931 -0.927 18002
193 1 1 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.932 0.035 18002
194 1 1 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.575 -0.517 18002
195 1 1 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.722 -0.282 18002
196 1 1 . 1 1 44 44 CYS H H 406 8.470 8.470 8.133 0.337 18002
197 1 1 . 1 1 45 45 TYR N N 407 122.704 122.704 126.028 -3.324 18002
198 1 1 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.092 -0.069 18002
199 1 1 . 1 1 45 45 TYR CA C 407 56.983 56.983 56.795 0.188 18002
200 1 1 . 1 1 45 45 TYR CB C 407 41.574 41.574 41.111 0.464 18002
201 1 1 . 1 1 45 45 TYR H H 407 10.013 10.013 8.864 1.149 18002
202 1 1 . 1 1 46 46 LYS N N 408 121.897 121.897 121.758 0.139 18002
203 1 1 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.519 -0.173 18002
204 1 1 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.620 3.399 18002
205 1 1 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.784 -1.072 18002
206 1 1 . 1 1 46 46 LYS H H 408 9.734 9.734 8.539 1.195 18002
207 1 1 . 1 1 47 47 SER N N 409 106.720 106.720 113.176 -6.456 18002
208 1 1 . 1 1 47 47 SER HA H 409 4.776 4.776 5.014 -0.238 18002
209 1 1 . 1 1 47 47 SER CA C 409 57.180 57.180 57.755 -0.575 18002
210 1 1 . 1 1 47 47 SER CB C 409 65.870 65.870 65.785 0.085 18002
211 1 1 . 1 1 47 47 SER H H 409 7.518 7.518 7.982 -0.464 18002
212 1 1 . 1 1 48 48 LYS N N 410 122.302 122.302 124.531 -2.229 18002
213 1 1 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.738 0.496 18002
214 1 1 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.373 -0.074 18002
215 1 1 . 1 1 48 48 LYS H H 410 8.195 8.195 9.004 -0.809 18002
216 1 1 . 1 1 49 49 GLU N N 411 118.983 118.983 119.500 -0.517 18002
217 1 1 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.265 0.517 18002
218 1 1 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.086 1.449 18002
219 1 1 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.629 -0.941 18002
220 1 1 . 1 1 49 49 GLU H H 411 8.752 8.752 8.133 0.619 18002
221 1 1 . 1 1 50 50 GLU N N 412 118.384 118.384 118.701 -0.317 18002
222 1 1 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.118 0.375 18002
223 1 1 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.686 -1.897 18002
224 1 1 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.492 1.513 18002
225 1 1 . 1 1 50 50 GLU H H 412 7.234 7.234 8.649 -1.415 18002
226 1 1 . 1 1 51 51 SER N N 413 114.767 114.767 111.083 3.684 18002
227 1 1 . 1 1 51 51 SER CA C 413 59.764 59.764 60.313 -0.549 18002
228 1 1 . 1 1 51 51 SER CB C 413 62.965 62.965 62.872 0.093 18002
229 1 1 . 1 1 51 51 SER H H 413 7.382 7.382 8.521 -1.139 18002
230 1 1 . 1 1 52 52 SER N N 414 114.496 114.496 115.565 -1.069 18002
231 1 1 . 1 1 52 52 SER HA H 414 4.560 4.560 4.672 -0.112 18002
232 1 1 . 1 1 52 52 SER CA C 414 58.574 58.574 58.196 0.378 18002
233 1 1 . 1 1 52 52 SER CB C 414 63.829 63.829 65.108 -1.279 18002
234 1 1 . 1 1 52 52 SER H H 414 7.682 7.682 8.211 -0.529 18002
235 1 1 . 1 1 53 53 GLY N N 415 111.107 111.107 110.704 0.403 18002
236 1 1 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.578 -1.345 18002
237 1 1 . 1 1 53 53 GLY H H 415 7.918 7.918 7.941 -0.023 18002
238 1 1 . 1 1 54 54 THR N N 416 120.214 120.214 117.700 2.514 18002
239 1 1 . 1 1 54 54 THR CB C 416 70.035 70.035 69.909 0.126 18002
240 1 1 . 1 1 54 54 THR H H 416 8.622 8.622 8.116 0.506 18002
241 1 1 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.464 0.011 18002
242 1 1 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.441 0.604 18002
243 1 1 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.129 -0.551 18002
244 1 1 . 1 1 56 56 ALA N N 418 125.591 125.591 123.090 2.501 18002
245 1 1 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.160 -0.204 18002
246 1 1 . 1 1 56 56 ALA CA C 418 54.535 54.535 52.982 1.553 18002
247 1 1 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.754 -0.847 18002
248 1 1 . 1 1 56 56 ALA H H 418 8.288 8.288 8.015 0.273 18002
249 1 1 . 1 1 57 57 HIS N N 419 108.119 108.119 118.085 -9.966 18002
250 1 1 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.691 -0.069 18002
251 1 1 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.754 -1.174 18002
252 1 1 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.147 2.072 18002
253 1 1 . 1 1 57 57 HIS H H 419 7.072 7.072 7.867 -0.795 18002
254 1 1 . 1 1 58 58 GLN N N 420 123.083 123.083 125.151 -2.068 18002
255 1 1 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.657 0.498 18002
256 1 1 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.263 0.241 18002
257 1 1 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.118 2.372 18002
258 1 1 . 1 1 58 58 GLN H H 420 8.669 8.669 8.671 -0.002 18002
259 1 1 . 1 1 59 59 MET N N 421 122.330 122.330 120.247 2.083 18002
260 1 1 . 1 1 59 59 MET HA H 421 4.621 4.621 4.822 -0.201 18002
261 1 1 . 1 1 59 59 MET CA C 421 54.892 54.892 54.820 0.072 18002
262 1 1 . 1 1 59 59 MET CB C 421 35.650 35.650 35.438 0.212 18002
263 1 1 . 1 1 59 59 MET H H 421 8.995 8.995 7.904 1.091 18002
264 1 1 . 1 1 60 60 ASN N N 422 123.220 123.220 119.241 3.979 18002
265 1 1 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.768 0.180 18002
266 1 1 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.659 -0.028 18002
267 1 1 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.295 0.444 18002
268 1 1 . 1 1 60 60 ASN H H 422 8.728 8.728 8.589 0.139 18002
269 1 1 . 1 1 61 61 LEU N N 423 126.072 126.072 123.569 2.503 18002
270 1 1 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.120 -0.004 18002
271 1 1 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.636 0.977 18002
272 1 1 . 1 1 61 61 LEU CB C 423 42.457 42.457 42.211 0.246 18002
273 1 1 . 1 1 61 61 LEU H H 423 8.942 8.942 8.347 0.595 18002
274 1 1 . 1 1 62 62 ARG N N 424 121.977 121.977 117.254 4.723 18002
275 1 1 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.950 0.422 18002
276 1 1 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.979 2.055 18002
277 1 1 . 1 1 62 62 ARG CB C 424 29.610 29.610 29.362 0.248 18002
278 1 1 . 1 1 62 62 ARG H H 424 8.000 8.000 7.671 0.329 18002
279 1 1 . 1 1 63 63 GLY N N 425 114.852 114.852 107.084 7.768 18002
280 1 1 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.512 0.298 18002
281 1 1 . 1 1 63 63 GLY H H 425 9.033 9.033 8.695 0.338 18002
282 1 1 . 1 1 64 64 CYS N N 426 117.102 117.102 117.903 -0.801 18002
283 1 1 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.337 0.562 18002
284 1 1 . 1 1 64 64 CYS CA C 426 57.760 57.760 58.852 -1.092 18002
285 1 1 . 1 1 64 64 CYS CB C 426 28.824 28.824 28.079 0.745 18002
286 1 1 . 1 1 64 64 CYS H H 426 8.248 8.248 7.730 0.518 18002
287 1 1 . 1 1 65 65 GLU N N 427 119.501 119.501 124.370 -4.869 18002
288 1 1 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.609 0.168 18002
289 1 1 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.222 0.169 18002
290 1 1 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.813 0.125 18002
291 1 1 . 1 1 65 65 GLU H H 427 8.449 8.449 8.827 -0.378 18002
292 1 1 . 1 1 66 66 VAL N N 428 125.286 125.286 120.955 4.331 18002
293 1 1 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.923 -0.033 18002
294 1 1 . 1 1 66 66 VAL CA C 428 60.752 60.752 59.350 1.402 18002
295 1 1 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.535 0.439 18002
296 1 1 . 1 1 66 66 VAL H H 428 8.624 8.624 8.573 0.051 18002
297 1 1 . 1 1 67 67 THR N N 429 124.132 124.132 121.215 2.917 18002
298 1 1 . 1 1 67 67 THR CA C 429 59.338 59.338 59.454 -0.116 18002
299 1 1 . 1 1 67 67 THR CB C 429 72.021 72.021 69.352 2.669 18002
300 1 1 . 1 1 67 67 THR H H 429 9.247 9.247 8.577 0.670 18002
301 1 1 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.548 0.101 18002
302 1 1 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.507 0.231 18002
303 1 1 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.101 1.467 18002
304 1 1 . 1 1 69 69 ASP N N 431 122.066 122.066 124.870 -2.804 18002
305 1 1 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.816 -0.169 18002
306 1 1 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.332 0.337 18002
307 1 1 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.727 -0.622 18002
308 1 1 . 1 1 69 69 ASP H H 431 8.250 8.250 8.755 -0.505 18002
309 1 1 . 1 1 70 70 VAL N N 432 121.874 121.874 123.062 -1.188 18002
310 1 1 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.602 -0.103 18002
311 1 1 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.558 -0.470 18002
312 1 1 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.754 1.278 18002
313 1 1 . 1 1 70 70 VAL H H 432 8.305 8.305 7.965 0.340 18002
314 1 1 . 1 1 71 71 ASN N N 433 124.366 124.366 128.574 -4.208 18002
315 1 1 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.011 -0.329 18002
316 1 1 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.099 0.662 18002
317 1 1 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.354 0.925 18002
318 1 1 . 1 1 71 71 ASN H H 433 8.637 8.637 8.146 0.491 18002
319 1 1 . 1 1 72 72 ILE N N 434 126.786 126.786 119.614 7.172 18002
320 1 1 . 1 1 72 72 ILE HA H 434 3.371 3.371 4.035 -0.664 18002
321 1 1 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.785 0.733 18002
322 1 1 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.963 -0.788 18002
323 1 1 . 1 1 72 72 ILE H H 434 8.943 8.943 8.428 0.515 18002
324 1 1 . 1 1 73 73 SER N N 435 118.305 118.305 118.081 0.224 18002
325 1 1 . 1 1 73 73 SER CA C 435 61.633 61.633 60.901 0.732 18002
326 1 1 . 1 1 73 73 SER CB C 435 62.435 62.435 62.535 -0.100 18002
327 1 1 . 1 1 73 73 SER H H 435 8.578 8.578 8.280 0.298 18002
328 1 1 . 1 1 74 74 GLY N N 436 107.443 107.443 106.603 0.840 18002
329 1 1 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.533 0.327 18002
330 1 1 . 1 1 74 74 GLY H H 436 7.620 7.620 8.066 -0.446 18002
331 1 1 . 1 1 75 75 GLN N N 437 116.895 116.895 116.853 0.042 18002
332 1 1 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.969 -0.679 18002
333 1 1 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.879 -0.178 18002
334 1 1 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.632 1.113 18002
335 1 1 . 1 1 75 75 GLN H H 437 7.798 7.798 8.287 -0.489 18002
336 1 1 . 1 1 76 76 LYS N N 438 119.308 119.308 118.369 0.939 18002
337 1 1 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.145 -0.003 18002
338 1 1 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.830 0.214 18002
339 1 1 . 1 1 76 76 LYS CB C 438 33.945 33.945 33.130 0.815 18002
340 1 1 . 1 1 76 76 LYS H H 438 7.522 7.522 8.122 -0.600 18002
341 1 1 . 1 1 77 77 PHE N N 439 125.905 125.905 121.088 4.817 18002
342 1 1 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.434 -0.223 18002
343 1 1 . 1 1 77 77 PHE CA C 439 55.639 55.639 54.092 1.547 18002
344 1 1 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.795 0.134 18002
345 1 1 . 1 1 77 77 PHE H H 439 8.461 8.461 7.742 0.719 18002
346 1 1 . 1 1 78 78 ASN N N 440 120.787 120.787 122.583 -1.796 18002
347 1 1 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.508 -0.595 18002
348 1 1 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.368 -0.565 18002
349 1 1 . 1 1 78 78 ASN H H 440 7.638 7.638 8.553 -0.915 18002
350 1 1 . 1 1 79 79 ILE N N 441 123.421 123.421 126.142 -2.721 18002
351 1 1 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.614 -0.443 18002
352 1 1 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.235 2.332 18002
353 1 1 . 1 1 79 79 ILE CB C 441 41.487 41.487 40.987 0.500 18002
354 1 1 . 1 1 79 79 ILE H H 441 9.550 9.550 8.629 0.921 18002
355 1 1 . 1 1 80 80 LYS N N 442 126.267 126.267 129.016 -2.749 18002
356 1 1 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.665 -0.203 18002
357 1 1 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.517 0.866 18002
358 1 1 . 1 1 80 80 LYS CB C 442 32.987 32.987 34.136 -1.149 18002
359 1 1 . 1 1 80 80 LYS H H 442 8.703 8.703 8.183 0.520 18002
360 1 1 . 1 1 81 81 LEU N N 443 125.194 125.194 125.975 -0.781 18002
361 1 1 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.920 0.352 18002
362 1 1 . 1 1 81 81 LEU CA C 443 53.349 53.349 52.982 0.367 18002
363 1 1 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.657 2.047 18002
364 1 1 . 1 1 81 81 LEU H H 443 9.223 9.223 8.932 0.291 18002
365 1 1 . 1 1 82 82 LEU N N 444 122.753 122.753 128.656 -5.903 18002
366 1 1 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.099 -0.085 18002
367 1 1 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.130 0.788 18002
368 1 1 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.254 -2.630 18002
369 1 1 . 1 1 82 82 LEU H H 444 8.420 8.420 8.399 0.021 18002
370 1 1 . 1 1 83 83 ILE N N 445 125.584 125.584 124.006 1.578 18002
371 1 1 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.125 0.160 18002
372 1 1 . 1 1 83 83 ILE CB C 445 41.036 41.036 42.408 -1.372 18002
373 1 1 . 1 1 83 83 ILE H H 445 9.010 9.010 8.025 0.985 18002
374 1 1 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.756 0.163 18002
375 1 1 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.321 1.712 18002
376 1 1 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.691 0.256 18002
377 1 1 . 1 1 85 85 VAL N N 447 119.780 119.780 116.832 2.948 18002
378 1 1 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.532 -0.029 18002
379 1 1 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.947 0.395 18002
380 1 1 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.368 0.898 18002
381 1 1 . 1 1 85 85 VAL H H 447 8.304 8.304 8.392 -0.088 18002
382 1 1 . 1 1 86 86 ALA N N 448 125.178 125.178 121.882 3.296 18002
383 1 1 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.200 -0.225 18002
384 1 1 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.523 1.038 18002
385 1 1 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.464 -0.476 18002
386 1 1 . 1 1 86 86 ALA H H 448 8.526 8.526 8.459 0.067 18002
387 1 1 . 1 1 87 87 GLU N N 449 114.625 114.625 118.365 -3.740 18002
388 1 1 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.132 0.158 18002
389 1 1 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.310 -0.579 18002
390 1 1 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.887 -0.626 18002
391 1 1 . 1 1 87 87 GLU H H 449 8.402 8.402 8.638 -0.236 18002
392 1 1 . 1 1 88 88 GLY N N 450 109.432 109.432 106.322 3.110 18002
393 1 1 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.842 0.995 18002
394 1 1 . 1 1 88 88 GLY H H 450 7.711 7.711 7.802 -0.091 18002
395 1 1 . 1 1 89 89 MET N N 451 121.382 121.382 119.672 1.710 18002
396 1 1 . 1 1 89 89 MET HA H 451 5.076 5.076 4.998 0.078 18002
397 1 1 . 1 1 89 89 MET CA C 451 53.860 53.860 54.958 -1.097 18002
398 1 1 . 1 1 89 89 MET CB C 451 35.942 35.942 36.667 -0.725 18002
399 1 1 . 1 1 89 89 MET H H 451 8.355 8.355 8.064 0.291 18002
400 1 1 . 1 1 90 90 ASN N N 452 123.538 123.538 123.239 0.299 18002
401 1 1 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.800 0.153 18002
402 1 1 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.562 -0.814 18002
403 1 1 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.395 2.247 18002
404 1 1 . 1 1 90 90 ASN H H 452 9.338 9.338 8.940 0.398 18002
405 1 1 . 1 1 91 91 GLU N N 453 125.978 125.978 124.110 1.868 18002
406 1 1 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.283 1.061 18002
407 1 1 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.658 -1.385 18002
408 1 1 . 1 1 91 91 GLU CB C 453 31.743 31.743 29.876 1.867 18002
409 1 1 . 1 1 91 91 GLU H H 453 8.168 8.168 8.022 0.146 18002
410 1 1 . 1 1 92 92 ILE N N 454 126.776 126.776 123.186 3.590 18002
411 1 1 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.526 1.040 18002
412 1 1 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.620 0.428 18002
413 1 1 . 1 1 92 92 ILE CB C 454 42.262 42.262 42.043 0.219 18002
414 1 1 . 1 1 92 92 ILE H H 454 9.000 9.000 8.300 0.700 18002
415 1 1 . 1 1 93 93 TRP N N 455 125.987 125.987 122.647 3.340 18002
416 1 1 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.058 -0.466 18002
417 1 1 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.869 -2.079 18002
418 1 1 . 1 1 93 93 TRP CB C 455 31.386 31.386 32.245 -0.859 18002
419 1 1 . 1 1 93 93 TRP H H 455 9.278 9.278 7.808 1.470 18002
420 1 1 . 1 1 94 94 LEU N N 456 120.912 120.912 117.714 3.198 18002
421 1 1 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.212 0.150 18002
422 1 1 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.163 0.054 18002
423 1 1 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.854 -0.260 18002
424 1 1 . 1 1 94 94 LEU H H 456 9.534 9.534 8.109 1.425 18002
425 1 1 . 1 1 95 95 ARG N N 457 123.669 123.669 121.282 2.387 18002
426 1 1 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.475 0.796 18002
427 1 1 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.625 -0.208 18002
428 1 1 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.286 0.976 18002
429 1 1 . 1 1 95 95 ARG H H 457 9.439 9.439 8.058 1.381 18002
430 1 1 . 1 1 96 96 CYS N N 458 125.273 125.273 119.362 5.911 18002
431 1 1 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.817 -0.119 18002
432 1 1 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.425 1.367 18002
433 1 1 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.951 1.452 18002
434 1 1 . 1 1 96 96 CYS H H 458 8.652 8.652 8.425 0.227 18002
435 1 1 . 1 1 97 97 ASP N N 459 119.661 119.661 119.874 -0.213 18002
436 1 1 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.711 0.029 18002
437 1 1 . 1 1 97 97 ASP CA C 459 56.228 56.228 55.029 1.199 18002
438 1 1 . 1 1 97 97 ASP CB C 459 43.585 43.585 43.087 0.498 18002
439 1 1 . 1 1 97 97 ASP H H 459 9.116 9.116 9.090 0.026 18002
440 1 1 . 1 1 98 98 ASN N N 460 109.173 109.173 115.557 -6.384 18002
441 1 1 . 1 1 98 98 ASN HA H 460 4.372 4.372 5.098 -0.726 18002
442 1 1 . 1 1 98 98 ASN CA C 460 52.014 52.014 53.046 -1.032 18002
443 1 1 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.535 1.276 18002
444 1 1 . 1 1 98 98 ASN H H 460 7.054 7.054 7.932 -0.878 18002
445 1 1 . 1 1 99 99 GLU N N 461 119.220 119.220 120.332 -1.112 18002
446 1 1 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.692 0.352 18002
447 1 1 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.076 0.692 18002
448 1 1 . 1 1 99 99 GLU H H 461 8.937 8.937 8.950 -0.013 18002
449 1 1 . 1 1 100 100 LYS N N 462 120.647 120.647 118.716 1.931 18002
450 1 1 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.096 0.549 18002
451 1 1 . 1 1 100 100 LYS CA C 462 60.536 60.536 58.885 1.651 18002
452 1 1 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.801 0.427 18002
453 1 1 . 1 1 100 100 LYS H H 462 8.033 8.033 8.278 -0.245 18002
454 1 1 . 1 1 101 101 GLN N N 463 121.938 121.938 119.527 2.411 18002
455 1 1 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.048 0.352 18002
456 1 1 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.193 0.202 18002
457 1 1 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.871 3.343 18002
458 1 1 . 1 1 101 101 GLN H H 463 8.372 8.372 8.637 -0.265 18002
459 1 1 . 1 1 102 102 TYR N N 464 117.422 117.422 120.183 -2.761 18002
460 1 1 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.137 0.479 18002
461 1 1 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.594 1.083 18002
462 1 1 . 1 1 102 102 TYR CB C 464 38.859 38.859 37.791 1.068 18002
463 1 1 . 1 1 102 102 TYR H H 464 8.221 8.221 7.919 0.302 18002
464 1 1 . 1 1 103 103 ALA N N 465 120.655 120.655 119.803 0.852 18002
465 1 1 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.898 -0.183 18002
466 1 1 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.974 0.939 18002
467 1 1 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.660 0.142 18002
468 1 1 . 1 1 103 103 ALA H H 465 8.637 8.637 7.688 0.949 18002
469 1 1 . 1 1 104 104 HIS N N 466 112.871 112.871 116.823 -3.952 18002
470 1 1 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.384 -0.243 18002
471 1 1 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.031 0.596 18002
472 1 1 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.777 -0.919 18002
473 1 1 . 1 1 104 104 HIS H H 466 7.852 7.852 8.210 -0.358 18002
474 1 1 . 1 1 105 105 TRP N N 467 121.317 121.317 119.231 2.086 18002
475 1 1 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.518 -0.823 18002
476 1 1 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.671 1.671 18002
477 1 1 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.644 -2.139 18002
478 1 1 . 1 1 105 105 TRP H H 467 8.668 8.668 7.864 0.804 18002
479 1 1 . 1 1 106 106 MET N N 468 122.346 122.346 120.014 2.332 18002
480 1 1 . 1 1 106 106 MET HA H 468 4.086 4.086 3.897 0.189 18002
481 1 1 . 1 1 106 106 MET CA C 468 58.743 58.743 58.987 -0.244 18002
482 1 1 . 1 1 106 106 MET CB C 468 31.402 31.402 31.664 -0.262 18002
483 1 1 . 1 1 106 106 MET H H 468 9.790 9.790 7.774 2.016 18002
484 1 1 . 1 1 107 107 ALA N N 469 119.758 119.758 122.039 -2.281 18002
485 1 1 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.331 -0.626 18002
486 1 1 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.519 1.610 18002
487 1 1 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.250 2.155 18002
488 1 1 . 1 1 107 107 ALA H H 469 7.702 7.702 7.573 0.129 18002
489 1 1 . 1 1 108 108 ALA N N 470 119.233 119.233 121.758 -2.525 18002
490 1 1 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.801 -0.255 18002
491 1 1 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.080 0.741 18002
492 1 1 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.844 -1.112 18002
493 1 1 . 1 1 108 108 ALA H H 470 7.156 7.156 7.715 -0.559 18002
494 1 1 . 1 1 109 109 CYS N N 471 116.736 116.736 117.387 -0.651 18002
495 1 1 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.151 -0.094 18002
496 1 1 . 1 1 109 109 CYS CA C 471 64.571 64.571 64.480 0.091 18002
497 1 1 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.222 0.171 18002
498 1 1 . 1 1 109 109 CYS H H 471 8.256 8.256 8.925 -0.669 18002
499 1 1 . 1 1 110 110 ARG N N 472 118.644 118.644 120.150 -1.506 18002
500 1 1 . 1 1 110 110 ARG HA H 472 3.734 3.734 3.962 -0.228 18002
501 1 1 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.437 0.767 18002
502 1 1 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.107 0.210 18002
503 1 1 . 1 1 110 110 ARG H H 472 8.403 8.403 7.528 0.875 18002
504 1 1 . 1 1 111 111 LEU N N 473 121.877 121.877 120.490 1.387 18002
505 1 1 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.953 -0.153 18002
506 1 1 . 1 1 111 111 LEU CA C 473 59.855 59.855 58.143 1.712 18002
507 1 1 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.874 -0.454 18002
508 1 1 . 1 1 111 111 LEU H H 473 7.916 7.916 8.286 -0.370 18002
509 1 1 . 1 1 112 112 ALA N N 474 122.765 122.765 120.027 2.738 18002
510 1 1 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.120 0.360 18002
511 1 1 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.492 0.769 18002
512 1 1 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.231 1.644 18002
513 1 1 . 1 1 112 112 ALA H H 474 8.393 8.393 8.717 -0.324 18002
514 1 1 . 1 1 113 113 SER N N 475 113.613 113.613 112.674 0.939 18002
515 1 1 . 1 1 113 113 SER HA H 475 4.782 4.782 4.260 0.522 18002
516 1 1 . 1 1 113 113 SER CA C 475 61.090 61.090 60.951 0.139 18002
517 1 1 . 1 1 113 113 SER CB C 475 63.612 63.612 63.235 0.377 18002
518 1 1 . 1 1 113 113 SER H H 475 8.150 8.150 8.023 0.127 18002
519 1 1 . 1 1 114 114 LYS N N 476 118.734 118.734 117.898 0.836 18002
520 1 1 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.253 0.300 18002
521 1 1 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.706 -1.562 18002
522 1 1 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.194 0.397 18002
523 1 1 . 1 1 114 114 LYS H H 476 7.239 7.239 8.009 -0.770 18002
524 1 1 . 1 1 115 115 GLY N N 477 107.818 107.818 107.166 0.652 18002
525 1 1 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.322 0.664 18002
526 1 1 . 1 1 115 115 GLY H H 477 8.401 8.401 7.580 0.821 18002
527 1 1 . 1 1 116 116 LYS N N 478 120.938 120.938 121.465 -0.527 18002
528 1 1 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.504 0.069 18002
529 1 1 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.880 -0.033 18002
530 1 1 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.316 1.005 18002
531 1 1 . 1 1 116 116 LYS H H 478 8.142 8.142 7.995 0.147 18002
532 1 1 . 1 1 117 117 THR N N 479 108.076 108.076 112.664 -4.588 18002
533 1 1 . 1 1 117 117 THR HA H 479 4.671 4.671 4.286 0.385 18002
534 1 1 . 1 1 117 117 THR CA C 479 59.191 59.191 60.511 -1.320 18002
535 1 1 . 1 1 117 117 THR CB C 479 72.228 72.228 70.098 2.130 18002
536 1 1 . 1 1 117 117 THR H H 479 7.926 7.926 7.957 -0.031 18002
537 1 1 . 1 1 118 118 MET N N 480 116.403 116.403 118.213 -1.810 18002
538 1 1 . 1 1 118 118 MET HA H 480 3.352 3.352 4.046 -0.694 18002
539 1 1 . 1 1 118 118 MET CA C 480 57.947 57.947 55.706 2.240 18002
540 1 1 . 1 1 118 118 MET CB C 480 33.920 33.920 29.710 4.210 18002
541 1 1 . 1 1 118 118 MET H H 480 8.899 8.899 8.236 0.663 18002
542 1 1 . 1 1 119 119 ALA N N 481 117.786 117.786 119.833 -2.047 18002
543 1 1 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.124 -0.040 18002
544 1 1 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.810 0.785 18002
545 1 1 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.289 -0.227 18002
546 1 1 . 1 1 119 119 ALA H H 481 7.645 7.645 7.842 -0.197 18002
547 1 1 . 1 1 120 120 ASP N N 482 120.348 120.348 119.065 1.283 18002
548 1 1 . 1 1 120 120 ASP CB C 482 44.616 44.616 42.836 1.780 18002
549 1 1 . 1 1 120 120 ASP H H 482 7.887 7.887 7.244 0.643 18002
550 1 1 . 1 1 121 121 SER HA H 483 4.223 4.223 4.289 -0.066 18002
551 1 1 . 1 1 121 121 SER CA C 483 61.455 61.455 61.077 0.378 18002
552 1 1 . 1 1 121 121 SER CB C 483 62.996 62.996 62.949 0.047 18002
553 1 1 . 1 1 122 122 SER N N 484 116.845 116.845 118.791 -1.946 18002
554 1 1 . 1 1 122 122 SER HA H 484 4.321 4.321 4.202 0.119 18002
555 1 1 . 1 1 122 122 SER CA C 484 60.584 60.584 61.262 -0.678 18002
556 1 1 . 1 1 122 122 SER CB C 484 64.314 64.314 63.040 1.274 18002
557 1 1 . 1 1 122 122 SER H H 484 8.875 8.875 8.408 0.467 18002
558 1 1 . 1 1 123 123 TYR N N 485 124.153 124.153 121.623 2.530 18002
559 1 1 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.234 -0.354 18002
560 1 1 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.388 2.926 18002
561 1 1 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.011 0.730 18002
562 1 1 . 1 1 123 123 TYR H H 485 8.018 8.018 7.903 0.115 18002
563 1 1 . 1 1 124 124 ASN N N 486 115.339 115.339 118.165 -2.826 18002
564 1 1 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.590 0.351 18002
565 1 1 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.100 0.606 18002
566 1 1 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.922 0.134 18002
567 1 1 . 1 1 124 124 ASN H H 486 8.665 8.665 7.636 1.029 18002
568 1 1 . 1 1 125 125 LEU N N 487 119.454 119.454 119.527 -0.073 18002
569 1 1 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.008 -0.070 18002
570 1 1 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.960 -0.290 18002
571 1 1 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.614 -0.046 18002
572 1 1 . 1 1 125 125 LEU H H 487 7.105 7.105 8.130 -1.025 18002
573 1 1 . 1 1 126 126 GLU N N 488 121.189 121.189 119.076 2.113 18002
574 1 1 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.010 0.020 18002
575 1 1 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.403 -0.368 18002
576 1 1 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.568 -0.483 18002
577 1 1 . 1 1 126 126 GLU H H 488 8.053 8.053 7.695 0.358 18002
578 1 1 . 1 1 127 127 VAL N N 489 119.073 119.073 116.960 2.113 18002
579 1 1 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.639 -0.621 18002
580 1 1 . 1 1 127 127 VAL CA C 489 67.322 67.322 66.071 1.251 18002
581 1 1 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.567 0.092 18002
582 1 1 . 1 1 127 127 VAL H H 489 7.769 7.769 7.644 0.125 18002
583 1 1 . 1 1 128 128 GLN N N 490 116.214 116.214 117.865 -1.651 18002
584 1 1 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.002 -0.170 18002
585 1 1 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.433 0.323 18002
586 1 1 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.838 0.274 18002
587 1 1 . 1 1 128 128 GLN H H 490 7.542 7.542 8.319 -0.777 18002
588 1 1 . 1 1 129 129 ASN N N 491 120.003 120.003 117.606 2.397 18002
589 1 1 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.634 -0.215 18002
590 1 1 . 1 1 129 129 ASN CA C 491 56.160 56.160 56.047 0.113 18002
591 1 1 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.700 -0.640 18002
592 1 1 . 1 1 129 129 ASN H H 491 8.582 8.582 7.284 1.298 18002
593 1 1 . 1 1 130 130 ILE N N 492 122.365 122.365 120.602 1.763 18002
594 1 1 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.441 2.312 18002
595 1 1 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.833 1.313 18002
596 1 1 . 1 1 130 130 ILE H H 492 8.186 8.186 7.479 0.707 18002
597 1 1 . 1 1 131 131 LEU N N 493 119.597 119.597 119.599 -0.002 18002
598 1 1 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.895 0.110 18002
599 1 1 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.160 0.699 18002
600 1 1 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.367 0.169 18002
601 1 1 . 1 1 131 131 LEU H H 493 8.224 8.224 7.791 0.433 18002
602 1 1 . 1 1 132 132 SER N N 494 114.884 114.884 114.970 -0.086 18002
603 1 1 . 1 1 132 132 SER HA H 494 4.430 4.430 4.132 0.298 18002
604 1 1 . 1 1 132 132 SER CA C 494 62.072 62.072 61.698 0.374 18002
605 1 1 . 1 1 132 132 SER CB C 494 62.703 62.703 62.814 -0.111 18002
606 1 1 . 1 1 132 132 SER H H 494 8.464 8.464 7.497 0.967 18002
607 1 1 . 1 1 133 133 PHE N N 495 123.047 123.047 120.074 2.973 18002
608 1 1 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.293 0.084 18002
609 1 1 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.806 -0.893 18002
610 1 1 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.748 0.302 18002
611 1 1 . 1 1 133 133 PHE H H 495 7.915 7.915 8.931 -1.016 18002
612 1 1 . 1 1 134 134 LEU N N 496 119.311 119.311 119.674 -0.363 18002
613 1 1 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.283 -0.378 18002
614 1 1 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.913 -0.312 18002
615 1 1 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.045 0.856 18002
616 1 1 . 1 1 134 134 LEU H H 496 8.386 8.386 7.439 0.947 18002
617 1 1 . 1 1 135 135 LYS N N 497 117.550 117.550 117.145 0.405 18002
618 1 1 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.008 -0.068 18002
619 1 1 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.625 -0.350 18002
620 1 1 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.463 0.031 18002
621 1 1 . 1 1 135 135 LYS H H 497 7.670 7.670 7.588 0.082 18002
622 1 1 . 1 1 136 136 MET N N 498 116.106 116.106 116.187 -0.081 18002
623 1 1 . 1 1 136 136 MET HA H 498 4.354 4.354 4.205 0.149 18002
624 1 1 . 1 1 136 136 MET CA C 498 55.994 55.994 57.311 -1.317 18002
625 1 1 . 1 1 136 136 MET CB C 498 32.772 32.772 33.211 -0.439 18002
626 1 1 . 1 1 136 136 MET H H 498 7.421 7.421 7.407 0.014 18002
627 1 1 . 1 1 137 137 GLN N N 499 118.651 118.651 114.376 4.275 18002
628 1 1 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.388 -0.204 18002
629 1 1 . 1 1 137 137 GLN CA C 499 55.308 55.308 54.943 0.365 18002
630 1 1 . 1 1 137 137 GLN H H 499 7.617 7.617 7.942 -0.325 18002
631 1 2 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.618 -0.493 18002
632 1 2 . 1 1 3 3 HIS CA C 365 55.015 55.015 55.554 -0.539 18002
633 1 2 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.003 1.926 18002
634 1 2 . 1 1 4 4 MET N N 366 120.431 120.431 120.704 -0.273 18002
635 1 2 . 1 1 4 4 MET HA H 366 4.345 4.345 4.567 -0.222 18002
636 1 2 . 1 1 4 4 MET CA C 366 55.337 55.337 54.985 0.352 18002
637 1 2 . 1 1 4 4 MET CB C 366 32.668 32.668 33.241 -0.573 18002
638 1 2 . 1 1 4 4 MET H H 366 8.373 8.373 7.038 1.335 18002
639 1 2 . 1 1 5 5 GLY N N 367 109.318 109.318 112.578 -3.260 18002
640 1 2 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.235 0.222 18002
641 1 2 . 1 1 5 5 GLY H H 367 8.224 8.224 8.644 -0.420 18002
642 1 2 . 1 1 6 6 ASP N N 368 120.307 120.307 120.132 0.175 18002
643 1 2 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.598 0.002 18002
644 1 2 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.690 0.823 18002
645 1 2 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.516 -0.190 18002
646 1 2 . 1 1 6 6 ASP H H 368 8.199 8.199 8.201 -0.002 18002
647 1 2 . 1 1 7 7 ILE N N 369 120.668 120.668 114.488 6.180 18002
648 1 2 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.212 0.006 18002
649 1 2 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.682 -0.098 18002
650 1 2 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.264 1.504 18002
651 1 2 . 1 1 7 7 ILE H H 369 8.138 8.138 8.080 0.058 18002
652 1 2 . 1 1 8 8 THR N N 370 117.564 117.564 119.577 -2.013 18002
653 1 2 . 1 1 8 8 THR HA H 370 4.322 4.322 4.417 -0.095 18002
654 1 2 . 1 1 8 8 THR CA C 370 62.332 62.332 60.507 1.825 18002
655 1 2 . 1 1 8 8 THR CB C 370 69.946 69.946 67.944 2.002 18002
656 1 2 . 1 1 8 8 THR H H 370 8.230 8.230 7.906 0.324 18002
657 1 2 . 1 1 9 9 SER N N 371 118.467 118.467 121.468 -3.001 18002
658 1 2 . 1 1 9 9 SER HA H 371 4.445 4.445 4.637 -0.192 18002
659 1 2 . 1 1 9 9 SER CA C 371 58.274 58.274 57.737 0.537 18002
660 1 2 . 1 1 9 9 SER CB C 371 63.996 63.996 64.014 -0.019 18002
661 1 2 . 1 1 9 9 SER H H 371 8.158 8.158 7.769 0.389 18002
662 1 2 . 1 1 10 10 ILE N N 372 123.959 123.959 120.722 3.237 18002
663 1 2 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.655 -4.939 18002
664 1 2 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.229 2.690 18002
665 1 2 . 1 1 10 10 ILE H H 372 8.112 8.112 8.562 -0.450 18002
666 1 2 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.593 -0.241 18002
667 1 2 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.745 1.436 18002
668 1 2 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.080 1.627 18002
669 1 2 . 1 1 12 12 GLU N N 374 119.349 119.349 120.554 -1.205 18002
670 1 2 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.809 -0.022 18002
671 1 2 . 1 1 12 12 GLU CA C 374 55.317 55.317 54.362 0.955 18002
672 1 2 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.570 2.022 18002
673 1 2 . 1 1 12 12 GLU H H 374 8.017 8.017 7.869 0.148 18002
674 1 2 . 1 1 13 13 LEU N N 375 122.288 122.288 125.796 -3.508 18002
675 1 2 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.402 0.076 18002
676 1 2 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.039 -1.109 18002
677 1 2 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.131 1.525 18002
678 1 2 . 1 1 13 13 LEU H H 375 8.036 8.036 8.287 -0.251 18002
679 1 2 . 1 1 14 14 ALA N N 376 125.461 125.461 127.838 -2.377 18002
680 1 2 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.596 0.650 18002
681 1 2 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.245 0.500 18002
682 1 2 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.930 -0.344 18002
683 1 2 . 1 1 14 14 ALA H H 376 8.181 8.181 8.026 0.155 18002
684 1 2 . 1 1 15 15 ASP N N 377 122.242 122.242 118.309 3.933 18002
685 1 2 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.322 -0.003 18002
686 1 2 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.583 0.169 18002
687 1 2 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.549 2.090 18002
688 1 2 . 1 1 15 15 ASP H H 377 8.326 8.326 8.488 -0.162 18002
689 1 2 . 1 1 16 16 TYR N N 378 118.961 118.961 119.103 -0.142 18002
690 1 2 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.899 0.492 18002
691 1 2 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.395 3.186 18002
692 1 2 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.255 0.768 18002
693 1 2 . 1 1 16 16 TYR H H 378 8.869 8.869 7.558 1.311 18002
694 1 2 . 1 1 17 17 ILE N N 379 125.214 125.214 118.292 6.922 18002
695 1 2 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.688 -0.358 18002
696 1 2 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.870 -0.138 18002
697 1 2 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.723 -0.747 18002
698 1 2 . 1 1 17 17 ILE H H 379 8.608 8.608 7.769 0.839 18002
699 1 2 . 1 1 18 18 LYS N N 380 122.917 122.917 120.159 2.758 18002
700 1 2 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.874 0.238 18002
701 1 2 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.940 0.896 18002
702 1 2 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.310 0.715 18002
703 1 2 . 1 1 18 18 LYS H H 380 7.424 7.424 8.365 -0.941 18002
704 1 2 . 1 1 19 19 VAL N N 381 122.839 122.839 119.225 3.614 18002
705 1 2 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.981 0.282 18002
706 1 2 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.057 1.459 18002
707 1 2 . 1 1 19 19 VAL CB C 381 35.148 35.148 36.105 -0.957 18002
708 1 2 . 1 1 19 19 VAL H H 381 9.223 9.223 7.914 1.309 18002
709 1 2 . 1 1 20 20 PHE N N 382 129.509 129.509 123.509 6.000 18002
710 1 2 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.966 -0.123 18002
711 1 2 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.593 -1.088 18002
712 1 2 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.405 2.457 18002
713 1 2 . 1 1 20 20 PHE H H 382 9.451 9.451 7.844 1.607 18002
714 1 2 . 1 1 21 21 LYS N N 383 126.417 126.417 123.705 2.712 18002
715 1 2 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.316 0.524 18002
716 1 2 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.979 0.240 18002
717 1 2 . 1 1 21 21 LYS H H 383 7.582 7.582 7.657 -0.075 18002
718 1 2 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.319 0.378 18002
719 1 2 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.973 -0.004 18002
720 1 2 . 1 1 23 23 LYS N N 385 118.026 118.026 115.420 2.606 18002
721 1 2 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.982 0.233 18002
722 1 2 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.776 -0.431 18002
723 1 2 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.298 0.735 18002
724 1 2 . 1 1 23 23 LYS H H 385 8.138 8.138 8.270 -0.132 18002
725 1 2 . 1 1 24 24 LYS N N 386 120.816 120.816 120.627 0.189 18002
726 1 2 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.164 0.022 18002
727 1 2 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.193 -0.331 18002
728 1 2 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.563 0.264 18002
729 1 2 . 1 1 24 24 LYS H H 386 7.727 7.727 8.483 -0.756 18002
730 1 2 . 1 1 25 25 LEU N N 387 121.214 121.214 120.783 0.431 18002
731 1 2 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.403 -0.235 18002
732 1 2 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.045 0.463 18002
733 1 2 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.816 -0.175 18002
734 1 2 . 1 1 25 25 LEU H H 387 8.241 8.241 7.751 0.490 18002
735 1 2 . 1 1 26 26 THR N N 388 112.798 112.798 113.481 -0.683 18002
736 1 2 . 1 1 26 26 THR HA H 388 4.313 4.313 4.591 -0.278 18002
737 1 2 . 1 1 26 26 THR CA C 388 61.795 61.795 60.647 1.148 18002
738 1 2 . 1 1 26 26 THR CB C 388 69.875 69.875 69.588 0.286 18002
739 1 2 . 1 1 26 26 THR H H 388 7.700 7.700 7.716 -0.016 18002
740 1 2 . 1 1 27 27 LEU N N 389 124.091 124.091 125.669 -1.578 18002
741 1 2 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.007 0.347 18002
742 1 2 . 1 1 27 27 LEU CA C 389 55.533 55.533 56.596 -1.063 18002
743 1 2 . 1 1 27 27 LEU CB C 389 42.298 42.298 40.946 1.352 18002
744 1 2 . 1 1 27 27 LEU H H 389 8.260 8.260 8.534 -0.274 18002
745 1 2 . 1 1 28 28 LYS N N 390 121.153 121.153 117.807 3.346 18002
746 1 2 . 1 1 28 28 LYS HA H 390 4.320 4.320 3.908 0.412 18002
747 1 2 . 1 1 28 28 LYS CA C 390 56.211 56.211 57.813 -1.602 18002
748 1 2 . 1 1 28 28 LYS CB C 390 33.675 33.675 31.130 2.545 18002
749 1 2 . 1 1 28 28 LYS H H 390 8.202 8.202 8.304 -0.102 18002
750 1 2 . 1 1 29 29 GLY N N 391 107.270 107.270 108.369 -1.099 18002
751 1 2 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.130 -0.255 18002
752 1 2 . 1 1 29 29 GLY H H 391 7.876 7.876 7.783 0.093 18002
753 1 2 . 1 1 30 30 TYR N N 392 118.471 118.471 118.496 -0.025 18002
754 1 2 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.183 0.263 18002
755 1 2 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.808 -0.761 18002
756 1 2 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.330 3.495 18002
757 1 2 . 1 1 30 30 TYR H H 392 8.183 8.183 8.581 -0.398 18002
758 1 2 . 1 1 31 31 LYS N N 393 122.833 122.833 120.398 2.435 18002
759 1 2 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.633 -0.118 18002
760 1 2 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.998 0.175 18002
761 1 2 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.877 -0.157 18002
762 1 2 . 1 1 31 31 LYS H H 393 8.731 8.731 7.550 1.181 18002
763 1 2 . 1 1 32 32 GLN N N 394 124.759 124.759 119.496 5.263 18002
764 1 2 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.623 0.055 18002
765 1 2 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.996 1.611 18002
766 1 2 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.390 1.658 18002
767 1 2 . 1 1 32 32 GLN H H 394 8.776 8.776 8.386 0.390 18002
768 1 2 . 1 1 33 33 TYR N N 395 125.112 125.112 121.432 3.680 18002
769 1 2 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.191 0.883 18002
770 1 2 . 1 1 33 33 TYR CA C 395 57.164 57.164 54.980 2.183 18002
771 1 2 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.356 2.316 18002
772 1 2 . 1 1 33 33 TYR H H 395 8.774 8.774 7.827 0.947 18002
773 1 2 . 1 1 34 34 TRP N N 396 122.638 122.638 121.698 0.940 18002
774 1 2 . 1 1 34 34 TRP HA H 396 4.682 4.682 4.909 -0.227 18002
775 1 2 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.967 3.251 18002
776 1 2 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.103 1.401 18002
777 1 2 . 1 1 34 34 TRP H H 396 8.975 8.975 6.981 1.994 18002
778 1 2 . 1 1 35 35 CYS N N 397 127.146 127.146 124.923 2.223 18002
779 1 2 . 1 1 35 35 CYS CA C 397 57.367 57.367 58.391 -1.024 18002
780 1 2 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.957 1.749 18002
781 1 2 . 1 1 35 35 CYS H H 397 8.804 8.804 8.399 0.405 18002
782 1 2 . 1 1 36 36 THR N N 398 110.578 110.578 116.983 -6.405 18002
783 1 2 . 1 1 36 36 THR HA H 398 5.358 5.358 5.106 0.252 18002
784 1 2 . 1 1 36 36 THR CA C 398 58.704 58.704 61.236 -2.532 18002
785 1 2 . 1 1 36 36 THR CB C 398 71.833 71.833 70.982 0.851 18002
786 1 2 . 1 1 36 36 THR H H 398 9.090 9.090 8.128 0.962 18002
787 1 2 . 1 1 37 37 PHE N N 399 127.322 127.322 122.646 4.676 18002
788 1 2 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.661 0.292 18002
789 1 2 . 1 1 37 37 PHE CA C 399 56.246 56.246 56.520 -0.274 18002
790 1 2 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.396 1.789 18002
791 1 2 . 1 1 37 37 PHE H H 399 8.846 8.846 8.348 0.498 18002
792 1 2 . 1 1 38 38 LYS N N 400 125.391 125.391 123.217 2.174 18002
793 1 2 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.605 -0.078 18002
794 1 2 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.443 0.534 18002
795 1 2 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.567 0.348 18002
796 1 2 . 1 1 38 38 LYS H H 400 8.252 8.252 7.979 0.273 18002
797 1 2 . 1 1 39 39 ASP N N 401 125.083 125.083 125.500 -0.417 18002
798 1 2 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.263 -0.185 18002
799 1 2 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.782 -0.299 18002
800 1 2 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.858 -0.337 18002
801 1 2 . 1 1 39 39 ASP H H 401 9.408 9.408 9.094 0.314 18002
802 1 2 . 1 1 40 40 THR N N 402 112.024 112.024 115.668 -3.644 18002
803 1 2 . 1 1 40 40 THR HA H 402 4.767 4.767 4.536 0.231 18002
804 1 2 . 1 1 40 40 THR CA C 402 60.811 60.811 61.330 -0.519 18002
805 1 2 . 1 1 40 40 THR CB C 402 68.823 68.823 69.649 -0.826 18002
806 1 2 . 1 1 40 40 THR H H 402 8.224 8.224 8.102 0.122 18002
807 1 2 . 1 1 41 41 SER N N 403 116.142 116.142 117.197 -1.055 18002
808 1 2 . 1 1 41 41 SER HA H 403 5.428 5.428 4.777 0.651 18002
809 1 2 . 1 1 41 41 SER CA C 403 58.297 58.297 57.634 0.663 18002
810 1 2 . 1 1 41 41 SER CB C 403 66.409 66.409 66.777 -0.368 18002
811 1 2 . 1 1 41 41 SER H H 403 8.197 8.197 8.505 -0.308 18002
812 1 2 . 1 1 42 42 ILE N N 404 122.292 122.292 121.004 1.288 18002
813 1 2 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.513 0.416 18002
814 1 2 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.393 1.411 18002
815 1 2 . 1 1 42 42 ILE CB C 404 41.420 41.420 38.986 2.434 18002
816 1 2 . 1 1 42 42 ILE H H 404 8.411 8.411 7.908 0.503 18002
817 1 2 . 1 1 43 43 SER N N 405 122.244 122.244 115.233 7.011 18002
818 1 2 . 1 1 43 43 SER HA H 405 4.966 4.966 4.811 0.155 18002
819 1 2 . 1 1 43 43 SER CA C 405 57.735 57.735 57.439 0.296 18002
820 1 2 . 1 1 43 43 SER CB C 405 65.388 65.388 66.009 -0.621 18002
821 1 2 . 1 1 43 43 SER H H 405 8.752 8.752 8.367 0.385 18002
822 1 2 . 1 1 44 44 CYS N N 406 120.004 120.004 122.218 -2.214 18002
823 1 2 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.831 0.136 18002
824 1 2 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.634 -1.576 18002
825 1 2 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.752 0.689 18002
826 1 2 . 1 1 44 44 CYS H H 406 8.470 8.470 8.767 -0.297 18002
827 1 2 . 1 1 45 45 TYR N N 407 122.704 122.704 125.147 -2.443 18002
828 1 2 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.314 -0.291 18002
829 1 2 . 1 1 45 45 TYR CA C 407 56.983 56.983 55.526 1.457 18002
830 1 2 . 1 1 45 45 TYR CB C 407 41.574 41.574 39.713 1.861 18002
831 1 2 . 1 1 45 45 TYR H H 407 10.013 10.013 8.110 1.903 18002
832 1 2 . 1 1 46 46 LYS N N 408 121.897 121.897 123.319 -1.422 18002
833 1 2 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.083 0.263 18002
834 1 2 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.993 3.026 18002
835 1 2 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.165 -0.453 18002
836 1 2 . 1 1 46 46 LYS H H 408 9.734 9.734 9.017 0.717 18002
837 1 2 . 1 1 47 47 SER N N 409 106.720 106.720 112.337 -5.617 18002
838 1 2 . 1 1 47 47 SER HA H 409 4.776 4.776 5.037 -0.261 18002
839 1 2 . 1 1 47 47 SER CA C 409 57.180 57.180 57.204 -0.024 18002
840 1 2 . 1 1 47 47 SER CB C 409 65.870 65.870 65.061 0.809 18002
841 1 2 . 1 1 47 47 SER H H 409 7.518 7.518 7.736 -0.218 18002
842 1 2 . 1 1 48 48 LYS N N 410 122.302 122.302 118.802 3.500 18002
843 1 2 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.483 1.751 18002
844 1 2 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.598 -0.299 18002
845 1 2 . 1 1 48 48 LYS H H 410 8.195 8.195 8.776 -0.581 18002
846 1 2 . 1 1 49 49 GLU N N 411 118.983 118.983 120.441 -1.458 18002
847 1 2 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.228 0.554 18002
848 1 2 . 1 1 49 49 GLU CA C 411 59.535 59.535 57.756 1.779 18002
849 1 2 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.815 -1.127 18002
850 1 2 . 1 1 49 49 GLU H H 411 8.752 8.752 8.251 0.501 18002
851 1 2 . 1 1 50 50 GLU N N 412 118.384 118.384 118.038 0.346 18002
852 1 2 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.007 0.486 18002
853 1 2 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.123 -1.334 18002
854 1 2 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.693 1.312 18002
855 1 2 . 1 1 50 50 GLU H H 412 7.234 7.234 8.417 -1.183 18002
856 1 2 . 1 1 51 51 SER N N 413 114.767 114.767 111.788 2.979 18002
857 1 2 . 1 1 51 51 SER CA C 413 59.764 59.764 61.129 -1.365 18002
858 1 2 . 1 1 51 51 SER CB C 413 62.965 62.965 62.505 0.460 18002
859 1 2 . 1 1 51 51 SER H H 413 7.382 7.382 8.329 -0.947 18002
860 1 2 . 1 1 52 52 SER N N 414 114.496 114.496 117.195 -2.699 18002
861 1 2 . 1 1 52 52 SER HA H 414 4.560 4.560 4.539 0.021 18002
862 1 2 . 1 1 52 52 SER CA C 414 58.574 58.574 59.377 -0.803 18002
863 1 2 . 1 1 52 52 SER CB C 414 63.829 63.829 64.510 -0.681 18002
864 1 2 . 1 1 52 52 SER H H 414 7.682 7.682 8.525 -0.843 18002
865 1 2 . 1 1 53 53 GLY N N 415 111.107 111.107 109.353 1.754 18002
866 1 2 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.632 -1.399 18002
867 1 2 . 1 1 53 53 GLY H H 415 7.918 7.918 7.655 0.263 18002
868 1 2 . 1 1 54 54 THR N N 416 120.214 120.214 117.147 3.067 18002
869 1 2 . 1 1 54 54 THR CB C 416 70.035 70.035 69.416 0.619 18002
870 1 2 . 1 1 54 54 THR H H 416 8.622 8.622 7.803 0.819 18002
871 1 2 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.748 -0.273 18002
872 1 2 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.177 -0.132 18002
873 1 2 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.607 -1.029 18002
874 1 2 . 1 1 56 56 ALA N N 418 125.591 125.591 125.185 0.406 18002
875 1 2 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.073 -0.117 18002
876 1 2 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.334 0.201 18002
877 1 2 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.460 -0.553 18002
878 1 2 . 1 1 56 56 ALA H H 418 8.288 8.288 8.838 -0.550 18002
879 1 2 . 1 1 57 57 HIS N N 419 108.119 108.119 116.195 -8.076 18002
880 1 2 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.770 -0.148 18002
881 1 2 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.189 -1.609 18002
882 1 2 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.328 1.891 18002
883 1 2 . 1 1 57 57 HIS H H 419 7.072 7.072 7.887 -0.815 18002
884 1 2 . 1 1 58 58 GLN N N 420 123.083 123.083 123.161 -0.078 18002
885 1 2 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.668 0.487 18002
886 1 2 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.758 0.746 18002
887 1 2 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.384 2.106 18002
888 1 2 . 1 1 58 58 GLN H H 420 8.669 8.669 8.822 -0.153 18002
889 1 2 . 1 1 59 59 MET N N 421 122.330 122.330 120.418 1.912 18002
890 1 2 . 1 1 59 59 MET HA H 421 4.621 4.621 4.595 0.026 18002
891 1 2 . 1 1 59 59 MET CA C 421 54.892 54.892 53.154 1.738 18002
892 1 2 . 1 1 59 59 MET CB C 421 35.650 35.650 36.723 -1.073 18002
893 1 2 . 1 1 59 59 MET H H 421 8.995 8.995 8.500 0.495 18002
894 1 2 . 1 1 60 60 ASN N N 422 123.220 123.220 121.822 1.398 18002
895 1 2 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.788 0.160 18002
896 1 2 . 1 1 60 60 ASN CA C 422 52.631 52.631 53.010 -0.379 18002
897 1 2 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.945 0.794 18002
898 1 2 . 1 1 60 60 ASN H H 422 8.728 8.728 8.601 0.127 18002
899 1 2 . 1 1 61 61 LEU N N 423 126.072 126.072 124.477 1.595 18002
900 1 2 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.191 -0.075 18002
901 1 2 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.221 1.392 18002
902 1 2 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.843 0.614 18002
903 1 2 . 1 1 61 61 LEU H H 423 8.942 8.942 7.957 0.985 18002
904 1 2 . 1 1 62 62 ARG N N 424 121.977 121.977 116.485 5.492 18002
905 1 2 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.945 0.427 18002
906 1 2 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.585 2.449 18002
907 1 2 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.139 -0.529 18002
908 1 2 . 1 1 62 62 ARG H H 424 8.000 8.000 7.918 0.082 18002
909 1 2 . 1 1 63 63 GLY N N 425 114.852 114.852 108.345 6.507 18002
910 1 2 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.661 0.149 18002
911 1 2 . 1 1 63 63 GLY H H 425 9.033 9.033 8.684 0.349 18002
912 1 2 . 1 1 64 64 CYS N N 426 117.102 117.102 117.355 -0.253 18002
913 1 2 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.840 0.059 18002
914 1 2 . 1 1 64 64 CYS CA C 426 57.760 57.760 55.657 2.103 18002
915 1 2 . 1 1 64 64 CYS CB C 426 28.824 28.824 31.598 -2.774 18002
916 1 2 . 1 1 64 64 CYS H H 426 8.248 8.248 7.815 0.433 18002
917 1 2 . 1 1 65 65 GLU N N 427 119.501 119.501 121.586 -2.085 18002
918 1 2 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.474 0.303 18002
919 1 2 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.778 -0.387 18002
920 1 2 . 1 1 65 65 GLU CB C 427 31.938 31.938 30.929 1.009 18002
921 1 2 . 1 1 65 65 GLU H H 427 8.449 8.449 9.024 -0.575 18002
922 1 2 . 1 1 66 66 VAL N N 428 125.286 125.286 126.872 -1.586 18002
923 1 2 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.280 0.610 18002
924 1 2 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.033 -0.281 18002
925 1 2 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.223 0.752 18002
926 1 2 . 1 1 66 66 VAL H H 428 8.624 8.624 8.528 0.096 18002
927 1 2 . 1 1 67 67 THR N N 429 124.132 124.132 125.177 -1.045 18002
928 1 2 . 1 1 67 67 THR CA C 429 59.338 59.338 60.530 -1.192 18002
929 1 2 . 1 1 67 67 THR CB C 429 72.021 72.021 70.430 1.591 18002
930 1 2 . 1 1 67 67 THR H H 429 9.247 9.247 8.098 1.149 18002
931 1 2 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.568 0.081 18002
932 1 2 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.252 0.486 18002
933 1 2 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.669 0.899 18002
934 1 2 . 1 1 69 69 ASP N N 431 122.066 122.066 121.435 0.631 18002
935 1 2 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.938 -0.291 18002
936 1 2 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.453 0.216 18002
937 1 2 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.399 -1.294 18002
938 1 2 . 1 1 69 69 ASP H H 431 8.250 8.250 8.607 -0.357 18002
939 1 2 . 1 1 70 70 VAL N N 432 121.874 121.874 121.955 -0.081 18002
940 1 2 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.549 -0.050 18002
941 1 2 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.601 0.487 18002
942 1 2 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.873 1.159 18002
943 1 2 . 1 1 70 70 VAL H H 432 8.305 8.305 8.037 0.268 18002
944 1 2 . 1 1 71 71 ASN N N 433 124.366 124.366 126.756 -2.390 18002
945 1 2 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.781 -0.099 18002
946 1 2 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.056 0.705 18002
947 1 2 . 1 1 71 71 ASN CB C 433 40.279 40.279 40.487 -0.208 18002
948 1 2 . 1 1 71 71 ASN H H 433 8.637 8.637 7.907 0.730 18002
949 1 2 . 1 1 72 72 ILE N N 434 126.786 126.786 122.555 4.231 18002
950 1 2 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.817 -0.446 18002
951 1 2 . 1 1 72 72 ILE CA C 434 64.518 64.518 61.007 3.511 18002
952 1 2 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.171 0.004 18002
953 1 2 . 1 1 72 72 ILE H H 434 8.943 8.943 8.499 0.444 18002
954 1 2 . 1 1 73 73 SER N N 435 118.305 118.305 116.494 1.811 18002
955 1 2 . 1 1 73 73 SER CA C 435 61.633 61.633 60.517 1.116 18002
956 1 2 . 1 1 73 73 SER CB C 435 62.435 62.435 63.227 -0.792 18002
957 1 2 . 1 1 73 73 SER H H 435 8.578 8.578 7.963 0.615 18002
958 1 2 . 1 1 74 74 GLY N N 436 107.443 107.443 105.883 1.560 18002
959 1 2 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.728 0.133 18002
960 1 2 . 1 1 74 74 GLY H H 436 7.620 7.620 7.981 -0.361 18002
961 1 2 . 1 1 75 75 GLN N N 437 116.895 116.895 115.641 1.254 18002
962 1 2 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.598 -0.308 18002
963 1 2 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.348 0.353 18002
964 1 2 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.562 1.183 18002
965 1 2 . 1 1 75 75 GLN H H 437 7.798 7.798 7.533 0.265 18002
966 1 2 . 1 1 76 76 LYS N N 438 119.308 119.308 119.416 -0.108 18002
967 1 2 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.402 -0.260 18002
968 1 2 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.719 -0.676 18002
969 1 2 . 1 1 76 76 LYS CB C 438 33.945 33.945 32.588 1.357 18002
970 1 2 . 1 1 76 76 LYS H H 438 7.522 7.522 7.501 0.021 18002
971 1 2 . 1 1 77 77 PHE N N 439 125.905 125.905 124.343 1.562 18002
972 1 2 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.652 -0.441 18002
973 1 2 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.321 -1.682 18002
974 1 2 . 1 1 77 77 PHE CB C 439 38.929 38.929 39.188 -0.259 18002
975 1 2 . 1 1 77 77 PHE H H 439 8.461 8.461 8.450 0.011 18002
976 1 2 . 1 1 78 78 ASN N N 440 120.787 120.787 123.800 -3.013 18002
977 1 2 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.509 -0.596 18002
978 1 2 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.773 -0.970 18002
979 1 2 . 1 1 78 78 ASN H H 440 7.638 7.638 8.195 -0.557 18002
980 1 2 . 1 1 79 79 ILE N N 441 123.421 123.421 121.563 1.858 18002
981 1 2 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.055 0.116 18002
982 1 2 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.759 1.808 18002
983 1 2 . 1 1 79 79 ILE CB C 441 41.487 41.487 36.406 5.081 18002
984 1 2 . 1 1 79 79 ILE H H 441 9.550 9.550 8.130 1.420 18002
985 1 2 . 1 1 80 80 LYS N N 442 126.267 126.267 128.561 -2.294 18002
986 1 2 . 1 1 80 80 LYS HA H 442 4.462 4.462 3.920 0.542 18002
987 1 2 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.118 1.265 18002
988 1 2 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.989 0.998 18002
989 1 2 . 1 1 80 80 LYS H H 442 8.703 8.703 8.519 0.184 18002
990 1 2 . 1 1 81 81 LEU N N 443 125.194 125.194 127.560 -2.366 18002
991 1 2 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.666 0.606 18002
992 1 2 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.331 0.017 18002
993 1 2 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.993 1.711 18002
994 1 2 . 1 1 81 81 LEU H H 443 9.223 9.223 7.643 1.580 18002
995 1 2 . 1 1 82 82 LEU N N 444 122.753 122.753 126.018 -3.265 18002
996 1 2 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.015 -0.001 18002
997 1 2 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.244 0.674 18002
998 1 2 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.784 -3.160 18002
999 1 2 . 1 1 82 82 LEU H H 444 8.420 8.420 8.069 0.351 18002
1000 1 2 . 1 1 83 83 ILE N N 445 125.584 125.584 122.093 3.491 18002
1001 1 2 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.285 0.000 18002
1002 1 2 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.812 -0.776 18002
1003 1 2 . 1 1 83 83 ILE H H 445 9.010 9.010 7.973 1.037 18002
1004 1 2 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.923 -0.004 18002
1005 1 2 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.216 1.817 18002
1006 1 2 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.943 0.004 18002
1007 1 2 . 1 1 85 85 VAL N N 447 119.780 119.780 118.583 1.197 18002
1008 1 2 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.522 -0.019 18002
1009 1 2 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.852 0.490 18002
1010 1 2 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.326 0.940 18002
1011 1 2 . 1 1 85 85 VAL H H 447 8.304 8.304 8.133 0.171 18002
1012 1 2 . 1 1 86 86 ALA N N 448 125.178 125.178 121.871 3.307 18002
1013 1 2 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.170 -0.195 18002
1014 1 2 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.677 0.884 18002
1015 1 2 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.313 -0.325 18002
1016 1 2 . 1 1 86 86 ALA H H 448 8.526 8.526 8.495 0.031 18002
1017 1 2 . 1 1 87 87 GLU N N 449 114.625 114.625 118.328 -3.703 18002
1018 1 2 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.139 0.151 18002
1019 1 2 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.384 -0.653 18002
1020 1 2 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.883 -0.623 18002
1021 1 2 . 1 1 87 87 GLU H H 449 8.402 8.402 8.711 -0.309 18002
1022 1 2 . 1 1 88 88 GLY N N 450 109.432 109.432 106.245 3.187 18002
1023 1 2 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.835 1.002 18002
1024 1 2 . 1 1 88 88 GLY H H 450 7.711 7.711 7.873 -0.162 18002
1025 1 2 . 1 1 89 89 MET N N 451 121.382 121.382 120.217 1.165 18002
1026 1 2 . 1 1 89 89 MET HA H 451 5.076 5.076 4.988 0.088 18002
1027 1 2 . 1 1 89 89 MET CA C 451 53.860 53.860 54.724 -0.864 18002
1028 1 2 . 1 1 89 89 MET CB C 451 35.942 35.942 37.331 -1.389 18002
1029 1 2 . 1 1 89 89 MET H H 451 8.355 8.355 7.833 0.522 18002
1030 1 2 . 1 1 90 90 ASN N N 452 123.538 123.538 123.125 0.413 18002
1031 1 2 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.937 0.016 18002
1032 1 2 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.527 -0.779 18002
1033 1 2 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.294 1.348 18002
1034 1 2 . 1 1 90 90 ASN H H 452 9.338 9.338 8.818 0.520 18002
1035 1 2 . 1 1 91 91 GLU N N 453 125.978 125.978 123.671 2.307 18002
1036 1 2 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.214 1.130 18002
1037 1 2 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.273 -1.000 18002
1038 1 2 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.466 1.277 18002
1039 1 2 . 1 1 91 91 GLU H H 453 8.168 8.168 8.349 -0.181 18002
1040 1 2 . 1 1 92 92 ILE N N 454 126.776 126.776 124.990 1.786 18002
1041 1 2 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.257 0.309 18002
1042 1 2 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.017 0.031 18002
1043 1 2 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.786 1.476 18002
1044 1 2 . 1 1 92 92 ILE H H 454 9.000 9.000 7.918 1.082 18002
1045 1 2 . 1 1 93 93 TRP N N 455 125.987 125.987 126.501 -0.514 18002
1046 1 2 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.892 -0.300 18002
1047 1 2 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.291 -1.501 18002
1048 1 2 . 1 1 93 93 TRP CB C 455 31.386 31.386 29.782 1.604 18002
1049 1 2 . 1 1 93 93 TRP H H 455 9.278 9.278 8.389 0.889 18002
1050 1 2 . 1 1 94 94 LEU N N 456 120.912 120.912 124.219 -3.307 18002
1051 1 2 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.944 0.418 18002
1052 1 2 . 1 1 94 94 LEU CA C 456 53.216 53.216 54.060 -0.844 18002
1053 1 2 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.447 1.147 18002
1054 1 2 . 1 1 94 94 LEU H H 456 9.534 9.534 8.018 1.516 18002
1055 1 2 . 1 1 95 95 ARG N N 457 123.669 123.669 122.824 0.845 18002
1056 1 2 . 1 1 95 95 ARG HA H 457 5.271 5.271 5.533 -0.262 18002
1057 1 2 . 1 1 95 95 ARG CA C 457 55.417 55.417 54.974 0.443 18002
1058 1 2 . 1 1 95 95 ARG CB C 457 33.262 33.262 33.598 -0.336 18002
1059 1 2 . 1 1 95 95 ARG H H 457 9.439 9.439 8.502 0.937 18002
1060 1 2 . 1 1 96 96 CYS N N 458 125.273 125.273 118.663 6.610 18002
1061 1 2 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.748 -0.050 18002
1062 1 2 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.847 0.945 18002
1063 1 2 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.071 -0.668 18002
1064 1 2 . 1 1 96 96 CYS H H 458 8.652 8.652 8.399 0.253 18002
1065 1 2 . 1 1 97 97 ASP N N 459 119.661 119.661 121.874 -2.213 18002
1066 1 2 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.834 -0.094 18002
1067 1 2 . 1 1 97 97 ASP CA C 459 56.228 56.228 52.638 3.590 18002
1068 1 2 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.730 1.855 18002
1069 1 2 . 1 1 97 97 ASP H H 459 9.116 9.116 8.359 0.757 18002
1070 1 2 . 1 1 98 98 ASN N N 460 109.173 109.173 116.025 -6.852 18002
1071 1 2 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.843 -0.471 18002
1072 1 2 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.322 -0.308 18002
1073 1 2 . 1 1 98 98 ASN CB C 460 40.811 40.811 41.242 -0.431 18002
1074 1 2 . 1 1 98 98 ASN H H 460 7.054 7.054 6.812 0.242 18002
1075 1 2 . 1 1 99 99 GLU N N 461 119.220 119.220 121.351 -2.131 18002
1076 1 2 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.178 -0.134 18002
1077 1 2 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.677 0.091 18002
1078 1 2 . 1 1 99 99 GLU H H 461 8.937 8.937 9.061 -0.124 18002
1079 1 2 . 1 1 100 100 LYS N N 462 120.647 120.647 119.795 0.852 18002
1080 1 2 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.071 0.574 18002
1081 1 2 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.659 0.877 18002
1082 1 2 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.931 0.297 18002
1083 1 2 . 1 1 100 100 LYS H H 462 8.033 8.033 8.454 -0.421 18002
1084 1 2 . 1 1 101 101 GLN N N 463 121.938 121.938 119.134 2.804 18002
1085 1 2 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.315 0.085 18002
1086 1 2 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.282 0.113 18002
1087 1 2 . 1 1 101 101 GLN CB C 463 32.214 32.214 27.993 4.221 18002
1088 1 2 . 1 1 101 101 GLN H H 463 8.372 8.372 8.259 0.113 18002
1089 1 2 . 1 1 102 102 TYR N N 464 117.422 117.422 120.743 -3.321 18002
1090 1 2 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.149 0.467 18002
1091 1 2 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.369 0.308 18002
1092 1 2 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.237 0.622 18002
1093 1 2 . 1 1 102 102 TYR H H 464 8.221 8.221 7.879 0.342 18002
1094 1 2 . 1 1 103 103 ALA N N 465 120.655 120.655 118.271 2.384 18002
1095 1 2 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.875 -0.160 18002
1096 1 2 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.478 1.435 18002
1097 1 2 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.409 0.393 18002
1098 1 2 . 1 1 103 103 ALA H H 465 8.637 8.637 7.990 0.647 18002
1099 1 2 . 1 1 104 104 HIS N N 466 112.871 112.871 117.321 -4.450 18002
1100 1 2 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.601 -0.460 18002
1101 1 2 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.850 0.777 18002
1102 1 2 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.064 -1.206 18002
1103 1 2 . 1 1 104 104 HIS H H 466 7.852 7.852 8.213 -0.361 18002
1104 1 2 . 1 1 105 105 TRP N N 467 121.317 121.317 119.214 2.103 18002
1105 1 2 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.482 -0.787 18002
1106 1 2 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.325 2.017 18002
1107 1 2 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.791 -2.286 18002
1108 1 2 . 1 1 105 105 TRP H H 467 8.668 8.668 7.787 0.881 18002
1109 1 2 . 1 1 106 106 MET N N 468 122.346 122.346 119.481 2.865 18002
1110 1 2 . 1 1 106 106 MET HA H 468 4.086 4.086 4.064 0.022 18002
1111 1 2 . 1 1 106 106 MET CA C 468 58.743 58.743 59.439 -0.696 18002
1112 1 2 . 1 1 106 106 MET CB C 468 31.402 31.402 32.152 -0.750 18002
1113 1 2 . 1 1 106 106 MET H H 468 9.790 9.790 8.123 1.667 18002
1114 1 2 . 1 1 107 107 ALA N N 469 119.758 119.758 120.423 -0.665 18002
1115 1 2 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.023 -0.318 18002
1116 1 2 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.415 1.714 18002
1117 1 2 . 1 1 107 107 ALA CB C 469 20.405 20.405 17.887 2.518 18002
1118 1 2 . 1 1 107 107 ALA H H 469 7.702 7.702 7.889 -0.187 18002
1119 1 2 . 1 1 108 108 ALA N N 470 119.233 119.233 121.691 -2.458 18002
1120 1 2 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.925 -0.379 18002
1121 1 2 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.854 0.967 18002
1122 1 2 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.747 -1.015 18002
1123 1 2 . 1 1 108 108 ALA H H 470 7.156 7.156 7.418 -0.262 18002
1124 1 2 . 1 1 109 109 CYS N N 471 116.736 116.736 117.416 -0.680 18002
1125 1 2 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.089 -0.032 18002
1126 1 2 . 1 1 109 109 CYS CA C 471 64.571 64.571 63.426 1.145 18002
1127 1 2 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.378 0.015 18002
1128 1 2 . 1 1 109 109 CYS H H 471 8.256 8.256 8.346 -0.090 18002
1129 1 2 . 1 1 110 110 ARG N N 472 118.644 118.644 119.951 -1.307 18002
1130 1 2 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.012 -0.278 18002
1131 1 2 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.940 1.264 18002
1132 1 2 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.559 0.758 18002
1133 1 2 . 1 1 110 110 ARG H H 472 8.403 8.403 7.338 1.065 18002
1134 1 2 . 1 1 111 111 LEU N N 473 121.877 121.877 119.061 2.816 18002
1135 1 2 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.929 -0.129 18002
1136 1 2 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.403 2.452 18002
1137 1 2 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.263 -0.843 18002
1138 1 2 . 1 1 111 111 LEU H H 473 7.916 7.916 7.421 0.495 18002
1139 1 2 . 1 1 112 112 ALA N N 474 122.765 122.765 119.925 2.840 18002
1140 1 2 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.085 0.395 18002
1141 1 2 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.633 0.628 18002
1142 1 2 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.365 1.510 18002
1143 1 2 . 1 1 112 112 ALA H H 474 8.393 8.393 7.914 0.479 18002
1144 1 2 . 1 1 113 113 SER N N 475 113.613 113.613 114.533 -0.920 18002
1145 1 2 . 1 1 113 113 SER HA H 475 4.782 4.782 4.198 0.584 18002
1146 1 2 . 1 1 113 113 SER CA C 475 61.090 61.090 61.128 -0.038 18002
1147 1 2 . 1 1 113 113 SER CB C 475 63.612 63.612 63.164 0.448 18002
1148 1 2 . 1 1 113 113 SER H H 475 8.150 8.150 8.263 -0.113 18002
1149 1 2 . 1 1 114 114 LYS N N 476 118.734 118.734 119.138 -0.404 18002
1150 1 2 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.319 0.234 18002
1151 1 2 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.178 -1.034 18002
1152 1 2 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.205 0.386 18002
1153 1 2 . 1 1 114 114 LYS H H 476 7.239 7.239 7.797 -0.558 18002
1154 1 2 . 1 1 115 115 GLY N N 477 107.818 107.818 108.196 -0.378 18002
1155 1 2 . 1 1 115 115 GLY CA C 477 45.986 45.986 46.208 -0.222 18002
1156 1 2 . 1 1 115 115 GLY H H 477 8.401 8.401 8.311 0.090 18002
1157 1 2 . 1 1 116 116 LYS N N 478 120.938 120.938 121.563 -0.625 18002
1158 1 2 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.599 -0.026 18002
1159 1 2 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.855 -0.008 18002
1160 1 2 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.233 1.088 18002
1161 1 2 . 1 1 116 116 LYS H H 478 8.142 8.142 7.769 0.373 18002
1162 1 2 . 1 1 117 117 THR N N 479 108.076 108.076 113.516 -5.440 18002
1163 1 2 . 1 1 117 117 THR HA H 479 4.671 4.671 4.467 0.204 18002
1164 1 2 . 1 1 117 117 THR CA C 479 59.191 59.191 61.047 -1.856 18002
1165 1 2 . 1 1 117 117 THR CB C 479 72.228 72.228 70.963 1.265 18002
1166 1 2 . 1 1 117 117 THR H H 479 7.926 7.926 8.017 -0.091 18002
1167 1 2 . 1 1 118 118 MET N N 480 116.403 116.403 118.561 -2.158 18002
1168 1 2 . 1 1 118 118 MET HA H 480 3.352 3.352 3.938 -0.586 18002
1169 1 2 . 1 1 118 118 MET CA C 480 57.947 57.947 55.180 2.767 18002
1170 1 2 . 1 1 118 118 MET CB C 480 33.920 33.920 31.352 2.568 18002
1171 1 2 . 1 1 118 118 MET H H 480 8.899 8.899 8.364 0.535 18002
1172 1 2 . 1 1 119 119 ALA N N 481 117.786 117.786 118.964 -1.178 18002
1173 1 2 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.043 0.041 18002
1174 1 2 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.171 -1.576 18002
1175 1 2 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.226 -0.164 18002
1176 1 2 . 1 1 119 119 ALA H H 481 7.645 7.645 7.877 -0.232 18002
1177 1 2 . 1 1 120 120 ASP N N 482 120.348 120.348 115.456 4.892 18002
1178 1 2 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.763 4.853 18002
1179 1 2 . 1 1 120 120 ASP H H 482 7.887 7.887 8.487 -0.600 18002
1180 1 2 . 1 1 121 121 SER HA H 483 4.223 4.223 4.162 0.061 18002
1181 1 2 . 1 1 121 121 SER CA C 483 61.455 61.455 61.405 0.050 18002
1182 1 2 . 1 1 121 121 SER CB C 483 62.996 62.996 63.207 -0.211 18002
1183 1 2 . 1 1 122 122 SER N N 484 116.845 116.845 113.918 2.927 18002
1184 1 2 . 1 1 122 122 SER HA H 484 4.321 4.321 4.405 -0.084 18002
1185 1 2 . 1 1 122 122 SER CA C 484 60.584 60.584 59.419 1.165 18002
1186 1 2 . 1 1 122 122 SER CB C 484 64.314 64.314 62.759 1.555 18002
1187 1 2 . 1 1 122 122 SER H H 484 8.875 8.875 8.274 0.601 18002
1188 1 2 . 1 1 123 123 TYR N N 485 124.153 124.153 122.584 1.569 18002
1189 1 2 . 1 1 123 123 TYR HA H 485 3.880 3.880 3.971 -0.091 18002
1190 1 2 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.819 1.495 18002
1191 1 2 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.281 -0.540 18002
1192 1 2 . 1 1 123 123 TYR H H 485 8.018 8.018 8.275 -0.257 18002
1193 1 2 . 1 1 124 124 ASN N N 486 115.339 115.339 116.450 -1.111 18002
1194 1 2 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.311 -0.370 18002
1195 1 2 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.306 0.400 18002
1196 1 2 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.062 -0.006 18002
1197 1 2 . 1 1 124 124 ASN H H 486 8.665 8.665 7.944 0.721 18002
1198 1 2 . 1 1 125 125 LEU N N 487 119.454 119.454 119.590 -0.136 18002
1199 1 2 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.085 -0.147 18002
1200 1 2 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.075 0.595 18002
1201 1 2 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.918 -0.350 18002
1202 1 2 . 1 1 125 125 LEU H H 487 7.105 7.105 7.414 -0.309 18002
1203 1 2 . 1 1 126 126 GLU N N 488 121.189 121.189 118.803 2.386 18002
1204 1 2 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.968 0.062 18002
1205 1 2 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.932 0.103 18002
1206 1 2 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.796 -0.711 18002
1207 1 2 . 1 1 126 126 GLU H H 488 8.053 8.053 7.809 0.244 18002
1208 1 2 . 1 1 127 127 VAL N N 489 119.073 119.073 116.823 2.250 18002
1209 1 2 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.545 -0.527 18002
1210 1 2 . 1 1 127 127 VAL CA C 489 67.322 67.322 66.240 1.082 18002
1211 1 2 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.226 0.433 18002
1212 1 2 . 1 1 127 127 VAL H H 489 7.769 7.769 7.355 0.414 18002
1213 1 2 . 1 1 128 128 GLN N N 490 116.214 116.214 117.497 -1.283 18002
1214 1 2 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.077 -0.245 18002
1215 1 2 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.381 0.375 18002
1216 1 2 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.875 0.237 18002
1217 1 2 . 1 1 128 128 GLN H H 490 7.542 7.542 8.074 -0.532 18002
1218 1 2 . 1 1 129 129 ASN N N 491 120.003 120.003 119.237 0.766 18002
1219 1 2 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.661 -0.242 18002
1220 1 2 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.752 0.409 18002
1221 1 2 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.374 -0.314 18002
1222 1 2 . 1 1 129 129 ASN H H 491 8.582 8.582 7.871 0.711 18002
1223 1 2 . 1 1 130 130 ILE N N 492 122.365 122.365 120.635 1.730 18002
1224 1 2 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.193 3.560 18002
1225 1 2 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.958 1.188 18002
1226 1 2 . 1 1 130 130 ILE H H 492 8.186 8.186 7.508 0.678 18002
1227 1 2 . 1 1 131 131 LEU N N 493 119.597 119.597 120.992 -1.395 18002
1228 1 2 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.984 0.021 18002
1229 1 2 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.554 0.305 18002
1230 1 2 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.703 -0.167 18002
1231 1 2 . 1 1 131 131 LEU H H 493 8.224 8.224 8.306 -0.082 18002
1232 1 2 . 1 1 132 132 SER N N 494 114.884 114.884 113.732 1.152 18002
1233 1 2 . 1 1 132 132 SER HA H 494 4.430 4.430 4.269 0.161 18002
1234 1 2 . 1 1 132 132 SER CA C 494 62.072 62.072 60.844 1.228 18002
1235 1 2 . 1 1 132 132 SER CB C 494 62.703 62.703 63.126 -0.423 18002
1236 1 2 . 1 1 132 132 SER H H 494 8.464 8.464 7.711 0.753 18002
1237 1 2 . 1 1 133 133 PHE N N 495 123.047 123.047 122.136 0.911 18002
1238 1 2 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.296 0.081 18002
1239 1 2 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.537 -0.624 18002
1240 1 2 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.468 -0.418 18002
1241 1 2 . 1 1 133 133 PHE H H 495 7.915 7.915 7.559 0.356 18002
1242 1 2 . 1 1 134 134 LEU N N 496 119.311 119.311 118.439 0.872 18002
1243 1 2 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.624 -0.719 18002
1244 1 2 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.403 0.198 18002
1245 1 2 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.785 0.117 18002
1246 1 2 . 1 1 134 134 LEU H H 496 8.386 8.386 8.573 -0.187 18002
1247 1 2 . 1 1 135 135 LYS N N 497 117.550 117.550 119.976 -2.426 18002
1248 1 2 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.054 -0.114 18002
1249 1 2 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.730 -0.455 18002
1250 1 2 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.386 0.108 18002
1251 1 2 . 1 1 135 135 LYS H H 497 7.670 7.670 7.901 -0.231 18002
1252 1 2 . 1 1 136 136 MET N N 498 116.106 116.106 117.083 -0.977 18002
1253 1 2 . 1 1 136 136 MET HA H 498 4.354 4.354 4.250 0.104 18002
1254 1 2 . 1 1 136 136 MET CA C 498 55.994 55.994 57.821 -1.827 18002
1255 1 2 . 1 1 136 136 MET CB C 498 32.772 32.772 33.741 -0.969 18002
1256 1 2 . 1 1 136 136 MET H H 498 7.421 7.421 7.502 -0.081 18002
1257 1 2 . 1 1 137 137 GLN N N 499 118.651 118.651 111.820 6.831 18002
1258 1 2 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.454 -0.270 18002
1259 1 2 . 1 1 137 137 GLN CA C 499 55.308 55.308 55.767 -0.459 18002
1260 1 2 . 1 1 137 137 GLN H H 499 7.617 7.617 8.194 -0.577 18002
1261 1 3 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.746 -0.621 18002
1262 1 3 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.412 -1.397 18002
1263 1 3 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.855 2.074 18002
1264 1 3 . 1 1 4 4 MET N N 366 120.431 120.431 121.621 -1.190 18002
1265 1 3 . 1 1 4 4 MET HA H 366 4.345 4.345 4.702 -0.357 18002
1266 1 3 . 1 1 4 4 MET CA C 366 55.337 55.337 55.469 -0.132 18002
1267 1 3 . 1 1 4 4 MET CB C 366 32.668 32.668 34.453 -1.785 18002
1268 1 3 . 1 1 4 4 MET H H 366 8.373 8.373 8.045 0.328 18002
1269 1 3 . 1 1 5 5 GLY N N 367 109.318 109.318 112.110 -2.792 18002
1270 1 3 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.123 0.334 18002
1271 1 3 . 1 1 5 5 GLY H H 367 8.224 8.224 8.677 -0.453 18002
1272 1 3 . 1 1 6 6 ASP N N 368 120.307 120.307 121.337 -1.030 18002
1273 1 3 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.325 0.275 18002
1274 1 3 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.675 -0.162 18002
1275 1 3 . 1 1 6 6 ASP CB C 368 41.326 41.326 40.201 1.125 18002
1276 1 3 . 1 1 6 6 ASP H H 368 8.199 8.199 8.439 -0.240 18002
1277 1 3 . 1 1 7 7 ILE N N 369 120.668 120.668 117.297 3.371 18002
1278 1 3 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.020 0.198 18002
1279 1 3 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.441 -0.857 18002
1280 1 3 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.239 0.529 18002
1281 1 3 . 1 1 7 7 ILE H H 369 8.138 8.138 8.131 0.007 18002
1282 1 3 . 1 1 8 8 THR N N 370 117.564 117.564 109.916 7.648 18002
1283 1 3 . 1 1 8 8 THR HA H 370 4.322 4.322 4.072 0.250 18002
1284 1 3 . 1 1 8 8 THR CA C 370 62.332 62.332 62.619 -0.287 18002
1285 1 3 . 1 1 8 8 THR CB C 370 69.946 69.946 67.677 2.269 18002
1286 1 3 . 1 1 8 8 THR H H 370 8.230 8.230 7.905 0.325 18002
1287 1 3 . 1 1 9 9 SER N N 371 118.467 118.467 114.041 4.426 18002
1288 1 3 . 1 1 9 9 SER HA H 371 4.445 4.445 4.440 0.005 18002
1289 1 3 . 1 1 9 9 SER CA C 371 58.274 58.274 58.054 0.220 18002
1290 1 3 . 1 1 9 9 SER CB C 371 63.996 63.996 63.627 0.369 18002
1291 1 3 . 1 1 9 9 SER H H 371 8.158 8.158 7.925 0.233 18002
1292 1 3 . 1 1 10 10 ILE N N 372 123.959 123.959 122.632 1.327 18002
1293 1 3 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.089 -4.373 18002
1294 1 3 . 1 1 10 10 ILE CB C 372 38.919 38.919 35.396 3.523 18002
1295 1 3 . 1 1 10 10 ILE H H 372 8.112 8.112 8.378 -0.266 18002
1296 1 3 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.642 -0.290 18002
1297 1 3 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.577 1.604 18002
1298 1 3 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.054 1.653 18002
1299 1 3 . 1 1 12 12 GLU N N 374 119.349 119.349 119.754 -0.405 18002
1300 1 3 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.351 0.436 18002
1301 1 3 . 1 1 12 12 GLU CA C 374 55.317 55.317 56.573 -1.256 18002
1302 1 3 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.028 3.563 18002
1303 1 3 . 1 1 12 12 GLU H H 374 8.017 8.017 7.608 0.409 18002
1304 1 3 . 1 1 13 13 LEU N N 375 122.288 122.288 126.636 -4.348 18002
1305 1 3 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.529 -0.051 18002
1306 1 3 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.068 -1.138 18002
1307 1 3 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.374 1.282 18002
1308 1 3 . 1 1 13 13 LEU H H 375 8.036 8.036 8.335 -0.299 18002
1309 1 3 . 1 1 14 14 ALA N N 376 125.461 125.461 127.436 -1.975 18002
1310 1 3 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.267 -0.021 18002
1311 1 3 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.432 0.313 18002
1312 1 3 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.231 -0.645 18002
1313 1 3 . 1 1 14 14 ALA H H 376 8.181 8.181 8.165 0.016 18002
1314 1 3 . 1 1 15 15 ASP N N 377 122.242 122.242 120.421 1.821 18002
1315 1 3 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.759 -0.440 18002
1316 1 3 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.788 -0.037 18002
1317 1 3 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.028 2.611 18002
1318 1 3 . 1 1 15 15 ASP H H 377 8.326 8.326 8.887 -0.561 18002
1319 1 3 . 1 1 16 16 TYR N N 378 118.961 118.961 119.528 -0.567 18002
1320 1 3 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.701 0.690 18002
1321 1 3 . 1 1 16 16 TYR CA C 378 59.581 59.581 58.156 1.425 18002
1322 1 3 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.557 0.466 18002
1323 1 3 . 1 1 16 16 TYR H H 378 8.869 8.869 7.582 1.287 18002
1324 1 3 . 1 1 17 17 ILE N N 379 125.214 125.214 121.895 3.319 18002
1325 1 3 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.334 -0.004 18002
1326 1 3 . 1 1 17 17 ILE CA C 379 58.732 58.732 59.695 -0.963 18002
1327 1 3 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.797 -0.821 18002
1328 1 3 . 1 1 17 17 ILE H H 379 8.608 8.608 8.148 0.460 18002
1329 1 3 . 1 1 18 18 LYS N N 380 122.917 122.917 125.166 -2.249 18002
1330 1 3 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.379 -0.267 18002
1331 1 3 . 1 1 18 18 LYS CA C 380 55.836 55.836 53.857 1.979 18002
1332 1 3 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.678 0.347 18002
1333 1 3 . 1 1 18 18 LYS H H 380 7.424 7.424 8.583 -1.159 18002
1334 1 3 . 1 1 19 19 VAL N N 381 122.839 122.839 122.257 0.582 18002
1335 1 3 . 1 1 19 19 VAL HA H 381 5.263 5.263 5.287 -0.024 18002
1336 1 3 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.799 1.717 18002
1337 1 3 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.233 -0.085 18002
1338 1 3 . 1 1 19 19 VAL H H 381 9.223 9.223 7.824 1.399 18002
1339 1 3 . 1 1 20 20 PHE N N 382 129.509 129.509 123.102 6.407 18002
1340 1 3 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.144 -0.301 18002
1341 1 3 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.244 -0.739 18002
1342 1 3 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.859 2.003 18002
1343 1 3 . 1 1 20 20 PHE H H 382 9.451 9.451 7.917 1.534 18002
1344 1 3 . 1 1 21 21 LYS N N 383 126.417 126.417 122.717 3.700 18002
1345 1 3 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.963 -0.122 18002
1346 1 3 . 1 1 21 21 LYS CB C 383 33.219 33.219 33.703 -0.484 18002
1347 1 3 . 1 1 21 21 LYS H H 383 7.582 7.582 7.996 -0.414 18002
1348 1 3 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.594 1.103 18002
1349 1 3 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.083 -0.114 18002
1350 1 3 . 1 1 23 23 LYS N N 385 118.026 118.026 118.016 0.010 18002
1351 1 3 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.962 0.253 18002
1352 1 3 . 1 1 23 23 LYS CA C 385 56.345 56.345 58.402 -2.057 18002
1353 1 3 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.481 1.552 18002
1354 1 3 . 1 1 23 23 LYS H H 385 8.138 8.138 8.385 -0.247 18002
1355 1 3 . 1 1 24 24 LYS N N 386 120.816 120.816 118.850 1.966 18002
1356 1 3 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.341 -0.155 18002
1357 1 3 . 1 1 24 24 LYS CA C 386 56.862 56.862 56.798 0.064 18002
1358 1 3 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.346 0.481 18002
1359 1 3 . 1 1 24 24 LYS H H 386 7.727 7.727 8.105 -0.378 18002
1360 1 3 . 1 1 25 25 LEU N N 387 121.214 121.214 119.217 1.997 18002
1361 1 3 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.448 -0.280 18002
1362 1 3 . 1 1 25 25 LEU CA C 387 56.508 56.508 55.010 1.498 18002
1363 1 3 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.758 -1.116 18002
1364 1 3 . 1 1 25 25 LEU H H 387 8.241 8.241 7.934 0.307 18002
1365 1 3 . 1 1 26 26 THR N N 388 112.798 112.798 114.857 -2.059 18002
1366 1 3 . 1 1 26 26 THR HA H 388 4.313 4.313 4.100 0.213 18002
1367 1 3 . 1 1 26 26 THR CA C 388 61.795 61.795 63.056 -1.261 18002
1368 1 3 . 1 1 26 26 THR CB C 388 69.875 69.875 68.123 1.752 18002
1369 1 3 . 1 1 26 26 THR H H 388 7.700 7.700 7.986 -0.286 18002
1370 1 3 . 1 1 27 27 LEU N N 389 124.091 124.091 125.230 -1.139 18002
1371 1 3 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.656 -0.302 18002
1372 1 3 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.854 0.679 18002
1373 1 3 . 1 1 27 27 LEU CB C 389 42.298 42.298 40.762 1.536 18002
1374 1 3 . 1 1 27 27 LEU H H 389 8.260 8.260 8.194 0.066 18002
1375 1 3 . 1 1 28 28 LYS N N 390 121.153 121.153 120.725 0.428 18002
1376 1 3 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.167 0.153 18002
1377 1 3 . 1 1 28 28 LYS CA C 390 56.211 56.211 57.674 -1.463 18002
1378 1 3 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.042 1.633 18002
1379 1 3 . 1 1 28 28 LYS H H 390 8.202 8.202 8.239 -0.037 18002
1380 1 3 . 1 1 29 29 GLY N N 391 107.270 107.270 107.491 -0.221 18002
1381 1 3 . 1 1 29 29 GLY CA C 391 44.875 44.875 46.352 -1.477 18002
1382 1 3 . 1 1 29 29 GLY H H 391 7.876 7.876 8.160 -0.284 18002
1383 1 3 . 1 1 30 30 TYR N N 392 118.471 118.471 127.355 -8.884 18002
1384 1 3 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.426 0.020 18002
1385 1 3 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.862 -0.815 18002
1386 1 3 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.242 2.583 18002
1387 1 3 . 1 1 30 30 TYR H H 392 8.183 8.183 8.570 -0.387 18002
1388 1 3 . 1 1 31 31 LYS N N 393 122.833 122.833 122.782 0.051 18002
1389 1 3 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.769 -0.254 18002
1390 1 3 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.463 0.711 18002
1391 1 3 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.076 0.644 18002
1392 1 3 . 1 1 31 31 LYS H H 393 8.731 8.731 7.810 0.921 18002
1393 1 3 . 1 1 32 32 GLN N N 394 124.759 124.759 119.017 5.742 18002
1394 1 3 . 1 1 32 32 GLN HA H 394 4.678 4.678 5.565 -0.887 18002
1395 1 3 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.719 1.888 18002
1396 1 3 . 1 1 32 32 GLN CB C 394 31.048 31.048 31.260 -0.212 18002
1397 1 3 . 1 1 32 32 GLN H H 394 8.776 8.776 8.595 0.181 18002
1398 1 3 . 1 1 33 33 TYR N N 395 125.112 125.112 122.731 2.381 18002
1399 1 3 . 1 1 33 33 TYR HA H 395 5.074 5.074 5.336 -0.262 18002
1400 1 3 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.604 1.560 18002
1401 1 3 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.688 0.984 18002
1402 1 3 . 1 1 33 33 TYR H H 395 8.774 8.774 8.972 -0.198 18002
1403 1 3 . 1 1 34 34 TRP N N 396 122.638 122.638 125.675 -3.037 18002
1404 1 3 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.321 -0.639 18002
1405 1 3 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.129 3.089 18002
1406 1 3 . 1 1 34 34 TRP CB C 396 29.504 29.504 29.256 0.248 18002
1407 1 3 . 1 1 34 34 TRP H H 396 8.975 8.975 8.132 0.843 18002
1408 1 3 . 1 1 35 35 CYS N N 397 127.146 127.146 123.252 3.894 18002
1409 1 3 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.920 0.447 18002
1410 1 3 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.342 1.364 18002
1411 1 3 . 1 1 35 35 CYS H H 397 8.804 8.804 8.655 0.149 18002
1412 1 3 . 1 1 36 36 THR N N 398 110.578 110.578 115.462 -4.884 18002
1413 1 3 . 1 1 36 36 THR HA H 398 5.358 5.358 5.145 0.213 18002
1414 1 3 . 1 1 36 36 THR CA C 398 58.704 58.704 60.318 -1.614 18002
1415 1 3 . 1 1 36 36 THR CB C 398 71.833 71.833 70.899 0.934 18002
1416 1 3 . 1 1 36 36 THR H H 398 9.090 9.090 8.108 0.982 18002
1417 1 3 . 1 1 37 37 PHE N N 399 127.322 127.322 127.087 0.235 18002
1418 1 3 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.556 0.397 18002
1419 1 3 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.957 -1.711 18002
1420 1 3 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.183 3.002 18002
1421 1 3 . 1 1 37 37 PHE H H 399 8.846 8.846 8.408 0.438 18002
1422 1 3 . 1 1 38 38 LYS N N 400 125.391 125.391 123.568 1.823 18002
1423 1 3 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.525 0.002 18002
1424 1 3 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.952 1.025 18002
1425 1 3 . 1 1 38 38 LYS CB C 400 35.915 35.915 34.024 1.891 18002
1426 1 3 . 1 1 38 38 LYS H H 400 8.252 8.252 7.560 0.692 18002
1427 1 3 . 1 1 39 39 ASP N N 401 125.083 125.083 117.293 7.790 18002
1428 1 3 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.290 -0.212 18002
1429 1 3 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.594 -0.111 18002
1430 1 3 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.753 -1.232 18002
1431 1 3 . 1 1 39 39 ASP H H 401 9.408 9.408 8.989 0.419 18002
1432 1 3 . 1 1 40 40 THR N N 402 112.024 112.024 107.065 4.959 18002
1433 1 3 . 1 1 40 40 THR HA H 402 4.767 4.767 4.292 0.475 18002
1434 1 3 . 1 1 40 40 THR CA C 402 60.811 60.811 62.290 -1.479 18002
1435 1 3 . 1 1 40 40 THR CB C 402 68.823 68.823 69.350 -0.527 18002
1436 1 3 . 1 1 40 40 THR H H 402 8.224 8.224 8.034 0.190 18002
1437 1 3 . 1 1 41 41 SER N N 403 116.142 116.142 117.619 -1.477 18002
1438 1 3 . 1 1 41 41 SER HA H 403 5.428 5.428 4.752 0.676 18002
1439 1 3 . 1 1 41 41 SER CA C 403 58.297 58.297 57.414 0.883 18002
1440 1 3 . 1 1 41 41 SER CB C 403 66.409 66.409 64.104 2.305 18002
1441 1 3 . 1 1 41 41 SER H H 403 8.197 8.197 7.704 0.493 18002
1442 1 3 . 1 1 42 42 ILE N N 404 122.292 122.292 126.995 -4.703 18002
1443 1 3 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.347 0.582 18002
1444 1 3 . 1 1 42 42 ILE CA C 404 59.804 59.804 59.934 -0.130 18002
1445 1 3 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.170 2.249 18002
1446 1 3 . 1 1 42 42 ILE H H 404 8.411 8.411 8.228 0.183 18002
1447 1 3 . 1 1 43 43 SER N N 405 122.244 122.244 119.463 2.781 18002
1448 1 3 . 1 1 43 43 SER HA H 405 4.966 4.966 4.875 0.091 18002
1449 1 3 . 1 1 43 43 SER CA C 405 57.735 57.735 56.552 1.183 18002
1450 1 3 . 1 1 43 43 SER CB C 405 65.388 65.388 65.910 -0.522 18002
1451 1 3 . 1 1 43 43 SER H H 405 8.752 8.752 8.041 0.711 18002
1452 1 3 . 1 1 44 44 CYS N N 406 120.004 120.004 121.343 -1.339 18002
1453 1 3 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.692 0.275 18002
1454 1 3 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.839 -0.781 18002
1455 1 3 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.464 0.976 18002
1456 1 3 . 1 1 44 44 CYS H H 406 8.470 8.470 8.238 0.232 18002
1457 1 3 . 1 1 45 45 TYR N N 407 122.704 122.704 127.910 -5.206 18002
1458 1 3 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.652 0.371 18002
1459 1 3 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.557 -0.574 18002
1460 1 3 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.752 0.822 18002
1461 1 3 . 1 1 45 45 TYR H H 407 10.013 10.013 7.812 2.201 18002
1462 1 3 . 1 1 46 46 LYS N N 408 121.897 121.897 122.825 -0.928 18002
1463 1 3 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.747 -0.401 18002
1464 1 3 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.978 3.041 18002
1465 1 3 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.989 -1.277 18002
1466 1 3 . 1 1 46 46 LYS H H 408 9.734 9.734 8.526 1.208 18002
1467 1 3 . 1 1 47 47 SER N N 409 106.720 106.720 110.443 -3.723 18002
1468 1 3 . 1 1 47 47 SER HA H 409 4.776 4.776 4.857 -0.081 18002
1469 1 3 . 1 1 47 47 SER CA C 409 57.180 57.180 57.941 -0.760 18002
1470 1 3 . 1 1 47 47 SER CB C 409 65.870 65.870 65.103 0.767 18002
1471 1 3 . 1 1 47 47 SER H H 409 7.518 7.518 7.852 -0.334 18002
1472 1 3 . 1 1 48 48 LYS N N 410 122.302 122.302 122.748 -0.446 18002
1473 1 3 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.392 0.842 18002
1474 1 3 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.128 0.171 18002
1475 1 3 . 1 1 48 48 LYS H H 410 8.195 8.195 8.800 -0.605 18002
1476 1 3 . 1 1 49 49 GLU N N 411 118.983 118.983 121.094 -2.111 18002
1477 1 3 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.134 0.648 18002
1478 1 3 . 1 1 49 49 GLU CA C 411 59.535 59.535 59.146 0.389 18002
1479 1 3 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.419 -0.732 18002
1480 1 3 . 1 1 49 49 GLU H H 411 8.752 8.752 8.525 0.227 18002
1481 1 3 . 1 1 50 50 GLU N N 412 118.384 118.384 119.057 -0.673 18002
1482 1 3 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.440 0.053 18002
1483 1 3 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.763 -0.974 18002
1484 1 3 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.579 0.426 18002
1485 1 3 . 1 1 50 50 GLU H H 412 7.234 7.234 7.808 -0.574 18002
1486 1 3 . 1 1 51 51 SER N N 413 114.767 114.767 116.727 -1.960 18002
1487 1 3 . 1 1 51 51 SER CA C 413 59.764 59.764 61.608 -1.843 18002
1488 1 3 . 1 1 51 51 SER CB C 413 62.965 62.965 63.280 -0.315 18002
1489 1 3 . 1 1 51 51 SER H H 413 7.382 7.382 8.523 -1.141 18002
1490 1 3 . 1 1 52 52 SER N N 414 114.496 114.496 114.342 0.154 18002
1491 1 3 . 1 1 52 52 SER HA H 414 4.560 4.560 4.650 -0.090 18002
1492 1 3 . 1 1 52 52 SER CA C 414 58.574 58.574 58.344 0.230 18002
1493 1 3 . 1 1 52 52 SER CB C 414 63.829 63.829 64.011 -0.182 18002
1494 1 3 . 1 1 52 52 SER H H 414 7.682 7.682 7.956 -0.274 18002
1495 1 3 . 1 1 53 53 GLY N N 415 111.107 111.107 108.843 2.264 18002
1496 1 3 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.845 -0.612 18002
1497 1 3 . 1 1 53 53 GLY H H 415 7.918 7.918 8.111 -0.193 18002
1498 1 3 . 1 1 54 54 THR N N 416 120.214 120.214 117.237 2.977 18002
1499 1 3 . 1 1 54 54 THR CB C 416 70.035 70.035 69.713 0.322 18002
1500 1 3 . 1 1 54 54 THR H H 416 8.622 8.622 8.285 0.337 18002
1501 1 3 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.686 0.789 18002
1502 1 3 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.487 -0.443 18002
1503 1 3 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.706 -0.128 18002
1504 1 3 . 1 1 56 56 ALA N N 418 125.591 125.591 125.922 -0.331 18002
1505 1 3 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.030 -0.074 18002
1506 1 3 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.861 0.674 18002
1507 1 3 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.701 -0.794 18002
1508 1 3 . 1 1 56 56 ALA H H 418 8.288 8.288 8.186 0.102 18002
1509 1 3 . 1 1 57 57 HIS N N 419 108.119 108.119 114.829 -6.710 18002
1510 1 3 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.656 -0.034 18002
1511 1 3 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.980 -1.399 18002
1512 1 3 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.920 2.299 18002
1513 1 3 . 1 1 57 57 HIS H H 419 7.072 7.072 7.774 -0.702 18002
1514 1 3 . 1 1 58 58 GLN N N 420 123.083 123.083 120.933 2.150 18002
1515 1 3 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.790 0.365 18002
1516 1 3 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.632 0.872 18002
1517 1 3 . 1 1 58 58 GLN CB C 420 32.490 32.490 31.420 1.070 18002
1518 1 3 . 1 1 58 58 GLN H H 420 8.669 8.669 7.892 0.777 18002
1519 1 3 . 1 1 59 59 MET N N 421 122.330 122.330 118.878 3.452 18002
1520 1 3 . 1 1 59 59 MET HA H 421 4.621 4.621 4.762 -0.141 18002
1521 1 3 . 1 1 59 59 MET CA C 421 54.892 54.892 54.016 0.876 18002
1522 1 3 . 1 1 59 59 MET CB C 421 35.650 35.650 36.562 -0.912 18002
1523 1 3 . 1 1 59 59 MET H H 421 8.995 8.995 8.003 0.992 18002
1524 1 3 . 1 1 60 60 ASN N N 422 123.220 123.220 119.932 3.288 18002
1525 1 3 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.934 0.014 18002
1526 1 3 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.345 0.286 18002
1527 1 3 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.968 0.771 18002
1528 1 3 . 1 1 60 60 ASN H H 422 8.728 8.728 8.561 0.167 18002
1529 1 3 . 1 1 61 61 LEU N N 423 126.072 126.072 123.725 2.347 18002
1530 1 3 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.366 -0.250 18002
1531 1 3 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.958 1.655 18002
1532 1 3 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.486 0.971 18002
1533 1 3 . 1 1 61 61 LEU H H 423 8.942 8.942 8.239 0.703 18002
1534 1 3 . 1 1 62 62 ARG N N 424 121.977 121.977 117.040 4.937 18002
1535 1 3 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.963 0.409 18002
1536 1 3 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.584 2.450 18002
1537 1 3 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.272 -0.662 18002
1538 1 3 . 1 1 62 62 ARG H H 424 8.000 8.000 8.012 -0.012 18002
1539 1 3 . 1 1 63 63 GLY N N 425 114.852 114.852 110.137 4.715 18002
1540 1 3 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.300 0.510 18002
1541 1 3 . 1 1 63 63 GLY H H 425 9.033 9.033 8.340 0.693 18002
1542 1 3 . 1 1 64 64 CYS N N 426 117.102 117.102 117.633 -0.531 18002
1543 1 3 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.605 0.294 18002
1544 1 3 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.273 1.487 18002
1545 1 3 . 1 1 64 64 CYS CB C 426 28.824 28.824 30.272 -1.448 18002
1546 1 3 . 1 1 64 64 CYS H H 426 8.248 8.248 7.904 0.344 18002
1547 1 3 . 1 1 65 65 GLU N N 427 119.501 119.501 120.993 -1.492 18002
1548 1 3 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.558 0.219 18002
1549 1 3 . 1 1 65 65 GLU CA C 427 55.391 55.391 54.964 0.427 18002
1550 1 3 . 1 1 65 65 GLU CB C 427 31.938 31.938 30.622 1.316 18002
1551 1 3 . 1 1 65 65 GLU H H 427 8.449 8.449 8.716 -0.267 18002
1552 1 3 . 1 1 66 66 VAL N N 428 125.286 125.286 121.755 3.531 18002
1553 1 3 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.390 0.500 18002
1554 1 3 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.239 -0.487 18002
1555 1 3 . 1 1 66 66 VAL CB C 428 33.975 33.975 32.388 1.587 18002
1556 1 3 . 1 1 66 66 VAL H H 428 8.624 8.624 8.470 0.154 18002
1557 1 3 . 1 1 67 67 THR N N 429 124.132 124.132 121.906 2.226 18002
1558 1 3 . 1 1 67 67 THR CA C 429 59.338 59.338 60.172 -0.834 18002
1559 1 3 . 1 1 67 67 THR CB C 429 72.021 72.021 70.365 1.656 18002
1560 1 3 . 1 1 67 67 THR H H 429 9.247 9.247 8.294 0.953 18002
1561 1 3 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.556 0.093 18002
1562 1 3 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.794 -0.056 18002
1563 1 3 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.677 0.891 18002
1564 1 3 . 1 1 69 69 ASP N N 431 122.066 122.066 121.142 0.924 18002
1565 1 3 . 1 1 69 69 ASP HA H 431 4.647 4.647 5.069 -0.422 18002
1566 1 3 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.506 0.163 18002
1567 1 3 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.480 -0.375 18002
1568 1 3 . 1 1 69 69 ASP H H 431 8.250 8.250 8.419 -0.169 18002
1569 1 3 . 1 1 70 70 VAL N N 432 121.874 121.874 120.703 1.171 18002
1570 1 3 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.569 -0.070 18002
1571 1 3 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.906 0.182 18002
1572 1 3 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.156 -0.124 18002
1573 1 3 . 1 1 70 70 VAL H H 432 8.305 8.305 7.982 0.323 18002
1574 1 3 . 1 1 71 71 ASN N N 433 124.366 124.366 124.282 0.084 18002
1575 1 3 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.050 -0.368 18002
1576 1 3 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.182 0.579 18002
1577 1 3 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.961 0.318 18002
1578 1 3 . 1 1 71 71 ASN H H 433 8.637 8.637 8.229 0.408 18002
1579 1 3 . 1 1 72 72 ILE N N 434 126.786 126.786 123.064 3.722 18002
1580 1 3 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.857 -0.486 18002
1581 1 3 . 1 1 72 72 ILE CA C 434 64.518 64.518 62.384 2.134 18002
1582 1 3 . 1 1 72 72 ILE CB C 434 37.175 37.175 36.841 0.334 18002
1583 1 3 . 1 1 72 72 ILE H H 434 8.943 8.943 8.920 0.023 18002
1584 1 3 . 1 1 73 73 SER N N 435 118.305 118.305 118.427 -0.122 18002
1585 1 3 . 1 1 73 73 SER CA C 435 61.633 61.633 61.013 0.620 18002
1586 1 3 . 1 1 73 73 SER CB C 435 62.435 62.435 63.097 -0.662 18002
1587 1 3 . 1 1 73 73 SER H H 435 8.578 8.578 8.274 0.304 18002
1588 1 3 . 1 1 74 74 GLY N N 436 107.443 107.443 106.014 1.429 18002
1589 1 3 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.562 0.299 18002
1590 1 3 . 1 1 74 74 GLY H H 436 7.620 7.620 7.965 -0.345 18002
1591 1 3 . 1 1 75 75 GLN N N 437 116.895 116.895 117.610 -0.715 18002
1592 1 3 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.476 -0.186 18002
1593 1 3 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.480 0.221 18002
1594 1 3 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.768 0.977 18002
1595 1 3 . 1 1 75 75 GLN H H 437 7.798 7.798 7.485 0.313 18002
1596 1 3 . 1 1 76 76 LYS N N 438 119.308 119.308 119.518 -0.210 18002
1597 1 3 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.161 -0.019 18002
1598 1 3 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.559 0.484 18002
1599 1 3 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.893 2.052 18002
1600 1 3 . 1 1 76 76 LYS H H 438 7.522 7.522 7.449 0.073 18002
1601 1 3 . 1 1 77 77 PHE N N 439 125.905 125.905 123.491 2.414 18002
1602 1 3 . 1 1 77 77 PHE HA H 439 4.211 4.211 3.961 0.250 18002
1603 1 3 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.084 -1.445 18002
1604 1 3 . 1 1 77 77 PHE CB C 439 38.929 38.929 37.362 1.567 18002
1605 1 3 . 1 1 77 77 PHE H H 439 8.461 8.461 7.358 1.103 18002
1606 1 3 . 1 1 78 78 ASN N N 440 120.787 120.787 123.207 -2.420 18002
1607 1 3 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.174 -0.261 18002
1608 1 3 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.713 0.090 18002
1609 1 3 . 1 1 78 78 ASN H H 440 7.638 7.638 8.263 -0.625 18002
1610 1 3 . 1 1 79 79 ILE N N 441 123.421 123.421 124.734 -1.313 18002
1611 1 3 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.222 -0.051 18002
1612 1 3 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.224 1.343 18002
1613 1 3 . 1 1 79 79 ILE CB C 441 41.487 41.487 40.304 1.183 18002
1614 1 3 . 1 1 79 79 ILE H H 441 9.550 9.550 9.432 0.118 18002
1615 1 3 . 1 1 80 80 LYS N N 442 126.267 126.267 129.736 -3.469 18002
1616 1 3 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.044 0.418 18002
1617 1 3 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.780 1.603 18002
1618 1 3 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.185 0.802 18002
1619 1 3 . 1 1 80 80 LYS H H 442 8.703 8.703 8.468 0.235 18002
1620 1 3 . 1 1 81 81 LEU N N 443 125.194 125.194 128.150 -2.956 18002
1621 1 3 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.686 0.586 18002
1622 1 3 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.056 0.293 18002
1623 1 3 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.268 1.436 18002
1624 1 3 . 1 1 81 81 LEU H H 443 9.223 9.223 7.573 1.650 18002
1625 1 3 . 1 1 82 82 LEU N N 444 122.753 122.753 126.981 -4.228 18002
1626 1 3 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.282 -0.268 18002
1627 1 3 . 1 1 82 82 LEU CA C 444 53.918 53.918 52.995 0.923 18002
1628 1 3 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.727 -3.103 18002
1629 1 3 . 1 1 82 82 LEU H H 444 8.420 8.420 7.992 0.428 18002
1630 1 3 . 1 1 83 83 ILE N N 445 125.584 125.584 120.940 4.644 18002
1631 1 3 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.314 -0.029 18002
1632 1 3 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.858 -0.822 18002
1633 1 3 . 1 1 83 83 ILE H H 445 9.010 9.010 7.966 1.044 18002
1634 1 3 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.749 0.170 18002
1635 1 3 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.441 1.591 18002
1636 1 3 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.161 0.786 18002
1637 1 3 . 1 1 85 85 VAL N N 447 119.780 119.780 117.408 2.372 18002
1638 1 3 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.484 0.019 18002
1639 1 3 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.351 0.991 18002
1640 1 3 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.352 0.914 18002
1641 1 3 . 1 1 85 85 VAL H H 447 8.304 8.304 8.028 0.276 18002
1642 1 3 . 1 1 86 86 ALA N N 448 125.178 125.178 123.888 1.290 18002
1643 1 3 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.036 -0.061 18002
1644 1 3 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.578 0.983 18002
1645 1 3 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.567 -0.579 18002
1646 1 3 . 1 1 86 86 ALA H H 448 8.526 8.526 8.712 -0.186 18002
1647 1 3 . 1 1 87 87 GLU N N 449 114.625 114.625 116.263 -1.638 18002
1648 1 3 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.089 0.201 18002
1649 1 3 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.327 -0.596 18002
1650 1 3 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.211 0.049 18002
1651 1 3 . 1 1 87 87 GLU H H 449 8.402 8.402 8.337 0.065 18002
1652 1 3 . 1 1 88 88 GLY N N 450 109.432 109.432 107.046 2.386 18002
1653 1 3 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.882 0.956 18002
1654 1 3 . 1 1 88 88 GLY H H 450 7.711 7.711 8.004 -0.293 18002
1655 1 3 . 1 1 89 89 MET N N 451 121.382 121.382 120.506 0.876 18002
1656 1 3 . 1 1 89 89 MET HA H 451 5.076 5.076 4.850 0.226 18002
1657 1 3 . 1 1 89 89 MET CA C 451 53.860 53.860 54.721 -0.861 18002
1658 1 3 . 1 1 89 89 MET CB C 451 35.942 35.942 36.928 -0.986 18002
1659 1 3 . 1 1 89 89 MET H H 451 8.355 8.355 8.031 0.324 18002
1660 1 3 . 1 1 90 90 ASN N N 452 123.538 123.538 123.710 -0.172 18002
1661 1 3 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.840 0.113 18002
1662 1 3 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.502 -0.754 18002
1663 1 3 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.429 2.213 18002
1664 1 3 . 1 1 90 90 ASN H H 452 9.338 9.338 9.005 0.333 18002
1665 1 3 . 1 1 91 91 GLU N N 453 125.978 125.978 123.565 2.413 18002
1666 1 3 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.213 1.131 18002
1667 1 3 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.418 -1.145 18002
1668 1 3 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.101 1.642 18002
1669 1 3 . 1 1 91 91 GLU H H 453 8.168 8.168 8.043 0.125 18002
1670 1 3 . 1 1 92 92 ILE N N 454 126.776 126.776 125.342 1.434 18002
1671 1 3 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.297 0.269 18002
1672 1 3 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.071 -0.023 18002
1673 1 3 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.669 0.593 18002
1674 1 3 . 1 1 92 92 ILE H H 454 9.000 9.000 7.965 1.035 18002
1675 1 3 . 1 1 93 93 TRP N N 455 125.987 125.987 124.407 1.580 18002
1676 1 3 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.887 -0.295 18002
1677 1 3 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.556 -1.766 18002
1678 1 3 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.618 0.768 18002
1679 1 3 . 1 1 93 93 TRP H H 455 9.278 9.278 8.282 0.996 18002
1680 1 3 . 1 1 94 94 LEU N N 456 120.912 120.912 123.834 -2.922 18002
1681 1 3 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.073 0.289 18002
1682 1 3 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.864 -0.648 18002
1683 1 3 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.880 0.714 18002
1684 1 3 . 1 1 94 94 LEU H H 456 9.534 9.534 8.064 1.470 18002
1685 1 3 . 1 1 95 95 ARG N N 457 123.669 123.669 121.944 1.725 18002
1686 1 3 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.606 0.665 18002
1687 1 3 . 1 1 95 95 ARG CA C 457 55.417 55.417 56.124 -0.707 18002
1688 1 3 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.138 1.124 18002
1689 1 3 . 1 1 95 95 ARG H H 457 9.439 9.439 8.941 0.498 18002
1690 1 3 . 1 1 96 96 CYS N N 458 125.273 125.273 121.010 4.263 18002
1691 1 3 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.977 -0.279 18002
1692 1 3 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.775 0.017 18002
1693 1 3 . 1 1 96 96 CYS CB C 458 30.403 30.403 29.758 0.645 18002
1694 1 3 . 1 1 96 96 CYS H H 458 8.652 8.652 8.652 -0.000 18002
1695 1 3 . 1 1 97 97 ASP N N 459 119.661 119.661 121.015 -1.354 18002
1696 1 3 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.727 0.013 18002
1697 1 3 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.906 1.322 18002
1698 1 3 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.725 1.860 18002
1699 1 3 . 1 1 97 97 ASP H H 459 9.116 9.116 8.940 0.176 18002
1700 1 3 . 1 1 98 98 ASN N N 460 109.173 109.173 118.124 -8.951 18002
1701 1 3 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.815 -0.443 18002
1702 1 3 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.182 -0.168 18002
1703 1 3 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.654 0.157 18002
1704 1 3 . 1 1 98 98 ASN H H 460 7.054 7.054 7.609 -0.555 18002
1705 1 3 . 1 1 99 99 GLU N N 461 119.220 119.220 119.826 -0.606 18002
1706 1 3 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.370 0.674 18002
1707 1 3 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.413 0.355 18002
1708 1 3 . 1 1 99 99 GLU H H 461 8.937 8.937 8.794 0.143 18002
1709 1 3 . 1 1 100 100 LYS N N 462 120.647 120.647 118.568 2.079 18002
1710 1 3 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.976 0.669 18002
1711 1 3 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.325 1.211 18002
1712 1 3 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.756 0.471 18002
1713 1 3 . 1 1 100 100 LYS H H 462 8.033 8.033 8.205 -0.172 18002
1714 1 3 . 1 1 101 101 GLN N N 463 121.938 121.938 119.091 2.847 18002
1715 1 3 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.974 0.426 18002
1716 1 3 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.084 0.311 18002
1717 1 3 . 1 1 101 101 GLN CB C 463 32.214 32.214 27.946 4.268 18002
1718 1 3 . 1 1 101 101 GLN H H 463 8.372 8.372 7.916 0.456 18002
1719 1 3 . 1 1 102 102 TYR N N 464 117.422 117.422 119.353 -1.931 18002
1720 1 3 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.160 0.456 18002
1721 1 3 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.108 1.569 18002
1722 1 3 . 1 1 102 102 TYR CB C 464 38.859 38.859 37.777 1.082 18002
1723 1 3 . 1 1 102 102 TYR H H 464 8.221 8.221 7.541 0.680 18002
1724 1 3 . 1 1 103 103 ALA N N 465 120.655 120.655 120.394 0.261 18002
1725 1 3 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.966 -0.251 18002
1726 1 3 . 1 1 103 103 ALA CA C 465 55.913 55.913 55.098 0.815 18002
1727 1 3 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.476 0.326 18002
1728 1 3 . 1 1 103 103 ALA H H 465 8.637 8.637 7.823 0.814 18002
1729 1 3 . 1 1 104 104 HIS N N 466 112.871 112.871 117.681 -4.810 18002
1730 1 3 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.493 -0.352 18002
1731 1 3 . 1 1 104 104 HIS CA C 466 60.627 60.627 58.908 1.719 18002
1732 1 3 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.822 -0.964 18002
1733 1 3 . 1 1 104 104 HIS H H 466 7.852 7.852 7.790 0.062 18002
1734 1 3 . 1 1 105 105 TRP N N 467 121.317 121.317 120.041 1.276 18002
1735 1 3 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.085 -0.390 18002
1736 1 3 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.829 0.513 18002
1737 1 3 . 1 1 105 105 TRP CB C 467 27.505 27.505 28.997 -1.492 18002
1738 1 3 . 1 1 105 105 TRP H H 467 8.668 8.668 7.728 0.940 18002
1739 1 3 . 1 1 106 106 MET N N 468 122.346 122.346 118.062 4.284 18002
1740 1 3 . 1 1 106 106 MET HA H 468 4.086 4.086 3.928 0.158 18002
1741 1 3 . 1 1 106 106 MET CA C 468 58.743 58.743 58.566 0.178 18002
1742 1 3 . 1 1 106 106 MET CB C 468 31.402 31.402 31.362 0.040 18002
1743 1 3 . 1 1 106 106 MET H H 468 9.790 9.790 8.113 1.677 18002
1744 1 3 . 1 1 107 107 ALA N N 469 119.758 119.758 119.544 0.214 18002
1745 1 3 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.271 -0.566 18002
1746 1 3 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.517 1.612 18002
1747 1 3 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.064 2.341 18002
1748 1 3 . 1 1 107 107 ALA H H 469 7.702 7.702 8.078 -0.376 18002
1749 1 3 . 1 1 108 108 ALA N N 470 119.233 119.233 121.115 -1.882 18002
1750 1 3 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.759 -0.213 18002
1751 1 3 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.170 1.651 18002
1752 1 3 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.027 -1.295 18002
1753 1 3 . 1 1 108 108 ALA H H 470 7.156 7.156 8.142 -0.986 18002
1754 1 3 . 1 1 109 109 CYS N N 471 116.736 116.736 115.741 0.995 18002
1755 1 3 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.314 -0.257 18002
1756 1 3 . 1 1 109 109 CYS CA C 471 64.571 64.571 60.077 4.494 18002
1757 1 3 . 1 1 109 109 CYS CB C 471 27.393 27.393 28.290 -0.897 18002
1758 1 3 . 1 1 109 109 CYS H H 471 8.256 8.256 7.781 0.475 18002
1759 1 3 . 1 1 110 110 ARG N N 472 118.644 118.644 119.914 -1.270 18002
1760 1 3 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.074 -0.340 18002
1761 1 3 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.511 1.692 18002
1762 1 3 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.135 0.182 18002
1763 1 3 . 1 1 110 110 ARG H H 472 8.403 8.403 7.992 0.411 18002
1764 1 3 . 1 1 111 111 LEU N N 473 121.877 121.877 122.431 -0.554 18002
1765 1 3 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.015 -0.215 18002
1766 1 3 . 1 1 111 111 LEU CA C 473 59.855 59.855 58.037 1.818 18002
1767 1 3 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.494 -1.074 18002
1768 1 3 . 1 1 111 111 LEU H H 473 7.916 7.916 7.834 0.082 18002
1769 1 3 . 1 1 112 112 ALA N N 474 122.765 122.765 120.110 2.655 18002
1770 1 3 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.895 0.585 18002
1771 1 3 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.998 0.263 18002
1772 1 3 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.615 2.260 18002
1773 1 3 . 1 1 112 112 ALA H H 474 8.393 8.393 7.734 0.659 18002
1774 1 3 . 1 1 113 113 SER N N 475 113.613 113.613 113.291 0.322 18002
1775 1 3 . 1 1 113 113 SER HA H 475 4.782 4.782 4.222 0.560 18002
1776 1 3 . 1 1 113 113 SER CA C 475 61.090 61.090 61.830 -0.740 18002
1777 1 3 . 1 1 113 113 SER CB C 475 63.612 63.612 63.402 0.210 18002
1778 1 3 . 1 1 113 113 SER H H 475 8.150 8.150 8.226 -0.076 18002
1779 1 3 . 1 1 114 114 LYS N N 476 118.734 118.734 118.107 0.627 18002
1780 1 3 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.443 0.110 18002
1781 1 3 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.480 -1.336 18002
1782 1 3 . 1 1 114 114 LYS CB C 476 32.591 32.591 33.066 -0.475 18002
1783 1 3 . 1 1 114 114 LYS H H 476 7.239 7.239 7.396 -0.157 18002
1784 1 3 . 1 1 115 115 GLY N N 477 107.818 107.818 110.814 -2.996 18002
1785 1 3 . 1 1 115 115 GLY CA C 477 45.986 45.986 46.197 -0.211 18002
1786 1 3 . 1 1 115 115 GLY H H 477 8.401 8.401 8.917 -0.516 18002
1787 1 3 . 1 1 116 116 LYS N N 478 120.938 120.938 121.590 -0.652 18002
1788 1 3 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.433 0.140 18002
1789 1 3 . 1 1 116 116 LYS CA C 478 54.847 54.847 55.963 -1.116 18002
1790 1 3 . 1 1 116 116 LYS CB C 478 35.321 35.321 33.932 1.389 18002
1791 1 3 . 1 1 116 116 LYS H H 478 8.142 8.142 7.792 0.350 18002
1792 1 3 . 1 1 117 117 THR N N 479 108.076 108.076 112.704 -4.628 18002
1793 1 3 . 1 1 117 117 THR HA H 479 4.671 4.671 4.436 0.235 18002
1794 1 3 . 1 1 117 117 THR CA C 479 59.191 59.191 59.611 -0.420 18002
1795 1 3 . 1 1 117 117 THR CB C 479 72.228 72.228 70.080 2.148 18002
1796 1 3 . 1 1 117 117 THR H H 479 7.926 7.926 8.133 -0.207 18002
1797 1 3 . 1 1 118 118 MET N N 480 116.403 116.403 119.322 -2.919 18002
1798 1 3 . 1 1 118 118 MET HA H 480 3.352 3.352 3.589 -0.237 18002
1799 1 3 . 1 1 118 118 MET CA C 480 57.947 57.947 57.985 -0.038 18002
1800 1 3 . 1 1 118 118 MET CB C 480 33.920 33.920 31.592 2.328 18002
1801 1 3 . 1 1 118 118 MET H H 480 8.899 8.899 8.632 0.267 18002
1802 1 3 . 1 1 119 119 ALA N N 481 117.786 117.786 119.815 -2.029 18002
1803 1 3 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.087 -0.003 18002
1804 1 3 . 1 1 119 119 ALA CA C 481 52.595 52.595 52.363 0.232 18002
1805 1 3 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.263 0.799 18002
1806 1 3 . 1 1 119 119 ALA H H 481 7.645 7.645 7.669 -0.024 18002
1807 1 3 . 1 1 120 120 ASP N N 482 120.348 120.348 119.169 1.179 18002
1808 1 3 . 1 1 120 120 ASP CB C 482 44.616 44.616 42.750 1.866 18002
1809 1 3 . 1 1 120 120 ASP H H 482 7.887 7.887 7.981 -0.094 18002
1810 1 3 . 1 1 121 121 SER HA H 483 4.223 4.223 4.443 -0.220 18002
1811 1 3 . 1 1 121 121 SER CA C 483 61.455 61.455 60.154 1.301 18002
1812 1 3 . 1 1 121 121 SER CB C 483 62.996 62.996 63.556 -0.560 18002
1813 1 3 . 1 1 122 122 SER N N 484 116.845 116.845 116.664 0.181 18002
1814 1 3 . 1 1 122 122 SER HA H 484 4.321 4.321 4.401 -0.080 18002
1815 1 3 . 1 1 122 122 SER CA C 484 60.584 60.584 59.544 1.040 18002
1816 1 3 . 1 1 122 122 SER CB C 484 64.314 64.314 63.631 0.683 18002
1817 1 3 . 1 1 122 122 SER H H 484 8.875 8.875 8.053 0.822 18002
1818 1 3 . 1 1 123 123 TYR N N 485 124.153 124.153 121.312 2.841 18002
1819 1 3 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.057 -0.177 18002
1820 1 3 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.496 2.818 18002
1821 1 3 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.306 0.435 18002
1822 1 3 . 1 1 123 123 TYR H H 485 8.018 8.018 8.424 -0.406 18002
1823 1 3 . 1 1 124 124 ASN N N 486 115.339 115.339 117.619 -2.280 18002
1824 1 3 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.474 0.467 18002
1825 1 3 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.901 0.805 18002
1826 1 3 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.553 0.502 18002
1827 1 3 . 1 1 124 124 ASN H H 486 8.665 8.665 7.996 0.669 18002
1828 1 3 . 1 1 125 125 LEU N N 487 119.454 119.454 119.118 0.336 18002
1829 1 3 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.073 -0.135 18002
1830 1 3 . 1 1 125 125 LEU CA C 487 57.670 57.670 56.912 0.758 18002
1831 1 3 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.876 -0.308 18002
1832 1 3 . 1 1 125 125 LEU H H 487 7.105 7.105 8.015 -0.910 18002
1833 1 3 . 1 1 126 126 GLU N N 488 121.189 121.189 118.165 3.024 18002
1834 1 3 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.065 -0.035 18002
1835 1 3 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.044 -0.009 18002
1836 1 3 . 1 1 126 126 GLU CB C 488 29.085 29.085 30.185 -1.100 18002
1837 1 3 . 1 1 126 126 GLU H H 488 8.053 8.053 7.920 0.133 18002
1838 1 3 . 1 1 127 127 VAL N N 489 119.073 119.073 116.865 2.208 18002
1839 1 3 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.707 -0.689 18002
1840 1 3 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.779 1.542 18002
1841 1 3 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.735 -0.076 18002
1842 1 3 . 1 1 127 127 VAL H H 489 7.769 7.769 7.823 -0.054 18002
1843 1 3 . 1 1 128 128 GLN N N 490 116.214 116.214 117.081 -0.867 18002
1844 1 3 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.005 -0.173 18002
1845 1 3 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.330 0.426 18002
1846 1 3 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.973 0.139 18002
1847 1 3 . 1 1 128 128 GLN H H 490 7.542 7.542 8.090 -0.548 18002
1848 1 3 . 1 1 129 129 ASN N N 491 120.003 120.003 116.918 3.085 18002
1849 1 3 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.666 -0.247 18002
1850 1 3 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.215 0.945 18002
1851 1 3 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.175 -0.115 18002
1852 1 3 . 1 1 129 129 ASN H H 491 8.582 8.582 7.381 1.201 18002
1853 1 3 . 1 1 130 130 ILE N N 492 122.365 122.365 119.778 2.587 18002
1854 1 3 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.340 3.413 18002
1855 1 3 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.272 0.874 18002
1856 1 3 . 1 1 130 130 ILE H H 492 8.186 8.186 7.723 0.463 18002
1857 1 3 . 1 1 131 131 LEU N N 493 119.597 119.597 121.032 -1.435 18002
1858 1 3 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.950 0.055 18002
1859 1 3 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.449 0.410 18002
1860 1 3 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.604 -0.068 18002
1861 1 3 . 1 1 131 131 LEU H H 493 8.224 8.224 7.801 0.423 18002
1862 1 3 . 1 1 132 132 SER N N 494 114.884 114.884 113.681 1.203 18002
1863 1 3 . 1 1 132 132 SER HA H 494 4.430 4.430 4.368 0.062 18002
1864 1 3 . 1 1 132 132 SER CA C 494 62.072 62.072 60.661 1.411 18002
1865 1 3 . 1 1 132 132 SER CB C 494 62.703 62.703 63.008 -0.305 18002
1866 1 3 . 1 1 132 132 SER H H 494 8.464 8.464 7.825 0.639 18002
1867 1 3 . 1 1 133 133 PHE N N 495 123.047 123.047 123.069 -0.022 18002
1868 1 3 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.411 -0.034 18002
1869 1 3 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.440 -0.527 18002
1870 1 3 . 1 1 133 133 PHE CB C 495 39.050 39.050 40.263 -1.213 18002
1871 1 3 . 1 1 133 133 PHE H H 495 7.915 7.915 8.469 -0.554 18002
1872 1 3 . 1 1 134 134 LEU N N 496 119.311 119.311 116.475 2.836 18002
1873 1 3 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.249 -0.344 18002
1874 1 3 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.678 -0.077 18002
1875 1 3 . 1 1 134 134 LEU CB C 496 41.901 41.901 42.055 -0.154 18002
1876 1 3 . 1 1 134 134 LEU H H 496 8.386 8.386 7.794 0.592 18002
1877 1 3 . 1 1 135 135 LYS N N 497 117.550 117.550 117.300 0.250 18002
1878 1 3 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.114 -0.174 18002
1879 1 3 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.218 0.057 18002
1880 1 3 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.361 0.133 18002
1881 1 3 . 1 1 135 135 LYS H H 497 7.670 7.670 7.611 0.059 18002
1882 1 3 . 1 1 136 136 MET N N 498 116.106 116.106 115.910 0.196 18002
1883 1 3 . 1 1 136 136 MET HA H 498 4.354 4.354 4.262 0.092 18002
1884 1 3 . 1 1 136 136 MET CA C 498 55.994 55.994 57.444 -1.450 18002
1885 1 3 . 1 1 136 136 MET CB C 498 32.772 32.772 33.127 -0.355 18002
1886 1 3 . 1 1 136 136 MET H H 498 7.421 7.421 7.693 -0.272 18002
1887 1 3 . 1 1 137 137 GLN N N 499 118.651 118.651 110.837 7.814 18002
1888 1 3 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.287 -0.103 18002
1889 1 3 . 1 1 137 137 GLN CA C 499 55.308 55.308 56.178 -0.870 18002
1890 1 3 . 1 1 137 137 GLN H H 499 7.617 7.617 7.687 -0.070 18002
1891 1 4 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.512 -0.387 18002
1892 1 4 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.809 -1.794 18002
1893 1 4 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.969 1.960 18002
1894 1 4 . 1 1 4 4 MET N N 366 120.431 120.431 118.855 1.576 18002
1895 1 4 . 1 1 4 4 MET HA H 366 4.345 4.345 4.251 0.094 18002
1896 1 4 . 1 1 4 4 MET CA C 366 55.337 55.337 55.363 -0.026 18002
1897 1 4 . 1 1 4 4 MET CB C 366 32.668 32.668 31.965 0.702 18002
1898 1 4 . 1 1 4 4 MET H H 366 8.373 8.373 8.433 -0.060 18002
1899 1 4 . 1 1 5 5 GLY N N 367 109.318 109.318 109.271 0.047 18002
1900 1 4 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.059 0.398 18002
1901 1 4 . 1 1 5 5 GLY H H 367 8.224 8.224 8.157 0.067 18002
1902 1 4 . 1 1 6 6 ASP N N 368 120.307 120.307 122.814 -2.507 18002
1903 1 4 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.992 -0.392 18002
1904 1 4 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.257 1.256 18002
1905 1 4 . 1 1 6 6 ASP CB C 368 41.326 41.326 42.283 -0.957 18002
1906 1 4 . 1 1 6 6 ASP H H 368 8.199 8.199 8.076 0.123 18002
1907 1 4 . 1 1 7 7 ILE N N 369 120.668 120.668 119.283 1.385 18002
1908 1 4 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.226 -0.008 18002
1909 1 4 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.163 -0.579 18002
1910 1 4 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.190 0.578 18002
1911 1 4 . 1 1 7 7 ILE H H 369 8.138 8.138 8.053 0.085 18002
1912 1 4 . 1 1 8 8 THR N N 370 117.564 117.564 117.224 0.340 18002
1913 1 4 . 1 1 8 8 THR HA H 370 4.322 4.322 4.297 0.025 18002
1914 1 4 . 1 1 8 8 THR CA C 370 62.332 62.332 61.577 0.755 18002
1915 1 4 . 1 1 8 8 THR CB C 370 69.946 69.946 67.484 2.462 18002
1916 1 4 . 1 1 8 8 THR H H 370 8.230 8.230 7.847 0.383 18002
1917 1 4 . 1 1 9 9 SER N N 371 118.467 118.467 120.594 -2.127 18002
1918 1 4 . 1 1 9 9 SER HA H 371 4.445 4.445 4.555 -0.110 18002
1919 1 4 . 1 1 9 9 SER CA C 371 58.274 58.274 57.825 0.449 18002
1920 1 4 . 1 1 9 9 SER CB C 371 63.996 63.996 63.657 0.339 18002
1921 1 4 . 1 1 9 9 SER H H 371 8.158 8.158 8.303 -0.145 18002
1922 1 4 . 1 1 10 10 ILE N N 372 123.959 123.959 123.362 0.597 18002
1923 1 4 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.187 -4.471 18002
1924 1 4 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.268 2.651 18002
1925 1 4 . 1 1 10 10 ILE H H 372 8.112 8.112 8.203 -0.091 18002
1926 1 4 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.510 -0.158 18002
1927 1 4 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.639 1.542 18002
1928 1 4 . 1 1 11 11 PRO CB C 373 31.707 31.707 29.969 1.738 18002
1929 1 4 . 1 1 12 12 GLU N N 374 119.349 119.349 121.752 -2.403 18002
1930 1 4 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.555 0.232 18002
1931 1 4 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.438 -0.121 18002
1932 1 4 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.281 2.310 18002
1933 1 4 . 1 1 12 12 GLU H H 374 8.017 8.017 7.932 0.085 18002
1934 1 4 . 1 1 13 13 LEU N N 375 122.288 122.288 125.098 -2.810 18002
1935 1 4 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.814 -0.336 18002
1936 1 4 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.221 -1.292 18002
1937 1 4 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.431 1.224 18002
1938 1 4 . 1 1 13 13 LEU H H 375 8.036 8.036 8.628 -0.592 18002
1939 1 4 . 1 1 14 14 ALA N N 376 125.461 125.461 128.498 -3.037 18002
1940 1 4 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.765 0.481 18002
1941 1 4 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.554 0.191 18002
1942 1 4 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.125 -0.538 18002
1943 1 4 . 1 1 14 14 ALA H H 376 8.181 8.181 8.231 -0.050 18002
1944 1 4 . 1 1 15 15 ASP N N 377 122.242 122.242 118.936 3.306 18002
1945 1 4 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.428 -0.109 18002
1946 1 4 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.485 0.267 18002
1947 1 4 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.028 2.611 18002
1948 1 4 . 1 1 15 15 ASP H H 377 8.326 8.326 8.677 -0.351 18002
1949 1 4 . 1 1 16 16 TYR N N 378 118.961 118.961 119.470 -0.509 18002
1950 1 4 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.899 0.492 18002
1951 1 4 . 1 1 16 16 TYR CA C 378 59.581 59.581 55.984 3.597 18002
1952 1 4 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.672 0.351 18002
1953 1 4 . 1 1 16 16 TYR H H 378 8.869 8.869 7.309 1.560 18002
1954 1 4 . 1 1 17 17 ILE N N 379 125.214 125.214 118.892 6.322 18002
1955 1 4 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.662 -0.332 18002
1956 1 4 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.655 0.077 18002
1957 1 4 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.293 -1.317 18002
1958 1 4 . 1 1 17 17 ILE H H 379 8.608 8.608 7.857 0.751 18002
1959 1 4 . 1 1 18 18 LYS N N 380 122.917 122.917 122.056 0.861 18002
1960 1 4 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.877 0.235 18002
1961 1 4 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.335 1.501 18002
1962 1 4 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.062 1.963 18002
1963 1 4 . 1 1 18 18 LYS H H 380 7.424 7.424 8.584 -1.160 18002
1964 1 4 . 1 1 19 19 VAL N N 381 122.839 122.839 121.717 1.122 18002
1965 1 4 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.967 0.296 18002
1966 1 4 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.946 1.570 18002
1967 1 4 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.785 -0.637 18002
1968 1 4 . 1 1 19 19 VAL H H 381 9.223 9.223 7.607 1.616 18002
1969 1 4 . 1 1 20 20 PHE N N 382 129.509 129.509 123.570 5.939 18002
1970 1 4 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.286 -0.443 18002
1971 1 4 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.906 -0.401 18002
1972 1 4 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.898 1.964 18002
1973 1 4 . 1 1 20 20 PHE H H 382 9.451 9.451 7.417 2.034 18002
1974 1 4 . 1 1 21 21 LYS N N 383 126.417 126.417 121.846 4.571 18002
1975 1 4 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.906 -0.065 18002
1976 1 4 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.343 0.876 18002
1977 1 4 . 1 1 21 21 LYS H H 383 7.582 7.582 7.833 -0.251 18002
1978 1 4 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.614 0.083 18002
1979 1 4 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.699 0.270 18002
1980 1 4 . 1 1 23 23 LYS N N 385 118.026 118.026 114.595 3.431 18002
1981 1 4 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.071 0.144 18002
1982 1 4 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.952 -0.607 18002
1983 1 4 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.503 0.530 18002
1984 1 4 . 1 1 23 23 LYS H H 385 8.138 8.138 7.833 0.305 18002
1985 1 4 . 1 1 24 24 LYS N N 386 120.816 120.816 122.876 -2.060 18002
1986 1 4 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.165 0.021 18002
1987 1 4 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.676 -0.814 18002
1988 1 4 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.674 0.153 18002
1989 1 4 . 1 1 24 24 LYS H H 386 7.727 7.727 8.258 -0.531 18002
1990 1 4 . 1 1 25 25 LEU N N 387 121.214 121.214 120.622 0.592 18002
1991 1 4 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.492 -0.324 18002
1992 1 4 . 1 1 25 25 LEU CA C 387 56.508 56.508 55.002 1.506 18002
1993 1 4 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.081 0.561 18002
1994 1 4 . 1 1 25 25 LEU H H 387 8.241 8.241 8.066 0.175 18002
1995 1 4 . 1 1 26 26 THR N N 388 112.798 112.798 108.570 4.228 18002
1996 1 4 . 1 1 26 26 THR HA H 388 4.313 4.313 4.095 0.218 18002
1997 1 4 . 1 1 26 26 THR CA C 388 61.795 61.795 63.305 -1.510 18002
1998 1 4 . 1 1 26 26 THR CB C 388 69.875 69.875 68.287 1.588 18002
1999 1 4 . 1 1 26 26 THR H H 388 7.700 7.700 7.690 0.010 18002
2000 1 4 . 1 1 27 27 LEU N N 389 124.091 124.091 123.122 0.969 18002
2001 1 4 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.615 -0.261 18002
2002 1 4 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.490 0.043 18002
2003 1 4 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.705 -0.407 18002
2004 1 4 . 1 1 27 27 LEU H H 389 8.260 8.260 8.087 0.173 18002
2005 1 4 . 1 1 28 28 LYS N N 390 121.153 121.153 118.838 2.315 18002
2006 1 4 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.540 -0.220 18002
2007 1 4 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.215 -0.004 18002
2008 1 4 . 1 1 28 28 LYS CB C 390 33.675 33.675 33.028 0.647 18002
2009 1 4 . 1 1 28 28 LYS H H 390 8.202 8.202 7.926 0.276 18002
2010 1 4 . 1 1 29 29 GLY N N 391 107.270 107.270 109.208 -1.938 18002
2011 1 4 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.725 -0.850 18002
2012 1 4 . 1 1 29 29 GLY H H 391 7.876 7.876 8.475 -0.599 18002
2013 1 4 . 1 1 30 30 TYR N N 392 118.471 118.471 126.214 -7.743 18002
2014 1 4 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.627 -0.181 18002
2015 1 4 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.228 -0.181 18002
2016 1 4 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.794 2.031 18002
2017 1 4 . 1 1 30 30 TYR H H 392 8.183 8.183 8.036 0.147 18002
2018 1 4 . 1 1 31 31 LYS N N 393 122.833 122.833 123.984 -1.151 18002
2019 1 4 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.634 -0.119 18002
2020 1 4 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.535 0.639 18002
2021 1 4 . 1 1 31 31 LYS CB C 393 35.720 35.720 33.666 2.054 18002
2022 1 4 . 1 1 31 31 LYS H H 393 8.731 8.731 7.664 1.067 18002
2023 1 4 . 1 1 32 32 GLN N N 394 124.759 124.759 119.078 5.681 18002
2024 1 4 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.665 0.013 18002
2025 1 4 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.382 1.225 18002
2026 1 4 . 1 1 32 32 GLN CB C 394 31.048 31.048 31.361 -0.313 18002
2027 1 4 . 1 1 32 32 GLN H H 394 8.776 8.776 8.398 0.378 18002
2028 1 4 . 1 1 33 33 TYR N N 395 125.112 125.112 125.897 -0.785 18002
2029 1 4 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.968 0.106 18002
2030 1 4 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.258 0.906 18002
2031 1 4 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.550 1.122 18002
2032 1 4 . 1 1 33 33 TYR H H 395 8.774 8.774 8.191 0.583 18002
2033 1 4 . 1 1 34 34 TRP N N 396 122.638 122.638 125.013 -2.375 18002
2034 1 4 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.677 -0.995 18002
2035 1 4 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.888 3.330 18002
2036 1 4 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.825 0.679 18002
2037 1 4 . 1 1 34 34 TRP H H 396 8.975 8.975 8.483 0.492 18002
2038 1 4 . 1 1 35 35 CYS N N 397 127.146 127.146 125.111 2.035 18002
2039 1 4 . 1 1 35 35 CYS CA C 397 57.367 57.367 58.363 -0.996 18002
2040 1 4 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.879 1.827 18002
2041 1 4 . 1 1 35 35 CYS H H 397 8.804 8.804 9.085 -0.281 18002
2042 1 4 . 1 1 36 36 THR N N 398 110.578 110.578 114.106 -3.528 18002
2043 1 4 . 1 1 36 36 THR HA H 398 5.358 5.358 4.991 0.367 18002
2044 1 4 . 1 1 36 36 THR CA C 398 58.704 58.704 60.708 -2.004 18002
2045 1 4 . 1 1 36 36 THR CB C 398 71.833 71.833 71.100 0.733 18002
2046 1 4 . 1 1 36 36 THR H H 398 9.090 9.090 7.968 1.122 18002
2047 1 4 . 1 1 37 37 PHE N N 399 127.322 127.322 124.893 2.429 18002
2048 1 4 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.568 0.385 18002
2049 1 4 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.710 -1.464 18002
2050 1 4 . 1 1 37 37 PHE CB C 399 42.185 42.185 41.182 1.003 18002
2051 1 4 . 1 1 37 37 PHE H H 399 8.846 8.846 8.221 0.625 18002
2052 1 4 . 1 1 38 38 LYS N N 400 125.391 125.391 127.623 -2.232 18002
2053 1 4 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.741 -0.214 18002
2054 1 4 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.723 1.254 18002
2055 1 4 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.796 0.119 18002
2056 1 4 . 1 1 38 38 LYS H H 400 8.252 8.252 8.794 -0.542 18002
2057 1 4 . 1 1 39 39 ASP N N 401 125.083 125.083 126.605 -1.522 18002
2058 1 4 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.280 -0.202 18002
2059 1 4 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.494 -0.011 18002
2060 1 4 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.683 -0.162 18002
2061 1 4 . 1 1 39 39 ASP H H 401 9.408 9.408 9.151 0.257 18002
2062 1 4 . 1 1 40 40 THR N N 402 112.024 112.024 117.800 -5.776 18002
2063 1 4 . 1 1 40 40 THR HA H 402 4.767 4.767 4.659 0.108 18002
2064 1 4 . 1 1 40 40 THR CA C 402 60.811 60.811 61.347 -0.536 18002
2065 1 4 . 1 1 40 40 THR CB C 402 68.823 68.823 69.311 -0.488 18002
2066 1 4 . 1 1 40 40 THR H H 402 8.224 8.224 8.222 0.002 18002
2067 1 4 . 1 1 41 41 SER N N 403 116.142 116.142 115.193 0.949 18002
2068 1 4 . 1 1 41 41 SER HA H 403 5.428 5.428 4.767 0.661 18002
2069 1 4 . 1 1 41 41 SER CA C 403 58.297 58.297 57.148 1.149 18002
2070 1 4 . 1 1 41 41 SER CB C 403 66.409 66.409 66.784 -0.375 18002
2071 1 4 . 1 1 41 41 SER H H 403 8.197 8.197 8.349 -0.152 18002
2072 1 4 . 1 1 42 42 ILE N N 404 122.292 122.292 121.208 1.084 18002
2073 1 4 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.436 0.493 18002
2074 1 4 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.928 0.876 18002
2075 1 4 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.044 1.376 18002
2076 1 4 . 1 1 42 42 ILE H H 404 8.411 8.411 7.884 0.527 18002
2077 1 4 . 1 1 43 43 SER N N 405 122.244 122.244 117.303 4.941 18002
2078 1 4 . 1 1 43 43 SER HA H 405 4.966 4.966 4.745 0.221 18002
2079 1 4 . 1 1 43 43 SER CA C 405 57.735 57.735 56.756 0.979 18002
2080 1 4 . 1 1 43 43 SER CB C 405 65.388 65.388 64.560 0.828 18002
2081 1 4 . 1 1 43 43 SER H H 405 8.752 8.752 8.477 0.275 18002
2082 1 4 . 1 1 44 44 CYS N N 406 120.004 120.004 126.223 -6.219 18002
2083 1 4 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.454 0.513 18002
2084 1 4 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.974 -0.916 18002
2085 1 4 . 1 1 44 44 CYS CB C 406 29.440 29.440 27.084 2.356 18002
2086 1 4 . 1 1 44 44 CYS H H 406 8.470 8.470 8.180 0.290 18002
2087 1 4 . 1 1 45 45 TYR N N 407 122.704 122.704 128.893 -6.189 18002
2088 1 4 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.417 0.606 18002
2089 1 4 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.569 -0.586 18002
2090 1 4 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.842 0.732 18002
2091 1 4 . 1 1 45 45 TYR H H 407 10.013 10.013 8.059 1.954 18002
2092 1 4 . 1 1 46 46 LYS N N 408 121.897 121.897 126.211 -4.314 18002
2093 1 4 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.458 -0.112 18002
2094 1 4 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.726 2.293 18002
2095 1 4 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.724 -1.012 18002
2096 1 4 . 1 1 46 46 LYS H H 408 9.734 9.734 8.833 0.901 18002
2097 1 4 . 1 1 47 47 SER N N 409 106.720 106.720 110.030 -3.310 18002
2098 1 4 . 1 1 47 47 SER HA H 409 4.776 4.776 4.732 0.044 18002
2099 1 4 . 1 1 47 47 SER CA C 409 57.180 57.180 57.943 -0.763 18002
2100 1 4 . 1 1 47 47 SER CB C 409 65.870 65.870 64.597 1.273 18002
2101 1 4 . 1 1 47 47 SER H H 409 7.518 7.518 7.723 -0.205 18002
2102 1 4 . 1 1 48 48 LYS N N 410 122.302 122.302 120.515 1.787 18002
2103 1 4 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.813 1.421 18002
2104 1 4 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.289 1.010 18002
2105 1 4 . 1 1 48 48 LYS H H 410 8.195 8.195 8.724 -0.529 18002
2106 1 4 . 1 1 49 49 GLU N N 411 118.983 118.983 119.582 -0.599 18002
2107 1 4 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.074 0.708 18002
2108 1 4 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.875 0.660 18002
2109 1 4 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.718 -1.030 18002
2110 1 4 . 1 1 49 49 GLU H H 411 8.752 8.752 7.669 1.083 18002
2111 1 4 . 1 1 50 50 GLU N N 412 118.384 118.384 117.260 1.124 18002
2112 1 4 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.249 0.244 18002
2113 1 4 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.439 -1.650 18002
2114 1 4 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.847 0.158 18002
2115 1 4 . 1 1 50 50 GLU H H 412 7.234 7.234 7.867 -0.633 18002
2116 1 4 . 1 1 51 51 SER N N 413 114.767 114.767 115.324 -0.557 18002
2117 1 4 . 1 1 51 51 SER CA C 413 59.764 59.764 60.698 -0.934 18002
2118 1 4 . 1 1 51 51 SER CB C 413 62.965 62.965 62.221 0.744 18002
2119 1 4 . 1 1 51 51 SER H H 413 7.382 7.382 7.963 -0.581 18002
2120 1 4 . 1 1 52 52 SER N N 414 114.496 114.496 119.406 -4.910 18002
2121 1 4 . 1 1 52 52 SER HA H 414 4.560 4.560 4.513 0.047 18002
2122 1 4 . 1 1 52 52 SER CA C 414 58.574 58.574 59.201 -0.627 18002
2123 1 4 . 1 1 52 52 SER CB C 414 63.829 63.829 63.334 0.495 18002
2124 1 4 . 1 1 52 52 SER H H 414 7.682 7.682 8.141 -0.459 18002
2125 1 4 . 1 1 53 53 GLY N N 415 111.107 111.107 108.976 2.131 18002
2126 1 4 . 1 1 53 53 GLY CA C 415 44.233 44.233 43.804 0.429 18002
2127 1 4 . 1 1 53 53 GLY H H 415 7.918 7.918 7.101 0.817 18002
2128 1 4 . 1 1 54 54 THR N N 416 120.214 120.214 114.060 6.154 18002
2129 1 4 . 1 1 54 54 THR CB C 416 70.035 70.035 70.605 -0.570 18002
2130 1 4 . 1 1 54 54 THR H H 416 8.622 8.622 8.092 0.530 18002
2131 1 4 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.894 0.581 18002
2132 1 4 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.146 -0.101 18002
2133 1 4 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.756 -0.178 18002
2134 1 4 . 1 1 56 56 ALA N N 418 125.591 125.591 125.858 -0.267 18002
2135 1 4 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.954 0.002 18002
2136 1 4 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.882 0.653 18002
2137 1 4 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.620 -0.713 18002
2138 1 4 . 1 1 56 56 ALA H H 418 8.288 8.288 8.044 0.244 18002
2139 1 4 . 1 1 57 57 HIS N N 419 108.119 108.119 113.767 -5.648 18002
2140 1 4 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.630 -0.008 18002
2141 1 4 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.089 -1.509 18002
2142 1 4 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.745 1.474 18002
2143 1 4 . 1 1 57 57 HIS H H 419 7.072 7.072 7.737 -0.665 18002
2144 1 4 . 1 1 58 58 GLN N N 420 123.083 123.083 122.582 0.501 18002
2145 1 4 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.891 0.264 18002
2146 1 4 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.420 1.084 18002
2147 1 4 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.355 2.135 18002
2148 1 4 . 1 1 58 58 GLN H H 420 8.669 8.669 8.481 0.188 18002
2149 1 4 . 1 1 59 59 MET N N 421 122.330 122.330 118.972 3.358 18002
2150 1 4 . 1 1 59 59 MET HA H 421 4.621 4.621 4.688 -0.067 18002
2151 1 4 . 1 1 59 59 MET CA C 421 54.892 54.892 54.655 0.237 18002
2152 1 4 . 1 1 59 59 MET CB C 421 35.650 35.650 35.534 0.116 18002
2153 1 4 . 1 1 59 59 MET H H 421 8.995 8.995 8.181 0.814 18002
2154 1 4 . 1 1 60 60 ASN N N 422 123.220 123.220 120.058 3.162 18002
2155 1 4 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.774 0.174 18002
2156 1 4 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.447 0.184 18002
2157 1 4 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.333 0.406 18002
2158 1 4 . 1 1 60 60 ASN H H 422 8.728 8.728 8.635 0.093 18002
2159 1 4 . 1 1 61 61 LEU N N 423 126.072 126.072 126.537 -0.465 18002
2160 1 4 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.227 -0.111 18002
2161 1 4 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.512 1.101 18002
2162 1 4 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.742 0.715 18002
2163 1 4 . 1 1 61 61 LEU H H 423 8.942 8.942 8.553 0.389 18002
2164 1 4 . 1 1 62 62 ARG N N 424 121.977 121.977 117.312 4.665 18002
2165 1 4 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.919 0.453 18002
2166 1 4 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.755 2.279 18002
2167 1 4 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.052 -0.442 18002
2168 1 4 . 1 1 62 62 ARG H H 424 8.000 8.000 7.959 0.041 18002
2169 1 4 . 1 1 63 63 GLY N N 425 114.852 114.852 110.023 4.829 18002
2170 1 4 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.698 0.112 18002
2171 1 4 . 1 1 63 63 GLY H H 425 9.033 9.033 8.567 0.466 18002
2172 1 4 . 1 1 64 64 CYS N N 426 117.102 117.102 116.790 0.312 18002
2173 1 4 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.490 0.409 18002
2174 1 4 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.514 1.246 18002
2175 1 4 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.208 -0.384 18002
2176 1 4 . 1 1 64 64 CYS H H 426 8.248 8.248 7.698 0.550 18002
2177 1 4 . 1 1 65 65 GLU N N 427 119.501 119.501 121.531 -2.030 18002
2178 1 4 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.341 0.436 18002
2179 1 4 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.543 -0.152 18002
2180 1 4 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.201 0.737 18002
2181 1 4 . 1 1 65 65 GLU H H 427 8.449 8.449 8.772 -0.323 18002
2182 1 4 . 1 1 66 66 VAL N N 428 125.286 125.286 126.324 -1.038 18002
2183 1 4 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.198 0.692 18002
2184 1 4 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.581 -0.829 18002
2185 1 4 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.459 0.516 18002
2186 1 4 . 1 1 66 66 VAL H H 428 8.624 8.624 8.438 0.186 18002
2187 1 4 . 1 1 67 67 THR N N 429 124.132 124.132 125.069 -0.937 18002
2188 1 4 . 1 1 67 67 THR CA C 429 59.338 59.338 60.038 -0.700 18002
2189 1 4 . 1 1 67 67 THR CB C 429 72.021 72.021 69.587 2.434 18002
2190 1 4 . 1 1 67 67 THR H H 429 9.247 9.247 8.018 1.229 18002
2191 1 4 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.529 0.120 18002
2192 1 4 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.426 0.312 18002
2193 1 4 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.744 0.824 18002
2194 1 4 . 1 1 69 69 ASP N N 431 122.066 122.066 121.171 0.895 18002
2195 1 4 . 1 1 69 69 ASP HA H 431 4.647 4.647 5.010 -0.363 18002
2196 1 4 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.498 0.171 18002
2197 1 4 . 1 1 69 69 ASP CB C 431 42.105 42.105 44.557 -2.452 18002
2198 1 4 . 1 1 69 69 ASP H H 431 8.250 8.250 8.903 -0.653 18002
2199 1 4 . 1 1 70 70 VAL N N 432 121.874 121.874 123.405 -1.531 18002
2200 1 4 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.978 -0.479 18002
2201 1 4 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.761 0.327 18002
2202 1 4 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.000 0.032 18002
2203 1 4 . 1 1 70 70 VAL H H 432 8.305 8.305 8.336 -0.031 18002
2204 1 4 . 1 1 71 71 ASN N N 433 124.366 124.366 127.567 -3.201 18002
2205 1 4 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.025 -0.343 18002
2206 1 4 . 1 1 71 71 ASN CA C 433 52.761 52.761 51.801 0.960 18002
2207 1 4 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.878 0.401 18002
2208 1 4 . 1 1 71 71 ASN H H 433 8.637 8.637 8.108 0.529 18002
2209 1 4 . 1 1 72 72 ILE N N 434 126.786 126.786 123.743 3.043 18002
2210 1 4 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.839 -0.468 18002
2211 1 4 . 1 1 72 72 ILE CA C 434 64.518 64.518 61.914 2.604 18002
2212 1 4 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.886 -0.711 18002
2213 1 4 . 1 1 72 72 ILE H H 434 8.943 8.943 8.893 0.050 18002
2214 1 4 . 1 1 73 73 SER N N 435 118.305 118.305 117.090 1.215 18002
2215 1 4 . 1 1 73 73 SER CA C 435 61.633 61.633 61.074 0.559 18002
2216 1 4 . 1 1 73 73 SER CB C 435 62.435 62.435 62.944 -0.509 18002
2217 1 4 . 1 1 73 73 SER H H 435 8.578 8.578 8.542 0.036 18002
2218 1 4 . 1 1 74 74 GLY N N 436 107.443 107.443 104.802 2.641 18002
2219 1 4 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.552 0.309 18002
2220 1 4 . 1 1 74 74 GLY H H 436 7.620 7.620 8.065 -0.445 18002
2221 1 4 . 1 1 75 75 GLN N N 437 116.895 116.895 116.997 -0.102 18002
2222 1 4 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.519 -0.229 18002
2223 1 4 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.535 0.166 18002
2224 1 4 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.823 0.922 18002
2225 1 4 . 1 1 75 75 GLN H H 437 7.798 7.798 7.261 0.537 18002
2226 1 4 . 1 1 76 76 LYS N N 438 119.308 119.308 120.326 -1.018 18002
2227 1 4 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.290 -0.148 18002
2228 1 4 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.609 0.434 18002
2229 1 4 . 1 1 76 76 LYS CB C 438 33.945 33.945 33.199 0.746 18002
2230 1 4 . 1 1 76 76 LYS H H 438 7.522 7.522 7.747 -0.225 18002
2231 1 4 . 1 1 77 77 PHE N N 439 125.905 125.905 123.469 2.436 18002
2232 1 4 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.421 -0.210 18002
2233 1 4 . 1 1 77 77 PHE CA C 439 55.639 55.639 55.765 -0.126 18002
2234 1 4 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.198 0.731 18002
2235 1 4 . 1 1 77 77 PHE H H 439 8.461 8.461 8.300 0.161 18002
2236 1 4 . 1 1 78 78 ASN N N 440 120.787 120.787 120.577 0.210 18002
2237 1 4 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.501 -0.588 18002
2238 1 4 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.967 -1.164 18002
2239 1 4 . 1 1 78 78 ASN H H 440 7.638 7.638 8.654 -1.016 18002
2240 1 4 . 1 1 79 79 ILE N N 441 123.421 123.421 123.686 -0.265 18002
2241 1 4 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.120 0.051 18002
2242 1 4 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.865 0.702 18002
2243 1 4 . 1 1 79 79 ILE CB C 441 41.487 41.487 38.213 3.274 18002
2244 1 4 . 1 1 79 79 ILE H H 441 9.550 9.550 8.623 0.927 18002
2245 1 4 . 1 1 80 80 LYS N N 442 126.267 126.267 128.648 -2.381 18002
2246 1 4 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.133 0.329 18002
2247 1 4 . 1 1 80 80 LYS CA C 442 56.383 56.383 53.825 2.558 18002
2248 1 4 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.439 1.548 18002
2249 1 4 . 1 1 80 80 LYS H H 442 8.703 8.703 8.786 -0.083 18002
2250 1 4 . 1 1 81 81 LEU N N 443 125.194 125.194 127.208 -2.014 18002
2251 1 4 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.577 0.695 18002
2252 1 4 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.840 -0.491 18002
2253 1 4 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.703 2.001 18002
2254 1 4 . 1 1 81 81 LEU H H 443 9.223 9.223 7.729 1.494 18002
2255 1 4 . 1 1 82 82 LEU N N 444 122.753 122.753 126.759 -4.006 18002
2256 1 4 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.101 -0.087 18002
2257 1 4 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.358 0.560 18002
2258 1 4 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.577 -2.953 18002
2259 1 4 . 1 1 82 82 LEU H H 444 8.420 8.420 8.169 0.251 18002
2260 1 4 . 1 1 83 83 ILE N N 445 125.584 125.584 122.894 2.690 18002
2261 1 4 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.114 0.171 18002
2262 1 4 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.956 -0.920 18002
2263 1 4 . 1 1 83 83 ILE H H 445 9.010 9.010 7.961 1.049 18002
2264 1 4 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.863 0.056 18002
2265 1 4 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.392 1.641 18002
2266 1 4 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.900 0.047 18002
2267 1 4 . 1 1 85 85 VAL N N 447 119.780 119.780 119.249 0.531 18002
2268 1 4 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.515 -0.012 18002
2269 1 4 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.618 0.724 18002
2270 1 4 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.390 0.876 18002
2271 1 4 . 1 1 85 85 VAL H H 447 8.304 8.304 8.439 -0.135 18002
2272 1 4 . 1 1 86 86 ALA N N 448 125.178 125.178 121.977 3.201 18002
2273 1 4 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.164 -0.189 18002
2274 1 4 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.665 0.896 18002
2275 1 4 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.344 -0.356 18002
2276 1 4 . 1 1 86 86 ALA H H 448 8.526 8.526 8.473 0.053 18002
2277 1 4 . 1 1 87 87 GLU N N 449 114.625 114.625 118.389 -3.764 18002
2278 1 4 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.136 0.154 18002
2279 1 4 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.327 -0.596 18002
2280 1 4 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.893 -0.633 18002
2281 1 4 . 1 1 87 87 GLU H H 449 8.402 8.402 8.645 -0.243 18002
2282 1 4 . 1 1 88 88 GLY N N 450 109.432 109.432 106.223 3.209 18002
2283 1 4 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.884 0.953 18002
2284 1 4 . 1 1 88 88 GLY H H 450 7.711 7.711 7.844 -0.133 18002
2285 1 4 . 1 1 89 89 MET N N 451 121.382 121.382 119.672 1.710 18002
2286 1 4 . 1 1 89 89 MET HA H 451 5.076 5.076 5.085 -0.009 18002
2287 1 4 . 1 1 89 89 MET CA C 451 53.860 53.860 54.814 -0.954 18002
2288 1 4 . 1 1 89 89 MET CB C 451 35.942 35.942 36.932 -0.990 18002
2289 1 4 . 1 1 89 89 MET H H 451 8.355 8.355 8.044 0.311 18002
2290 1 4 . 1 1 90 90 ASN N N 452 123.538 123.538 122.632 0.906 18002
2291 1 4 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.862 0.091 18002
2292 1 4 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.730 -0.982 18002
2293 1 4 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.200 1.442 18002
2294 1 4 . 1 1 90 90 ASN H H 452 9.338 9.338 8.904 0.434 18002
2295 1 4 . 1 1 91 91 GLU N N 453 125.978 125.978 124.344 1.634 18002
2296 1 4 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.215 1.129 18002
2297 1 4 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.339 -1.066 18002
2298 1 4 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.082 1.661 18002
2299 1 4 . 1 1 91 91 GLU H H 453 8.168 8.168 8.384 -0.216 18002
2300 1 4 . 1 1 92 92 ILE N N 454 126.776 126.776 124.945 1.831 18002
2301 1 4 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.228 0.338 18002
2302 1 4 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.812 0.236 18002
2303 1 4 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.364 0.898 18002
2304 1 4 . 1 1 92 92 ILE H H 454 9.000 9.000 7.726 1.274 18002
2305 1 4 . 1 1 93 93 TRP N N 455 125.987 125.987 122.747 3.240 18002
2306 1 4 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.709 -0.117 18002
2307 1 4 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.651 -1.861 18002
2308 1 4 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.822 0.564 18002
2309 1 4 . 1 1 93 93 TRP H H 455 9.278 9.278 7.976 1.302 18002
2310 1 4 . 1 1 94 94 LEU N N 456 120.912 120.912 123.950 -3.038 18002
2311 1 4 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.970 0.392 18002
2312 1 4 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.669 -0.453 18002
2313 1 4 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.902 0.692 18002
2314 1 4 . 1 1 94 94 LEU H H 456 9.534 9.534 7.823 1.711 18002
2315 1 4 . 1 1 95 95 ARG N N 457 123.669 123.669 121.706 1.963 18002
2316 1 4 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.623 0.648 18002
2317 1 4 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.816 -0.399 18002
2318 1 4 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.639 0.623 18002
2319 1 4 . 1 1 95 95 ARG H H 457 9.439 9.439 8.476 0.963 18002
2320 1 4 . 1 1 96 96 CYS N N 458 125.273 125.273 119.690 5.583 18002
2321 1 4 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.217 -0.519 18002
2322 1 4 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.816 -0.024 18002
2323 1 4 . 1 1 96 96 CYS CB C 458 30.403 30.403 29.656 0.747 18002
2324 1 4 . 1 1 96 96 CYS H H 458 8.652 8.652 8.641 0.011 18002
2325 1 4 . 1 1 97 97 ASP N N 459 119.661 119.661 123.572 -3.911 18002
2326 1 4 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.804 -0.064 18002
2327 1 4 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.525 1.703 18002
2328 1 4 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.989 1.595 18002
2329 1 4 . 1 1 97 97 ASP H H 459 9.116 9.116 9.195 -0.079 18002
2330 1 4 . 1 1 98 98 ASN N N 460 109.173 109.173 115.552 -6.379 18002
2331 1 4 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.748 -0.376 18002
2332 1 4 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.185 -0.171 18002
2333 1 4 . 1 1 98 98 ASN CB C 460 40.811 40.811 41.337 -0.526 18002
2334 1 4 . 1 1 98 98 ASN H H 460 7.054 7.054 7.647 -0.593 18002
2335 1 4 . 1 1 99 99 GLU N N 461 119.220 119.220 120.400 -1.180 18002
2336 1 4 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.594 0.450 18002
2337 1 4 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.314 0.454 18002
2338 1 4 . 1 1 99 99 GLU H H 461 8.937 8.937 8.552 0.385 18002
2339 1 4 . 1 1 100 100 LYS N N 462 120.647 120.647 119.351 1.296 18002
2340 1 4 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.048 0.597 18002
2341 1 4 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.485 1.051 18002
2342 1 4 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.820 0.408 18002
2343 1 4 . 1 1 100 100 LYS H H 462 8.033 8.033 8.394 -0.361 18002
2344 1 4 . 1 1 101 101 GLN N N 463 121.938 121.938 119.227 2.711 18002
2345 1 4 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.157 0.243 18002
2346 1 4 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.354 0.041 18002
2347 1 4 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.504 3.710 18002
2348 1 4 . 1 1 101 101 GLN H H 463 8.372 8.372 7.423 0.949 18002
2349 1 4 . 1 1 102 102 TYR N N 464 117.422 117.422 119.711 -2.289 18002
2350 1 4 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.117 0.499 18002
2351 1 4 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.645 1.032 18002
2352 1 4 . 1 1 102 102 TYR CB C 464 38.859 38.859 37.899 0.960 18002
2353 1 4 . 1 1 102 102 TYR H H 464 8.221 8.221 7.619 0.602 18002
2354 1 4 . 1 1 103 103 ALA N N 465 120.655 120.655 118.234 2.421 18002
2355 1 4 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.914 -0.199 18002
2356 1 4 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.439 1.474 18002
2357 1 4 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.332 0.470 18002
2358 1 4 . 1 1 103 103 ALA H H 465 8.637 8.637 8.067 0.570 18002
2359 1 4 . 1 1 104 104 HIS N N 466 112.871 112.871 116.736 -3.865 18002
2360 1 4 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.564 -0.423 18002
2361 1 4 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.775 0.852 18002
2362 1 4 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.239 -1.381 18002
2363 1 4 . 1 1 104 104 HIS H H 466 7.852 7.852 7.863 -0.011 18002
2364 1 4 . 1 1 105 105 TRP N N 467 121.317 121.317 118.882 2.435 18002
2365 1 4 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.590 -0.895 18002
2366 1 4 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.183 2.159 18002
2367 1 4 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.761 -2.256 18002
2368 1 4 . 1 1 105 105 TRP H H 467 8.668 8.668 7.929 0.739 18002
2369 1 4 . 1 1 106 106 MET N N 468 122.346 122.346 120.125 2.221 18002
2370 1 4 . 1 1 106 106 MET HA H 468 4.086 4.086 4.003 0.083 18002
2371 1 4 . 1 1 106 106 MET CA C 468 58.743 58.743 58.880 -0.137 18002
2372 1 4 . 1 1 106 106 MET CB C 468 31.402 31.402 32.090 -0.688 18002
2373 1 4 . 1 1 106 106 MET H H 468 9.790 9.790 8.421 1.369 18002
2374 1 4 . 1 1 107 107 ALA N N 469 119.758 119.758 120.229 -0.471 18002
2375 1 4 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.921 -0.216 18002
2376 1 4 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.529 1.600 18002
2377 1 4 . 1 1 107 107 ALA CB C 469 20.405 20.405 17.466 2.939 18002
2378 1 4 . 1 1 107 107 ALA H H 469 7.702 7.702 7.863 -0.161 18002
2379 1 4 . 1 1 108 108 ALA N N 470 119.233 119.233 122.435 -3.202 18002
2380 1 4 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.921 -0.375 18002
2381 1 4 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.079 0.742 18002
2382 1 4 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.185 -1.453 18002
2383 1 4 . 1 1 108 108 ALA H H 470 7.156 7.156 7.253 -0.097 18002
2384 1 4 . 1 1 109 109 CYS N N 471 116.736 116.736 117.397 -0.661 18002
2385 1 4 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.284 -0.227 18002
2386 1 4 . 1 1 109 109 CYS CA C 471 64.571 64.571 60.399 4.172 18002
2387 1 4 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.506 0.887 18002
2388 1 4 . 1 1 109 109 CYS H H 471 8.256 8.256 8.391 -0.135 18002
2389 1 4 . 1 1 110 110 ARG N N 472 118.644 118.644 120.243 -1.599 18002
2390 1 4 . 1 1 110 110 ARG HA H 472 3.734 3.734 3.999 -0.265 18002
2391 1 4 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.118 1.086 18002
2392 1 4 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.078 0.239 18002
2393 1 4 . 1 1 110 110 ARG H H 472 8.403 8.403 7.430 0.973 18002
2394 1 4 . 1 1 111 111 LEU N N 473 121.877 121.877 121.902 -0.025 18002
2395 1 4 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.090 -0.290 18002
2396 1 4 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.764 2.091 18002
2397 1 4 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.833 -1.413 18002
2398 1 4 . 1 1 111 111 LEU H H 473 7.916 7.916 8.111 -0.195 18002
2399 1 4 . 1 1 112 112 ALA N N 474 122.765 122.765 119.279 3.486 18002
2400 1 4 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.974 0.506 18002
2401 1 4 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.557 0.704 18002
2402 1 4 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.025 1.850 18002
2403 1 4 . 1 1 112 112 ALA H H 474 8.393 8.393 8.834 -0.441 18002
2404 1 4 . 1 1 113 113 SER N N 475 113.613 113.613 112.802 0.811 18002
2405 1 4 . 1 1 113 113 SER HA H 475 4.782 4.782 4.218 0.564 18002
2406 1 4 . 1 1 113 113 SER CA C 475 61.090 61.090 60.996 0.094 18002
2407 1 4 . 1 1 113 113 SER CB C 475 63.612 63.612 63.221 0.391 18002
2408 1 4 . 1 1 113 113 SER H H 475 8.150 8.150 7.654 0.496 18002
2409 1 4 . 1 1 114 114 LYS N N 476 118.734 118.734 117.382 1.352 18002
2410 1 4 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.180 0.373 18002
2411 1 4 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.837 -1.693 18002
2412 1 4 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.300 0.291 18002
2413 1 4 . 1 1 114 114 LYS H H 476 7.239 7.239 7.843 -0.604 18002
2414 1 4 . 1 1 115 115 GLY N N 477 107.818 107.818 106.001 1.817 18002
2415 1 4 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.210 0.776 18002
2416 1 4 . 1 1 115 115 GLY H H 477 8.401 8.401 7.829 0.572 18002
2417 1 4 . 1 1 116 116 LYS N N 478 120.938 120.938 121.507 -0.569 18002
2418 1 4 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.456 0.117 18002
2419 1 4 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.253 0.594 18002
2420 1 4 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.380 0.941 18002
2421 1 4 . 1 1 116 116 LYS H H 478 8.142 8.142 7.805 0.337 18002
2422 1 4 . 1 1 117 117 THR N N 479 108.076 108.076 115.478 -7.402 18002
2423 1 4 . 1 1 117 117 THR HA H 479 4.671 4.671 4.277 0.394 18002
2424 1 4 . 1 1 117 117 THR CA C 479 59.191 59.191 61.184 -1.993 18002
2425 1 4 . 1 1 117 117 THR CB C 479 72.228 72.228 69.626 2.602 18002
2426 1 4 . 1 1 117 117 THR H H 479 7.926 7.926 7.903 0.023 18002
2427 1 4 . 1 1 118 118 MET N N 480 116.403 116.403 118.846 -2.443 18002
2428 1 4 . 1 1 118 118 MET HA H 480 3.352 3.352 4.022 -0.670 18002
2429 1 4 . 1 1 118 118 MET CA C 480 57.947 57.947 55.474 2.473 18002
2430 1 4 . 1 1 118 118 MET CB C 480 33.920 33.920 31.217 2.703 18002
2431 1 4 . 1 1 118 118 MET H H 480 8.899 8.899 8.717 0.182 18002
2432 1 4 . 1 1 119 119 ALA N N 481 117.786 117.786 120.628 -2.842 18002
2433 1 4 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.030 0.054 18002
2434 1 4 . 1 1 119 119 ALA CA C 481 52.595 52.595 53.821 -1.226 18002
2435 1 4 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.488 -0.426 18002
2436 1 4 . 1 1 119 119 ALA H H 481 7.645 7.645 8.264 -0.619 18002
2437 1 4 . 1 1 120 120 ASP N N 482 120.348 120.348 114.602 5.746 18002
2438 1 4 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.137 5.479 18002
2439 1 4 . 1 1 120 120 ASP H H 482 7.887 7.887 8.268 -0.381 18002
2440 1 4 . 1 1 121 121 SER HA H 483 4.223 4.223 4.082 0.141 18002
2441 1 4 . 1 1 121 121 SER CA C 483 61.455 61.455 62.023 -0.568 18002
2442 1 4 . 1 1 121 121 SER CB C 483 62.996 62.996 63.166 -0.170 18002
2443 1 4 . 1 1 122 122 SER N N 484 116.845 116.845 115.325 1.520 18002
2444 1 4 . 1 1 122 122 SER HA H 484 4.321 4.321 4.446 -0.125 18002
2445 1 4 . 1 1 122 122 SER CA C 484 60.584 60.584 59.726 0.858 18002
2446 1 4 . 1 1 122 122 SER CB C 484 64.314 64.314 62.773 1.541 18002
2447 1 4 . 1 1 122 122 SER H H 484 8.875 8.875 8.336 0.539 18002
2448 1 4 . 1 1 123 123 TYR N N 485 124.153 124.153 123.672 0.481 18002
2449 1 4 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.234 -0.354 18002
2450 1 4 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.916 1.398 18002
2451 1 4 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.223 -0.482 18002
2452 1 4 . 1 1 123 123 TYR H H 485 8.018 8.018 8.046 -0.028 18002
2453 1 4 . 1 1 124 124 ASN N N 486 115.339 115.339 116.685 -1.346 18002
2454 1 4 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.454 -0.513 18002
2455 1 4 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.541 0.165 18002
2456 1 4 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.294 -0.238 18002
2457 1 4 . 1 1 124 124 ASN H H 486 8.665 8.665 7.808 0.857 18002
2458 1 4 . 1 1 125 125 LEU N N 487 119.454 119.454 119.563 -0.109 18002
2459 1 4 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.000 -0.062 18002
2460 1 4 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.475 0.195 18002
2461 1 4 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.819 -0.251 18002
2462 1 4 . 1 1 125 125 LEU H H 487 7.105 7.105 8.158 -1.053 18002
2463 1 4 . 1 1 126 126 GLU N N 488 121.189 121.189 117.331 3.858 18002
2464 1 4 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.088 -0.058 18002
2465 1 4 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.896 0.139 18002
2466 1 4 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.892 -0.807 18002
2467 1 4 . 1 1 126 126 GLU H H 488 8.053 8.053 7.469 0.584 18002
2468 1 4 . 1 1 127 127 VAL N N 489 119.073 119.073 118.500 0.573 18002
2469 1 4 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.687 -0.669 18002
2470 1 4 . 1 1 127 127 VAL CA C 489 67.322 67.322 66.175 1.147 18002
2471 1 4 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.638 0.021 18002
2472 1 4 . 1 1 127 127 VAL H H 489 7.769 7.769 8.042 -0.273 18002
2473 1 4 . 1 1 128 128 GLN N N 490 116.214 116.214 117.616 -1.402 18002
2474 1 4 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.015 -0.183 18002
2475 1 4 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.498 0.258 18002
2476 1 4 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.949 0.163 18002
2477 1 4 . 1 1 128 128 GLN H H 490 7.542 7.542 7.862 -0.320 18002
2478 1 4 . 1 1 129 129 ASN N N 491 120.003 120.003 118.165 1.838 18002
2479 1 4 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.676 -0.257 18002
2480 1 4 . 1 1 129 129 ASN CA C 491 56.160 56.160 56.053 0.107 18002
2481 1 4 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.203 -0.143 18002
2482 1 4 . 1 1 129 129 ASN H H 491 8.582 8.582 7.502 1.080 18002
2483 1 4 . 1 1 130 130 ILE N N 492 122.365 122.365 119.438 2.927 18002
2484 1 4 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.403 3.350 18002
2485 1 4 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.977 1.169 18002
2486 1 4 . 1 1 130 130 ILE H H 492 8.186 8.186 7.438 0.748 18002
2487 1 4 . 1 1 131 131 LEU N N 493 119.597 119.597 120.050 -0.453 18002
2488 1 4 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.953 0.052 18002
2489 1 4 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.365 0.494 18002
2490 1 4 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.364 0.172 18002
2491 1 4 . 1 1 131 131 LEU H H 493 8.224 8.224 7.955 0.269 18002
2492 1 4 . 1 1 132 132 SER N N 494 114.884 114.884 114.801 0.083 18002
2493 1 4 . 1 1 132 132 SER HA H 494 4.430 4.430 4.251 0.179 18002
2494 1 4 . 1 1 132 132 SER CA C 494 62.072 62.072 61.900 0.172 18002
2495 1 4 . 1 1 132 132 SER CB C 494 62.703 62.703 62.567 0.136 18002
2496 1 4 . 1 1 132 132 SER H H 494 8.464 8.464 7.960 0.504 18002
2497 1 4 . 1 1 133 133 PHE N N 495 123.047 123.047 120.073 2.974 18002
2498 1 4 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.168 0.209 18002
2499 1 4 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.514 -0.602 18002
2500 1 4 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.588 0.462 18002
2501 1 4 . 1 1 133 133 PHE H H 495 7.915 7.915 8.260 -0.345 18002
2502 1 4 . 1 1 134 134 LEU N N 496 119.311 119.311 117.049 2.262 18002
2503 1 4 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.027 -0.122 18002
2504 1 4 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.288 -0.686 18002
2505 1 4 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.140 0.761 18002
2506 1 4 . 1 1 134 134 LEU H H 496 8.386 8.386 7.806 0.580 18002
2507 1 4 . 1 1 135 135 LYS N N 497 117.550 117.550 118.256 -0.706 18002
2508 1 4 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.112 -0.172 18002
2509 1 4 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.825 -0.550 18002
2510 1 4 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.216 0.278 18002
2511 1 4 . 1 1 135 135 LYS H H 497 7.670 7.670 7.721 -0.051 18002
2512 1 4 . 1 1 136 136 MET N N 498 116.106 116.106 113.573 2.533 18002
2513 1 4 . 1 1 136 136 MET HA H 498 4.354 4.354 4.802 -0.448 18002
2514 1 4 . 1 1 136 136 MET CA C 498 55.994 55.994 55.050 0.944 18002
2515 1 4 . 1 1 136 136 MET CB C 498 32.772 32.772 33.836 -1.064 18002
2516 1 4 . 1 1 136 136 MET H H 498 7.421 7.421 7.802 -0.381 18002
2517 1 4 . 1 1 137 137 GLN N N 499 118.651 118.651 121.866 -3.215 18002
2518 1 4 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.091 0.093 18002
2519 1 4 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.031 -2.723 18002
2520 1 4 . 1 1 137 137 GLN H H 499 7.617 7.617 8.083 -0.466 18002
2521 1 5 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.290 -0.165 18002
2522 1 5 . 1 1 3 3 HIS CA C 365 55.015 55.015 57.010 -1.995 18002
2523 1 5 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.382 2.547 18002
2524 1 5 . 1 1 4 4 MET N N 366 120.431 120.431 122.034 -1.603 18002
2525 1 5 . 1 1 4 4 MET HA H 366 4.345 4.345 4.525 -0.180 18002
2526 1 5 . 1 1 4 4 MET CA C 366 55.337 55.337 55.553 -0.216 18002
2527 1 5 . 1 1 4 4 MET CB C 366 32.668 32.668 33.091 -0.423 18002
2528 1 5 . 1 1 4 4 MET H H 366 8.373 8.373 8.287 0.086 18002
2529 1 5 . 1 1 5 5 GLY N N 367 109.318 109.318 110.590 -1.272 18002
2530 1 5 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.815 -0.358 18002
2531 1 5 . 1 1 5 5 GLY H H 367 8.224 8.224 8.788 -0.564 18002
2532 1 5 . 1 1 6 6 ASP N N 368 120.307 120.307 117.524 2.783 18002
2533 1 5 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.592 0.008 18002
2534 1 5 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.449 1.064 18002
2535 1 5 . 1 1 6 6 ASP CB C 368 41.326 41.326 42.221 -0.895 18002
2536 1 5 . 1 1 6 6 ASP H H 368 8.199 8.199 7.712 0.487 18002
2537 1 5 . 1 1 7 7 ILE N N 369 120.668 120.668 115.906 4.762 18002
2538 1 5 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.298 -0.080 18002
2539 1 5 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.286 0.298 18002
2540 1 5 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.272 1.496 18002
2541 1 5 . 1 1 7 7 ILE H H 369 8.138 8.138 8.082 0.056 18002
2542 1 5 . 1 1 8 8 THR N N 370 117.564 117.564 115.799 1.765 18002
2543 1 5 . 1 1 8 8 THR HA H 370 4.322 4.322 4.567 -0.245 18002
2544 1 5 . 1 1 8 8 THR CA C 370 62.332 62.332 60.399 1.933 18002
2545 1 5 . 1 1 8 8 THR CB C 370 69.946 69.946 70.288 -0.342 18002
2546 1 5 . 1 1 8 8 THR H H 370 8.230 8.230 7.716 0.514 18002
2547 1 5 . 1 1 9 9 SER N N 371 118.467 118.467 119.567 -1.100 18002
2548 1 5 . 1 1 9 9 SER HA H 371 4.445 4.445 4.583 -0.138 18002
2549 1 5 . 1 1 9 9 SER CA C 371 58.274 58.274 57.985 0.289 18002
2550 1 5 . 1 1 9 9 SER CB C 371 63.996 63.996 63.159 0.837 18002
2551 1 5 . 1 1 9 9 SER H H 371 8.158 8.158 8.503 -0.345 18002
2552 1 5 . 1 1 10 10 ILE N N 372 123.959 123.959 121.305 2.654 18002
2553 1 5 . 1 1 10 10 ILE CA C 372 58.716 58.716 61.909 -3.193 18002
2554 1 5 . 1 1 10 10 ILE CB C 372 38.919 38.919 35.352 3.567 18002
2555 1 5 . 1 1 10 10 ILE H H 372 8.112 8.112 8.443 -0.331 18002
2556 1 5 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.524 -0.172 18002
2557 1 5 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.563 1.617 18002
2558 1 5 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.728 0.979 18002
2559 1 5 . 1 1 12 12 GLU N N 374 119.349 119.349 123.546 -4.197 18002
2560 1 5 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.385 0.402 18002
2561 1 5 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.846 -0.529 18002
2562 1 5 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.530 3.061 18002
2563 1 5 . 1 1 12 12 GLU H H 374 8.017 8.017 8.208 -0.191 18002
2564 1 5 . 1 1 13 13 LEU N N 375 122.288 122.288 126.053 -3.765 18002
2565 1 5 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.766 -0.288 18002
2566 1 5 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.108 -1.178 18002
2567 1 5 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.926 0.730 18002
2568 1 5 . 1 1 13 13 LEU H H 375 8.036 8.036 8.244 -0.208 18002
2569 1 5 . 1 1 14 14 ALA N N 376 125.461 125.461 128.696 -3.235 18002
2570 1 5 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.701 0.545 18002
2571 1 5 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.847 -0.102 18002
2572 1 5 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.005 -0.419 18002
2573 1 5 . 1 1 14 14 ALA H H 376 8.181 8.181 8.463 -0.282 18002
2574 1 5 . 1 1 15 15 ASP N N 377 122.242 122.242 119.048 3.194 18002
2575 1 5 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.441 -0.122 18002
2576 1 5 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.349 0.403 18002
2577 1 5 . 1 1 15 15 ASP CB C 377 46.639 46.639 42.708 3.931 18002
2578 1 5 . 1 1 15 15 ASP H H 377 8.326 8.326 8.677 -0.351 18002
2579 1 5 . 1 1 16 16 TYR N N 378 118.961 118.961 118.245 0.716 18002
2580 1 5 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.769 0.622 18002
2581 1 5 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.184 2.397 18002
2582 1 5 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.463 0.560 18002
2583 1 5 . 1 1 16 16 TYR H H 378 8.869 8.869 8.105 0.764 18002
2584 1 5 . 1 1 17 17 ILE N N 379 125.214 125.214 119.387 5.827 18002
2585 1 5 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.762 -0.432 18002
2586 1 5 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.564 0.168 18002
2587 1 5 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.430 -1.454 18002
2588 1 5 . 1 1 17 17 ILE H H 379 8.608 8.608 7.923 0.685 18002
2589 1 5 . 1 1 18 18 LYS N N 380 122.917 122.917 120.081 2.836 18002
2590 1 5 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.198 -0.086 18002
2591 1 5 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.592 1.244 18002
2592 1 5 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.730 -0.704 18002
2593 1 5 . 1 1 18 18 LYS H H 380 7.424 7.424 8.338 -0.914 18002
2594 1 5 . 1 1 19 19 VAL N N 381 122.839 122.839 119.349 3.490 18002
2595 1 5 . 1 1 19 19 VAL HA H 381 5.263 5.263 5.218 0.045 18002
2596 1 5 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.759 1.757 18002
2597 1 5 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.761 -0.613 18002
2598 1 5 . 1 1 19 19 VAL H H 381 9.223 9.223 8.045 1.178 18002
2599 1 5 . 1 1 20 20 PHE N N 382 129.509 129.509 125.755 3.754 18002
2600 1 5 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.080 -0.237 18002
2601 1 5 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.754 -0.249 18002
2602 1 5 . 1 1 20 20 PHE CB C 382 42.862 42.862 39.823 3.039 18002
2603 1 5 . 1 1 20 20 PHE H H 382 9.451 9.451 8.158 1.293 18002
2604 1 5 . 1 1 21 21 LYS N N 383 126.417 126.417 127.508 -1.091 18002
2605 1 5 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.331 0.510 18002
2606 1 5 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.823 0.396 18002
2607 1 5 . 1 1 21 21 LYS H H 383 7.582 7.582 8.115 -0.533 18002
2608 1 5 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.937 0.760 18002
2609 1 5 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.228 -0.259 18002
2610 1 5 . 1 1 23 23 LYS N N 385 118.026 118.026 118.245 -0.219 18002
2611 1 5 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.997 0.218 18002
2612 1 5 . 1 1 23 23 LYS CA C 385 56.345 56.345 57.087 -0.743 18002
2613 1 5 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.815 1.218 18002
2614 1 5 . 1 1 23 23 LYS H H 385 8.138 8.138 8.025 0.113 18002
2615 1 5 . 1 1 24 24 LYS N N 386 120.816 120.816 120.802 0.014 18002
2616 1 5 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.076 0.110 18002
2617 1 5 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.878 -1.016 18002
2618 1 5 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.490 0.337 18002
2619 1 5 . 1 1 24 24 LYS H H 386 7.727 7.727 8.502 -0.775 18002
2620 1 5 . 1 1 25 25 LEU N N 387 121.214 121.214 120.242 0.972 18002
2621 1 5 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.286 -0.118 18002
2622 1 5 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.706 -0.198 18002
2623 1 5 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.238 -0.596 18002
2624 1 5 . 1 1 25 25 LEU H H 387 8.241 8.241 7.851 0.390 18002
2625 1 5 . 1 1 26 26 THR N N 388 112.798 112.798 110.279 2.519 18002
2626 1 5 . 1 1 26 26 THR HA H 388 4.313 4.313 4.440 -0.127 18002
2627 1 5 . 1 1 26 26 THR CA C 388 61.795 61.795 61.345 0.450 18002
2628 1 5 . 1 1 26 26 THR CB C 388 69.875 69.875 69.893 -0.018 18002
2629 1 5 . 1 1 26 26 THR H H 388 7.700 7.700 7.795 -0.095 18002
2630 1 5 . 1 1 27 27 LEU N N 389 124.091 124.091 116.098 7.993 18002
2631 1 5 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.833 -0.479 18002
2632 1 5 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.288 0.245 18002
2633 1 5 . 1 1 27 27 LEU CB C 389 42.298 42.298 43.514 -1.216 18002
2634 1 5 . 1 1 27 27 LEU H H 389 8.260 8.260 7.788 0.472 18002
2635 1 5 . 1 1 28 28 LYS N N 390 121.153 121.153 116.656 4.497 18002
2636 1 5 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.252 0.068 18002
2637 1 5 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.319 -0.109 18002
2638 1 5 . 1 1 28 28 LYS CB C 390 33.675 33.675 31.839 1.836 18002
2639 1 5 . 1 1 28 28 LYS H H 390 8.202 8.202 8.719 -0.517 18002
2640 1 5 . 1 1 29 29 GLY N N 391 107.270 107.270 110.180 -2.910 18002
2641 1 5 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.343 -0.468 18002
2642 1 5 . 1 1 29 29 GLY H H 391 7.876 7.876 8.010 -0.134 18002
2643 1 5 . 1 1 30 30 TYR N N 392 118.471 118.471 116.840 1.631 18002
2644 1 5 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.170 0.276 18002
2645 1 5 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.301 -0.254 18002
2646 1 5 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.161 2.664 18002
2647 1 5 . 1 1 30 30 TYR H H 392 8.183 8.183 8.315 -0.132 18002
2648 1 5 . 1 1 31 31 LYS N N 393 122.833 122.833 123.199 -0.366 18002
2649 1 5 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.676 -0.161 18002
2650 1 5 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.609 0.564 18002
2651 1 5 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.088 -0.368 18002
2652 1 5 . 1 1 31 31 LYS H H 393 8.731 8.731 8.005 0.726 18002
2653 1 5 . 1 1 32 32 GLN N N 394 124.759 124.759 121.874 2.885 18002
2654 1 5 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.483 0.195 18002
2655 1 5 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.237 1.369 18002
2656 1 5 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.232 1.816 18002
2657 1 5 . 1 1 32 32 GLN H H 394 8.776 8.776 8.434 0.342 18002
2658 1 5 . 1 1 33 33 TYR N N 395 125.112 125.112 124.328 0.784 18002
2659 1 5 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.797 0.277 18002
2660 1 5 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.982 0.182 18002
2661 1 5 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.279 2.393 18002
2662 1 5 . 1 1 33 33 TYR H H 395 8.774 8.774 8.174 0.600 18002
2663 1 5 . 1 1 34 34 TRP N N 396 122.638 122.638 123.787 -1.149 18002
2664 1 5 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.408 -0.726 18002
2665 1 5 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.260 2.958 18002
2666 1 5 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.944 0.560 18002
2667 1 5 . 1 1 34 34 TRP H H 396 8.975 8.975 8.464 0.511 18002
2668 1 5 . 1 1 35 35 CYS N N 397 127.146 127.146 125.453 1.693 18002
2669 1 5 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.423 -0.056 18002
2670 1 5 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.953 1.753 18002
2671 1 5 . 1 1 35 35 CYS H H 397 8.804 8.804 8.961 -0.157 18002
2672 1 5 . 1 1 36 36 THR N N 398 110.578 110.578 116.107 -5.529 18002
2673 1 5 . 1 1 36 36 THR HA H 398 5.358 5.358 5.008 0.350 18002
2674 1 5 . 1 1 36 36 THR CA C 398 58.704 58.704 61.100 -2.396 18002
2675 1 5 . 1 1 36 36 THR CB C 398 71.833 71.833 71.121 0.712 18002
2676 1 5 . 1 1 36 36 THR H H 398 9.090 9.090 7.933 1.157 18002
2677 1 5 . 1 1 37 37 PHE N N 399 127.322 127.322 125.620 1.702 18002
2678 1 5 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.514 0.439 18002
2679 1 5 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.397 -1.151 18002
2680 1 5 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.502 1.683 18002
2681 1 5 . 1 1 37 37 PHE H H 399 8.846 8.846 8.193 0.653 18002
2682 1 5 . 1 1 38 38 LYS N N 400 125.391 125.391 124.461 0.930 18002
2683 1 5 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.966 -0.439 18002
2684 1 5 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.261 1.716 18002
2685 1 5 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.622 0.293 18002
2686 1 5 . 1 1 38 38 LYS H H 400 8.252 8.252 7.884 0.368 18002
2687 1 5 . 1 1 39 39 ASP N N 401 125.083 125.083 119.456 5.627 18002
2688 1 5 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.281 -0.203 18002
2689 1 5 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.592 -0.108 18002
2690 1 5 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.871 -0.350 18002
2691 1 5 . 1 1 39 39 ASP H H 401 9.408 9.408 8.887 0.521 18002
2692 1 5 . 1 1 40 40 THR N N 402 112.024 112.024 112.784 -0.760 18002
2693 1 5 . 1 1 40 40 THR HA H 402 4.767 4.767 4.597 0.170 18002
2694 1 5 . 1 1 40 40 THR CA C 402 60.811 60.811 62.096 -1.285 18002
2695 1 5 . 1 1 40 40 THR CB C 402 68.823 68.823 69.791 -0.968 18002
2696 1 5 . 1 1 40 40 THR H H 402 8.224 8.224 8.325 -0.101 18002
2697 1 5 . 1 1 41 41 SER N N 403 116.142 116.142 114.972 1.170 18002
2698 1 5 . 1 1 41 41 SER HA H 403 5.428 5.428 4.836 0.592 18002
2699 1 5 . 1 1 41 41 SER CA C 403 58.297 58.297 56.752 1.545 18002
2700 1 5 . 1 1 41 41 SER CB C 403 66.409 66.409 66.113 0.296 18002
2701 1 5 . 1 1 41 41 SER H H 403 8.197 8.197 7.597 0.600 18002
2702 1 5 . 1 1 42 42 ILE N N 404 122.292 122.292 119.362 2.930 18002
2703 1 5 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.216 0.713 18002
2704 1 5 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.036 1.768 18002
2705 1 5 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.321 2.099 18002
2706 1 5 . 1 1 42 42 ILE H H 404 8.411 8.411 7.930 0.481 18002
2707 1 5 . 1 1 43 43 SER N N 405 122.244 122.244 116.190 6.054 18002
2708 1 5 . 1 1 43 43 SER HA H 405 4.966 4.966 4.850 0.116 18002
2709 1 5 . 1 1 43 43 SER CA C 405 57.735 57.735 56.725 1.010 18002
2710 1 5 . 1 1 43 43 SER CB C 405 65.388 65.388 66.001 -0.614 18002
2711 1 5 . 1 1 43 43 SER H H 405 8.752 8.752 8.143 0.609 18002
2712 1 5 . 1 1 44 44 CYS N N 406 120.004 120.004 120.827 -0.823 18002
2713 1 5 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.735 0.232 18002
2714 1 5 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.620 -0.562 18002
2715 1 5 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.953 0.487 18002
2716 1 5 . 1 1 44 44 CYS H H 406 8.470 8.470 8.049 0.421 18002
2717 1 5 . 1 1 45 45 TYR N N 407 122.704 122.704 127.114 -4.410 18002
2718 1 5 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.603 0.420 18002
2719 1 5 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.065 -0.082 18002
2720 1 5 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.818 0.756 18002
2721 1 5 . 1 1 45 45 TYR H H 407 10.013 10.013 7.991 2.022 18002
2722 1 5 . 1 1 46 46 LYS N N 408 121.897 121.897 124.050 -2.153 18002
2723 1 5 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.441 -0.095 18002
2724 1 5 . 1 1 46 46 LYS CA C 408 60.019 60.019 58.443 1.576 18002
2725 1 5 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.589 -0.877 18002
2726 1 5 . 1 1 46 46 LYS H H 408 9.734 9.734 9.014 0.720 18002
2727 1 5 . 1 1 47 47 SER N N 409 106.720 106.720 111.817 -5.097 18002
2728 1 5 . 1 1 47 47 SER HA H 409 4.776 4.776 4.910 -0.134 18002
2729 1 5 . 1 1 47 47 SER CA C 409 57.180 57.180 57.294 -0.114 18002
2730 1 5 . 1 1 47 47 SER CB C 409 65.870 65.870 65.577 0.293 18002
2731 1 5 . 1 1 47 47 SER H H 409 7.518 7.518 7.790 -0.272 18002
2732 1 5 . 1 1 48 48 LYS N N 410 122.302 122.302 117.807 4.495 18002
2733 1 5 . 1 1 48 48 LYS CA C 410 59.234 59.234 56.836 2.398 18002
2734 1 5 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.548 0.751 18002
2735 1 5 . 1 1 48 48 LYS H H 410 8.195 8.195 8.607 -0.411 18002
2736 1 5 . 1 1 49 49 GLU N N 411 118.983 118.983 121.048 -2.065 18002
2737 1 5 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.037 0.745 18002
2738 1 5 . 1 1 49 49 GLU CA C 411 59.535 59.535 59.737 -0.202 18002
2739 1 5 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.749 -1.061 18002
2740 1 5 . 1 1 49 49 GLU H H 411 8.752 8.752 8.128 0.624 18002
2741 1 5 . 1 1 50 50 GLU N N 412 118.384 118.384 118.631 -0.247 18002
2742 1 5 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.338 0.155 18002
2743 1 5 . 1 1 50 50 GLU CA C 412 55.789 55.789 58.311 -2.522 18002
2744 1 5 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.025 0.980 18002
2745 1 5 . 1 1 50 50 GLU H H 412 7.234 7.234 8.905 -1.671 18002
2746 1 5 . 1 1 51 51 SER N N 413 114.767 114.767 116.057 -1.290 18002
2747 1 5 . 1 1 51 51 SER CA C 413 59.764 59.764 60.774 -1.010 18002
2748 1 5 . 1 1 51 51 SER CB C 413 62.965 62.965 63.027 -0.062 18002
2749 1 5 . 1 1 51 51 SER H H 413 7.382 7.382 8.649 -1.267 18002
2750 1 5 . 1 1 52 52 SER N N 414 114.496 114.496 113.175 1.321 18002
2751 1 5 . 1 1 52 52 SER HA H 414 4.560 4.560 4.653 -0.093 18002
2752 1 5 . 1 1 52 52 SER CA C 414 58.574 58.574 58.078 0.496 18002
2753 1 5 . 1 1 52 52 SER CB C 414 63.829 63.829 64.102 -0.273 18002
2754 1 5 . 1 1 52 52 SER H H 414 7.682 7.682 7.723 -0.041 18002
2755 1 5 . 1 1 53 53 GLY N N 415 111.107 111.107 110.961 0.146 18002
2756 1 5 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.037 -0.804 18002
2757 1 5 . 1 1 53 53 GLY H H 415 7.918 7.918 8.420 -0.502 18002
2758 1 5 . 1 1 54 54 THR N N 416 120.214 120.214 116.664 3.550 18002
2759 1 5 . 1 1 54 54 THR CB C 416 70.035 70.035 71.246 -1.211 18002
2760 1 5 . 1 1 54 54 THR H H 416 8.622 8.622 8.105 0.517 18002
2761 1 5 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.811 0.664 18002
2762 1 5 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.381 0.664 18002
2763 1 5 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.789 -0.211 18002
2764 1 5 . 1 1 56 56 ALA N N 418 125.591 125.591 124.640 0.951 18002
2765 1 5 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.998 -0.042 18002
2766 1 5 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.757 0.778 18002
2767 1 5 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.324 -0.417 18002
2768 1 5 . 1 1 56 56 ALA H H 418 8.288 8.288 8.062 0.226 18002
2769 1 5 . 1 1 57 57 HIS N N 419 108.119 108.119 116.708 -8.589 18002
2770 1 5 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.673 -0.051 18002
2771 1 5 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.176 -1.596 18002
2772 1 5 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.213 2.006 18002
2773 1 5 . 1 1 57 57 HIS H H 419 7.072 7.072 7.410 -0.338 18002
2774 1 5 . 1 1 58 58 GLN N N 420 123.083 123.083 124.672 -1.589 18002
2775 1 5 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.523 0.632 18002
2776 1 5 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.832 0.672 18002
2777 1 5 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.183 2.307 18002
2778 1 5 . 1 1 58 58 GLN H H 420 8.669 8.669 8.201 0.468 18002
2779 1 5 . 1 1 59 59 MET N N 421 122.330 122.330 120.668 1.662 18002
2780 1 5 . 1 1 59 59 MET HA H 421 4.621 4.621 4.651 -0.030 18002
2781 1 5 . 1 1 59 59 MET CA C 421 54.892 54.892 54.407 0.485 18002
2782 1 5 . 1 1 59 59 MET CB C 421 35.650 35.650 35.203 0.447 18002
2783 1 5 . 1 1 59 59 MET H H 421 8.995 8.995 7.935 1.060 18002
2784 1 5 . 1 1 60 60 ASN N N 422 123.220 123.220 119.691 3.529 18002
2785 1 5 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.875 0.073 18002
2786 1 5 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.606 0.025 18002
2787 1 5 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.503 1.236 18002
2788 1 5 . 1 1 60 60 ASN H H 422 8.728 8.728 8.547 0.181 18002
2789 1 5 . 1 1 61 61 LEU N N 423 126.072 126.072 123.593 2.479 18002
2790 1 5 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.234 -0.118 18002
2791 1 5 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.272 1.341 18002
2792 1 5 . 1 1 61 61 LEU CB C 423 42.457 42.457 42.329 0.128 18002
2793 1 5 . 1 1 61 61 LEU H H 423 8.942 8.942 8.286 0.656 18002
2794 1 5 . 1 1 62 62 ARG N N 424 121.977 121.977 116.162 5.815 18002
2795 1 5 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.930 0.442 18002
2796 1 5 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.539 2.495 18002
2797 1 5 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.387 -0.777 18002
2798 1 5 . 1 1 62 62 ARG H H 424 8.000 8.000 7.785 0.215 18002
2799 1 5 . 1 1 63 63 GLY N N 425 114.852 114.852 107.970 6.882 18002
2800 1 5 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.460 0.350 18002
2801 1 5 . 1 1 63 63 GLY H H 425 9.033 9.033 8.418 0.615 18002
2802 1 5 . 1 1 64 64 CYS N N 426 117.102 117.102 116.493 0.609 18002
2803 1 5 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.513 0.386 18002
2804 1 5 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.477 1.283 18002
2805 1 5 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.835 -1.011 18002
2806 1 5 . 1 1 64 64 CYS H H 426 8.248 8.248 7.520 0.728 18002
2807 1 5 . 1 1 65 65 GLU N N 427 119.501 119.501 121.141 -1.640 18002
2808 1 5 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.461 0.316 18002
2809 1 5 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.705 -0.314 18002
2810 1 5 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.794 0.144 18002
2811 1 5 . 1 1 65 65 GLU H H 427 8.449 8.449 8.650 -0.201 18002
2812 1 5 . 1 1 66 66 VAL N N 428 125.286 125.286 125.187 0.099 18002
2813 1 5 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.494 0.396 18002
2814 1 5 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.833 -0.081 18002
2815 1 5 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.784 -0.809 18002
2816 1 5 . 1 1 66 66 VAL H H 428 8.624 8.624 8.495 0.129 18002
2817 1 5 . 1 1 67 67 THR N N 429 124.132 124.132 125.449 -1.317 18002
2818 1 5 . 1 1 67 67 THR CA C 429 59.338 59.338 60.203 -0.865 18002
2819 1 5 . 1 1 67 67 THR CB C 429 72.021 72.021 70.160 1.861 18002
2820 1 5 . 1 1 67 67 THR H H 429 9.247 9.247 8.388 0.859 18002
2821 1 5 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.796 -0.147 18002
2822 1 5 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.570 0.168 18002
2823 1 5 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.552 1.016 18002
2824 1 5 . 1 1 69 69 ASP N N 431 122.066 122.066 123.583 -1.517 18002
2825 1 5 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.823 -0.176 18002
2826 1 5 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.631 0.038 18002
2827 1 5 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.311 -1.206 18002
2828 1 5 . 1 1 69 69 ASP H H 431 8.250 8.250 8.663 -0.413 18002
2829 1 5 . 1 1 70 70 VAL N N 432 121.874 121.874 122.742 -0.868 18002
2830 1 5 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.552 -0.053 18002
2831 1 5 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.250 -0.162 18002
2832 1 5 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.290 -0.258 18002
2833 1 5 . 1 1 70 70 VAL H H 432 8.305 8.305 8.201 0.104 18002
2834 1 5 . 1 1 71 71 ASN N N 433 124.366 124.366 124.797 -0.431 18002
2835 1 5 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.016 -0.334 18002
2836 1 5 . 1 1 71 71 ASN CA C 433 52.761 52.761 51.966 0.795 18002
2837 1 5 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.768 0.511 18002
2838 1 5 . 1 1 71 71 ASN H H 433 8.637 8.637 8.406 0.231 18002
2839 1 5 . 1 1 72 72 ILE N N 434 126.786 126.786 123.018 3.768 18002
2840 1 5 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.848 -0.477 18002
2841 1 5 . 1 1 72 72 ILE CA C 434 64.518 64.518 62.376 2.142 18002
2842 1 5 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.357 -0.182 18002
2843 1 5 . 1 1 72 72 ILE H H 434 8.943 8.943 8.780 0.163 18002
2844 1 5 . 1 1 73 73 SER N N 435 118.305 118.305 115.104 3.201 18002
2845 1 5 . 1 1 73 73 SER CA C 435 61.633 61.633 60.092 1.541 18002
2846 1 5 . 1 1 73 73 SER CB C 435 62.435 62.435 63.260 -0.825 18002
2847 1 5 . 1 1 73 73 SER H H 435 8.578 8.578 8.015 0.563 18002
2848 1 5 . 1 1 74 74 GLY N N 436 107.443 107.443 105.800 1.643 18002
2849 1 5 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.744 0.117 18002
2850 1 5 . 1 1 74 74 GLY H H 436 7.620 7.620 7.513 0.107 18002
2851 1 5 . 1 1 75 75 GLN N N 437 116.895 116.895 116.089 0.806 18002
2852 1 5 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.603 -0.313 18002
2853 1 5 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.521 0.180 18002
2854 1 5 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.793 0.952 18002
2855 1 5 . 1 1 75 75 GLN H H 437 7.798 7.798 7.780 0.018 18002
2856 1 5 . 1 1 76 76 LYS N N 438 119.308 119.308 119.720 -0.412 18002
2857 1 5 . 1 1 76 76 LYS HA H 438 4.142 4.142 3.634 0.508 18002
2858 1 5 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.694 -0.651 18002
2859 1 5 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.215 2.731 18002
2860 1 5 . 1 1 76 76 LYS H H 438 7.522 7.522 7.285 0.237 18002
2861 1 5 . 1 1 77 77 PHE N N 439 125.905 125.905 123.585 2.320 18002
2862 1 5 . 1 1 77 77 PHE HA H 439 4.211 4.211 3.887 0.324 18002
2863 1 5 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.433 -0.794 18002
2864 1 5 . 1 1 77 77 PHE CB C 439 38.929 38.929 37.056 1.873 18002
2865 1 5 . 1 1 77 77 PHE H H 439 8.461 8.461 6.740 1.721 18002
2866 1 5 . 1 1 78 78 ASN N N 440 120.787 120.787 122.373 -1.586 18002
2867 1 5 . 1 1 78 78 ASN CA C 440 51.913 51.913 51.962 -0.049 18002
2868 1 5 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.718 0.085 18002
2869 1 5 . 1 1 78 78 ASN H H 440 7.638 7.638 8.136 -0.498 18002
2870 1 5 . 1 1 79 79 ILE N N 441 123.421 123.421 126.572 -3.151 18002
2871 1 5 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.326 -0.155 18002
2872 1 5 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.146 1.421 18002
2873 1 5 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.758 1.729 18002
2874 1 5 . 1 1 79 79 ILE H H 441 9.550 9.550 8.666 0.884 18002
2875 1 5 . 1 1 80 80 LYS N N 442 126.267 126.267 130.421 -4.154 18002
2876 1 5 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.398 0.064 18002
2877 1 5 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.871 1.512 18002
2878 1 5 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.425 0.562 18002
2879 1 5 . 1 1 80 80 LYS H H 442 8.703 8.703 8.281 0.422 18002
2880 1 5 . 1 1 81 81 LEU N N 443 125.194 125.194 127.881 -2.687 18002
2881 1 5 . 1 1 81 81 LEU HA H 443 5.272 5.272 5.019 0.253 18002
2882 1 5 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.492 -0.143 18002
2883 1 5 . 1 1 81 81 LEU CB C 443 44.704 44.704 44.177 0.527 18002
2884 1 5 . 1 1 81 81 LEU H H 443 9.223 9.223 7.649 1.574 18002
2885 1 5 . 1 1 82 82 LEU N N 444 122.753 122.753 125.272 -2.519 18002
2886 1 5 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.045 -0.031 18002
2887 1 5 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.344 0.574 18002
2888 1 5 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.843 -3.219 18002
2889 1 5 . 1 1 82 82 LEU H H 444 8.420 8.420 7.899 0.521 18002
2890 1 5 . 1 1 83 83 ILE N N 445 125.584 125.584 121.319 4.265 18002
2891 1 5 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.372 -0.087 18002
2892 1 5 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.783 -0.747 18002
2893 1 5 . 1 1 83 83 ILE H H 445 9.010 9.010 7.883 1.127 18002
2894 1 5 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.854 0.065 18002
2895 1 5 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.275 1.758 18002
2896 1 5 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.762 0.186 18002
2897 1 5 . 1 1 85 85 VAL N N 447 119.780 119.780 119.431 0.349 18002
2898 1 5 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.542 -0.039 18002
2899 1 5 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.617 0.725 18002
2900 1 5 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.882 0.384 18002
2901 1 5 . 1 1 85 85 VAL H H 447 8.304 8.304 8.280 0.024 18002
2902 1 5 . 1 1 86 86 ALA N N 448 125.178 125.178 122.527 2.651 18002
2903 1 5 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.135 -0.160 18002
2904 1 5 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.696 0.865 18002
2905 1 5 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.350 -0.362 18002
2906 1 5 . 1 1 86 86 ALA H H 448 8.526 8.526 8.513 0.013 18002
2907 1 5 . 1 1 87 87 GLU N N 449 114.625 114.625 117.682 -3.057 18002
2908 1 5 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.138 0.152 18002
2909 1 5 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.414 -0.683 18002
2910 1 5 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.866 -0.605 18002
2911 1 5 . 1 1 87 87 GLU H H 449 8.402 8.402 8.630 -0.228 18002
2912 1 5 . 1 1 88 88 GLY N N 450 109.432 109.432 106.139 3.293 18002
2913 1 5 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.789 1.048 18002
2914 1 5 . 1 1 88 88 GLY H H 450 7.711 7.711 7.421 0.290 18002
2915 1 5 . 1 1 89 89 MET N N 451 121.382 121.382 120.071 1.311 18002
2916 1 5 . 1 1 89 89 MET HA H 451 5.076 5.076 5.088 -0.012 18002
2917 1 5 . 1 1 89 89 MET CA C 451 53.860 53.860 54.589 -0.729 18002
2918 1 5 . 1 1 89 89 MET CB C 451 35.942 35.942 37.420 -1.478 18002
2919 1 5 . 1 1 89 89 MET H H 451 8.355 8.355 7.889 0.466 18002
2920 1 5 . 1 1 90 90 ASN N N 452 123.538 123.538 123.032 0.506 18002
2921 1 5 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.864 0.089 18002
2922 1 5 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.654 -0.906 18002
2923 1 5 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.159 1.483 18002
2924 1 5 . 1 1 90 90 ASN H H 452 9.338 9.338 8.707 0.631 18002
2925 1 5 . 1 1 91 91 GLU N N 453 125.978 125.978 123.787 2.191 18002
2926 1 5 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.210 1.134 18002
2927 1 5 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.438 -1.165 18002
2928 1 5 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.143 1.600 18002
2929 1 5 . 1 1 91 91 GLU H H 453 8.168 8.168 8.414 -0.246 18002
2930 1 5 . 1 1 92 92 ILE N N 454 126.776 126.776 124.689 2.087 18002
2931 1 5 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.332 0.234 18002
2932 1 5 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.125 -0.077 18002
2933 1 5 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.720 0.542 18002
2934 1 5 . 1 1 92 92 ILE H H 454 9.000 9.000 7.474 1.526 18002
2935 1 5 . 1 1 93 93 TRP N N 455 125.987 125.987 124.041 1.946 18002
2936 1 5 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.909 -0.317 18002
2937 1 5 . 1 1 93 93 TRP CA C 455 53.790 53.790 56.027 -2.237 18002
2938 1 5 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.897 0.489 18002
2939 1 5 . 1 1 93 93 TRP H H 455 9.278 9.278 8.329 0.949 18002
2940 1 5 . 1 1 94 94 LEU N N 456 120.912 120.912 123.716 -2.804 18002
2941 1 5 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.034 0.328 18002
2942 1 5 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.909 -0.693 18002
2943 1 5 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.827 0.767 18002
2944 1 5 . 1 1 94 94 LEU H H 456 9.534 9.534 8.183 1.351 18002
2945 1 5 . 1 1 95 95 ARG N N 457 123.669 123.669 122.485 1.184 18002
2946 1 5 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.443 0.828 18002
2947 1 5 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.450 -0.033 18002
2948 1 5 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.055 1.207 18002
2949 1 5 . 1 1 95 95 ARG H H 457 9.439 9.439 8.645 0.794 18002
2950 1 5 . 1 1 96 96 CYS N N 458 125.273 125.273 124.075 1.198 18002
2951 1 5 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.770 -0.072 18002
2952 1 5 . 1 1 96 96 CYS CA C 458 58.792 58.792 60.078 -1.286 18002
2953 1 5 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.550 1.853 18002
2954 1 5 . 1 1 96 96 CYS H H 458 8.652 8.652 8.646 0.006 18002
2955 1 5 . 1 1 97 97 ASP N N 459 119.661 119.661 124.500 -4.839 18002
2956 1 5 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.853 -0.113 18002
2957 1 5 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.763 1.465 18002
2958 1 5 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.631 0.954 18002
2959 1 5 . 1 1 97 97 ASP H H 459 9.116 9.116 9.314 -0.198 18002
2960 1 5 . 1 1 98 98 ASN N N 460 109.173 109.173 116.639 -7.466 18002
2961 1 5 . 1 1 98 98 ASN HA H 460 4.372 4.372 5.038 -0.666 18002
2962 1 5 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.806 -0.792 18002
2963 1 5 . 1 1 98 98 ASN CB C 460 40.811 40.811 41.428 -0.618 18002
2964 1 5 . 1 1 98 98 ASN H H 460 7.054 7.054 7.790 -0.736 18002
2965 1 5 . 1 1 99 99 GLU N N 461 119.220 119.220 120.737 -1.517 18002
2966 1 5 . 1 1 99 99 GLU CA C 461 60.044 60.044 58.849 1.195 18002
2967 1 5 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.204 0.564 18002
2968 1 5 . 1 1 99 99 GLU H H 461 8.937 8.937 8.514 0.423 18002
2969 1 5 . 1 1 100 100 LYS N N 462 120.647 120.647 119.490 1.157 18002
2970 1 5 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.157 0.488 18002
2971 1 5 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.194 1.342 18002
2972 1 5 . 1 1 100 100 LYS CB C 462 32.228 32.228 32.090 0.138 18002
2973 1 5 . 1 1 100 100 LYS H H 462 8.033 8.033 8.036 -0.003 18002
2974 1 5 . 1 1 101 101 GLN N N 463 121.938 121.938 119.339 2.599 18002
2975 1 5 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.884 0.516 18002
2976 1 5 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.279 0.116 18002
2977 1 5 . 1 1 101 101 GLN CB C 463 32.214 32.214 27.843 4.371 18002
2978 1 5 . 1 1 101 101 GLN H H 463 8.372 8.372 8.073 0.299 18002
2979 1 5 . 1 1 102 102 TYR N N 464 117.422 117.422 121.368 -3.946 18002
2980 1 5 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.052 0.564 18002
2981 1 5 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.855 -0.178 18002
2982 1 5 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.079 0.780 18002
2983 1 5 . 1 1 102 102 TYR H H 464 8.221 8.221 8.153 0.068 18002
2984 1 5 . 1 1 103 103 ALA N N 465 120.655 120.655 118.811 1.844 18002
2985 1 5 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.914 -0.199 18002
2986 1 5 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.683 1.230 18002
2987 1 5 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.431 0.371 18002
2988 1 5 . 1 1 103 103 ALA H H 465 8.637 8.637 7.978 0.659 18002
2989 1 5 . 1 1 104 104 HIS N N 466 112.871 112.871 116.928 -4.057 18002
2990 1 5 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.805 -0.664 18002
2991 1 5 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.294 1.333 18002
2992 1 5 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.109 -1.251 18002
2993 1 5 . 1 1 104 104 HIS H H 466 7.852 7.852 8.442 -0.590 18002
2994 1 5 . 1 1 105 105 TRP N N 467 121.317 121.317 119.506 1.811 18002
2995 1 5 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.559 -0.864 18002
2996 1 5 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.399 1.943 18002
2997 1 5 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.247 -1.742 18002
2998 1 5 . 1 1 105 105 TRP H H 467 8.668 8.668 7.932 0.736 18002
2999 1 5 . 1 1 106 106 MET N N 468 122.346 122.346 117.510 4.836 18002
3000 1 5 . 1 1 106 106 MET HA H 468 4.086 4.086 4.020 0.066 18002
3001 1 5 . 1 1 106 106 MET CA C 468 58.743 58.743 59.021 -0.278 18002
3002 1 5 . 1 1 106 106 MET CB C 468 31.402 31.402 31.462 -0.060 18002
3003 1 5 . 1 1 106 106 MET H H 468 9.790 9.790 8.273 1.517 18002
3004 1 5 . 1 1 107 107 ALA N N 469 119.758 119.758 119.545 0.213 18002
3005 1 5 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.379 -0.674 18002
3006 1 5 . 1 1 107 107 ALA CA C 469 56.129 56.129 53.492 2.637 18002
3007 1 5 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.081 2.324 18002
3008 1 5 . 1 1 107 107 ALA H H 469 7.702 7.702 7.855 -0.153 18002
3009 1 5 . 1 1 108 108 ALA N N 470 119.233 119.233 122.269 -3.036 18002
3010 1 5 . 1 1 108 108 ALA HA H 470 3.546 3.546 4.027 -0.481 18002
3011 1 5 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.976 0.845 18002
3012 1 5 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.311 -1.579 18002
3013 1 5 . 1 1 108 108 ALA H H 470 7.156 7.156 7.486 -0.330 18002
3014 1 5 . 1 1 109 109 CYS N N 471 116.736 116.736 115.781 0.955 18002
3015 1 5 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.188 -0.131 18002
3016 1 5 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.783 1.788 18002
3017 1 5 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.324 1.069 18002
3018 1 5 . 1 1 109 109 CYS H H 471 8.256 8.256 8.449 -0.193 18002
3019 1 5 . 1 1 110 110 ARG N N 472 118.644 118.644 117.575 1.069 18002
3020 1 5 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.128 -0.394 18002
3021 1 5 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.442 1.762 18002
3022 1 5 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.985 0.332 18002
3023 1 5 . 1 1 110 110 ARG H H 472 8.403 8.403 7.527 0.876 18002
3024 1 5 . 1 1 111 111 LEU N N 473 121.877 121.877 122.037 -0.160 18002
3025 1 5 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.199 -0.399 18002
3026 1 5 . 1 1 111 111 LEU CA C 473 59.855 59.855 58.134 1.721 18002
3027 1 5 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.642 -0.222 18002
3028 1 5 . 1 1 111 111 LEU H H 473 7.916 7.916 8.363 -0.447 18002
3029 1 5 . 1 1 112 112 ALA N N 474 122.765 122.765 121.440 1.325 18002
3030 1 5 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.908 0.572 18002
3031 1 5 . 1 1 112 112 ALA CA C 474 55.261 55.261 55.154 0.107 18002
3032 1 5 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.618 2.257 18002
3033 1 5 . 1 1 112 112 ALA H H 474 8.393 8.393 8.267 0.126 18002
3034 1 5 . 1 1 113 113 SER N N 475 113.613 113.613 113.241 0.372 18002
3035 1 5 . 1 1 113 113 SER HA H 475 4.782 4.782 4.274 0.508 18002
3036 1 5 . 1 1 113 113 SER CA C 475 61.090 61.090 61.187 -0.097 18002
3037 1 5 . 1 1 113 113 SER CB C 475 63.612 63.612 63.378 0.234 18002
3038 1 5 . 1 1 113 113 SER H H 475 8.150 8.150 7.732 0.418 18002
3039 1 5 . 1 1 114 114 LYS N N 476 118.734 118.734 118.937 -0.203 18002
3040 1 5 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.354 0.199 18002
3041 1 5 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.242 -1.098 18002
3042 1 5 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.954 -0.363 18002
3043 1 5 . 1 1 114 114 LYS H H 476 7.239 7.239 7.731 -0.492 18002
3044 1 5 . 1 1 115 115 GLY N N 477 107.818 107.818 108.702 -0.884 18002
3045 1 5 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.573 0.413 18002
3046 1 5 . 1 1 115 115 GLY H H 477 8.401 8.401 8.526 -0.125 18002
3047 1 5 . 1 1 116 116 LYS N N 478 120.938 120.938 119.814 1.124 18002
3048 1 5 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.536 0.037 18002
3049 1 5 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.150 0.697 18002
3050 1 5 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.470 -0.149 18002
3051 1 5 . 1 1 116 116 LYS H H 478 8.142 8.142 7.494 0.648 18002
3052 1 5 . 1 1 117 117 THR N N 479 108.076 108.076 114.304 -6.228 18002
3053 1 5 . 1 1 117 117 THR HA H 479 4.671 4.671 4.223 0.448 18002
3054 1 5 . 1 1 117 117 THR CA C 479 59.191 59.191 60.388 -1.197 18002
3055 1 5 . 1 1 117 117 THR CB C 479 72.228 72.228 70.044 2.184 18002
3056 1 5 . 1 1 117 117 THR H H 479 7.926 7.926 8.084 -0.158 18002
3057 1 5 . 1 1 118 118 MET N N 480 116.403 116.403 115.573 0.830 18002
3058 1 5 . 1 1 118 118 MET HA H 480 3.352 3.352 3.750 -0.398 18002
3059 1 5 . 1 1 118 118 MET CA C 480 57.947 57.947 56.307 1.640 18002
3060 1 5 . 1 1 118 118 MET CB C 480 33.920 33.920 30.295 3.625 18002
3061 1 5 . 1 1 118 118 MET H H 480 8.899 8.899 8.263 0.636 18002
3062 1 5 . 1 1 119 119 ALA N N 481 117.786 117.786 120.789 -3.003 18002
3063 1 5 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.973 0.111 18002
3064 1 5 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.100 -1.505 18002
3065 1 5 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.124 -0.062 18002
3066 1 5 . 1 1 119 119 ALA H H 481 7.645 7.645 8.138 -0.493 18002
3067 1 5 . 1 1 120 120 ASP N N 482 120.348 120.348 115.818 4.530 18002
3068 1 5 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.194 5.422 18002
3069 1 5 . 1 1 120 120 ASP H H 482 7.887 7.887 8.414 -0.527 18002
3070 1 5 . 1 1 121 121 SER HA H 483 4.223 4.223 4.061 0.162 18002
3071 1 5 . 1 1 121 121 SER CA C 483 61.455 61.455 61.530 -0.075 18002
3072 1 5 . 1 1 121 121 SER CB C 483 62.996 62.996 63.075 -0.079 18002
3073 1 5 . 1 1 122 122 SER N N 484 116.845 116.845 115.227 1.618 18002
3074 1 5 . 1 1 122 122 SER HA H 484 4.321 4.321 4.427 -0.106 18002
3075 1 5 . 1 1 122 122 SER CA C 484 60.584 60.584 59.739 0.845 18002
3076 1 5 . 1 1 122 122 SER CB C 484 64.314 64.314 63.077 1.237 18002
3077 1 5 . 1 1 122 122 SER H H 484 8.875 8.875 8.265 0.610 18002
3078 1 5 . 1 1 123 123 TYR N N 485 124.153 124.153 123.414 0.739 18002
3079 1 5 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.133 -0.253 18002
3080 1 5 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.361 1.953 18002
3081 1 5 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.119 -0.378 18002
3082 1 5 . 1 1 123 123 TYR H H 485 8.018 8.018 8.296 -0.278 18002
3083 1 5 . 1 1 124 124 ASN N N 486 115.339 115.339 117.058 -1.719 18002
3084 1 5 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.264 -0.323 18002
3085 1 5 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.825 0.881 18002
3086 1 5 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.329 -0.273 18002
3087 1 5 . 1 1 124 124 ASN H H 486 8.665 8.665 7.969 0.696 18002
3088 1 5 . 1 1 125 125 LEU N N 487 119.454 119.454 118.328 1.126 18002
3089 1 5 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.073 -0.135 18002
3090 1 5 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.792 -0.123 18002
3091 1 5 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.451 0.117 18002
3092 1 5 . 1 1 125 125 LEU H H 487 7.105 7.105 8.339 -1.234 18002
3093 1 5 . 1 1 126 126 GLU N N 488 121.189 121.189 117.045 4.144 18002
3094 1 5 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.985 0.045 18002
3095 1 5 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.751 0.284 18002
3096 1 5 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.976 -0.891 18002
3097 1 5 . 1 1 126 126 GLU H H 488 8.053 8.053 7.351 0.702 18002
3098 1 5 . 1 1 127 127 VAL N N 489 119.073 119.073 116.754 2.319 18002
3099 1 5 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.717 -0.699 18002
3100 1 5 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.345 1.977 18002
3101 1 5 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.581 0.078 18002
3102 1 5 . 1 1 127 127 VAL H H 489 7.769 7.769 7.612 0.158 18002
3103 1 5 . 1 1 128 128 GLN N N 490 116.214 116.214 118.218 -2.004 18002
3104 1 5 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.088 -0.256 18002
3105 1 5 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.568 0.188 18002
3106 1 5 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.112 -0.000 18002
3107 1 5 . 1 1 128 128 GLN H H 490 7.542 7.542 8.118 -0.576 18002
3108 1 5 . 1 1 129 129 ASN N N 491 120.003 120.003 117.100 2.903 18002
3109 1 5 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.477 -0.058 18002
3110 1 5 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.672 0.488 18002
3111 1 5 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.467 -0.407 18002
3112 1 5 . 1 1 129 129 ASN H H 491 8.582 8.582 7.439 1.143 18002
3113 1 5 . 1 1 130 130 ILE N N 492 122.365 122.365 120.279 2.086 18002
3114 1 5 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.608 3.145 18002
3115 1 5 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.148 0.999 18002
3116 1 5 . 1 1 130 130 ILE H H 492 8.186 8.186 7.373 0.813 18002
3117 1 5 . 1 1 131 131 LEU N N 493 119.597 119.597 120.585 -0.988 18002
3118 1 5 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.872 0.133 18002
3119 1 5 . 1 1 131 131 LEU CA C 493 58.859 58.859 59.099 -0.240 18002
3120 1 5 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.197 0.339 18002
3121 1 5 . 1 1 131 131 LEU H H 493 8.224 8.224 7.872 0.352 18002
3122 1 5 . 1 1 132 132 SER N N 494 114.884 114.884 113.952 0.932 18002
3123 1 5 . 1 1 132 132 SER HA H 494 4.430 4.430 4.228 0.202 18002
3124 1 5 . 1 1 132 132 SER CA C 494 62.072 62.072 61.695 0.377 18002
3125 1 5 . 1 1 132 132 SER CB C 494 62.703 62.703 62.963 -0.260 18002
3126 1 5 . 1 1 132 132 SER H H 494 8.464 8.464 7.938 0.526 18002
3127 1 5 . 1 1 133 133 PHE N N 495 123.047 123.047 119.056 3.991 18002
3128 1 5 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.385 -0.008 18002
3129 1 5 . 1 1 133 133 PHE CA C 495 60.913 60.913 60.569 0.344 18002
3130 1 5 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.135 -0.085 18002
3131 1 5 . 1 1 133 133 PHE H H 495 7.915 7.915 7.650 0.265 18002
3132 1 5 . 1 1 134 134 LEU N N 496 119.311 119.311 119.938 -0.627 18002
3133 1 5 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.073 -0.168 18002
3134 1 5 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.210 -0.609 18002
3135 1 5 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.621 0.280 18002
3136 1 5 . 1 1 134 134 LEU H H 496 8.386 8.386 8.918 -0.532 18002
3137 1 5 . 1 1 135 135 LYS N N 497 117.550 117.550 117.606 -0.056 18002
3138 1 5 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.012 -0.072 18002
3139 1 5 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.545 -0.271 18002
3140 1 5 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.392 0.102 18002
3141 1 5 . 1 1 135 135 LYS H H 497 7.670 7.670 8.030 -0.360 18002
3142 1 5 . 1 1 136 136 MET N N 498 116.106 116.106 116.359 -0.253 18002
3143 1 5 . 1 1 136 136 MET HA H 498 4.354 4.354 4.225 0.129 18002
3144 1 5 . 1 1 136 136 MET CA C 498 55.994 55.994 56.142 -0.148 18002
3145 1 5 . 1 1 136 136 MET CB C 498 32.772 32.772 32.402 0.370 18002
3146 1 5 . 1 1 136 136 MET H H 498 7.421 7.421 7.399 0.022 18002
3147 1 5 . 1 1 137 137 GLN N N 499 118.651 118.651 112.027 6.624 18002
3148 1 5 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.062 0.122 18002
3149 1 5 . 1 1 137 137 GLN CA C 499 55.308 55.308 56.681 -1.373 18002
3150 1 5 . 1 1 137 137 GLN H H 499 7.617 7.617 7.680 -0.063 18002
3151 1 6 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.126 -0.001 18002
3152 1 6 . 1 1 3 3 HIS CA C 365 55.015 55.015 58.429 -3.414 18002
3153 1 6 . 1 1 3 3 HIS CB C 365 31.929 31.929 28.866 3.063 18002
3154 1 6 . 1 1 4 4 MET N N 366 120.431 120.431 118.556 1.875 18002
3155 1 6 . 1 1 4 4 MET HA H 366 4.345 4.345 4.226 0.119 18002
3156 1 6 . 1 1 4 4 MET CA C 366 55.337 55.337 57.552 -2.215 18002
3157 1 6 . 1 1 4 4 MET CB C 366 32.668 32.668 33.211 -0.543 18002
3158 1 6 . 1 1 4 4 MET H H 366 8.373 8.373 8.196 0.177 18002
3159 1 6 . 1 1 5 5 GLY N N 367 109.318 109.318 106.249 3.069 18002
3160 1 6 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.312 1.145 18002
3161 1 6 . 1 1 5 5 GLY H H 367 8.224 8.224 7.891 0.333 18002
3162 1 6 . 1 1 6 6 ASP N N 368 120.307 120.307 124.775 -4.468 18002
3163 1 6 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.503 0.097 18002
3164 1 6 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.256 0.257 18002
3165 1 6 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.140 0.186 18002
3166 1 6 . 1 1 6 6 ASP H H 368 8.199 8.199 8.313 -0.114 18002
3167 1 6 . 1 1 7 7 ILE N N 369 120.668 120.668 117.975 2.693 18002
3168 1 6 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.134 0.084 18002
3169 1 6 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.031 0.553 18002
3170 1 6 . 1 1 7 7 ILE CB C 369 38.768 38.768 36.617 2.151 18002
3171 1 6 . 1 1 7 7 ILE H H 369 8.138 8.138 8.350 -0.212 18002
3172 1 6 . 1 1 8 8 THR N N 370 117.564 117.564 114.212 3.352 18002
3173 1 6 . 1 1 8 8 THR HA H 370 4.322 4.322 3.984 0.338 18002
3174 1 6 . 1 1 8 8 THR CA C 370 62.332 62.332 64.263 -1.931 18002
3175 1 6 . 1 1 8 8 THR CB C 370 69.946 69.946 68.636 1.310 18002
3176 1 6 . 1 1 8 8 THR H H 370 8.230 8.230 8.033 0.197 18002
3177 1 6 . 1 1 9 9 SER N N 371 118.467 118.467 115.437 3.030 18002
3178 1 6 . 1 1 9 9 SER HA H 371 4.445 4.445 4.569 -0.124 18002
3179 1 6 . 1 1 9 9 SER CA C 371 58.274 58.274 57.802 0.472 18002
3180 1 6 . 1 1 9 9 SER CB C 371 63.996 63.996 65.431 -1.435 18002
3181 1 6 . 1 1 9 9 SER H H 371 8.158 8.158 8.339 -0.181 18002
3182 1 6 . 1 1 10 10 ILE N N 372 123.959 123.959 123.090 0.869 18002
3183 1 6 . 1 1 10 10 ILE CA C 372 58.716 58.716 60.981 -2.265 18002
3184 1 6 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.620 2.299 18002
3185 1 6 . 1 1 10 10 ILE H H 372 8.112 8.112 7.807 0.305 18002
3186 1 6 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.618 -0.266 18002
3187 1 6 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.999 1.182 18002
3188 1 6 . 1 1 11 11 PRO CB C 373 31.707 31.707 31.729 -0.022 18002
3189 1 6 . 1 1 12 12 GLU N N 374 119.349 119.349 124.704 -5.355 18002
3190 1 6 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.336 0.451 18002
3191 1 6 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.988 -0.671 18002
3192 1 6 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.350 3.241 18002
3193 1 6 . 1 1 12 12 GLU H H 374 8.017 8.017 8.471 -0.454 18002
3194 1 6 . 1 1 13 13 LEU N N 375 122.288 122.288 126.321 -4.033 18002
3195 1 6 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.715 -0.237 18002
3196 1 6 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.303 -1.373 18002
3197 1 6 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.625 1.031 18002
3198 1 6 . 1 1 13 13 LEU H H 375 8.036 8.036 8.042 -0.006 18002
3199 1 6 . 1 1 14 14 ALA N N 376 125.461 125.461 128.575 -3.114 18002
3200 1 6 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.050 0.196 18002
3201 1 6 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.410 0.335 18002
3202 1 6 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.401 -0.815 18002
3203 1 6 . 1 1 14 14 ALA H H 376 8.181 8.181 8.179 0.002 18002
3204 1 6 . 1 1 15 15 ASP N N 377 122.242 122.242 119.896 2.346 18002
3205 1 6 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.916 -0.597 18002
3206 1 6 . 1 1 15 15 ASP CA C 377 53.752 53.752 54.245 -0.493 18002
3207 1 6 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.766 1.873 18002
3208 1 6 . 1 1 15 15 ASP H H 377 8.326 8.326 8.551 -0.225 18002
3209 1 6 . 1 1 16 16 TYR N N 378 118.961 118.961 118.577 0.384 18002
3210 1 6 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.059 0.332 18002
3211 1 6 . 1 1 16 16 TYR CA C 378 59.581 59.581 55.897 3.684 18002
3212 1 6 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.237 -0.214 18002
3213 1 6 . 1 1 16 16 TYR H H 378 8.869 8.869 7.728 1.141 18002
3214 1 6 . 1 1 17 17 ILE N N 379 125.214 125.214 118.416 6.798 18002
3215 1 6 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.594 -0.264 18002
3216 1 6 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.981 -0.249 18002
3217 1 6 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.268 -0.292 18002
3218 1 6 . 1 1 17 17 ILE H H 379 8.608 8.608 7.798 0.810 18002
3219 1 6 . 1 1 18 18 LYS N N 380 122.917 122.917 119.243 3.674 18002
3220 1 6 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.241 -0.129 18002
3221 1 6 . 1 1 18 18 LYS CA C 380 55.836 55.836 53.797 2.039 18002
3222 1 6 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.303 0.722 18002
3223 1 6 . 1 1 18 18 LYS H H 380 7.424 7.424 8.268 -0.844 18002
3224 1 6 . 1 1 19 19 VAL N N 381 122.839 122.839 118.966 3.873 18002
3225 1 6 . 1 1 19 19 VAL HA H 381 5.263 5.263 5.015 0.248 18002
3226 1 6 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.724 1.792 18002
3227 1 6 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.335 -0.187 18002
3228 1 6 . 1 1 19 19 VAL H H 381 9.223 9.223 7.734 1.488 18002
3229 1 6 . 1 1 20 20 PHE N N 382 129.509 129.509 126.235 3.274 18002
3230 1 6 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.922 -0.079 18002
3231 1 6 . 1 1 20 20 PHE CA C 382 55.505 55.505 57.147 -1.642 18002
3232 1 6 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.271 2.591 18002
3233 1 6 . 1 1 20 20 PHE H H 382 9.451 9.451 8.180 1.271 18002
3234 1 6 . 1 1 21 21 LYS N N 383 126.417 126.417 126.765 -0.348 18002
3235 1 6 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.248 0.593 18002
3236 1 6 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.993 0.226 18002
3237 1 6 . 1 1 21 21 LYS H H 383 7.582 7.582 7.803 -0.221 18002
3238 1 6 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.753 0.944 18002
3239 1 6 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.141 -0.172 18002
3240 1 6 . 1 1 23 23 LYS N N 385 118.026 118.026 117.592 0.434 18002
3241 1 6 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.878 0.337 18002
3242 1 6 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.730 -0.385 18002
3243 1 6 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.588 1.445 18002
3244 1 6 . 1 1 23 23 LYS H H 385 8.138 8.138 8.187 -0.049 18002
3245 1 6 . 1 1 24 24 LYS N N 386 120.816 120.816 121.813 -0.997 18002
3246 1 6 . 1 1 24 24 LYS HA H 386 4.186 4.186 3.986 0.200 18002
3247 1 6 . 1 1 24 24 LYS CA C 386 56.862 56.862 58.265 -1.403 18002
3248 1 6 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.437 0.390 18002
3249 1 6 . 1 1 24 24 LYS H H 386 7.727 7.727 8.528 -0.801 18002
3250 1 6 . 1 1 25 25 LEU N N 387 121.214 121.214 117.723 3.491 18002
3251 1 6 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.469 -0.301 18002
3252 1 6 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.623 -0.115 18002
3253 1 6 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.329 -0.687 18002
3254 1 6 . 1 1 25 25 LEU H H 387 8.241 8.241 7.697 0.544 18002
3255 1 6 . 1 1 26 26 THR N N 388 112.798 112.798 111.949 0.849 18002
3256 1 6 . 1 1 26 26 THR HA H 388 4.313 4.313 4.315 -0.002 18002
3257 1 6 . 1 1 26 26 THR CA C 388 61.795 61.795 62.410 -0.615 18002
3258 1 6 . 1 1 26 26 THR CB C 388 69.875 69.875 69.137 0.738 18002
3259 1 6 . 1 1 26 26 THR H H 388 7.700 7.700 7.916 -0.216 18002
3260 1 6 . 1 1 27 27 LEU N N 389 124.091 124.091 126.110 -2.019 18002
3261 1 6 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.845 -0.491 18002
3262 1 6 . 1 1 27 27 LEU CA C 389 55.533 55.533 53.252 2.281 18002
3263 1 6 . 1 1 27 27 LEU CB C 389 42.298 42.298 43.462 -1.164 18002
3264 1 6 . 1 1 27 27 LEU H H 389 8.260 8.260 7.883 0.377 18002
3265 1 6 . 1 1 28 28 LYS N N 390 121.153 121.153 120.432 0.721 18002
3266 1 6 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.083 0.237 18002
3267 1 6 . 1 1 28 28 LYS CA C 390 56.211 56.211 58.722 -2.511 18002
3268 1 6 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.135 1.540 18002
3269 1 6 . 1 1 28 28 LYS H H 390 8.202 8.202 8.547 -0.345 18002
3270 1 6 . 1 1 29 29 GLY N N 391 107.270 107.270 105.453 1.817 18002
3271 1 6 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.403 -0.528 18002
3272 1 6 . 1 1 29 29 GLY H H 391 7.876 7.876 8.079 -0.203 18002
3273 1 6 . 1 1 30 30 TYR N N 392 118.471 118.471 127.041 -8.570 18002
3274 1 6 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.514 -0.068 18002
3275 1 6 . 1 1 30 30 TYR CA C 392 59.047 59.047 60.000 -0.953 18002
3276 1 6 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.007 2.818 18002
3277 1 6 . 1 1 30 30 TYR H H 392 8.183 8.183 8.379 -0.196 18002
3278 1 6 . 1 1 31 31 LYS N N 393 122.833 122.833 123.885 -1.052 18002
3279 1 6 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.705 -0.190 18002
3280 1 6 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.907 0.267 18002
3281 1 6 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.486 1.234 18002
3282 1 6 . 1 1 31 31 LYS H H 393 8.731 8.731 7.806 0.925 18002
3283 1 6 . 1 1 32 32 GLN N N 394 124.759 124.759 118.640 6.119 18002
3284 1 6 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.987 -0.309 18002
3285 1 6 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.105 1.502 18002
3286 1 6 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.907 0.141 18002
3287 1 6 . 1 1 32 32 GLN H H 394 8.776 8.776 8.457 0.320 18002
3288 1 6 . 1 1 33 33 TYR N N 395 125.112 125.112 122.880 2.232 18002
3289 1 6 . 1 1 33 33 TYR HA H 395 5.074 5.074 5.202 -0.128 18002
3290 1 6 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.584 1.580 18002
3291 1 6 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.041 1.631 18002
3292 1 6 . 1 1 33 33 TYR H H 395 8.774 8.774 8.375 0.399 18002
3293 1 6 . 1 1 34 34 TRP N N 396 122.638 122.638 121.088 1.550 18002
3294 1 6 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.390 -0.708 18002
3295 1 6 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.263 2.955 18002
3296 1 6 . 1 1 34 34 TRP CB C 396 29.504 29.504 31.474 -1.970 18002
3297 1 6 . 1 1 34 34 TRP H H 396 8.975 8.975 8.176 0.799 18002
3298 1 6 . 1 1 35 35 CYS N N 397 127.146 127.146 122.211 4.935 18002
3299 1 6 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.488 0.879 18002
3300 1 6 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.401 1.304 18002
3301 1 6 . 1 1 35 35 CYS H H 397 8.804 8.804 8.610 0.194 18002
3302 1 6 . 1 1 36 36 THR N N 398 110.578 110.578 116.729 -6.151 18002
3303 1 6 . 1 1 36 36 THR HA H 398 5.358 5.358 5.078 0.280 18002
3304 1 6 . 1 1 36 36 THR CA C 398 58.704 58.704 61.315 -2.611 18002
3305 1 6 . 1 1 36 36 THR CB C 398 71.833 71.833 71.026 0.807 18002
3306 1 6 . 1 1 36 36 THR H H 398 9.090 9.090 7.840 1.250 18002
3307 1 6 . 1 1 37 37 PHE N N 399 127.322 127.322 123.365 3.957 18002
3308 1 6 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.510 0.443 18002
3309 1 6 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.984 -1.738 18002
3310 1 6 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.557 2.627 18002
3311 1 6 . 1 1 37 37 PHE H H 399 8.846 8.846 8.294 0.552 18002
3312 1 6 . 1 1 38 38 LYS N N 400 125.391 125.391 124.531 0.860 18002
3313 1 6 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.654 -0.127 18002
3314 1 6 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.796 1.181 18002
3315 1 6 . 1 1 38 38 LYS CB C 400 35.915 35.915 36.108 -0.193 18002
3316 1 6 . 1 1 38 38 LYS H H 400 8.252 8.252 7.856 0.396 18002
3317 1 6 . 1 1 39 39 ASP N N 401 125.083 125.083 123.617 1.466 18002
3318 1 6 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.272 -0.194 18002
3319 1 6 . 1 1 39 39 ASP CA C 401 57.483 57.483 56.755 0.728 18002
3320 1 6 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.266 -0.745 18002
3321 1 6 . 1 1 39 39 ASP H H 401 9.408 9.408 8.855 0.553 18002
3322 1 6 . 1 1 40 40 THR N N 402 112.024 112.024 117.291 -5.267 18002
3323 1 6 . 1 1 40 40 THR HA H 402 4.767 4.767 4.326 0.441 18002
3324 1 6 . 1 1 40 40 THR CA C 402 60.811 60.811 62.399 -1.588 18002
3325 1 6 . 1 1 40 40 THR CB C 402 68.823 68.823 69.121 -0.298 18002
3326 1 6 . 1 1 40 40 THR H H 402 8.224 8.224 8.349 -0.125 18002
3327 1 6 . 1 1 41 41 SER N N 403 116.142 116.142 114.576 1.566 18002
3328 1 6 . 1 1 41 41 SER HA H 403 5.428 5.428 4.707 0.721 18002
3329 1 6 . 1 1 41 41 SER CA C 403 58.297 58.297 56.183 2.114 18002
3330 1 6 . 1 1 41 41 SER CB C 403 66.409 66.409 66.183 0.226 18002
3331 1 6 . 1 1 41 41 SER H H 403 8.197 8.197 7.580 0.617 18002
3332 1 6 . 1 1 42 42 ILE N N 404 122.292 122.292 120.422 1.870 18002
3333 1 6 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.305 0.624 18002
3334 1 6 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.287 1.517 18002
3335 1 6 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.296 2.124 18002
3336 1 6 . 1 1 42 42 ILE H H 404 8.411 8.411 8.491 -0.080 18002
3337 1 6 . 1 1 43 43 SER N N 405 122.244 122.244 115.342 6.902 18002
3338 1 6 . 1 1 43 43 SER HA H 405 4.966 4.966 4.482 0.484 18002
3339 1 6 . 1 1 43 43 SER CA C 405 57.735 57.735 56.413 1.322 18002
3340 1 6 . 1 1 43 43 SER CB C 405 65.388 65.388 65.525 -0.137 18002
3341 1 6 . 1 1 43 43 SER H H 405 8.752 8.752 8.021 0.731 18002
3342 1 6 . 1 1 44 44 CYS N N 406 120.004 120.004 121.789 -1.785 18002
3343 1 6 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.302 0.665 18002
3344 1 6 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.158 -0.100 18002
3345 1 6 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.646 0.794 18002
3346 1 6 . 1 1 44 44 CYS H H 406 8.470 8.470 7.900 0.570 18002
3347 1 6 . 1 1 45 45 TYR N N 407 122.704 122.704 125.483 -2.779 18002
3348 1 6 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.898 0.125 18002
3349 1 6 . 1 1 45 45 TYR CA C 407 56.983 56.983 55.463 1.520 18002
3350 1 6 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.285 1.289 18002
3351 1 6 . 1 1 45 45 TYR H H 407 10.013 10.013 7.320 2.693 18002
3352 1 6 . 1 1 46 46 LYS N N 408 121.897 121.897 122.442 -0.545 18002
3353 1 6 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.598 -0.252 18002
3354 1 6 . 1 1 46 46 LYS CA C 408 60.019 60.019 58.352 1.667 18002
3355 1 6 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.553 -0.841 18002
3356 1 6 . 1 1 46 46 LYS H H 408 9.734 9.734 8.930 0.804 18002
3357 1 6 . 1 1 47 47 SER N N 409 106.720 106.720 113.662 -6.942 18002
3358 1 6 . 1 1 47 47 SER HA H 409 4.776 4.776 4.761 0.015 18002
3359 1 6 . 1 1 47 47 SER CA C 409 57.180 57.180 56.713 0.467 18002
3360 1 6 . 1 1 47 47 SER CB C 409 65.870 65.870 65.401 0.469 18002
3361 1 6 . 1 1 47 47 SER H H 409 7.518 7.518 7.983 -0.465 18002
3362 1 6 . 1 1 48 48 LYS N N 410 122.302 122.302 121.591 0.711 18002
3363 1 6 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.251 0.983 18002
3364 1 6 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.100 0.199 18002
3365 1 6 . 1 1 48 48 LYS H H 410 8.195 8.195 8.592 -0.397 18002
3366 1 6 . 1 1 49 49 GLU N N 411 118.983 118.983 119.206 -0.223 18002
3367 1 6 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.044 0.738 18002
3368 1 6 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.523 1.012 18002
3369 1 6 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.785 -1.097 18002
3370 1 6 . 1 1 49 49 GLU H H 411 8.752 8.752 8.082 0.670 18002
3371 1 6 . 1 1 50 50 GLU N N 412 118.384 118.384 115.738 2.646 18002
3372 1 6 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.069 0.424 18002
3373 1 6 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.899 -1.110 18002
3374 1 6 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.904 1.101 18002
3375 1 6 . 1 1 50 50 GLU H H 412 7.234 7.234 8.020 -0.786 18002
3376 1 6 . 1 1 51 51 SER N N 413 114.767 114.767 112.611 2.156 18002
3377 1 6 . 1 1 51 51 SER CA C 413 59.764 59.764 60.527 -0.763 18002
3378 1 6 . 1 1 51 51 SER CB C 413 62.965 62.965 63.375 -0.410 18002
3379 1 6 . 1 1 51 51 SER H H 413 7.382 7.382 7.895 -0.513 18002
3380 1 6 . 1 1 52 52 SER N N 414 114.496 114.496 113.555 0.941 18002
3381 1 6 . 1 1 52 52 SER HA H 414 4.560 4.560 4.529 0.031 18002
3382 1 6 . 1 1 52 52 SER CA C 414 58.574 58.574 58.528 0.046 18002
3383 1 6 . 1 1 52 52 SER CB C 414 63.829 63.829 63.748 0.081 18002
3384 1 6 . 1 1 52 52 SER H H 414 7.682 7.682 8.107 -0.425 18002
3385 1 6 . 1 1 53 53 GLY N N 415 111.107 111.107 111.954 -0.847 18002
3386 1 6 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.285 -0.052 18002
3387 1 6 . 1 1 53 53 GLY H H 415 7.918 7.918 7.943 -0.025 18002
3388 1 6 . 1 1 54 54 THR N N 416 120.214 120.214 119.195 1.019 18002
3389 1 6 . 1 1 54 54 THR CB C 416 70.035 70.035 69.980 0.055 18002
3390 1 6 . 1 1 54 54 THR H H 416 8.622 8.622 7.762 0.860 18002
3391 1 6 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.305 0.170 18002
3392 1 6 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.244 -0.199 18002
3393 1 6 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.714 -0.136 18002
3394 1 6 . 1 1 56 56 ALA N N 418 125.591 125.591 126.745 -1.154 18002
3395 1 6 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.004 -0.048 18002
3396 1 6 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.081 0.453 18002
3397 1 6 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.367 -0.460 18002
3398 1 6 . 1 1 56 56 ALA H H 418 8.288 8.288 8.303 -0.015 18002
3399 1 6 . 1 1 57 57 HIS N N 419 108.119 108.119 115.327 -7.208 18002
3400 1 6 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.651 -0.029 18002
3401 1 6 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.299 -1.719 18002
3402 1 6 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.688 1.531 18002
3403 1 6 . 1 1 57 57 HIS H H 419 7.072 7.072 7.703 -0.631 18002
3404 1 6 . 1 1 58 58 GLN N N 420 123.083 123.083 122.200 0.883 18002
3405 1 6 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.494 0.661 18002
3406 1 6 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.044 0.460 18002
3407 1 6 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.062 2.428 18002
3408 1 6 . 1 1 58 58 GLN H H 420 8.669 8.669 7.883 0.786 18002
3409 1 6 . 1 1 59 59 MET N N 421 122.330 122.330 121.982 0.348 18002
3410 1 6 . 1 1 59 59 MET HA H 421 4.621 4.621 4.554 0.067 18002
3411 1 6 . 1 1 59 59 MET CA C 421 54.892 54.892 54.617 0.275 18002
3412 1 6 . 1 1 59 59 MET CB C 421 35.650 35.650 36.878 -1.228 18002
3413 1 6 . 1 1 59 59 MET H H 421 8.995 8.995 8.043 0.952 18002
3414 1 6 . 1 1 60 60 ASN N N 422 123.220 123.220 120.408 2.812 18002
3415 1 6 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.799 0.149 18002
3416 1 6 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.520 0.111 18002
3417 1 6 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.124 1.615 18002
3418 1 6 . 1 1 60 60 ASN H H 422 8.728 8.728 8.444 0.284 18002
3419 1 6 . 1 1 61 61 LEU N N 423 126.072 126.072 122.024 4.048 18002
3420 1 6 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.245 -0.129 18002
3421 1 6 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.514 1.099 18002
3422 1 6 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.722 0.735 18002
3423 1 6 . 1 1 61 61 LEU H H 423 8.942 8.942 8.248 0.694 18002
3424 1 6 . 1 1 62 62 ARG N N 424 121.977 121.977 119.770 2.207 18002
3425 1 6 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.091 0.281 18002
3426 1 6 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.008 2.026 18002
3427 1 6 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.023 -0.413 18002
3428 1 6 . 1 1 62 62 ARG H H 424 8.000 8.000 8.143 -0.143 18002
3429 1 6 . 1 1 63 63 GLY N N 425 114.852 114.852 112.327 2.525 18002
3430 1 6 . 1 1 63 63 GLY CA C 425 45.810 45.810 44.766 1.044 18002
3431 1 6 . 1 1 63 63 GLY H H 425 9.033 9.033 8.756 0.277 18002
3432 1 6 . 1 1 64 64 CYS N N 426 117.102 117.102 117.812 -0.710 18002
3433 1 6 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.499 0.400 18002
3434 1 6 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.721 0.039 18002
3435 1 6 . 1 1 64 64 CYS CB C 426 28.824 28.824 28.833 -0.009 18002
3436 1 6 . 1 1 64 64 CYS H H 426 8.248 8.248 7.843 0.405 18002
3437 1 6 . 1 1 65 65 GLU N N 427 119.501 119.501 120.764 -1.263 18002
3438 1 6 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.502 0.275 18002
3439 1 6 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.944 -0.553 18002
3440 1 6 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.638 0.300 18002
3441 1 6 . 1 1 65 65 GLU H H 427 8.449 8.449 8.528 -0.079 18002
3442 1 6 . 1 1 66 66 VAL N N 428 125.286 125.286 121.868 3.418 18002
3443 1 6 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.429 0.461 18002
3444 1 6 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.909 -0.157 18002
3445 1 6 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.939 0.036 18002
3446 1 6 . 1 1 66 66 VAL H H 428 8.624 8.624 8.390 0.234 18002
3447 1 6 . 1 1 67 67 THR N N 429 124.132 124.132 123.745 0.387 18002
3448 1 6 . 1 1 67 67 THR CA C 429 59.338 59.338 60.525 -1.187 18002
3449 1 6 . 1 1 67 67 THR CB C 429 72.021 72.021 70.573 1.448 18002
3450 1 6 . 1 1 67 67 THR H H 429 9.247 9.247 8.346 0.901 18002
3451 1 6 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.748 -0.099 18002
3452 1 6 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.402 0.336 18002
3453 1 6 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.695 0.873 18002
3454 1 6 . 1 1 69 69 ASP N N 431 122.066 122.066 121.830 0.236 18002
3455 1 6 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.940 -0.293 18002
3456 1 6 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.398 0.271 18002
3457 1 6 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.611 -1.506 18002
3458 1 6 . 1 1 69 69 ASP H H 431 8.250 8.250 8.490 -0.240 18002
3459 1 6 . 1 1 70 70 VAL N N 432 121.874 121.874 122.089 -0.215 18002
3460 1 6 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.764 -0.265 18002
3461 1 6 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.829 0.259 18002
3462 1 6 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.054 -0.022 18002
3463 1 6 . 1 1 70 70 VAL H H 432 8.305 8.305 8.098 0.207 18002
3464 1 6 . 1 1 71 71 ASN N N 433 124.366 124.366 126.251 -1.885 18002
3465 1 6 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.016 -0.334 18002
3466 1 6 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.170 0.591 18002
3467 1 6 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.736 0.542 18002
3468 1 6 . 1 1 71 71 ASN H H 433 8.637 8.637 8.557 0.080 18002
3469 1 6 . 1 1 72 72 ILE N N 434 126.786 126.786 124.177 2.609 18002
3470 1 6 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.810 -0.439 18002
3471 1 6 . 1 1 72 72 ILE CA C 434 64.518 64.518 62.633 1.885 18002
3472 1 6 . 1 1 72 72 ILE CB C 434 37.175 37.175 38.095 -0.920 18002
3473 1 6 . 1 1 72 72 ILE H H 434 8.943 8.943 8.771 0.172 18002
3474 1 6 . 1 1 73 73 SER N N 435 118.305 118.305 115.824 2.481 18002
3475 1 6 . 1 1 73 73 SER CA C 435 61.633 61.633 60.463 1.170 18002
3476 1 6 . 1 1 73 73 SER CB C 435 62.435 62.435 63.172 -0.737 18002
3477 1 6 . 1 1 73 73 SER H H 435 8.578 8.578 8.237 0.341 18002
3478 1 6 . 1 1 74 74 GLY N N 436 107.443 107.443 105.456 1.987 18002
3479 1 6 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.810 0.051 18002
3480 1 6 . 1 1 74 74 GLY H H 436 7.620 7.620 7.686 -0.066 18002
3481 1 6 . 1 1 75 75 GLN N N 437 116.895 116.895 116.833 0.062 18002
3482 1 6 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.910 -0.620 18002
3483 1 6 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.715 -0.014 18002
3484 1 6 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.867 0.878 18002
3485 1 6 . 1 1 75 75 GLN H H 437 7.798 7.798 7.841 -0.043 18002
3486 1 6 . 1 1 76 76 LYS N N 438 119.308 119.308 120.639 -1.331 18002
3487 1 6 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.484 -0.342 18002
3488 1 6 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.662 -0.619 18002
3489 1 6 . 1 1 76 76 LYS CB C 438 33.945 33.945 32.396 1.549 18002
3490 1 6 . 1 1 76 76 LYS H H 438 7.522 7.522 7.656 -0.134 18002
3491 1 6 . 1 1 77 77 PHE N N 439 125.905 125.905 124.402 1.503 18002
3492 1 6 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.459 -0.248 18002
3493 1 6 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.387 -1.748 18002
3494 1 6 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.376 0.553 18002
3495 1 6 . 1 1 77 77 PHE H H 439 8.461 8.461 8.473 -0.012 18002
3496 1 6 . 1 1 78 78 ASN N N 440 120.787 120.787 122.870 -2.083 18002
3497 1 6 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.122 -0.209 18002
3498 1 6 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.218 0.585 18002
3499 1 6 . 1 1 78 78 ASN H H 440 7.638 7.638 8.052 -0.414 18002
3500 1 6 . 1 1 79 79 ILE N N 441 123.421 123.421 122.803 0.618 18002
3501 1 6 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.152 0.019 18002
3502 1 6 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.907 1.660 18002
3503 1 6 . 1 1 79 79 ILE CB C 441 41.487 41.487 36.173 5.314 18002
3504 1 6 . 1 1 79 79 ILE H H 441 9.550 9.550 7.833 1.717 18002
3505 1 6 . 1 1 80 80 LYS N N 442 126.267 126.267 129.433 -3.166 18002
3506 1 6 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.066 0.396 18002
3507 1 6 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.797 1.585 18002
3508 1 6 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.728 1.259 18002
3509 1 6 . 1 1 80 80 LYS H H 442 8.703 8.703 8.087 0.616 18002
3510 1 6 . 1 1 81 81 LEU N N 443 125.194 125.194 127.010 -1.816 18002
3511 1 6 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.404 0.868 18002
3512 1 6 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.643 -0.294 18002
3513 1 6 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.194 2.510 18002
3514 1 6 . 1 1 81 81 LEU H H 443 9.223 9.223 7.794 1.429 18002
3515 1 6 . 1 1 82 82 LEU N N 444 122.753 122.753 127.200 -4.447 18002
3516 1 6 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.126 -0.112 18002
3517 1 6 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.213 0.705 18002
3518 1 6 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.594 -2.970 18002
3519 1 6 . 1 1 82 82 LEU H H 444 8.420 8.420 7.732 0.688 18002
3520 1 6 . 1 1 83 83 ILE N N 445 125.584 125.584 122.130 3.454 18002
3521 1 6 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.450 -0.165 18002
3522 1 6 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.887 -0.851 18002
3523 1 6 . 1 1 83 83 ILE H H 445 9.010 9.010 7.893 1.117 18002
3524 1 6 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.845 0.074 18002
3525 1 6 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.440 1.593 18002
3526 1 6 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.693 0.254 18002
3527 1 6 . 1 1 85 85 VAL N N 447 119.780 119.780 119.821 -0.041 18002
3528 1 6 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.546 -0.043 18002
3529 1 6 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.578 0.764 18002
3530 1 6 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.508 0.758 18002
3531 1 6 . 1 1 85 85 VAL H H 447 8.304 8.304 8.328 -0.024 18002
3532 1 6 . 1 1 86 86 ALA N N 448 125.178 125.178 121.836 3.342 18002
3533 1 6 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.193 -0.218 18002
3534 1 6 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.588 0.973 18002
3535 1 6 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.387 -0.399 18002
3536 1 6 . 1 1 86 86 ALA H H 448 8.526 8.526 8.469 0.057 18002
3537 1 6 . 1 1 87 87 GLU N N 449 114.625 114.625 118.428 -3.803 18002
3538 1 6 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.137 0.153 18002
3539 1 6 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.376 -0.645 18002
3540 1 6 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.926 -0.666 18002
3541 1 6 . 1 1 87 87 GLU H H 449 8.402 8.402 8.738 -0.336 18002
3542 1 6 . 1 1 88 88 GLY N N 450 109.432 109.432 106.218 3.214 18002
3543 1 6 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.840 0.997 18002
3544 1 6 . 1 1 88 88 GLY H H 450 7.711 7.711 7.819 -0.108 18002
3545 1 6 . 1 1 89 89 MET N N 451 121.382 121.382 120.383 0.999 18002
3546 1 6 . 1 1 89 89 MET HA H 451 5.076 5.076 4.985 0.091 18002
3547 1 6 . 1 1 89 89 MET CA C 451 53.860 53.860 54.604 -0.744 18002
3548 1 6 . 1 1 89 89 MET CB C 451 35.942 35.942 37.517 -1.575 18002
3549 1 6 . 1 1 89 89 MET H H 451 8.355 8.355 8.008 0.347 18002
3550 1 6 . 1 1 90 90 ASN N N 452 123.538 123.538 123.366 0.172 18002
3551 1 6 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.866 0.087 18002
3552 1 6 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.741 -0.993 18002
3553 1 6 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.966 1.676 18002
3554 1 6 . 1 1 90 90 ASN H H 452 9.338 9.338 8.888 0.450 18002
3555 1 6 . 1 1 91 91 GLU N N 453 125.978 125.978 123.939 2.039 18002
3556 1 6 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.214 1.130 18002
3557 1 6 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.367 -1.094 18002
3558 1 6 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.000 1.743 18002
3559 1 6 . 1 1 91 91 GLU H H 453 8.168 8.168 8.229 -0.061 18002
3560 1 6 . 1 1 92 92 ILE N N 454 126.776 126.776 124.882 1.894 18002
3561 1 6 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.380 0.186 18002
3562 1 6 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.753 0.295 18002
3563 1 6 . 1 1 92 92 ILE CB C 454 42.262 42.262 42.000 0.262 18002
3564 1 6 . 1 1 92 92 ILE H H 454 9.000 9.000 7.551 1.449 18002
3565 1 6 . 1 1 93 93 TRP N N 455 125.987 125.987 122.476 3.511 18002
3566 1 6 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.929 -0.337 18002
3567 1 6 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.835 -2.045 18002
3568 1 6 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.875 0.511 18002
3569 1 6 . 1 1 93 93 TRP H H 455 9.278 9.278 8.282 0.996 18002
3570 1 6 . 1 1 94 94 LEU N N 456 120.912 120.912 121.774 -0.862 18002
3571 1 6 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.135 0.227 18002
3572 1 6 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.567 -0.351 18002
3573 1 6 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.469 1.125 18002
3574 1 6 . 1 1 94 94 LEU H H 456 9.534 9.534 8.016 1.518 18002
3575 1 6 . 1 1 95 95 ARG N N 457 123.669 123.669 123.721 -0.052 18002
3576 1 6 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.889 0.382 18002
3577 1 6 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.942 -0.525 18002
3578 1 6 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.801 0.461 18002
3579 1 6 . 1 1 95 95 ARG H H 457 9.439 9.439 8.754 0.685 18002
3580 1 6 . 1 1 96 96 CYS N N 458 125.273 125.273 119.042 6.231 18002
3581 1 6 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.615 0.083 18002
3582 1 6 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.386 1.406 18002
3583 1 6 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.476 -1.073 18002
3584 1 6 . 1 1 96 96 CYS H H 458 8.652 8.652 8.108 0.544 18002
3585 1 6 . 1 1 97 97 ASP N N 459 119.661 119.661 118.132 1.529 18002
3586 1 6 . 1 1 97 97 ASP HA H 459 4.740 4.740 3.733 1.007 18002
3587 1 6 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.517 2.711 18002
3588 1 6 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.360 1.225 18002
3589 1 6 . 1 1 97 97 ASP H H 459 9.116 9.116 8.046 1.070 18002
3590 1 6 . 1 1 98 98 ASN N N 460 109.173 109.173 117.127 -7.954 18002
3591 1 6 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.844 -0.472 18002
3592 1 6 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.489 -0.475 18002
3593 1 6 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.628 0.183 18002
3594 1 6 . 1 1 98 98 ASN H H 460 7.054 7.054 7.169 -0.115 18002
3595 1 6 . 1 1 99 99 GLU N N 461 119.220 119.220 124.339 -5.119 18002
3596 1 6 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.532 -0.488 18002
3597 1 6 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.439 0.329 18002
3598 1 6 . 1 1 99 99 GLU H H 461 8.937 8.937 9.246 -0.309 18002
3599 1 6 . 1 1 100 100 LYS N N 462 120.647 120.647 118.116 2.531 18002
3600 1 6 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.913 0.732 18002
3601 1 6 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.191 1.345 18002
3602 1 6 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.895 0.333 18002
3603 1 6 . 1 1 100 100 LYS H H 462 8.033 8.033 8.335 -0.302 18002
3604 1 6 . 1 1 101 101 GLN N N 463 121.938 121.938 119.335 2.603 18002
3605 1 6 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.416 -0.016 18002
3606 1 6 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.754 0.641 18002
3607 1 6 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.419 3.795 18002
3608 1 6 . 1 1 101 101 GLN H H 463 8.372 8.372 7.903 0.469 18002
3609 1 6 . 1 1 102 102 TYR N N 464 117.422 117.422 120.516 -3.094 18002
3610 1 6 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.212 0.404 18002
3611 1 6 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.413 0.264 18002
3612 1 6 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.306 0.553 18002
3613 1 6 . 1 1 102 102 TYR H H 464 8.221 8.221 7.943 0.278 18002
3614 1 6 . 1 1 103 103 ALA N N 465 120.655 120.655 119.322 1.333 18002
3615 1 6 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.045 -0.330 18002
3616 1 6 . 1 1 103 103 ALA CA C 465 55.913 55.913 53.962 1.952 18002
3617 1 6 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.334 0.468 18002
3618 1 6 . 1 1 103 103 ALA H H 465 8.637 8.637 7.753 0.884 18002
3619 1 6 . 1 1 104 104 HIS N N 466 112.871 112.871 119.705 -6.834 18002
3620 1 6 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.351 -0.210 18002
3621 1 6 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.031 0.596 18002
3622 1 6 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.958 -1.100 18002
3623 1 6 . 1 1 104 104 HIS H H 466 7.852 7.852 7.789 0.063 18002
3624 1 6 . 1 1 105 105 TRP N N 467 121.317 121.317 118.229 3.088 18002
3625 1 6 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.626 -0.931 18002
3626 1 6 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.526 1.815 18002
3627 1 6 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.301 -1.796 18002
3628 1 6 . 1 1 105 105 TRP H H 467 8.668 8.668 7.953 0.715 18002
3629 1 6 . 1 1 106 106 MET N N 468 122.346 122.346 119.430 2.916 18002
3630 1 6 . 1 1 106 106 MET HA H 468 4.086 4.086 3.982 0.104 18002
3631 1 6 . 1 1 106 106 MET CA C 468 58.743 58.743 58.544 0.199 18002
3632 1 6 . 1 1 106 106 MET CB C 468 31.402 31.402 31.227 0.175 18002
3633 1 6 . 1 1 106 106 MET H H 468 9.790 9.790 8.048 1.742 18002
3634 1 6 . 1 1 107 107 ALA N N 469 119.758 119.758 121.236 -1.478 18002
3635 1 6 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.856 -0.151 18002
3636 1 6 . 1 1 107 107 ALA CA C 469 56.129 56.129 55.399 0.730 18002
3637 1 6 . 1 1 107 107 ALA CB C 469 20.405 20.405 17.845 2.560 18002
3638 1 6 . 1 1 107 107 ALA H H 469 7.702 7.702 7.550 0.152 18002
3639 1 6 . 1 1 108 108 ALA N N 470 119.233 119.233 121.685 -2.452 18002
3640 1 6 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.733 -0.187 18002
3641 1 6 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.229 0.592 18002
3642 1 6 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.869 -1.137 18002
3643 1 6 . 1 1 108 108 ALA H H 470 7.156 7.156 7.766 -0.610 18002
3644 1 6 . 1 1 109 109 CYS N N 471 116.736 116.736 116.454 0.282 18002
3645 1 6 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.277 -0.220 18002
3646 1 6 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.863 1.708 18002
3647 1 6 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.544 0.849 18002
3648 1 6 . 1 1 109 109 CYS H H 471 8.256 8.256 8.814 -0.558 18002
3649 1 6 . 1 1 110 110 ARG N N 472 118.644 118.644 119.998 -1.354 18002
3650 1 6 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.031 -0.297 18002
3651 1 6 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.348 0.856 18002
3652 1 6 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.555 -0.238 18002
3653 1 6 . 1 1 110 110 ARG H H 472 8.403 8.403 8.153 0.250 18002
3654 1 6 . 1 1 111 111 LEU N N 473 121.877 121.877 121.130 0.747 18002
3655 1 6 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.881 -0.081 18002
3656 1 6 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.910 1.945 18002
3657 1 6 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.562 -1.142 18002
3658 1 6 . 1 1 111 111 LEU H H 473 7.916 7.916 8.826 -0.910 18002
3659 1 6 . 1 1 112 112 ALA N N 474 122.765 122.765 120.391 2.374 18002
3660 1 6 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.998 0.482 18002
3661 1 6 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.490 0.771 18002
3662 1 6 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.992 1.883 18002
3663 1 6 . 1 1 112 112 ALA H H 474 8.393 8.393 8.657 -0.264 18002
3664 1 6 . 1 1 113 113 SER N N 475 113.613 113.613 112.005 1.608 18002
3665 1 6 . 1 1 113 113 SER HA H 475 4.782 4.782 4.261 0.521 18002
3666 1 6 . 1 1 113 113 SER CA C 475 61.090 61.090 60.321 0.769 18002
3667 1 6 . 1 1 113 113 SER CB C 475 63.612 63.612 63.256 0.356 18002
3668 1 6 . 1 1 113 113 SER H H 475 8.150 8.150 8.014 0.136 18002
3669 1 6 . 1 1 114 114 LYS N N 476 118.734 118.734 117.856 0.878 18002
3670 1 6 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.229 0.324 18002
3671 1 6 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.824 -1.680 18002
3672 1 6 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.430 0.161 18002
3673 1 6 . 1 1 114 114 LYS H H 476 7.239 7.239 8.057 -0.818 18002
3674 1 6 . 1 1 115 115 GLY N N 477 107.818 107.818 108.272 -0.454 18002
3675 1 6 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.723 0.263 18002
3676 1 6 . 1 1 115 115 GLY H H 477 8.401 8.401 7.890 0.511 18002
3677 1 6 . 1 1 116 116 LYS N N 478 120.938 120.938 122.008 -1.070 18002
3678 1 6 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.448 0.125 18002
3679 1 6 . 1 1 116 116 LYS CA C 478 54.847 54.847 55.171 -0.324 18002
3680 1 6 . 1 1 116 116 LYS CB C 478 35.321 35.321 33.769 1.552 18002
3681 1 6 . 1 1 116 116 LYS H H 478 8.142 8.142 7.817 0.325 18002
3682 1 6 . 1 1 117 117 THR N N 479 108.076 108.076 113.900 -5.824 18002
3683 1 6 . 1 1 117 117 THR HA H 479 4.671 4.671 4.247 0.424 18002
3684 1 6 . 1 1 117 117 THR CA C 479 59.191 59.191 61.234 -2.043 18002
3685 1 6 . 1 1 117 117 THR CB C 479 72.228 72.228 70.426 1.802 18002
3686 1 6 . 1 1 117 117 THR H H 479 7.926 7.926 8.011 -0.085 18002
3687 1 6 . 1 1 118 118 MET N N 480 116.403 116.403 118.579 -2.176 18002
3688 1 6 . 1 1 118 118 MET HA H 480 3.352 3.352 3.926 -0.574 18002
3689 1 6 . 1 1 118 118 MET CA C 480 57.947 57.947 55.565 2.382 18002
3690 1 6 . 1 1 118 118 MET CB C 480 33.920 33.920 31.978 1.942 18002
3691 1 6 . 1 1 118 118 MET H H 480 8.899 8.899 8.537 0.362 18002
3692 1 6 . 1 1 119 119 ALA N N 481 117.786 117.786 120.939 -3.153 18002
3693 1 6 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.035 0.049 18002
3694 1 6 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.153 -1.558 18002
3695 1 6 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.171 -0.109 18002
3696 1 6 . 1 1 119 119 ALA H H 481 7.645 7.645 8.217 -0.572 18002
3697 1 6 . 1 1 120 120 ASP N N 482 120.348 120.348 113.915 6.433 18002
3698 1 6 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.816 4.801 18002
3699 1 6 . 1 1 120 120 ASP H H 482 7.887 7.887 8.258 -0.371 18002
3700 1 6 . 1 1 121 121 SER HA H 483 4.223 4.223 4.141 0.082 18002
3701 1 6 . 1 1 121 121 SER CA C 483 61.455 61.455 61.587 -0.132 18002
3702 1 6 . 1 1 121 121 SER CB C 483 62.996 62.996 63.140 -0.144 18002
3703 1 6 . 1 1 122 122 SER N N 484 116.845 116.845 115.439 1.406 18002
3704 1 6 . 1 1 122 122 SER HA H 484 4.321 4.321 4.282 0.039 18002
3705 1 6 . 1 1 122 122 SER CA C 484 60.584 60.584 60.428 0.156 18002
3706 1 6 . 1 1 122 122 SER CB C 484 64.314 64.314 62.822 1.492 18002
3707 1 6 . 1 1 122 122 SER H H 484 8.875 8.875 8.251 0.624 18002
3708 1 6 . 1 1 123 123 TYR N N 485 124.153 124.153 121.569 2.584 18002
3709 1 6 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.083 -0.203 18002
3710 1 6 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.543 1.771 18002
3711 1 6 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.317 -0.576 18002
3712 1 6 . 1 1 123 123 TYR H H 485 8.018 8.018 8.475 -0.457 18002
3713 1 6 . 1 1 124 124 ASN N N 486 115.339 115.339 117.045 -1.706 18002
3714 1 6 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.568 -0.627 18002
3715 1 6 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.853 0.853 18002
3716 1 6 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.399 -0.343 18002
3717 1 6 . 1 1 124 124 ASN H H 486 8.665 8.665 7.939 0.726 18002
3718 1 6 . 1 1 125 125 LEU N N 487 119.454 119.454 120.474 -1.020 18002
3719 1 6 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.111 -0.173 18002
3720 1 6 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.697 -0.027 18002
3721 1 6 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.886 -0.318 18002
3722 1 6 . 1 1 125 125 LEU H H 487 7.105 7.105 7.535 -0.430 18002
3723 1 6 . 1 1 126 126 GLU N N 488 121.189 121.189 119.692 1.497 18002
3724 1 6 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.031 -0.001 18002
3725 1 6 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.229 -0.194 18002
3726 1 6 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.041 0.043 18002
3727 1 6 . 1 1 126 126 GLU H H 488 8.053 8.053 8.475 -0.422 18002
3728 1 6 . 1 1 127 127 VAL N N 489 119.073 119.073 116.491 2.582 18002
3729 1 6 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.728 -0.710 18002
3730 1 6 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.333 1.989 18002
3731 1 6 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.330 0.329 18002
3732 1 6 . 1 1 127 127 VAL H H 489 7.769 7.769 7.028 0.741 18002
3733 1 6 . 1 1 128 128 GLN N N 490 116.214 116.214 117.661 -1.447 18002
3734 1 6 . 1 1 128 128 GLN HA H 490 3.832 3.832 3.961 -0.129 18002
3735 1 6 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.530 0.226 18002
3736 1 6 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.808 0.304 18002
3737 1 6 . 1 1 128 128 GLN H H 490 7.542 7.542 7.832 -0.290 18002
3738 1 6 . 1 1 129 129 ASN N N 491 120.003 120.003 116.709 3.294 18002
3739 1 6 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.666 -0.247 18002
3740 1 6 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.758 0.402 18002
3741 1 6 . 1 1 129 129 ASN CB C 491 38.060 38.060 39.114 -1.054 18002
3742 1 6 . 1 1 129 129 ASN H H 491 8.582 8.582 7.522 1.060 18002
3743 1 6 . 1 1 130 130 ILE N N 492 122.365 122.365 121.345 1.020 18002
3744 1 6 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.190 2.563 18002
3745 1 6 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.707 1.439 18002
3746 1 6 . 1 1 130 130 ILE H H 492 8.186 8.186 7.431 0.755 18002
3747 1 6 . 1 1 131 131 LEU N N 493 119.597 119.597 119.935 -0.338 18002
3748 1 6 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.944 0.061 18002
3749 1 6 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.695 0.164 18002
3750 1 6 . 1 1 131 131 LEU CB C 493 41.536 41.536 40.009 1.527 18002
3751 1 6 . 1 1 131 131 LEU H H 493 8.224 8.224 7.768 0.456 18002
3752 1 6 . 1 1 132 132 SER N N 494 114.884 114.884 115.086 -0.202 18002
3753 1 6 . 1 1 132 132 SER HA H 494 4.430 4.430 4.095 0.335 18002
3754 1 6 . 1 1 132 132 SER CA C 494 62.072 62.072 62.026 0.046 18002
3755 1 6 . 1 1 132 132 SER CB C 494 62.703 62.703 62.402 0.301 18002
3756 1 6 . 1 1 132 132 SER H H 494 8.464 8.464 7.803 0.661 18002
3757 1 6 . 1 1 133 133 PHE N N 495 123.047 123.047 120.056 2.991 18002
3758 1 6 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.270 0.107 18002
3759 1 6 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.176 -0.263 18002
3760 1 6 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.717 0.333 18002
3761 1 6 . 1 1 133 133 PHE H H 495 7.915 7.915 8.002 -0.087 18002
3762 1 6 . 1 1 134 134 LEU N N 496 119.311 119.311 119.235 0.076 18002
3763 1 6 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.019 -0.114 18002
3764 1 6 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.951 -0.350 18002
3765 1 6 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.492 0.409 18002
3766 1 6 . 1 1 134 134 LEU H H 496 8.386 8.386 7.593 0.793 18002
3767 1 6 . 1 1 135 135 LYS N N 497 117.550 117.550 119.476 -1.926 18002
3768 1 6 . 1 1 135 135 LYS HA H 497 3.940 3.940 3.985 -0.045 18002
3769 1 6 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.968 -0.693 18002
3770 1 6 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.250 0.244 18002
3771 1 6 . 1 1 135 135 LYS H H 497 7.670 7.670 8.797 -1.127 18002
3772 1 6 . 1 1 136 136 MET N N 498 116.106 116.106 112.070 4.036 18002
3773 1 6 . 1 1 136 136 MET HA H 498 4.354 4.354 4.851 -0.497 18002
3774 1 6 . 1 1 136 136 MET CA C 498 55.994 55.994 56.427 -0.433 18002
3775 1 6 . 1 1 136 136 MET CB C 498 32.772 32.772 33.115 -0.343 18002
3776 1 6 . 1 1 136 136 MET H H 498 7.421 7.421 7.481 -0.060 18002
3777 1 6 . 1 1 137 137 GLN N N 499 118.651 118.651 120.215 -1.564 18002
3778 1 6 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.840 0.344 18002
3779 1 6 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.609 -3.301 18002
3780 1 6 . 1 1 137 137 GLN H H 499 7.617 7.617 8.166 -0.549 18002
3781 1 7 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.654 -0.529 18002
3782 1 7 . 1 1 3 3 HIS CA C 365 55.015 55.015 55.753 -0.738 18002
3783 1 7 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.315 1.614 18002
3784 1 7 . 1 1 4 4 MET N N 366 120.431 120.431 123.882 -3.451 18002
3785 1 7 . 1 1 4 4 MET HA H 366 4.345 4.345 4.624 -0.279 18002
3786 1 7 . 1 1 4 4 MET CA C 366 55.337 55.337 55.421 -0.084 18002
3787 1 7 . 1 1 4 4 MET CB C 366 32.668 32.668 33.671 -1.003 18002
3788 1 7 . 1 1 4 4 MET H H 366 8.373 8.373 8.359 0.014 18002
3789 1 7 . 1 1 5 5 GLY N N 367 109.318 109.318 108.633 0.685 18002
3790 1 7 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.848 -0.391 18002
3791 1 7 . 1 1 5 5 GLY H H 367 8.224 8.224 8.837 -0.613 18002
3792 1 7 . 1 1 6 6 ASP N N 368 120.307 120.307 119.023 1.284 18002
3793 1 7 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.714 -0.114 18002
3794 1 7 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.249 0.264 18002
3795 1 7 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.611 -0.285 18002
3796 1 7 . 1 1 6 6 ASP H H 368 8.199 8.199 7.915 0.284 18002
3797 1 7 . 1 1 7 7 ILE N N 369 120.668 120.668 123.534 -2.866 18002
3798 1 7 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.150 0.068 18002
3799 1 7 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.526 0.058 18002
3800 1 7 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.507 0.261 18002
3801 1 7 . 1 1 7 7 ILE H H 369 8.138 8.138 8.139 -0.001 18002
3802 1 7 . 1 1 8 8 THR N N 370 117.564 117.564 114.673 2.891 18002
3803 1 7 . 1 1 8 8 THR HA H 370 4.322 4.322 4.020 0.302 18002
3804 1 7 . 1 1 8 8 THR CA C 370 62.332 62.332 63.012 -0.680 18002
3805 1 7 . 1 1 8 8 THR CB C 370 69.946 69.946 68.320 1.626 18002
3806 1 7 . 1 1 8 8 THR H H 370 8.230 8.230 8.077 0.153 18002
3807 1 7 . 1 1 9 9 SER N N 371 118.467 118.467 117.546 0.921 18002
3808 1 7 . 1 1 9 9 SER HA H 371 4.445 4.445 4.593 -0.148 18002
3809 1 7 . 1 1 9 9 SER CA C 371 58.274 58.274 56.609 1.665 18002
3810 1 7 . 1 1 9 9 SER CB C 371 63.996 63.996 63.551 0.445 18002
3811 1 7 . 1 1 9 9 SER H H 371 8.158 8.158 8.038 0.120 18002
3812 1 7 . 1 1 10 10 ILE N N 372 123.959 123.959 120.565 3.394 18002
3813 1 7 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.012 -4.296 18002
3814 1 7 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.008 2.911 18002
3815 1 7 . 1 1 10 10 ILE H H 372 8.112 8.112 8.052 0.060 18002
3816 1 7 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.575 -0.223 18002
3817 1 7 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.602 1.579 18002
3818 1 7 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.525 1.182 18002
3819 1 7 . 1 1 12 12 GLU N N 374 119.349 119.349 123.029 -3.680 18002
3820 1 7 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.454 0.333 18002
3821 1 7 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.416 -0.099 18002
3822 1 7 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.442 3.149 18002
3823 1 7 . 1 1 12 12 GLU H H 374 8.017 8.017 8.380 -0.363 18002
3824 1 7 . 1 1 13 13 LEU N N 375 122.288 122.288 128.028 -5.740 18002
3825 1 7 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.588 -0.110 18002
3826 1 7 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.107 -1.177 18002
3827 1 7 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.829 0.827 18002
3828 1 7 . 1 1 13 13 LEU H H 375 8.036 8.036 8.406 -0.370 18002
3829 1 7 . 1 1 14 14 ALA N N 376 125.461 125.461 126.368 -0.907 18002
3830 1 7 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.127 0.119 18002
3831 1 7 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.470 0.275 18002
3832 1 7 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.063 -0.477 18002
3833 1 7 . 1 1 14 14 ALA H H 376 8.181 8.181 8.068 0.113 18002
3834 1 7 . 1 1 15 15 ASP N N 377 122.242 122.242 119.387 2.855 18002
3835 1 7 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.791 -0.472 18002
3836 1 7 . 1 1 15 15 ASP CA C 377 53.752 53.752 54.023 -0.271 18002
3837 1 7 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.487 2.152 18002
3838 1 7 . 1 1 15 15 ASP H H 377 8.326 8.326 8.819 -0.493 18002
3839 1 7 . 1 1 16 16 TYR N N 378 118.961 118.961 119.238 -0.277 18002
3840 1 7 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.923 0.468 18002
3841 1 7 . 1 1 16 16 TYR CA C 378 59.581 59.581 59.139 0.442 18002
3842 1 7 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.424 -0.401 18002
3843 1 7 . 1 1 16 16 TYR H H 378 8.869 8.869 8.771 0.098 18002
3844 1 7 . 1 1 17 17 ILE N N 379 125.214 125.214 120.512 4.702 18002
3845 1 7 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.351 -0.021 18002
3846 1 7 . 1 1 17 17 ILE CA C 379 58.732 58.732 60.300 -1.568 18002
3847 1 7 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.920 -0.944 18002
3848 1 7 . 1 1 17 17 ILE H H 379 8.608 8.608 8.249 0.359 18002
3849 1 7 . 1 1 18 18 LYS N N 380 122.917 122.917 125.945 -3.028 18002
3850 1 7 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.031 0.081 18002
3851 1 7 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.854 0.982 18002
3852 1 7 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.056 -0.031 18002
3853 1 7 . 1 1 18 18 LYS H H 380 7.424 7.424 8.478 -1.054 18002
3854 1 7 . 1 1 19 19 VAL N N 381 122.839 122.839 121.882 0.957 18002
3855 1 7 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.347 0.916 18002
3856 1 7 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.978 1.538 18002
3857 1 7 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.047 0.101 18002
3858 1 7 . 1 1 19 19 VAL H H 381 9.223 9.223 8.015 1.208 18002
3859 1 7 . 1 1 20 20 PHE N N 382 129.509 129.509 123.386 6.123 18002
3860 1 7 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.926 -0.083 18002
3861 1 7 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.191 0.313 18002
3862 1 7 . 1 1 20 20 PHE CB C 382 42.862 42.862 39.728 3.134 18002
3863 1 7 . 1 1 20 20 PHE H H 382 9.451 9.451 8.445 1.006 18002
3864 1 7 . 1 1 21 21 LYS N N 383 126.417 126.417 126.181 0.236 18002
3865 1 7 . 1 1 21 21 LYS CA C 383 52.841 52.841 53.918 -1.077 18002
3866 1 7 . 1 1 21 21 LYS CB C 383 33.219 33.219 31.804 1.415 18002
3867 1 7 . 1 1 21 21 LYS H H 383 7.582 7.582 8.448 -0.866 18002
3868 1 7 . 1 1 22 22 PRO CA C 384 63.697 63.697 64.697 -1.000 18002
3869 1 7 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.206 -0.238 18002
3870 1 7 . 1 1 23 23 LYS N N 385 118.026 118.026 118.180 -0.154 18002
3871 1 7 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.561 -0.346 18002
3872 1 7 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.407 -0.062 18002
3873 1 7 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.951 1.082 18002
3874 1 7 . 1 1 23 23 LYS H H 385 8.138 8.138 8.273 -0.135 18002
3875 1 7 . 1 1 24 24 LYS N N 386 120.816 120.816 123.530 -2.714 18002
3876 1 7 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.190 -0.004 18002
3877 1 7 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.437 -0.575 18002
3878 1 7 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.515 0.312 18002
3879 1 7 . 1 1 24 24 LYS H H 386 7.727 7.727 8.314 -0.587 18002
3880 1 7 . 1 1 25 25 LEU N N 387 121.214 121.214 119.780 1.434 18002
3881 1 7 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.410 -0.242 18002
3882 1 7 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.732 -0.224 18002
3883 1 7 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.768 -1.126 18002
3884 1 7 . 1 1 25 25 LEU H H 387 8.241 8.241 8.329 -0.088 18002
3885 1 7 . 1 1 26 26 THR N N 388 112.798 112.798 110.121 2.677 18002
3886 1 7 . 1 1 26 26 THR HA H 388 4.313 4.313 4.446 -0.133 18002
3887 1 7 . 1 1 26 26 THR CA C 388 61.795 61.795 62.746 -0.951 18002
3888 1 7 . 1 1 26 26 THR CB C 388 69.875 69.875 69.696 0.179 18002
3889 1 7 . 1 1 26 26 THR H H 388 7.700 7.700 7.974 -0.274 18002
3890 1 7 . 1 1 27 27 LEU N N 389 124.091 124.091 115.978 8.113 18002
3891 1 7 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.773 -0.419 18002
3892 1 7 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.793 0.740 18002
3893 1 7 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.214 0.084 18002
3894 1 7 . 1 1 27 27 LEU H H 389 8.260 8.260 7.384 0.876 18002
3895 1 7 . 1 1 28 28 LYS N N 390 121.153 121.153 118.896 2.257 18002
3896 1 7 . 1 1 28 28 LYS HA H 390 4.320 4.320 3.877 0.443 18002
3897 1 7 . 1 1 28 28 LYS CA C 390 56.211 56.211 58.396 -2.185 18002
3898 1 7 . 1 1 28 28 LYS CB C 390 33.675 33.675 30.727 2.948 18002
3899 1 7 . 1 1 28 28 LYS H H 390 8.202 8.202 8.564 -0.362 18002
3900 1 7 . 1 1 29 29 GLY N N 391 107.270 107.270 109.747 -2.477 18002
3901 1 7 . 1 1 29 29 GLY CA C 391 44.875 44.875 46.770 -1.895 18002
3902 1 7 . 1 1 29 29 GLY H H 391 7.876 7.876 8.547 -0.671 18002
3903 1 7 . 1 1 30 30 TYR N N 392 118.471 118.471 127.296 -8.825 18002
3904 1 7 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.347 0.099 18002
3905 1 7 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.885 -0.838 18002
3906 1 7 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.209 2.616 18002
3907 1 7 . 1 1 30 30 TYR H H 392 8.183 8.183 8.244 -0.061 18002
3908 1 7 . 1 1 31 31 LYS N N 393 122.833 122.833 122.044 0.789 18002
3909 1 7 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.626 -0.111 18002
3910 1 7 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.223 0.951 18002
3911 1 7 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.287 1.433 18002
3912 1 7 . 1 1 31 31 LYS H H 393 8.731 8.731 7.872 0.859 18002
3913 1 7 . 1 1 32 32 GLN N N 394 124.759 124.759 118.495 6.264 18002
3914 1 7 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.902 -0.224 18002
3915 1 7 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.461 2.146 18002
3916 1 7 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.927 0.121 18002
3917 1 7 . 1 1 32 32 GLN H H 394 8.776 8.776 8.129 0.647 18002
3918 1 7 . 1 1 33 33 TYR N N 395 125.112 125.112 122.585 2.527 18002
3919 1 7 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.294 0.780 18002
3920 1 7 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.254 0.910 18002
3921 1 7 . 1 1 33 33 TYR CB C 395 42.672 42.672 39.359 3.313 18002
3922 1 7 . 1 1 33 33 TYR H H 395 8.774 8.774 9.054 -0.280 18002
3923 1 7 . 1 1 34 34 TRP N N 396 122.638 122.638 125.622 -2.984 18002
3924 1 7 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.427 -0.745 18002
3925 1 7 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.581 2.637 18002
3926 1 7 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.348 1.156 18002
3927 1 7 . 1 1 34 34 TRP H H 396 8.975 8.975 7.312 1.663 18002
3928 1 7 . 1 1 35 35 CYS N N 397 127.146 127.146 122.454 4.692 18002
3929 1 7 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.231 1.136 18002
3930 1 7 . 1 1 35 35 CYS CB C 397 31.706 31.706 31.059 0.647 18002
3931 1 7 . 1 1 35 35 CYS H H 397 8.804 8.804 8.564 0.240 18002
3932 1 7 . 1 1 36 36 THR N N 398 110.578 110.578 113.387 -2.809 18002
3933 1 7 . 1 1 36 36 THR HA H 398 5.358 5.358 4.982 0.376 18002
3934 1 7 . 1 1 36 36 THR CA C 398 58.704 58.704 61.328 -2.624 18002
3935 1 7 . 1 1 36 36 THR CB C 398 71.833 71.833 71.191 0.642 18002
3936 1 7 . 1 1 36 36 THR H H 398 9.090 9.090 8.124 0.966 18002
3937 1 7 . 1 1 37 37 PHE N N 399 127.322 127.322 128.050 -0.728 18002
3938 1 7 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.588 0.365 18002
3939 1 7 . 1 1 37 37 PHE CA C 399 56.246 56.246 56.569 -0.323 18002
3940 1 7 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.026 3.159 18002
3941 1 7 . 1 1 37 37 PHE H H 399 8.846 8.846 8.304 0.542 18002
3942 1 7 . 1 1 38 38 LYS N N 400 125.391 125.391 124.673 0.718 18002
3943 1 7 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.970 -0.443 18002
3944 1 7 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.155 1.822 18002
3945 1 7 . 1 1 38 38 LYS CB C 400 35.915 35.915 34.367 1.548 18002
3946 1 7 . 1 1 38 38 LYS H H 400 8.252 8.252 8.000 0.252 18002
3947 1 7 . 1 1 39 39 ASP N N 401 125.083 125.083 118.320 6.763 18002
3948 1 7 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.227 -0.149 18002
3949 1 7 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.844 -0.361 18002
3950 1 7 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.092 -0.570 18002
3951 1 7 . 1 1 39 39 ASP H H 401 9.408 9.408 8.854 0.554 18002
3952 1 7 . 1 1 40 40 THR N N 402 112.024 112.024 114.240 -2.216 18002
3953 1 7 . 1 1 40 40 THR HA H 402 4.767 4.767 4.650 0.117 18002
3954 1 7 . 1 1 40 40 THR CA C 402 60.811 60.811 61.115 -0.305 18002
3955 1 7 . 1 1 40 40 THR CB C 402 68.823 68.823 69.568 -0.745 18002
3956 1 7 . 1 1 40 40 THR H H 402 8.224 8.224 8.202 0.022 18002
3957 1 7 . 1 1 41 41 SER N N 403 116.142 116.142 114.719 1.423 18002
3958 1 7 . 1 1 41 41 SER HA H 403 5.428 5.428 4.643 0.785 18002
3959 1 7 . 1 1 41 41 SER CA C 403 58.297 58.297 57.177 1.120 18002
3960 1 7 . 1 1 41 41 SER CB C 403 66.409 66.409 66.555 -0.145 18002
3961 1 7 . 1 1 41 41 SER H H 403 8.197 8.197 8.522 -0.325 18002
3962 1 7 . 1 1 42 42 ILE N N 404 122.292 122.292 121.508 0.784 18002
3963 1 7 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.677 0.252 18002
3964 1 7 . 1 1 42 42 ILE CA C 404 59.804 59.804 59.049 0.755 18002
3965 1 7 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.441 1.979 18002
3966 1 7 . 1 1 42 42 ILE H H 404 8.411 8.411 8.009 0.402 18002
3967 1 7 . 1 1 43 43 SER N N 405 122.244 122.244 116.926 5.318 18002
3968 1 7 . 1 1 43 43 SER HA H 405 4.966 4.966 4.842 0.124 18002
3969 1 7 . 1 1 43 43 SER CA C 405 57.735 57.735 57.820 -0.085 18002
3970 1 7 . 1 1 43 43 SER CB C 405 65.388 65.388 65.814 -0.425 18002
3971 1 7 . 1 1 43 43 SER H H 405 8.752 8.752 8.121 0.631 18002
3972 1 7 . 1 1 44 44 CYS N N 406 120.004 120.004 122.352 -2.348 18002
3973 1 7 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.813 0.154 18002
3974 1 7 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.414 -1.357 18002
3975 1 7 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.156 0.284 18002
3976 1 7 . 1 1 44 44 CYS H H 406 8.470 8.470 8.627 -0.157 18002
3977 1 7 . 1 1 45 45 TYR N N 407 122.704 122.704 127.675 -4.971 18002
3978 1 7 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.820 0.203 18002
3979 1 7 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.465 -0.482 18002
3980 1 7 . 1 1 45 45 TYR CB C 407 41.574 41.574 42.098 -0.524 18002
3981 1 7 . 1 1 45 45 TYR H H 407 10.013 10.013 8.867 1.146 18002
3982 1 7 . 1 1 46 46 LYS N N 408 121.897 121.897 124.378 -2.481 18002
3983 1 7 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.197 0.149 18002
3984 1 7 . 1 1 46 46 LYS CA C 408 60.019 60.019 55.846 4.173 18002
3985 1 7 . 1 1 46 46 LYS CB C 408 32.712 32.712 32.872 -0.160 18002
3986 1 7 . 1 1 46 46 LYS H H 408 9.734 9.734 8.825 0.909 18002
3987 1 7 . 1 1 47 47 SER N N 409 106.720 106.720 113.172 -6.452 18002
3988 1 7 . 1 1 47 47 SER HA H 409 4.776 4.776 5.013 -0.237 18002
3989 1 7 . 1 1 47 47 SER CA C 409 57.180 57.180 56.815 0.365 18002
3990 1 7 . 1 1 47 47 SER CB C 409 65.870 65.870 65.456 0.414 18002
3991 1 7 . 1 1 47 47 SER H H 409 7.518 7.518 7.911 -0.393 18002
3992 1 7 . 1 1 48 48 LYS N N 410 122.302 122.302 119.562 2.740 18002
3993 1 7 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.550 1.684 18002
3994 1 7 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.200 1.099 18002
3995 1 7 . 1 1 48 48 LYS H H 410 8.195 8.195 8.744 -0.549 18002
3996 1 7 . 1 1 49 49 GLU N N 411 118.983 118.983 120.376 -1.393 18002
3997 1 7 . 1 1 49 49 GLU HA H 411 4.782 4.782 3.920 0.862 18002
3998 1 7 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.959 0.576 18002
3999 1 7 . 1 1 49 49 GLU CB C 411 28.688 28.688 28.636 0.052 18002
4000 1 7 . 1 1 49 49 GLU H H 411 8.752 8.752 7.747 1.005 18002
4001 1 7 . 1 1 50 50 GLU N N 412 118.384 118.384 118.200 0.184 18002
4002 1 7 . 1 1 50 50 GLU HA H 412 4.493 4.493 3.782 0.711 18002
4003 1 7 . 1 1 50 50 GLU CA C 412 55.789 55.789 58.235 -2.446 18002
4004 1 7 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.714 1.291 18002
4005 1 7 . 1 1 50 50 GLU H H 412 7.234 7.234 7.289 -0.055 18002
4006 1 7 . 1 1 51 51 SER N N 413 114.767 114.767 114.798 -0.031 18002
4007 1 7 . 1 1 51 51 SER CA C 413 59.764 59.764 60.925 -1.161 18002
4008 1 7 . 1 1 51 51 SER CB C 413 62.965 62.965 63.476 -0.511 18002
4009 1 7 . 1 1 51 51 SER H H 413 7.382 7.382 7.923 -0.541 18002
4010 1 7 . 1 1 52 52 SER N N 414 114.496 114.496 113.321 1.175 18002
4011 1 7 . 1 1 52 52 SER HA H 414 4.560 4.560 4.650 -0.090 18002
4012 1 7 . 1 1 52 52 SER CA C 414 58.574 58.574 58.101 0.473 18002
4013 1 7 . 1 1 52 52 SER CB C 414 63.829 63.829 63.983 -0.154 18002
4014 1 7 . 1 1 52 52 SER H H 414 7.682 7.682 7.685 -0.003 18002
4015 1 7 . 1 1 53 53 GLY N N 415 111.107 111.107 110.876 0.231 18002
4016 1 7 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.894 -0.661 18002
4017 1 7 . 1 1 53 53 GLY H H 415 7.918 7.918 8.006 -0.088 18002
4018 1 7 . 1 1 54 54 THR N N 416 120.214 120.214 115.521 4.693 18002
4019 1 7 . 1 1 54 54 THR CB C 416 70.035 70.035 70.813 -0.778 18002
4020 1 7 . 1 1 54 54 THR H H 416 8.622 8.622 8.327 0.295 18002
4021 1 7 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.629 0.846 18002
4022 1 7 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.216 0.829 18002
4023 1 7 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.905 -1.327 18002
4024 1 7 . 1 1 56 56 ALA N N 418 125.591 125.591 123.332 2.259 18002
4025 1 7 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.073 -0.117 18002
4026 1 7 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.144 1.391 18002
4027 1 7 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.662 -0.755 18002
4028 1 7 . 1 1 56 56 ALA H H 418 8.288 8.288 7.888 0.400 18002
4029 1 7 . 1 1 57 57 HIS N N 419 108.119 108.119 114.592 -6.473 18002
4030 1 7 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.737 -0.115 18002
4031 1 7 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.211 -1.631 18002
4032 1 7 . 1 1 57 57 HIS CB C 419 34.219 34.219 33.956 0.263 18002
4033 1 7 . 1 1 57 57 HIS H H 419 7.072 7.072 7.605 -0.533 18002
4034 1 7 . 1 1 58 58 GLN N N 420 123.083 123.083 120.782 2.301 18002
4035 1 7 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.873 0.282 18002
4036 1 7 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.832 0.672 18002
4037 1 7 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.900 1.590 18002
4038 1 7 . 1 1 58 58 GLN H H 420 8.669 8.669 8.403 0.266 18002
4039 1 7 . 1 1 59 59 MET N N 421 122.330 122.330 119.186 3.144 18002
4040 1 7 . 1 1 59 59 MET HA H 421 4.621 4.621 4.809 -0.188 18002
4041 1 7 . 1 1 59 59 MET CA C 421 54.892 54.892 54.744 0.148 18002
4042 1 7 . 1 1 59 59 MET CB C 421 35.650 35.650 36.523 -0.873 18002
4043 1 7 . 1 1 59 59 MET H H 421 8.995 8.995 8.126 0.869 18002
4044 1 7 . 1 1 60 60 ASN N N 422 123.220 123.220 120.034 3.186 18002
4045 1 7 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.864 0.084 18002
4046 1 7 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.551 0.080 18002
4047 1 7 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.555 0.184 18002
4048 1 7 . 1 1 60 60 ASN H H 422 8.728 8.728 8.706 0.022 18002
4049 1 7 . 1 1 61 61 LEU N N 423 126.072 126.072 125.029 1.043 18002
4050 1 7 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.315 -0.199 18002
4051 1 7 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.996 1.617 18002
4052 1 7 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.475 0.982 18002
4053 1 7 . 1 1 61 61 LEU H H 423 8.942 8.942 8.339 0.603 18002
4054 1 7 . 1 1 62 62 ARG N N 424 121.977 121.977 117.198 4.779 18002
4055 1 7 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.962 0.410 18002
4056 1 7 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.625 2.409 18002
4057 1 7 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.036 -0.426 18002
4058 1 7 . 1 1 62 62 ARG H H 424 8.000 8.000 7.739 0.261 18002
4059 1 7 . 1 1 63 63 GLY N N 425 114.852 114.852 109.215 5.637 18002
4060 1 7 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.544 0.266 18002
4061 1 7 . 1 1 63 63 GLY H H 425 9.033 9.033 8.738 0.295 18002
4062 1 7 . 1 1 64 64 CYS N N 426 117.102 117.102 116.823 0.279 18002
4063 1 7 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.614 0.285 18002
4064 1 7 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.390 1.370 18002
4065 1 7 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.364 -0.540 18002
4066 1 7 . 1 1 64 64 CYS H H 426 8.248 8.248 7.687 0.561 18002
4067 1 7 . 1 1 65 65 GLU N N 427 119.501 119.501 122.015 -2.514 18002
4068 1 7 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.440 0.337 18002
4069 1 7 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.830 -0.439 18002
4070 1 7 . 1 1 65 65 GLU CB C 427 31.938 31.938 30.934 1.004 18002
4071 1 7 . 1 1 65 65 GLU H H 427 8.449 8.449 9.019 -0.570 18002
4072 1 7 . 1 1 66 66 VAL N N 428 125.286 125.286 127.040 -1.754 18002
4073 1 7 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.429 0.461 18002
4074 1 7 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.128 -0.376 18002
4075 1 7 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.403 -0.428 18002
4076 1 7 . 1 1 66 66 VAL H H 428 8.624 8.624 8.563 0.061 18002
4077 1 7 . 1 1 67 67 THR N N 429 124.132 124.132 124.695 -0.563 18002
4078 1 7 . 1 1 67 67 THR CA C 429 59.338 59.338 60.559 -1.221 18002
4079 1 7 . 1 1 67 67 THR CB C 429 72.021 72.021 69.775 2.246 18002
4080 1 7 . 1 1 67 67 THR H H 429 9.247 9.247 8.393 0.854 18002
4081 1 7 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.732 -0.083 18002
4082 1 7 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.435 0.303 18002
4083 1 7 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.308 1.260 18002
4084 1 7 . 1 1 69 69 ASP N N 431 122.066 122.066 124.207 -2.141 18002
4085 1 7 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.899 -0.252 18002
4086 1 7 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.456 0.213 18002
4087 1 7 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.086 0.019 18002
4088 1 7 . 1 1 69 69 ASP H H 431 8.250 8.250 8.500 -0.250 18002
4089 1 7 . 1 1 70 70 VAL N N 432 121.874 121.874 122.394 -0.520 18002
4090 1 7 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.473 0.026 18002
4091 1 7 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.243 -0.155 18002
4092 1 7 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.325 1.707 18002
4093 1 7 . 1 1 70 70 VAL H H 432 8.305 8.305 8.059 0.246 18002
4094 1 7 . 1 1 71 71 ASN N N 433 124.366 124.366 128.057 -3.691 18002
4095 1 7 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.960 -0.278 18002
4096 1 7 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.089 0.672 18002
4097 1 7 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.790 1.489 18002
4098 1 7 . 1 1 71 71 ASN H H 433 8.637 8.637 8.335 0.302 18002
4099 1 7 . 1 1 72 72 ILE N N 434 126.786 126.786 120.054 6.732 18002
4100 1 7 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.722 -0.351 18002
4101 1 7 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.518 1.000 18002
4102 1 7 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.774 -0.599 18002
4103 1 7 . 1 1 72 72 ILE H H 434 8.943 8.943 8.168 0.775 18002
4104 1 7 . 1 1 73 73 SER N N 435 118.305 118.305 118.076 0.229 18002
4105 1 7 . 1 1 73 73 SER CA C 435 61.633 61.633 60.748 0.885 18002
4106 1 7 . 1 1 73 73 SER CB C 435 62.435 62.435 62.781 -0.346 18002
4107 1 7 . 1 1 73 73 SER H H 435 8.578 8.578 8.308 0.270 18002
4108 1 7 . 1 1 74 74 GLY N N 436 107.443 107.443 106.217 1.226 18002
4109 1 7 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.714 0.147 18002
4110 1 7 . 1 1 74 74 GLY H H 436 7.620 7.620 7.453 0.167 18002
4111 1 7 . 1 1 75 75 GLN N N 437 116.895 116.895 117.519 -0.624 18002
4112 1 7 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.569 -0.279 18002
4113 1 7 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.439 0.262 18002
4114 1 7 . 1 1 75 75 GLN CB C 437 26.745 26.745 26.018 0.727 18002
4115 1 7 . 1 1 75 75 GLN H H 437 7.798 7.798 7.796 0.002 18002
4116 1 7 . 1 1 76 76 LYS N N 438 119.308 119.308 119.316 -0.008 18002
4117 1 7 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.297 -0.155 18002
4118 1 7 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.007 0.036 18002
4119 1 7 . 1 1 76 76 LYS CB C 438 33.945 33.945 34.158 -0.213 18002
4120 1 7 . 1 1 76 76 LYS H H 438 7.522 7.522 7.477 0.045 18002
4121 1 7 . 1 1 77 77 PHE N N 439 125.905 125.905 122.510 3.395 18002
4122 1 7 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.181 0.030 18002
4123 1 7 . 1 1 77 77 PHE CA C 439 55.639 55.639 55.831 -0.192 18002
4124 1 7 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.759 0.170 18002
4125 1 7 . 1 1 77 77 PHE H H 439 8.461 8.461 7.979 0.482 18002
4126 1 7 . 1 1 78 78 ASN N N 440 120.787 120.787 121.839 -1.052 18002
4127 1 7 . 1 1 78 78 ASN CA C 440 51.913 51.913 51.902 0.011 18002
4128 1 7 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.029 -0.226 18002
4129 1 7 . 1 1 78 78 ASN H H 440 7.638 7.638 8.357 -0.719 18002
4130 1 7 . 1 1 79 79 ILE N N 441 123.421 123.421 126.595 -3.174 18002
4131 1 7 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.256 -0.085 18002
4132 1 7 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.091 1.476 18002
4133 1 7 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.461 2.026 18002
4134 1 7 . 1 1 79 79 ILE H H 441 9.550 9.550 8.749 0.801 18002
4135 1 7 . 1 1 80 80 LYS N N 442 126.267 126.267 130.349 -4.082 18002
4136 1 7 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.653 -0.191 18002
4137 1 7 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.521 0.862 18002
4138 1 7 . 1 1 80 80 LYS CB C 442 32.987 32.987 33.307 -0.320 18002
4139 1 7 . 1 1 80 80 LYS H H 442 8.703 8.703 8.187 0.516 18002
4140 1 7 . 1 1 81 81 LEU N N 443 125.194 125.194 128.691 -3.497 18002
4141 1 7 . 1 1 81 81 LEU HA H 443 5.272 5.272 5.073 0.199 18002
4142 1 7 . 1 1 81 81 LEU CA C 443 53.349 53.349 52.777 0.572 18002
4143 1 7 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.767 0.937 18002
4144 1 7 . 1 1 81 81 LEU H H 443 9.223 9.223 9.112 0.111 18002
4145 1 7 . 1 1 82 82 LEU N N 444 122.753 122.753 128.449 -5.696 18002
4146 1 7 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.452 -0.438 18002
4147 1 7 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.017 0.901 18002
4148 1 7 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.813 -3.189 18002
4149 1 7 . 1 1 82 82 LEU H H 444 8.420 8.420 8.360 0.060 18002
4150 1 7 . 1 1 83 83 ILE N N 445 125.584 125.584 121.281 4.303 18002
4151 1 7 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.203 0.082 18002
4152 1 7 . 1 1 83 83 ILE CB C 445 41.036 41.036 42.125 -1.089 18002
4153 1 7 . 1 1 83 83 ILE H H 445 9.010 9.010 8.273 0.737 18002
4154 1 7 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.727 0.192 18002
4155 1 7 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.370 1.663 18002
4156 1 7 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.658 0.289 18002
4157 1 7 . 1 1 85 85 VAL N N 447 119.780 119.780 119.669 0.111 18002
4158 1 7 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.511 -0.008 18002
4159 1 7 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.666 0.676 18002
4160 1 7 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.806 0.459 18002
4161 1 7 . 1 1 85 85 VAL H H 447 8.304 8.304 8.094 0.210 18002
4162 1 7 . 1 1 86 86 ALA N N 448 125.178 125.178 124.087 1.091 18002
4163 1 7 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.139 -0.164 18002
4164 1 7 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.567 0.994 18002
4165 1 7 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.433 -0.445 18002
4166 1 7 . 1 1 86 86 ALA H H 448 8.526 8.526 8.590 -0.064 18002
4167 1 7 . 1 1 87 87 GLU N N 449 114.625 114.625 117.427 -2.802 18002
4168 1 7 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.111 0.179 18002
4169 1 7 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.282 -0.551 18002
4170 1 7 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.755 -0.495 18002
4171 1 7 . 1 1 87 87 GLU H H 449 8.402 8.402 8.637 -0.235 18002
4172 1 7 . 1 1 88 88 GLY N N 450 109.432 109.432 105.753 3.679 18002
4173 1 7 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.925 0.912 18002
4174 1 7 . 1 1 88 88 GLY H H 450 7.711 7.711 7.407 0.304 18002
4175 1 7 . 1 1 89 89 MET N N 451 121.382 121.382 120.242 1.140 18002
4176 1 7 . 1 1 89 89 MET HA H 451 5.076 5.076 4.934 0.141 18002
4177 1 7 . 1 1 89 89 MET CA C 451 53.860 53.860 55.125 -1.265 18002
4178 1 7 . 1 1 89 89 MET CB C 451 35.942 35.942 36.295 -0.353 18002
4179 1 7 . 1 1 89 89 MET H H 451 8.355 8.355 8.092 0.263 18002
4180 1 7 . 1 1 90 90 ASN N N 452 123.538 123.538 123.949 -0.411 18002
4181 1 7 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.789 0.164 18002
4182 1 7 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.459 -0.711 18002
4183 1 7 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.657 1.985 18002
4184 1 7 . 1 1 90 90 ASN H H 452 9.338 9.338 9.000 0.338 18002
4185 1 7 . 1 1 91 91 GLU N N 453 125.978 125.978 124.152 1.826 18002
4186 1 7 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.350 0.994 18002
4187 1 7 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.364 -1.091 18002
4188 1 7 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.432 1.311 18002
4189 1 7 . 1 1 91 91 GLU H H 453 8.168 8.168 8.089 0.079 18002
4190 1 7 . 1 1 92 92 ILE N N 454 126.776 126.776 122.560 4.216 18002
4191 1 7 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.409 1.157 18002
4192 1 7 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.423 0.625 18002
4193 1 7 . 1 1 92 92 ILE CB C 454 42.262 42.262 42.742 -0.480 18002
4194 1 7 . 1 1 92 92 ILE H H 454 9.000 9.000 8.820 0.180 18002
4195 1 7 . 1 1 93 93 TRP N N 455 125.987 125.987 121.520 4.467 18002
4196 1 7 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.227 -0.635 18002
4197 1 7 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.142 -1.352 18002
4198 1 7 . 1 1 93 93 TRP CB C 455 31.386 31.386 32.234 -0.848 18002
4199 1 7 . 1 1 93 93 TRP H H 455 9.278 9.278 7.430 1.848 18002
4200 1 7 . 1 1 94 94 LEU N N 456 120.912 120.912 119.229 1.683 18002
4201 1 7 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.610 0.752 18002
4202 1 7 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.198 0.018 18002
4203 1 7 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.894 -0.300 18002
4204 1 7 . 1 1 94 94 LEU H H 456 9.534 9.534 7.918 1.616 18002
4205 1 7 . 1 1 95 95 ARG N N 457 123.669 123.669 121.511 2.158 18002
4206 1 7 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.402 0.869 18002
4207 1 7 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.763 -0.346 18002
4208 1 7 . 1 1 95 95 ARG CB C 457 33.262 33.262 31.925 1.337 18002
4209 1 7 . 1 1 95 95 ARG H H 457 9.439 9.439 8.059 1.380 18002
4210 1 7 . 1 1 96 96 CYS N N 458 125.273 125.273 123.575 1.698 18002
4211 1 7 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.790 -0.092 18002
4212 1 7 . 1 1 96 96 CYS CA C 458 58.792 58.792 60.063 -1.271 18002
4213 1 7 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.490 1.913 18002
4214 1 7 . 1 1 96 96 CYS H H 458 8.652 8.652 8.701 -0.049 18002
4215 1 7 . 1 1 97 97 ASP N N 459 119.661 119.661 124.677 -5.016 18002
4216 1 7 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.812 -0.072 18002
4217 1 7 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.422 1.806 18002
4218 1 7 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.817 0.768 18002
4219 1 7 . 1 1 97 97 ASP H H 459 9.116 9.116 9.078 0.038 18002
4220 1 7 . 1 1 98 98 ASN N N 460 109.173 109.173 113.834 -4.661 18002
4221 1 7 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.726 -0.354 18002
4222 1 7 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.638 -0.624 18002
4223 1 7 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.046 1.765 18002
4224 1 7 . 1 1 98 98 ASN H H 460 7.054 7.054 7.573 -0.519 18002
4225 1 7 . 1 1 99 99 GLU N N 461 119.220 119.220 118.491 0.729 18002
4226 1 7 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.084 0.960 18002
4227 1 7 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.368 0.400 18002
4228 1 7 . 1 1 99 99 GLU H H 461 8.937 8.937 8.776 0.161 18002
4229 1 7 . 1 1 100 100 LYS N N 462 120.647 120.647 119.899 0.748 18002
4230 1 7 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.008 0.637 18002
4231 1 7 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.373 1.163 18002
4232 1 7 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.997 0.231 18002
4233 1 7 . 1 1 100 100 LYS H H 462 8.033 8.033 8.127 -0.094 18002
4234 1 7 . 1 1 101 101 GLN N N 463 121.938 121.938 118.767 3.171 18002
4235 1 7 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.277 0.123 18002
4236 1 7 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.677 -0.282 18002
4237 1 7 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.097 4.117 18002
4238 1 7 . 1 1 101 101 GLN H H 463 8.372 8.372 8.292 0.080 18002
4239 1 7 . 1 1 102 102 TYR N N 464 117.422 117.422 120.047 -2.625 18002
4240 1 7 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.239 0.377 18002
4241 1 7 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.000 0.677 18002
4242 1 7 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.053 0.806 18002
4243 1 7 . 1 1 102 102 TYR H H 464 8.221 8.221 7.500 0.721 18002
4244 1 7 . 1 1 103 103 ALA N N 465 120.655 120.655 121.395 -0.740 18002
4245 1 7 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.807 -0.092 18002
4246 1 7 . 1 1 103 103 ALA CA C 465 55.913 55.913 55.102 0.811 18002
4247 1 7 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.170 0.632 18002
4248 1 7 . 1 1 103 103 ALA H H 465 8.637 8.637 7.877 0.760 18002
4249 1 7 . 1 1 104 104 HIS N N 466 112.871 112.871 117.357 -4.486 18002
4250 1 7 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.436 -0.295 18002
4251 1 7 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.550 1.077 18002
4252 1 7 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.056 -1.198 18002
4253 1 7 . 1 1 104 104 HIS H H 466 7.852 7.852 7.473 0.379 18002
4254 1 7 . 1 1 105 105 TRP N N 467 121.317 121.317 120.257 1.060 18002
4255 1 7 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.480 -0.785 18002
4256 1 7 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.121 1.221 18002
4257 1 7 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.255 -1.750 18002
4258 1 7 . 1 1 105 105 TRP H H 467 8.668 8.668 8.117 0.551 18002
4259 1 7 . 1 1 106 106 MET N N 468 122.346 122.346 117.207 5.139 18002
4260 1 7 . 1 1 106 106 MET HA H 468 4.086 4.086 3.939 0.147 18002
4261 1 7 . 1 1 106 106 MET CA C 468 58.743 58.743 56.729 2.014 18002
4262 1 7 . 1 1 106 106 MET CB C 468 31.402 31.402 30.764 0.638 18002
4263 1 7 . 1 1 106 106 MET H H 468 9.790 9.790 9.097 0.693 18002
4264 1 7 . 1 1 107 107 ALA N N 469 119.758 119.758 121.129 -1.371 18002
4265 1 7 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.349 -0.644 18002
4266 1 7 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.356 1.773 18002
4267 1 7 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.384 2.021 18002
4268 1 7 . 1 1 107 107 ALA H H 469 7.702 7.702 7.385 0.317 18002
4269 1 7 . 1 1 108 108 ALA N N 470 119.233 119.233 122.979 -3.746 18002
4270 1 7 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.741 -0.195 18002
4271 1 7 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.432 0.389 18002
4272 1 7 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.819 -1.087 18002
4273 1 7 . 1 1 108 108 ALA H H 470 7.156 7.156 7.874 -0.718 18002
4274 1 7 . 1 1 109 109 CYS N N 471 116.736 116.736 116.138 0.598 18002
4275 1 7 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.151 -0.094 18002
4276 1 7 . 1 1 109 109 CYS CA C 471 64.571 64.571 63.950 0.621 18002
4277 1 7 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.260 0.133 18002
4278 1 7 . 1 1 109 109 CYS H H 471 8.256 8.256 8.373 -0.117 18002
4279 1 7 . 1 1 110 110 ARG N N 472 118.644 118.644 118.455 0.189 18002
4280 1 7 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.046 -0.312 18002
4281 1 7 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.995 1.209 18002
4282 1 7 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.355 -0.038 18002
4283 1 7 . 1 1 110 110 ARG H H 472 8.403 8.403 7.391 1.012 18002
4284 1 7 . 1 1 111 111 LEU N N 473 121.877 121.877 121.933 -0.056 18002
4285 1 7 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.039 -0.239 18002
4286 1 7 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.838 2.017 18002
4287 1 7 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.799 -1.379 18002
4288 1 7 . 1 1 111 111 LEU H H 473 7.916 7.916 8.898 -0.982 18002
4289 1 7 . 1 1 112 112 ALA N N 474 122.765 122.765 121.092 1.673 18002
4290 1 7 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.125 0.355 18002
4291 1 7 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.393 0.868 18002
4292 1 7 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.122 1.752 18002
4293 1 7 . 1 1 112 112 ALA H H 474 8.393 8.393 8.770 -0.377 18002
4294 1 7 . 1 1 113 113 SER N N 475 113.613 113.613 113.919 -0.306 18002
4295 1 7 . 1 1 113 113 SER HA H 475 4.782 4.782 4.269 0.513 18002
4296 1 7 . 1 1 113 113 SER CA C 475 61.090 61.090 60.731 0.359 18002
4297 1 7 . 1 1 113 113 SER CB C 475 63.612 63.612 62.884 0.728 18002
4298 1 7 . 1 1 113 113 SER H H 475 8.150 8.150 8.523 -0.373 18002
4299 1 7 . 1 1 114 114 LYS N N 476 118.734 118.734 117.758 0.976 18002
4300 1 7 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.082 0.471 18002
4301 1 7 . 1 1 114 114 LYS CA C 476 55.144 55.144 57.229 -2.085 18002
4302 1 7 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.621 -0.030 18002
4303 1 7 . 1 1 114 114 LYS H H 476 7.239 7.239 7.608 -0.369 18002
4304 1 7 . 1 1 115 115 GLY N N 477 107.818 107.818 105.744 2.074 18002
4305 1 7 . 1 1 115 115 GLY CA C 477 45.986 45.986 44.985 1.001 18002
4306 1 7 . 1 1 115 115 GLY H H 477 8.401 8.401 7.832 0.569 18002
4307 1 7 . 1 1 116 116 LYS N N 478 120.938 120.938 120.184 0.754 18002
4308 1 7 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.424 0.149 18002
4309 1 7 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.439 0.408 18002
4310 1 7 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.499 0.822 18002
4311 1 7 . 1 1 116 116 LYS H H 478 8.142 8.142 7.755 0.387 18002
4312 1 7 . 1 1 117 117 THR N N 479 108.076 108.076 113.622 -5.546 18002
4313 1 7 . 1 1 117 117 THR HA H 479 4.671 4.671 4.234 0.437 18002
4314 1 7 . 1 1 117 117 THR CA C 479 59.191 59.191 60.969 -1.778 18002
4315 1 7 . 1 1 117 117 THR CB C 479 72.228 72.228 70.046 2.182 18002
4316 1 7 . 1 1 117 117 THR H H 479 7.926 7.926 8.032 -0.106 18002
4317 1 7 . 1 1 118 118 MET N N 480 116.403 116.403 118.209 -1.806 18002
4318 1 7 . 1 1 118 118 MET HA H 480 3.352 3.352 3.838 -0.486 18002
4319 1 7 . 1 1 118 118 MET CA C 480 57.947 57.947 55.996 1.951 18002
4320 1 7 . 1 1 118 118 MET CB C 480 33.920 33.920 32.270 1.650 18002
4321 1 7 . 1 1 118 118 MET H H 480 8.899 8.899 8.352 0.547 18002
4322 1 7 . 1 1 119 119 ALA N N 481 117.786 117.786 120.949 -3.163 18002
4323 1 7 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.952 0.132 18002
4324 1 7 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.224 -1.629 18002
4325 1 7 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.909 0.153 18002
4326 1 7 . 1 1 119 119 ALA H H 481 7.645 7.645 8.009 -0.364 18002
4327 1 7 . 1 1 120 120 ASP N N 482 120.348 120.348 115.791 4.557 18002
4328 1 7 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.250 5.366 18002
4329 1 7 . 1 1 120 120 ASP H H 482 7.887 7.887 8.433 -0.546 18002
4330 1 7 . 1 1 121 121 SER HA H 483 4.223 4.223 4.134 0.089 18002
4331 1 7 . 1 1 121 121 SER CA C 483 61.455 61.455 61.670 -0.215 18002
4332 1 7 . 1 1 121 121 SER CB C 483 62.996 62.996 63.186 -0.190 18002
4333 1 7 . 1 1 122 122 SER N N 484 116.845 116.845 114.781 2.064 18002
4334 1 7 . 1 1 122 122 SER HA H 484 4.321 4.321 4.485 -0.164 18002
4335 1 7 . 1 1 122 122 SER CA C 484 60.584 60.584 59.817 0.767 18002
4336 1 7 . 1 1 122 122 SER CB C 484 64.314 64.314 62.853 1.461 18002
4337 1 7 . 1 1 122 122 SER H H 484 8.875 8.875 8.458 0.417 18002
4338 1 7 . 1 1 123 123 TYR N N 485 124.153 124.153 123.270 0.883 18002
4339 1 7 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.122 -0.242 18002
4340 1 7 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.276 2.038 18002
4341 1 7 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.360 -0.619 18002
4342 1 7 . 1 1 123 123 TYR H H 485 8.018 8.018 7.934 0.084 18002
4343 1 7 . 1 1 124 124 ASN N N 486 115.339 115.339 117.451 -2.112 18002
4344 1 7 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.986 -0.045 18002
4345 1 7 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.330 0.376 18002
4346 1 7 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.115 -0.059 18002
4347 1 7 . 1 1 124 124 ASN H H 486 8.665 8.665 8.096 0.569 18002
4348 1 7 . 1 1 125 125 LEU N N 487 119.454 119.454 118.793 0.661 18002
4349 1 7 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.041 -0.103 18002
4350 1 7 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.192 0.478 18002
4351 1 7 . 1 1 125 125 LEU CB C 487 41.568 41.568 42.142 -0.574 18002
4352 1 7 . 1 1 125 125 LEU H H 487 7.105 7.105 7.896 -0.791 18002
4353 1 7 . 1 1 126 126 GLU N N 488 121.189 121.189 119.043 2.146 18002
4354 1 7 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.050 -0.020 18002
4355 1 7 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.811 0.224 18002
4356 1 7 . 1 1 126 126 GLU CB C 488 29.085 29.085 28.978 0.107 18002
4357 1 7 . 1 1 126 126 GLU H H 488 8.053 8.053 7.743 0.310 18002
4358 1 7 . 1 1 127 127 VAL N N 489 119.073 119.073 116.333 2.740 18002
4359 1 7 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.638 -0.620 18002
4360 1 7 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.363 1.959 18002
4361 1 7 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.408 0.251 18002
4362 1 7 . 1 1 127 127 VAL H H 489 7.769 7.769 7.317 0.452 18002
4363 1 7 . 1 1 128 128 GLN N N 490 116.214 116.214 117.543 -1.329 18002
4364 1 7 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.068 -0.236 18002
4365 1 7 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.193 0.563 18002
4366 1 7 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.960 0.152 18002
4367 1 7 . 1 1 128 128 GLN H H 490 7.542 7.542 7.810 -0.268 18002
4368 1 7 . 1 1 129 129 ASN N N 491 120.003 120.003 117.317 2.686 18002
4369 1 7 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.639 -0.220 18002
4370 1 7 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.447 0.713 18002
4371 1 7 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.499 -0.439 18002
4372 1 7 . 1 1 129 129 ASN H H 491 8.582 8.582 7.786 0.796 18002
4373 1 7 . 1 1 130 130 ILE N N 492 122.365 122.365 120.181 2.184 18002
4374 1 7 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.538 3.215 18002
4375 1 7 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.135 1.011 18002
4376 1 7 . 1 1 130 130 ILE H H 492 8.186 8.186 7.168 1.018 18002
4377 1 7 . 1 1 131 131 LEU N N 493 119.597 119.597 120.973 -1.376 18002
4378 1 7 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.948 0.057 18002
4379 1 7 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.236 0.623 18002
4380 1 7 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.680 -0.144 18002
4381 1 7 . 1 1 131 131 LEU H H 493 8.224 8.224 7.956 0.268 18002
4382 1 7 . 1 1 132 132 SER N N 494 114.884 114.884 114.146 0.738 18002
4383 1 7 . 1 1 132 132 SER HA H 494 4.430 4.430 4.217 0.213 18002
4384 1 7 . 1 1 132 132 SER CA C 494 62.072 62.072 60.748 1.324 18002
4385 1 7 . 1 1 132 132 SER CB C 494 62.703 62.703 62.741 -0.038 18002
4386 1 7 . 1 1 132 132 SER H H 494 8.464 8.464 7.715 0.749 18002
4387 1 7 . 1 1 133 133 PHE N N 495 123.047 123.047 123.319 -0.272 18002
4388 1 7 . 1 1 133 133 PHE HA H 495 4.377 4.377 3.983 0.394 18002
4389 1 7 . 1 1 133 133 PHE CA C 495 60.913 60.913 62.087 -1.174 18002
4390 1 7 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.115 -0.065 18002
4391 1 7 . 1 1 133 133 PHE H H 495 7.915 7.915 8.585 -0.670 18002
4392 1 7 . 1 1 134 134 LEU N N 496 119.311 119.311 117.515 1.796 18002
4393 1 7 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.125 -0.220 18002
4394 1 7 . 1 1 134 134 LEU CA C 496 57.601 57.601 56.887 0.714 18002
4395 1 7 . 1 1 134 134 LEU CB C 496 41.901 41.901 40.155 1.746 18002
4396 1 7 . 1 1 134 134 LEU H H 496 8.386 8.386 8.024 0.362 18002
4397 1 7 . 1 1 135 135 LYS N N 497 117.550 117.550 120.725 -3.175 18002
4398 1 7 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.089 -0.149 18002
4399 1 7 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.791 -0.516 18002
4400 1 7 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.952 -0.458 18002
4401 1 7 . 1 1 135 135 LYS H H 497 7.670 7.670 7.660 0.010 18002
4402 1 7 . 1 1 136 136 MET N N 498 116.106 116.106 113.795 2.311 18002
4403 1 7 . 1 1 136 136 MET HA H 498 4.354 4.354 4.620 -0.266 18002
4404 1 7 . 1 1 136 136 MET CA C 498 55.994 55.994 55.136 0.858 18002
4405 1 7 . 1 1 136 136 MET CB C 498 32.772 32.772 32.592 0.180 18002
4406 1 7 . 1 1 136 136 MET H H 498 7.421 7.421 7.636 -0.215 18002
4407 1 7 . 1 1 137 137 GLN N N 499 118.651 118.651 118.481 0.170 18002
4408 1 7 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.959 0.225 18002
4409 1 7 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.522 -2.214 18002
4410 1 7 . 1 1 137 137 GLN H H 499 7.617 7.617 8.679 -1.062 18002
4411 1 8 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.705 -0.580 18002
4412 1 8 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.657 -1.642 18002
4413 1 8 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.578 2.351 18002
4414 1 8 . 1 1 4 4 MET N N 366 120.431 120.431 119.701 0.730 18002
4415 1 8 . 1 1 4 4 MET HA H 366 4.345 4.345 4.583 -0.238 18002
4416 1 8 . 1 1 4 4 MET CA C 366 55.337 55.337 56.042 -0.705 18002
4417 1 8 . 1 1 4 4 MET CB C 366 32.668 32.668 34.187 -1.519 18002
4418 1 8 . 1 1 4 4 MET H H 366 8.373 8.373 7.953 0.420 18002
4419 1 8 . 1 1 5 5 GLY N N 367 109.318 109.318 109.809 -0.491 18002
4420 1 8 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.896 0.561 18002
4421 1 8 . 1 1 5 5 GLY H H 367 8.224 8.224 7.621 0.603 18002
4422 1 8 . 1 1 6 6 ASP N N 368 120.307 120.307 122.714 -2.407 18002
4423 1 8 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.833 -0.233 18002
4424 1 8 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.368 0.145 18002
4425 1 8 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.560 -0.234 18002
4426 1 8 . 1 1 6 6 ASP H H 368 8.199 8.199 8.487 -0.288 18002
4427 1 8 . 1 1 7 7 ILE N N 369 120.668 120.668 119.216 1.452 18002
4428 1 8 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.347 -0.129 18002
4429 1 8 . 1 1 7 7 ILE CA C 369 61.584 61.584 59.793 1.791 18002
4430 1 8 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.364 1.404 18002
4431 1 8 . 1 1 7 7 ILE H H 369 8.138 8.138 8.225 -0.087 18002
4432 1 8 . 1 1 8 8 THR N N 370 117.564 117.564 114.232 3.332 18002
4433 1 8 . 1 1 8 8 THR HA H 370 4.322 4.322 4.410 -0.088 18002
4434 1 8 . 1 1 8 8 THR CA C 370 62.332 62.332 60.982 1.350 18002
4435 1 8 . 1 1 8 8 THR CB C 370 69.946 69.946 69.981 -0.035 18002
4436 1 8 . 1 1 8 8 THR H H 370 8.230 8.230 7.681 0.549 18002
4437 1 8 . 1 1 9 9 SER N N 371 118.467 118.467 116.040 2.427 18002
4438 1 8 . 1 1 9 9 SER HA H 371 4.445 4.445 4.722 -0.277 18002
4439 1 8 . 1 1 9 9 SER CA C 371 58.274 58.274 57.382 0.892 18002
4440 1 8 . 1 1 9 9 SER CB C 371 63.996 63.996 64.766 -0.770 18002
4441 1 8 . 1 1 9 9 SER H H 371 8.158 8.158 8.322 -0.164 18002
4442 1 8 . 1 1 10 10 ILE N N 372 123.959 123.959 120.650 3.309 18002
4443 1 8 . 1 1 10 10 ILE CA C 372 58.716 58.716 64.202 -5.486 18002
4444 1 8 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.397 2.522 18002
4445 1 8 . 1 1 10 10 ILE H H 372 8.112 8.112 8.681 -0.569 18002
4446 1 8 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.525 -0.173 18002
4447 1 8 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.590 1.591 18002
4448 1 8 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.036 1.671 18002
4449 1 8 . 1 1 12 12 GLU N N 374 119.349 119.349 119.943 -0.594 18002
4450 1 8 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.456 0.331 18002
4451 1 8 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.977 -0.660 18002
4452 1 8 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.312 3.279 18002
4453 1 8 . 1 1 12 12 GLU H H 374 8.017 8.017 7.777 0.240 18002
4454 1 8 . 1 1 13 13 LEU N N 375 122.288 122.288 127.489 -5.201 18002
4455 1 8 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.518 -0.040 18002
4456 1 8 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.343 -1.413 18002
4457 1 8 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.128 1.528 18002
4458 1 8 . 1 1 13 13 LEU H H 375 8.036 8.036 8.330 -0.294 18002
4459 1 8 . 1 1 14 14 ALA N N 376 125.461 125.461 127.331 -1.870 18002
4460 1 8 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.863 0.383 18002
4461 1 8 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.494 0.251 18002
4462 1 8 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.979 -0.393 18002
4463 1 8 . 1 1 14 14 ALA H H 376 8.181 8.181 8.235 -0.054 18002
4464 1 8 . 1 1 15 15 ASP N N 377 122.242 122.242 118.427 3.815 18002
4465 1 8 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.463 -0.144 18002
4466 1 8 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.426 0.326 18002
4467 1 8 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.573 2.066 18002
4468 1 8 . 1 1 15 15 ASP H H 377 8.326 8.326 8.865 -0.539 18002
4469 1 8 . 1 1 16 16 TYR N N 378 118.961 118.961 118.414 0.547 18002
4470 1 8 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.644 0.747 18002
4471 1 8 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.480 2.101 18002
4472 1 8 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.316 0.707 18002
4473 1 8 . 1 1 16 16 TYR H H 378 8.869 8.869 7.043 1.826 18002
4474 1 8 . 1 1 17 17 ILE N N 379 125.214 125.214 122.468 2.746 18002
4475 1 8 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.449 -0.119 18002
4476 1 8 . 1 1 17 17 ILE CA C 379 58.732 58.732 59.632 -0.900 18002
4477 1 8 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.834 -0.857 18002
4478 1 8 . 1 1 17 17 ILE H H 379 8.608 8.608 8.384 0.224 18002
4479 1 8 . 1 1 18 18 LYS N N 380 122.917 122.917 125.234 -2.317 18002
4480 1 8 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.019 0.093 18002
4481 1 8 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.931 0.905 18002
4482 1 8 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.369 -0.344 18002
4483 1 8 . 1 1 18 18 LYS H H 380 7.424 7.424 8.362 -0.938 18002
4484 1 8 . 1 1 19 19 VAL N N 381 122.839 122.839 123.695 -0.856 18002
4485 1 8 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.466 0.797 18002
4486 1 8 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.081 1.435 18002
4487 1 8 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.502 -0.354 18002
4488 1 8 . 1 1 19 19 VAL H H 381 9.223 9.223 7.915 1.308 18002
4489 1 8 . 1 1 20 20 PHE N N 382 129.509 129.509 125.110 4.399 18002
4490 1 8 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.900 -0.057 18002
4491 1 8 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.498 0.007 18002
4492 1 8 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.179 2.683 18002
4493 1 8 . 1 1 20 20 PHE H H 382 9.451 9.451 8.025 1.426 18002
4494 1 8 . 1 1 21 21 LYS N N 383 126.417 126.417 125.723 0.694 18002
4495 1 8 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.421 0.420 18002
4496 1 8 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.294 0.925 18002
4497 1 8 . 1 1 21 21 LYS H H 383 7.582 7.582 8.463 -0.881 18002
4498 1 8 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.422 0.275 18002
4499 1 8 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.084 -0.115 18002
4500 1 8 . 1 1 23 23 LYS N N 385 118.026 118.026 116.577 1.449 18002
4501 1 8 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.977 0.238 18002
4502 1 8 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.985 -0.640 18002
4503 1 8 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.623 0.410 18002
4504 1 8 . 1 1 23 23 LYS H H 385 8.138 8.138 7.975 0.163 18002
4505 1 8 . 1 1 24 24 LYS N N 386 120.816 120.816 123.221 -2.405 18002
4506 1 8 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.194 -0.008 18002
4507 1 8 . 1 1 24 24 LYS CA C 386 56.862 56.862 56.878 -0.016 18002
4508 1 8 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.768 0.059 18002
4509 1 8 . 1 1 24 24 LYS H H 386 7.727 7.727 8.277 -0.550 18002
4510 1 8 . 1 1 25 25 LEU N N 387 121.214 121.214 121.069 0.145 18002
4511 1 8 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.297 -0.129 18002
4512 1 8 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.763 -0.255 18002
4513 1 8 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.537 0.105 18002
4514 1 8 . 1 1 25 25 LEU H H 387 8.241 8.241 7.999 0.242 18002
4515 1 8 . 1 1 26 26 THR N N 388 112.798 112.798 112.428 0.370 18002
4516 1 8 . 1 1 26 26 THR HA H 388 4.313 4.313 4.417 -0.104 18002
4517 1 8 . 1 1 26 26 THR CA C 388 61.795 61.795 61.760 0.035 18002
4518 1 8 . 1 1 26 26 THR CB C 388 69.875 69.875 69.697 0.178 18002
4519 1 8 . 1 1 26 26 THR H H 388 7.700 7.700 8.057 -0.357 18002
4520 1 8 . 1 1 27 27 LEU N N 389 124.091 124.091 112.912 11.179 18002
4521 1 8 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.680 -0.326 18002
4522 1 8 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.456 1.077 18002
4523 1 8 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.758 -0.460 18002
4524 1 8 . 1 1 27 27 LEU H H 389 8.260 8.260 7.795 0.465 18002
4525 1 8 . 1 1 28 28 LYS N N 390 121.153 121.153 122.702 -1.549 18002
4526 1 8 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.012 0.308 18002
4527 1 8 . 1 1 28 28 LYS CA C 390 56.211 56.211 57.641 -1.430 18002
4528 1 8 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.412 1.263 18002
4529 1 8 . 1 1 28 28 LYS H H 390 8.202 8.202 7.842 0.360 18002
4530 1 8 . 1 1 29 29 GLY N N 391 107.270 107.270 111.187 -3.917 18002
4531 1 8 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.583 -0.708 18002
4532 1 8 . 1 1 29 29 GLY H H 391 7.876 7.876 8.225 -0.349 18002
4533 1 8 . 1 1 30 30 TYR N N 392 118.471 118.471 125.025 -6.554 18002
4534 1 8 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.426 0.020 18002
4535 1 8 . 1 1 30 30 TYR CA C 392 59.047 59.047 60.089 -1.042 18002
4536 1 8 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.893 2.932 18002
4537 1 8 . 1 1 30 30 TYR H H 392 8.183 8.183 8.477 -0.294 18002
4538 1 8 . 1 1 31 31 LYS N N 393 122.833 122.833 124.489 -1.656 18002
4539 1 8 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.708 -0.193 18002
4540 1 8 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.865 0.309 18002
4541 1 8 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.302 1.418 18002
4542 1 8 . 1 1 31 31 LYS H H 393 8.731 8.731 7.770 0.961 18002
4543 1 8 . 1 1 32 32 GLN N N 394 124.759 124.759 119.052 5.707 18002
4544 1 8 . 1 1 32 32 GLN HA H 394 4.678 4.678 5.085 -0.407 18002
4545 1 8 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.082 1.525 18002
4546 1 8 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.634 0.414 18002
4547 1 8 . 1 1 32 32 GLN H H 394 8.776 8.776 8.503 0.273 18002
4548 1 8 . 1 1 33 33 TYR N N 395 125.112 125.112 123.465 1.647 18002
4549 1 8 . 1 1 33 33 TYR HA H 395 5.074 5.074 5.233 -0.159 18002
4550 1 8 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.470 1.694 18002
4551 1 8 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.775 0.897 18002
4552 1 8 . 1 1 33 33 TYR H H 395 8.774 8.774 8.360 0.414 18002
4553 1 8 . 1 1 34 34 TRP N N 396 122.638 122.638 124.235 -1.597 18002
4554 1 8 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.124 -0.442 18002
4555 1 8 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.109 3.108 18002
4556 1 8 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.765 0.739 18002
4557 1 8 . 1 1 34 34 TRP H H 396 8.975 8.975 8.150 0.825 18002
4558 1 8 . 1 1 35 35 CYS N N 397 127.146 127.146 124.280 2.866 18002
4559 1 8 . 1 1 35 35 CYS CA C 397 57.367 57.367 58.943 -1.576 18002
4560 1 8 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.596 2.111 18002
4561 1 8 . 1 1 35 35 CYS H H 397 8.804 8.804 8.863 -0.059 18002
4562 1 8 . 1 1 36 36 THR N N 398 110.578 110.578 115.428 -4.850 18002
4563 1 8 . 1 1 36 36 THR HA H 398 5.358 5.358 4.975 0.383 18002
4564 1 8 . 1 1 36 36 THR CA C 398 58.704 58.704 61.210 -2.506 18002
4565 1 8 . 1 1 36 36 THR CB C 398 71.833 71.833 70.525 1.308 18002
4566 1 8 . 1 1 36 36 THR H H 398 9.090 9.090 7.804 1.286 18002
4567 1 8 . 1 1 37 37 PHE N N 399 127.322 127.322 126.263 1.059 18002
4568 1 8 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.528 0.425 18002
4569 1 8 . 1 1 37 37 PHE CA C 399 56.246 56.246 58.422 -2.176 18002
4570 1 8 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.166 2.019 18002
4571 1 8 . 1 1 37 37 PHE H H 399 8.846 8.846 8.233 0.613 18002
4572 1 8 . 1 1 38 38 LYS N N 400 125.391 125.391 121.961 3.430 18002
4573 1 8 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.748 -0.221 18002
4574 1 8 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.650 1.327 18002
4575 1 8 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.374 0.541 18002
4576 1 8 . 1 1 38 38 LYS H H 400 8.252 8.252 7.905 0.347 18002
4577 1 8 . 1 1 39 39 ASP N N 401 125.083 125.083 119.344 5.739 18002
4578 1 8 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.265 -0.187 18002
4579 1 8 . 1 1 39 39 ASP CA C 401 57.483 57.483 56.817 0.666 18002
4580 1 8 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.965 -0.444 18002
4581 1 8 . 1 1 39 39 ASP H H 401 9.408 9.408 8.897 0.511 18002
4582 1 8 . 1 1 40 40 THR N N 402 112.024 112.024 116.383 -4.359 18002
4583 1 8 . 1 1 40 40 THR HA H 402 4.767 4.767 4.475 0.292 18002
4584 1 8 . 1 1 40 40 THR CA C 402 60.811 60.811 61.484 -0.673 18002
4585 1 8 . 1 1 40 40 THR CB C 402 68.823 68.823 69.086 -0.263 18002
4586 1 8 . 1 1 40 40 THR H H 402 8.224 8.224 8.227 -0.003 18002
4587 1 8 . 1 1 41 41 SER N N 403 116.142 116.142 116.663 -0.521 18002
4588 1 8 . 1 1 41 41 SER HA H 403 5.428 5.428 4.711 0.717 18002
4589 1 8 . 1 1 41 41 SER CA C 403 58.297 58.297 57.378 0.919 18002
4590 1 8 . 1 1 41 41 SER CB C 403 66.409 66.409 66.416 -0.007 18002
4591 1 8 . 1 1 41 41 SER H H 403 8.197 8.197 7.776 0.421 18002
4592 1 8 . 1 1 42 42 ILE N N 404 122.292 122.292 122.569 -0.277 18002
4593 1 8 . 1 1 42 42 ILE HA H 404 4.929 4.929 3.983 0.946 18002
4594 1 8 . 1 1 42 42 ILE CA C 404 59.804 59.804 59.781 0.023 18002
4595 1 8 . 1 1 42 42 ILE CB C 404 41.420 41.420 39.723 1.697 18002
4596 1 8 . 1 1 42 42 ILE H H 404 8.411 8.411 8.085 0.326 18002
4597 1 8 . 1 1 43 43 SER N N 405 122.244 122.244 117.719 4.525 18002
4598 1 8 . 1 1 43 43 SER HA H 405 4.966 4.966 4.608 0.358 18002
4599 1 8 . 1 1 43 43 SER CA C 405 57.735 57.735 57.527 0.208 18002
4600 1 8 . 1 1 43 43 SER CB C 405 65.388 65.388 65.412 -0.024 18002
4601 1 8 . 1 1 43 43 SER H H 405 8.752 8.752 8.254 0.498 18002
4602 1 8 . 1 1 44 44 CYS N N 406 120.004 120.004 125.924 -5.920 18002
4603 1 8 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.338 0.629 18002
4604 1 8 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.378 -0.320 18002
4605 1 8 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.314 0.126 18002
4606 1 8 . 1 1 44 44 CYS H H 406 8.470 8.470 8.177 0.293 18002
4607 1 8 . 1 1 45 45 TYR N N 407 122.704 122.704 123.173 -0.469 18002
4608 1 8 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.436 0.587 18002
4609 1 8 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.666 -0.683 18002
4610 1 8 . 1 1 45 45 TYR CB C 407 41.574 41.574 41.507 0.067 18002
4611 1 8 . 1 1 45 45 TYR H H 407 10.013 10.013 7.710 2.303 18002
4612 1 8 . 1 1 46 46 LYS N N 408 121.897 121.897 122.869 -0.972 18002
4613 1 8 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.565 -0.219 18002
4614 1 8 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.951 2.068 18002
4615 1 8 . 1 1 46 46 LYS CB C 408 32.712 32.712 34.259 -1.547 18002
4616 1 8 . 1 1 46 46 LYS H H 408 9.734 9.734 8.707 1.027 18002
4617 1 8 . 1 1 47 47 SER N N 409 106.720 106.720 112.167 -5.447 18002
4618 1 8 . 1 1 47 47 SER HA H 409 4.776 4.776 4.810 -0.034 18002
4619 1 8 . 1 1 47 47 SER CA C 409 57.180 57.180 57.269 -0.089 18002
4620 1 8 . 1 1 47 47 SER CB C 409 65.870 65.870 65.868 0.002 18002
4621 1 8 . 1 1 47 47 SER H H 409 7.518 7.518 7.705 -0.187 18002
4622 1 8 . 1 1 48 48 LYS N N 410 122.302 122.302 120.496 1.806 18002
4623 1 8 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.871 1.363 18002
4624 1 8 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.511 -0.212 18002
4625 1 8 . 1 1 48 48 LYS H H 410 8.195 8.195 8.688 -0.494 18002
4626 1 8 . 1 1 49 49 GLU N N 411 118.983 118.983 118.471 0.512 18002
4627 1 8 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.125 0.657 18002
4628 1 8 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.227 1.308 18002
4629 1 8 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.784 -1.096 18002
4630 1 8 . 1 1 49 49 GLU H H 411 8.752 8.752 8.283 0.469 18002
4631 1 8 . 1 1 50 50 GLU N N 412 118.384 118.384 114.527 3.857 18002
4632 1 8 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.046 0.447 18002
4633 1 8 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.743 -0.954 18002
4634 1 8 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.701 1.304 18002
4635 1 8 . 1 1 50 50 GLU H H 412 7.234 7.234 8.135 -0.901 18002
4636 1 8 . 1 1 51 51 SER N N 413 114.767 114.767 112.391 2.376 18002
4637 1 8 . 1 1 51 51 SER CA C 413 59.764 59.764 60.888 -1.124 18002
4638 1 8 . 1 1 51 51 SER CB C 413 62.965 62.965 63.566 -0.601 18002
4639 1 8 . 1 1 51 51 SER H H 413 7.382 7.382 8.496 -1.114 18002
4640 1 8 . 1 1 52 52 SER N N 414 114.496 114.496 112.692 1.804 18002
4641 1 8 . 1 1 52 52 SER HA H 414 4.560 4.560 4.503 0.057 18002
4642 1 8 . 1 1 52 52 SER CA C 414 58.574 58.574 58.168 0.406 18002
4643 1 8 . 1 1 52 52 SER CB C 414 63.829 63.829 64.622 -0.793 18002
4644 1 8 . 1 1 52 52 SER H H 414 7.682 7.682 8.114 -0.432 18002
4645 1 8 . 1 1 53 53 GLY N N 415 111.107 111.107 110.563 0.544 18002
4646 1 8 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.735 -0.502 18002
4647 1 8 . 1 1 53 53 GLY H H 415 7.918 7.918 7.799 0.119 18002
4648 1 8 . 1 1 54 54 THR N N 416 120.214 120.214 115.569 4.645 18002
4649 1 8 . 1 1 54 54 THR CB C 416 70.035 70.035 70.390 -0.355 18002
4650 1 8 . 1 1 54 54 THR H H 416 8.622 8.622 8.010 0.612 18002
4651 1 8 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.958 0.517 18002
4652 1 8 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.519 -0.474 18002
4653 1 8 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.681 -0.103 18002
4654 1 8 . 1 1 56 56 ALA N N 418 125.591 125.591 125.663 -0.072 18002
4655 1 8 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.921 0.035 18002
4656 1 8 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.620 0.915 18002
4657 1 8 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.287 -0.380 18002
4658 1 8 . 1 1 56 56 ALA H H 418 8.288 8.288 8.206 0.082 18002
4659 1 8 . 1 1 57 57 HIS N N 419 108.119 108.119 114.197 -6.078 18002
4660 1 8 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.535 0.087 18002
4661 1 8 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.521 -0.941 18002
4662 1 8 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.142 2.078 18002
4663 1 8 . 1 1 57 57 HIS H H 419 7.072 7.072 7.680 -0.608 18002
4664 1 8 . 1 1 58 58 GLN N N 420 123.083 123.083 125.174 -2.091 18002
4665 1 8 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.564 0.591 18002
4666 1 8 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.705 0.799 18002
4667 1 8 . 1 1 58 58 GLN CB C 420 32.490 32.490 29.790 2.700 18002
4668 1 8 . 1 1 58 58 GLN H H 420 8.669 8.669 8.573 0.096 18002
4669 1 8 . 1 1 59 59 MET N N 421 122.330 122.330 119.865 2.465 18002
4670 1 8 . 1 1 59 59 MET HA H 421 4.621 4.621 4.603 0.018 18002
4671 1 8 . 1 1 59 59 MET CA C 421 54.892 54.892 54.254 0.638 18002
4672 1 8 . 1 1 59 59 MET CB C 421 35.650 35.650 34.357 1.293 18002
4673 1 8 . 1 1 59 59 MET H H 421 8.995 8.995 8.033 0.962 18002
4674 1 8 . 1 1 60 60 ASN N N 422 123.220 123.220 119.945 3.275 18002
4675 1 8 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.712 0.236 18002
4676 1 8 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.759 -0.128 18002
4677 1 8 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.851 -0.112 18002
4678 1 8 . 1 1 60 60 ASN H H 422 8.728 8.728 8.523 0.205 18002
4679 1 8 . 1 1 61 61 LEU N N 423 126.072 126.072 123.918 2.154 18002
4680 1 8 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.265 -0.149 18002
4681 1 8 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.343 1.270 18002
4682 1 8 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.448 1.009 18002
4683 1 8 . 1 1 61 61 LEU H H 423 8.942 8.942 8.379 0.563 18002
4684 1 8 . 1 1 62 62 ARG N N 424 121.977 121.977 117.310 4.667 18002
4685 1 8 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.038 0.334 18002
4686 1 8 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.747 2.287 18002
4687 1 8 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.061 -0.451 18002
4688 1 8 . 1 1 62 62 ARG H H 424 8.000 8.000 8.047 -0.047 18002
4689 1 8 . 1 1 63 63 GLY N N 425 114.852 114.852 110.578 4.274 18002
4690 1 8 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.254 0.556 18002
4691 1 8 . 1 1 63 63 GLY H H 425 9.033 9.033 8.774 0.259 18002
4692 1 8 . 1 1 64 64 CYS N N 426 117.102 117.102 117.418 -0.316 18002
4693 1 8 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.595 0.304 18002
4694 1 8 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.688 0.072 18002
4695 1 8 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.080 -0.256 18002
4696 1 8 . 1 1 64 64 CYS H H 426 8.248 8.248 7.715 0.533 18002
4697 1 8 . 1 1 65 65 GLU N N 427 119.501 119.501 122.338 -2.837 18002
4698 1 8 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.592 0.185 18002
4699 1 8 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.339 0.052 18002
4700 1 8 . 1 1 65 65 GLU CB C 427 31.938 31.938 32.684 -0.747 18002
4701 1 8 . 1 1 65 65 GLU H H 427 8.449 8.449 8.897 -0.448 18002
4702 1 8 . 1 1 66 66 VAL N N 428 125.286 125.286 121.250 4.036 18002
4703 1 8 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.867 0.023 18002
4704 1 8 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.844 -0.092 18002
4705 1 8 . 1 1 66 66 VAL CB C 428 33.975 33.975 35.391 -1.416 18002
4706 1 8 . 1 1 66 66 VAL H H 428 8.624 8.624 8.315 0.309 18002
4707 1 8 . 1 1 67 67 THR N N 429 124.132 124.132 122.487 1.645 18002
4708 1 8 . 1 1 67 67 THR CA C 429 59.338 59.338 59.562 -0.224 18002
4709 1 8 . 1 1 67 67 THR CB C 429 72.021 72.021 69.684 2.337 18002
4710 1 8 . 1 1 67 67 THR H H 429 9.247 9.247 8.305 0.942 18002
4711 1 8 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.698 -0.049 18002
4712 1 8 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.795 -0.057 18002
4713 1 8 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.454 1.114 18002
4714 1 8 . 1 1 69 69 ASP N N 431 122.066 122.066 123.605 -1.539 18002
4715 1 8 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.947 -0.300 18002
4716 1 8 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.384 0.285 18002
4717 1 8 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.022 0.083 18002
4718 1 8 . 1 1 69 69 ASP H H 431 8.250 8.250 8.450 -0.200 18002
4719 1 8 . 1 1 70 70 VAL N N 432 121.874 121.874 122.953 -1.079 18002
4720 1 8 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.718 -0.219 18002
4721 1 8 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.424 0.664 18002
4722 1 8 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.471 0.561 18002
4723 1 8 . 1 1 70 70 VAL H H 432 8.305 8.305 8.076 0.229 18002
4724 1 8 . 1 1 71 71 ASN N N 433 124.366 124.366 127.618 -3.252 18002
4725 1 8 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.928 -0.246 18002
4726 1 8 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.029 0.732 18002
4727 1 8 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.365 0.914 18002
4728 1 8 . 1 1 71 71 ASN H H 433 8.637 8.637 7.965 0.672 18002
4729 1 8 . 1 1 72 72 ILE N N 434 126.786 126.786 122.847 3.939 18002
4730 1 8 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.705 -0.335 18002
4731 1 8 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.142 1.376 18002
4732 1 8 . 1 1 72 72 ILE CB C 434 37.175 37.175 36.763 0.412 18002
4733 1 8 . 1 1 72 72 ILE H H 434 8.943 8.943 8.780 0.163 18002
4734 1 8 . 1 1 73 73 SER N N 435 118.305 118.305 116.925 1.380 18002
4735 1 8 . 1 1 73 73 SER CA C 435 61.633 61.633 60.947 0.686 18002
4736 1 8 . 1 1 73 73 SER CB C 435 62.435 62.435 62.832 -0.397 18002
4737 1 8 . 1 1 73 73 SER H H 435 8.578 8.578 8.316 0.262 18002
4738 1 8 . 1 1 74 74 GLY N N 436 107.443 107.443 106.927 0.516 18002
4739 1 8 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.406 0.455 18002
4740 1 8 . 1 1 74 74 GLY H H 436 7.620 7.620 7.500 0.120 18002
4741 1 8 . 1 1 75 75 GLN N N 437 116.895 116.895 117.236 -0.341 18002
4742 1 8 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.405 -0.115 18002
4743 1 8 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.634 0.067 18002
4744 1 8 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.889 0.856 18002
4745 1 8 . 1 1 75 75 GLN H H 437 7.798 7.798 7.630 0.168 18002
4746 1 8 . 1 1 76 76 LYS N N 438 119.308 119.308 120.072 -0.764 18002
4747 1 8 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.354 -0.212 18002
4748 1 8 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.469 0.574 18002
4749 1 8 . 1 1 76 76 LYS CB C 438 33.945 33.945 32.075 1.870 18002
4750 1 8 . 1 1 76 76 LYS H H 438 7.522 7.522 7.454 0.068 18002
4751 1 8 . 1 1 77 77 PHE N N 439 125.905 125.905 121.384 4.521 18002
4752 1 8 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.131 0.080 18002
4753 1 8 . 1 1 77 77 PHE CA C 439 55.639 55.639 55.897 -0.258 18002
4754 1 8 . 1 1 77 77 PHE CB C 439 38.929 38.929 37.248 1.681 18002
4755 1 8 . 1 1 77 77 PHE H H 439 8.461 8.461 7.617 0.844 18002
4756 1 8 . 1 1 78 78 ASN N N 440 120.787 120.787 121.373 -0.586 18002
4757 1 8 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.120 -0.207 18002
4758 1 8 . 1 1 78 78 ASN CB C 440 40.803 40.803 42.120 -1.317 18002
4759 1 8 . 1 1 78 78 ASN H H 440 7.638 7.638 8.196 -0.558 18002
4760 1 8 . 1 1 79 79 ILE N N 441 123.421 123.421 124.729 -1.308 18002
4761 1 8 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.374 -0.203 18002
4762 1 8 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.947 1.620 18002
4763 1 8 . 1 1 79 79 ILE CB C 441 41.487 41.487 40.471 1.016 18002
4764 1 8 . 1 1 79 79 ILE H H 441 9.550 9.550 8.814 0.736 18002
4765 1 8 . 1 1 80 80 LYS N N 442 126.267 126.267 128.673 -2.406 18002
4766 1 8 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.668 -0.206 18002
4767 1 8 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.835 0.548 18002
4768 1 8 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.638 0.349 18002
4769 1 8 . 1 1 80 80 LYS H H 442 8.703 8.703 8.534 0.169 18002
4770 1 8 . 1 1 81 81 LEU N N 443 125.194 125.194 128.313 -3.119 18002
4771 1 8 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.890 0.382 18002
4772 1 8 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.457 -0.108 18002
4773 1 8 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.182 2.522 18002
4774 1 8 . 1 1 81 81 LEU H H 443 9.223 9.223 8.438 0.785 18002
4775 1 8 . 1 1 82 82 LEU N N 444 122.753 122.753 128.448 -5.695 18002
4776 1 8 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.210 -0.196 18002
4777 1 8 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.200 0.718 18002
4778 1 8 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.569 -2.945 18002
4779 1 8 . 1 1 82 82 LEU H H 444 8.420 8.420 8.026 0.394 18002
4780 1 8 . 1 1 83 83 ILE N N 445 125.584 125.584 122.443 3.141 18002
4781 1 8 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.315 -0.029 18002
4782 1 8 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.839 -0.803 18002
4783 1 8 . 1 1 83 83 ILE H H 445 9.010 9.010 7.953 1.057 18002
4784 1 8 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.776 0.143 18002
4785 1 8 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.479 1.554 18002
4786 1 8 . 1 1 84 84 PRO CB C 446 31.947 31.947 30.958 0.989 18002
4787 1 8 . 1 1 85 85 VAL N N 447 119.780 119.780 120.795 -1.015 18002
4788 1 8 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.424 0.079 18002
4789 1 8 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.838 0.504 18002
4790 1 8 . 1 1 85 85 VAL CB C 447 35.266 35.266 33.871 1.395 18002
4791 1 8 . 1 1 85 85 VAL H H 447 8.304 8.304 7.728 0.576 18002
4792 1 8 . 1 1 86 86 ALA N N 448 125.178 125.178 122.190 2.988 18002
4793 1 8 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.167 -0.192 18002
4794 1 8 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.391 1.170 18002
4795 1 8 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.451 -0.463 18002
4796 1 8 . 1 1 86 86 ALA H H 448 8.526 8.526 8.288 0.238 18002
4797 1 8 . 1 1 87 87 GLU N N 449 114.625 114.625 118.456 -3.831 18002
4798 1 8 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.124 0.166 18002
4799 1 8 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.391 -0.660 18002
4800 1 8 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.879 -0.619 18002
4801 1 8 . 1 1 87 87 GLU H H 449 8.402 8.402 8.611 -0.209 18002
4802 1 8 . 1 1 88 88 GLY N N 450 109.432 109.432 106.152 3.280 18002
4803 1 8 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.850 0.987 18002
4804 1 8 . 1 1 88 88 GLY H H 450 7.711 7.711 7.808 -0.097 18002
4805 1 8 . 1 1 89 89 MET N N 451 121.382 121.382 120.066 1.316 18002
4806 1 8 . 1 1 89 89 MET HA H 451 5.076 5.076 4.877 0.199 18002
4807 1 8 . 1 1 89 89 MET CA C 451 53.860 53.860 54.933 -1.073 18002
4808 1 8 . 1 1 89 89 MET CB C 451 35.942 35.942 36.623 -0.681 18002
4809 1 8 . 1 1 89 89 MET H H 451 8.355 8.355 8.007 0.348 18002
4810 1 8 . 1 1 90 90 ASN N N 452 123.538 123.538 123.236 0.302 18002
4811 1 8 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.772 0.181 18002
4812 1 8 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.157 -0.409 18002
4813 1 8 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.433 2.209 18002
4814 1 8 . 1 1 90 90 ASN H H 452 9.338 9.338 8.832 0.506 18002
4815 1 8 . 1 1 91 91 GLU N N 453 125.978 125.978 124.686 1.292 18002
4816 1 8 . 1 1 91 91 GLU HA H 453 5.344 5.344 3.862 1.482 18002
4817 1 8 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.291 -1.018 18002
4818 1 8 . 1 1 91 91 GLU CB C 453 31.743 31.743 29.639 2.104 18002
4819 1 8 . 1 1 91 91 GLU H H 453 8.168 8.168 8.131 0.037 18002
4820 1 8 . 1 1 92 92 ILE N N 454 126.776 126.776 125.876 0.900 18002
4821 1 8 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.818 0.748 18002
4822 1 8 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.337 0.712 18002
4823 1 8 . 1 1 92 92 ILE CB C 454 42.262 42.262 39.644 2.618 18002
4824 1 8 . 1 1 92 92 ILE H H 454 9.000 9.000 7.274 1.726 18002
4825 1 8 . 1 1 93 93 TRP N N 455 125.987 125.987 126.475 -0.488 18002
4826 1 8 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.969 -0.377 18002
4827 1 8 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.009 -1.219 18002
4828 1 8 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.924 0.462 18002
4829 1 8 . 1 1 93 93 TRP H H 455 9.278 9.278 8.012 1.266 18002
4830 1 8 . 1 1 94 94 LEU N N 456 120.912 120.912 120.073 0.839 18002
4831 1 8 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.680 0.682 18002
4832 1 8 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.376 -0.160 18002
4833 1 8 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.652 0.942 18002
4834 1 8 . 1 1 94 94 LEU H H 456 9.534 9.534 8.117 1.417 18002
4835 1 8 . 1 1 95 95 ARG N N 457 123.669 123.669 121.275 2.394 18002
4836 1 8 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.468 0.803 18002
4837 1 8 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.986 -0.569 18002
4838 1 8 . 1 1 95 95 ARG CB C 457 33.262 33.262 31.879 1.383 18002
4839 1 8 . 1 1 95 95 ARG H H 457 9.439 9.439 8.680 0.759 18002
4840 1 8 . 1 1 96 96 CYS N N 458 125.273 125.273 121.823 3.450 18002
4841 1 8 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.135 -0.437 18002
4842 1 8 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.035 0.757 18002
4843 1 8 . 1 1 96 96 CYS CB C 458 30.403 30.403 30.697 -0.294 18002
4844 1 8 . 1 1 96 96 CYS H H 458 8.652 8.652 8.403 0.249 18002
4845 1 8 . 1 1 97 97 ASP N N 459 119.661 119.661 123.853 -4.192 18002
4846 1 8 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.777 -0.037 18002
4847 1 8 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.614 1.614 18002
4848 1 8 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.844 1.741 18002
4849 1 8 . 1 1 97 97 ASP H H 459 9.116 9.116 8.943 0.173 18002
4850 1 8 . 1 1 98 98 ASN N N 460 109.173 109.173 115.366 -6.193 18002
4851 1 8 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.605 -0.233 18002
4852 1 8 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.091 -0.077 18002
4853 1 8 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.951 0.860 18002
4854 1 8 . 1 1 98 98 ASN H H 460 7.054 7.054 7.278 -0.224 18002
4855 1 8 . 1 1 99 99 GLU N N 461 119.220 119.220 119.267 -0.047 18002
4856 1 8 . 1 1 99 99 GLU CA C 461 60.044 60.044 58.933 1.111 18002
4857 1 8 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.389 0.379 18002
4858 1 8 . 1 1 99 99 GLU H H 461 8.937 8.937 8.714 0.223 18002
4859 1 8 . 1 1 100 100 LYS N N 462 120.647 120.647 119.134 1.513 18002
4860 1 8 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.974 0.671 18002
4861 1 8 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.626 0.910 18002
4862 1 8 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.865 0.363 18002
4863 1 8 . 1 1 100 100 LYS H H 462 8.033 8.033 8.190 -0.157 18002
4864 1 8 . 1 1 101 101 GLN N N 463 121.938 121.938 118.881 3.057 18002
4865 1 8 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.087 0.313 18002
4866 1 8 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.936 0.459 18002
4867 1 8 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.201 4.013 18002
4868 1 8 . 1 1 101 101 GLN H H 463 8.372 8.372 7.919 0.453 18002
4869 1 8 . 1 1 102 102 TYR N N 464 117.422 117.422 120.566 -3.144 18002
4870 1 8 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.075 0.541 18002
4871 1 8 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.969 0.708 18002
4872 1 8 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.088 0.771 18002
4873 1 8 . 1 1 102 102 TYR H H 464 8.221 8.221 7.525 0.696 18002
4874 1 8 . 1 1 103 103 ALA N N 465 120.655 120.655 117.564 3.091 18002
4875 1 8 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.022 -0.307 18002
4876 1 8 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.285 1.628 18002
4877 1 8 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.566 0.236 18002
4878 1 8 . 1 1 103 103 ALA H H 465 8.637 8.637 7.568 1.069 18002
4879 1 8 . 1 1 104 104 HIS N N 466 112.871 112.871 116.456 -3.585 18002
4880 1 8 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.601 -0.460 18002
4881 1 8 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.733 0.894 18002
4882 1 8 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.602 -1.744 18002
4883 1 8 . 1 1 104 104 HIS H H 466 7.852 7.852 8.033 -0.181 18002
4884 1 8 . 1 1 105 105 TRP N N 467 121.317 121.317 120.087 1.230 18002
4885 1 8 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.477 -0.782 18002
4886 1 8 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.032 1.310 18002
4887 1 8 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.237 -1.732 18002
4888 1 8 . 1 1 105 105 TRP H H 467 8.668 8.668 7.907 0.761 18002
4889 1 8 . 1 1 106 106 MET N N 468 122.346 122.346 118.436 3.910 18002
4890 1 8 . 1 1 106 106 MET HA H 468 4.086 4.086 3.907 0.179 18002
4891 1 8 . 1 1 106 106 MET CA C 468 58.743 58.743 57.372 1.371 18002
4892 1 8 . 1 1 106 106 MET CB C 468 31.402 31.402 30.254 1.148 18002
4893 1 8 . 1 1 106 106 MET H H 468 9.790 9.790 7.943 1.847 18002
4894 1 8 . 1 1 107 107 ALA N N 469 119.758 119.758 120.120 -0.362 18002
4895 1 8 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.352 -0.647 18002
4896 1 8 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.775 1.354 18002
4897 1 8 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.106 2.299 18002
4898 1 8 . 1 1 107 107 ALA H H 469 7.702 7.702 8.016 -0.314 18002
4899 1 8 . 1 1 108 108 ALA N N 470 119.233 119.233 120.239 -1.006 18002
4900 1 8 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.965 -0.419 18002
4901 1 8 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.367 1.454 18002
4902 1 8 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.470 -1.738 18002
4903 1 8 . 1 1 108 108 ALA H H 470 7.156 7.156 8.223 -1.067 18002
4904 1 8 . 1 1 109 109 CYS N N 471 116.736 116.736 117.397 -0.661 18002
4905 1 8 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.137 -0.080 18002
4906 1 8 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.684 1.887 18002
4907 1 8 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.354 1.039 18002
4908 1 8 . 1 1 109 109 CYS H H 471 8.256 8.256 8.652 -0.396 18002
4909 1 8 . 1 1 110 110 ARG N N 472 118.644 118.644 120.199 -1.555 18002
4910 1 8 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.111 -0.377 18002
4911 1 8 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.596 1.608 18002
4912 1 8 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.161 0.156 18002
4913 1 8 . 1 1 110 110 ARG H H 472 8.403 8.403 7.936 0.467 18002
4914 1 8 . 1 1 111 111 LEU N N 473 121.877 121.877 119.555 2.322 18002
4915 1 8 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.180 -0.380 18002
4916 1 8 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.893 1.962 18002
4917 1 8 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.898 -0.478 18002
4918 1 8 . 1 1 111 111 LEU H H 473 7.916 7.916 7.519 0.397 18002
4919 1 8 . 1 1 112 112 ALA N N 474 122.765 122.765 122.063 0.702 18002
4920 1 8 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.039 0.441 18002
4921 1 8 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.501 0.760 18002
4922 1 8 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.520 2.355 18002
4923 1 8 . 1 1 112 112 ALA H H 474 8.393 8.393 8.564 -0.171 18002
4924 1 8 . 1 1 113 113 SER N N 475 113.613 113.613 112.324 1.289 18002
4925 1 8 . 1 1 113 113 SER HA H 475 4.782 4.782 4.331 0.451 18002
4926 1 8 . 1 1 113 113 SER CA C 475 61.090 61.090 60.128 0.962 18002
4927 1 8 . 1 1 113 113 SER CB C 475 63.612 63.612 63.391 0.222 18002
4928 1 8 . 1 1 113 113 SER H H 475 8.150 8.150 7.950 0.200 18002
4929 1 8 . 1 1 114 114 LYS N N 476 118.734 118.734 118.140 0.594 18002
4930 1 8 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.167 0.386 18002
4931 1 8 . 1 1 114 114 LYS CA C 476 55.144 55.144 57.154 -2.010 18002
4932 1 8 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.346 0.245 18002
4933 1 8 . 1 1 114 114 LYS H H 476 7.239 7.239 8.119 -0.880 18002
4934 1 8 . 1 1 115 115 GLY N N 477 107.818 107.818 106.735 1.083 18002
4935 1 8 . 1 1 115 115 GLY CA C 477 45.986 45.986 44.724 1.262 18002
4936 1 8 . 1 1 115 115 GLY H H 477 8.401 8.401 7.716 0.684 18002
4937 1 8 . 1 1 116 116 LYS N N 478 120.938 120.938 120.991 -0.053 18002
4938 1 8 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.654 -0.081 18002
4939 1 8 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.877 -0.030 18002
4940 1 8 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.885 0.436 18002
4941 1 8 . 1 1 116 116 LYS H H 478 8.142 8.142 7.730 0.412 18002
4942 1 8 . 1 1 117 117 THR N N 479 108.076 108.076 118.794 -10.718 18002
4943 1 8 . 1 1 117 117 THR HA H 479 4.671 4.671 4.240 0.431 18002
4944 1 8 . 1 1 117 117 THR CA C 479 59.191 59.191 61.803 -2.611 18002
4945 1 8 . 1 1 117 117 THR CB C 479 72.228 72.228 69.420 2.808 18002
4946 1 8 . 1 1 117 117 THR H H 479 7.926 7.926 8.451 -0.525 18002
4947 1 8 . 1 1 118 118 MET N N 480 116.403 116.403 120.869 -4.466 18002
4948 1 8 . 1 1 118 118 MET HA H 480 3.352 3.352 3.688 -0.336 18002
4949 1 8 . 1 1 118 118 MET CA C 480 57.947 57.947 55.318 2.630 18002
4950 1 8 . 1 1 118 118 MET CB C 480 33.920 33.920 31.129 2.791 18002
4951 1 8 . 1 1 118 118 MET H H 480 8.899 8.899 8.356 0.543 18002
4952 1 8 . 1 1 119 119 ALA N N 481 117.786 117.786 122.282 -4.496 18002
4953 1 8 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.946 0.138 18002
4954 1 8 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.248 -1.653 18002
4955 1 8 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.829 0.233 18002
4956 1 8 . 1 1 119 119 ALA H H 481 7.645 7.645 8.311 -0.666 18002
4957 1 8 . 1 1 120 120 ASP N N 482 120.348 120.348 116.347 4.001 18002
4958 1 8 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.038 5.578 18002
4959 1 8 . 1 1 120 120 ASP H H 482 7.887 7.887 8.439 -0.552 18002
4960 1 8 . 1 1 121 121 SER HA H 483 4.223 4.223 4.175 0.048 18002
4961 1 8 . 1 1 121 121 SER CA C 483 61.455 61.455 61.187 0.269 18002
4962 1 8 . 1 1 121 121 SER CB C 483 62.996 62.996 63.188 -0.193 18002
4963 1 8 . 1 1 122 122 SER N N 484 116.845 116.845 115.242 1.603 18002
4964 1 8 . 1 1 122 122 SER HA H 484 4.321 4.321 4.519 -0.198 18002
4965 1 8 . 1 1 122 122 SER CA C 484 60.584 60.584 60.119 0.465 18002
4966 1 8 . 1 1 122 122 SER CB C 484 64.314 64.314 63.560 0.754 18002
4967 1 8 . 1 1 122 122 SER H H 484 8.875 8.875 8.340 0.535 18002
4968 1 8 . 1 1 123 123 TYR N N 485 124.153 124.153 123.211 0.942 18002
4969 1 8 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.156 -0.276 18002
4970 1 8 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.980 2.334 18002
4971 1 8 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.018 -0.277 18002
4972 1 8 . 1 1 123 123 TYR H H 485 8.018 8.018 8.584 -0.566 18002
4973 1 8 . 1 1 124 124 ASN N N 486 115.339 115.339 117.188 -1.849 18002
4974 1 8 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.266 -0.325 18002
4975 1 8 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.572 1.134 18002
4976 1 8 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.042 0.014 18002
4977 1 8 . 1 1 124 124 ASN H H 486 8.665 8.665 7.759 0.906 18002
4978 1 8 . 1 1 125 125 LEU N N 487 119.454 119.454 120.556 -1.102 18002
4979 1 8 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.199 -0.261 18002
4980 1 8 . 1 1 125 125 LEU CA C 487 57.670 57.670 56.972 0.697 18002
4981 1 8 . 1 1 125 125 LEU CB C 487 41.568 41.568 42.339 -0.771 18002
4982 1 8 . 1 1 125 125 LEU H H 487 7.105 7.105 7.643 -0.538 18002
4983 1 8 . 1 1 126 126 GLU N N 488 121.189 121.189 119.680 1.509 18002
4984 1 8 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.039 -0.009 18002
4985 1 8 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.033 0.002 18002
4986 1 8 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.190 -0.105 18002
4987 1 8 . 1 1 126 126 GLU H H 488 8.053 8.053 8.281 -0.228 18002
4988 1 8 . 1 1 127 127 VAL N N 489 119.073 119.073 116.459 2.614 18002
4989 1 8 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.693 -0.675 18002
4990 1 8 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.453 1.869 18002
4991 1 8 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.495 0.164 18002
4992 1 8 . 1 1 127 127 VAL H H 489 7.769 7.769 6.939 0.830 18002
4993 1 8 . 1 1 128 128 GLN N N 490 116.214 116.214 118.034 -1.820 18002
4994 1 8 . 1 1 128 128 GLN HA H 490 3.832 3.832 3.952 -0.120 18002
4995 1 8 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.618 0.138 18002
4996 1 8 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.735 0.376 18002
4997 1 8 . 1 1 128 128 GLN H H 490 7.542 7.542 7.929 -0.387 18002
4998 1 8 . 1 1 129 129 ASN N N 491 120.003 120.003 118.225 1.778 18002
4999 1 8 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.657 -0.238 18002
5000 1 8 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.938 0.222 18002
5001 1 8 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.381 -0.321 18002
5002 1 8 . 1 1 129 129 ASN H H 491 8.582 8.582 7.428 1.154 18002
5003 1 8 . 1 1 130 130 ILE N N 492 122.365 122.365 120.682 1.683 18002
5004 1 8 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.659 3.094 18002
5005 1 8 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.887 1.259 18002
5006 1 8 . 1 1 130 130 ILE H H 492 8.186 8.186 7.359 0.827 18002
5007 1 8 . 1 1 131 131 LEU N N 493 119.597 119.597 120.848 -1.251 18002
5008 1 8 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.934 0.071 18002
5009 1 8 . 1 1 131 131 LEU CA C 493 58.859 58.859 59.358 -0.498 18002
5010 1 8 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.851 -0.315 18002
5011 1 8 . 1 1 131 131 LEU H H 493 8.224 8.224 8.719 -0.495 18002
5012 1 8 . 1 1 132 132 SER N N 494 114.884 114.884 113.556 1.328 18002
5013 1 8 . 1 1 132 132 SER HA H 494 4.430 4.430 4.209 0.221 18002
5014 1 8 . 1 1 132 132 SER CA C 494 62.072 62.072 60.941 1.131 18002
5015 1 8 . 1 1 132 132 SER CB C 494 62.703 62.703 62.545 0.158 18002
5016 1 8 . 1 1 132 132 SER H H 494 8.464 8.464 7.626 0.838 18002
5017 1 8 . 1 1 133 133 PHE N N 495 123.047 123.047 122.103 0.944 18002
5018 1 8 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.348 0.029 18002
5019 1 8 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.787 -0.874 18002
5020 1 8 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.351 -0.301 18002
5021 1 8 . 1 1 133 133 PHE H H 495 7.915 7.915 7.984 -0.069 18002
5022 1 8 . 1 1 134 134 LEU N N 496 119.311 119.311 116.318 2.993 18002
5023 1 8 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.492 -0.587 18002
5024 1 8 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.556 0.045 18002
5025 1 8 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.291 0.610 18002
5026 1 8 . 1 1 134 134 LEU H H 496 8.386 8.386 8.077 0.309 18002
5027 1 8 . 1 1 135 135 LYS N N 497 117.550 117.550 121.060 -3.510 18002
5028 1 8 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.238 -0.298 18002
5029 1 8 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.949 -0.674 18002
5030 1 8 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.831 -0.337 18002
5031 1 8 . 1 1 135 135 LYS H H 497 7.670 7.670 8.462 -0.792 18002
5032 1 8 . 1 1 136 136 MET N N 498 116.106 116.106 114.824 1.282 18002
5033 1 8 . 1 1 136 136 MET HA H 498 4.354 4.354 4.632 -0.278 18002
5034 1 8 . 1 1 136 136 MET CA C 498 55.994 55.994 54.922 1.072 18002
5035 1 8 . 1 1 136 136 MET CB C 498 32.772 32.772 33.400 -0.628 18002
5036 1 8 . 1 1 136 136 MET H H 498 7.421 7.421 7.689 -0.268 18002
5037 1 8 . 1 1 137 137 GLN N N 499 118.651 118.651 121.077 -2.426 18002
5038 1 8 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.145 0.039 18002
5039 1 8 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.287 -2.979 18002
5040 1 8 . 1 1 137 137 GLN H H 499 7.617 7.617 7.836 -0.219 18002
5041 1 9 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.565 -0.440 18002
5042 1 9 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.902 -1.887 18002
5043 1 9 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.340 1.589 18002
5044 1 9 . 1 1 4 4 MET N N 366 120.431 120.431 122.404 -1.973 18002
5045 1 9 . 1 1 4 4 MET HA H 366 4.345 4.345 4.765 -0.420 18002
5046 1 9 . 1 1 4 4 MET CA C 366 55.337 55.337 55.601 -0.264 18002
5047 1 9 . 1 1 4 4 MET CB C 366 32.668 32.668 34.918 -2.250 18002
5048 1 9 . 1 1 4 4 MET H H 366 8.373 8.373 9.008 -0.635 18002
5049 1 9 . 1 1 5 5 GLY N N 367 109.318 109.318 111.721 -2.403 18002
5050 1 9 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.515 0.942 18002
5051 1 9 . 1 1 5 5 GLY H H 367 8.224 8.224 8.174 0.050 18002
5052 1 9 . 1 1 6 6 ASP N N 368 120.307 120.307 122.021 -1.714 18002
5053 1 9 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.652 -0.052 18002
5054 1 9 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.604 0.909 18002
5055 1 9 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.423 -0.097 18002
5056 1 9 . 1 1 6 6 ASP H H 368 8.199 8.199 8.301 -0.102 18002
5057 1 9 . 1 1 7 7 ILE N N 369 120.668 120.668 114.861 5.807 18002
5058 1 9 . 1 1 7 7 ILE HA H 369 4.218 4.218 3.904 0.314 18002
5059 1 9 . 1 1 7 7 ILE CA C 369 61.584 61.584 63.041 -1.457 18002
5060 1 9 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.046 0.722 18002
5061 1 9 . 1 1 7 7 ILE H H 369 8.138 8.138 8.221 -0.083 18002
5062 1 9 . 1 1 8 8 THR N N 370 117.564 117.564 112.377 5.187 18002
5063 1 9 . 1 1 8 8 THR HA H 370 4.322 4.322 3.862 0.460 18002
5064 1 9 . 1 1 8 8 THR CA C 370 62.332 62.332 64.450 -2.118 18002
5065 1 9 . 1 1 8 8 THR CB C 370 69.946 69.946 67.853 2.093 18002
5066 1 9 . 1 1 8 8 THR H H 370 8.230 8.230 7.980 0.250 18002
5067 1 9 . 1 1 9 9 SER N N 371 118.467 118.467 117.980 0.487 18002
5068 1 9 . 1 1 9 9 SER HA H 371 4.445 4.445 4.124 0.321 18002
5069 1 9 . 1 1 9 9 SER CA C 371 58.274 58.274 59.440 -1.166 18002
5070 1 9 . 1 1 9 9 SER CB C 371 63.996 63.996 62.149 1.847 18002
5071 1 9 . 1 1 9 9 SER H H 371 8.158 8.158 8.152 0.006 18002
5072 1 9 . 1 1 10 10 ILE N N 372 123.959 123.959 118.699 5.260 18002
5073 1 9 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.577 -4.861 18002
5074 1 9 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.481 2.438 18002
5075 1 9 . 1 1 10 10 ILE H H 372 8.112 8.112 7.983 0.129 18002
5076 1 9 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.571 -0.219 18002
5077 1 9 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.716 1.465 18002
5078 1 9 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.565 1.142 18002
5079 1 9 . 1 1 12 12 GLU N N 374 119.349 119.349 122.535 -3.186 18002
5080 1 9 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.729 0.058 18002
5081 1 9 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.003 0.314 18002
5082 1 9 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.453 2.138 18002
5083 1 9 . 1 1 12 12 GLU H H 374 8.017 8.017 8.144 -0.127 18002
5084 1 9 . 1 1 13 13 LEU N N 375 122.288 122.288 125.734 -3.446 18002
5085 1 9 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.730 -0.252 18002
5086 1 9 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.322 -1.391 18002
5087 1 9 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.378 1.278 18002
5088 1 9 . 1 1 13 13 LEU H H 375 8.036 8.036 8.478 -0.442 18002
5089 1 9 . 1 1 14 14 ALA N N 376 125.461 125.461 128.045 -2.584 18002
5090 1 9 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.123 0.123 18002
5091 1 9 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.499 0.246 18002
5092 1 9 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.407 -0.821 18002
5093 1 9 . 1 1 14 14 ALA H H 376 8.181 8.181 8.106 0.075 18002
5094 1 9 . 1 1 15 15 ASP N N 377 122.242 122.242 121.417 0.825 18002
5095 1 9 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.909 -0.590 18002
5096 1 9 . 1 1 15 15 ASP CA C 377 53.752 53.752 54.046 -0.294 18002
5097 1 9 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.621 2.018 18002
5098 1 9 . 1 1 15 15 ASP H H 377 8.326 8.326 8.684 -0.358 18002
5099 1 9 . 1 1 16 16 TYR N N 378 118.961 118.961 120.358 -1.397 18002
5100 1 9 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.755 -0.364 18002
5101 1 9 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.098 3.483 18002
5102 1 9 . 1 1 16 16 TYR CB C 378 39.023 39.023 40.240 -1.217 18002
5103 1 9 . 1 1 16 16 TYR H H 378 8.869 8.869 8.243 0.626 18002
5104 1 9 . 1 1 17 17 ILE N N 379 125.214 125.214 115.875 9.339 18002
5105 1 9 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.456 -0.126 18002
5106 1 9 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.657 0.075 18002
5107 1 9 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.227 -0.251 18002
5108 1 9 . 1 1 17 17 ILE H H 379 8.608 8.608 7.736 0.872 18002
5109 1 9 . 1 1 18 18 LYS N N 380 122.917 122.917 119.967 2.950 18002
5110 1 9 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.333 -0.221 18002
5111 1 9 . 1 1 18 18 LYS CA C 380 55.836 55.836 53.694 2.142 18002
5112 1 9 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.483 1.542 18002
5113 1 9 . 1 1 18 18 LYS H H 380 7.424 7.424 8.233 -0.809 18002
5114 1 9 . 1 1 19 19 VAL N N 381 122.839 122.839 122.754 0.085 18002
5115 1 9 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.720 0.543 18002
5116 1 9 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.350 1.166 18002
5117 1 9 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.735 -0.587 18002
5118 1 9 . 1 1 19 19 VAL H H 381 9.223 9.223 7.756 1.467 18002
5119 1 9 . 1 1 20 20 PHE N N 382 129.509 129.509 127.840 1.669 18002
5120 1 9 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.988 -0.145 18002
5121 1 9 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.310 -0.805 18002
5122 1 9 . 1 1 20 20 PHE CB C 382 42.862 42.862 42.478 0.384 18002
5123 1 9 . 1 1 20 20 PHE H H 382 9.451 9.451 8.073 1.378 18002
5124 1 9 . 1 1 21 21 LYS N N 383 126.417 126.417 123.386 3.031 18002
5125 1 9 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.591 0.250 18002
5126 1 9 . 1 1 21 21 LYS CB C 383 33.219 33.219 31.870 1.349 18002
5127 1 9 . 1 1 21 21 LYS H H 383 7.582 7.582 7.383 0.199 18002
5128 1 9 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.453 1.244 18002
5129 1 9 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.234 -0.265 18002
5130 1 9 . 1 1 23 23 LYS N N 385 118.026 118.026 120.170 -2.144 18002
5131 1 9 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.202 0.013 18002
5132 1 9 . 1 1 23 23 LYS CA C 385 56.345 56.345 57.759 -1.414 18002
5133 1 9 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.856 0.177 18002
5134 1 9 . 1 1 23 23 LYS H H 385 8.138 8.138 7.718 0.420 18002
5135 1 9 . 1 1 24 24 LYS N N 386 120.816 120.816 119.289 1.527 18002
5136 1 9 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.259 -0.073 18002
5137 1 9 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.464 -0.602 18002
5138 1 9 . 1 1 24 24 LYS CB C 386 32.827 32.827 31.532 1.295 18002
5139 1 9 . 1 1 24 24 LYS H H 386 7.727 7.727 7.898 -0.171 18002
5140 1 9 . 1 1 25 25 LEU N N 387 121.214 121.214 120.485 0.729 18002
5141 1 9 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.090 0.078 18002
5142 1 9 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.165 0.343 18002
5143 1 9 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.440 0.202 18002
5144 1 9 . 1 1 25 25 LEU H H 387 8.241 8.241 8.015 0.226 18002
5145 1 9 . 1 1 26 26 THR N N 388 112.798 112.798 111.891 0.907 18002
5146 1 9 . 1 1 26 26 THR HA H 388 4.313 4.313 4.037 0.276 18002
5147 1 9 . 1 1 26 26 THR CA C 388 61.795 61.795 62.928 -1.133 18002
5148 1 9 . 1 1 26 26 THR CB C 388 69.875 69.875 68.242 1.633 18002
5149 1 9 . 1 1 26 26 THR H H 388 7.700 7.700 7.945 -0.245 18002
5150 1 9 . 1 1 27 27 LEU N N 389 124.091 124.091 123.158 0.933 18002
5151 1 9 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.575 -0.221 18002
5152 1 9 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.949 0.584 18002
5153 1 9 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.151 0.147 18002
5154 1 9 . 1 1 27 27 LEU H H 389 8.260 8.260 8.069 0.191 18002
5155 1 9 . 1 1 28 28 LYS N N 390 121.153 121.153 120.431 0.722 18002
5156 1 9 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.342 -0.022 18002
5157 1 9 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.734 -0.523 18002
5158 1 9 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.518 1.157 18002
5159 1 9 . 1 1 28 28 LYS H H 390 8.202 8.202 8.047 0.155 18002
5160 1 9 . 1 1 29 29 GLY N N 391 107.270 107.270 106.614 0.656 18002
5161 1 9 . 1 1 29 29 GLY CA C 391 44.875 44.875 44.911 -0.036 18002
5162 1 9 . 1 1 29 29 GLY H H 391 7.876 7.876 7.771 0.105 18002
5163 1 9 . 1 1 30 30 TYR N N 392 118.471 118.471 117.224 1.247 18002
5164 1 9 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.233 0.213 18002
5165 1 9 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.692 -0.645 18002
5166 1 9 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.224 2.601 18002
5167 1 9 . 1 1 30 30 TYR H H 392 8.183 8.183 8.665 -0.482 18002
5168 1 9 . 1 1 31 31 LYS N N 393 122.833 122.833 122.775 0.058 18002
5169 1 9 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.645 -0.130 18002
5170 1 9 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.099 1.075 18002
5171 1 9 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.838 -1.118 18002
5172 1 9 . 1 1 31 31 LYS H H 393 8.731 8.731 7.648 1.083 18002
5173 1 9 . 1 1 32 32 GLN N N 394 124.759 124.759 122.056 2.703 18002
5174 1 9 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.657 0.021 18002
5175 1 9 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.728 1.879 18002
5176 1 9 . 1 1 32 32 GLN CB C 394 31.048 31.048 28.921 2.127 18002
5177 1 9 . 1 1 32 32 GLN H H 394 8.776 8.776 8.342 0.434 18002
5178 1 9 . 1 1 33 33 TYR N N 395 125.112 125.112 124.428 0.684 18002
5179 1 9 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.079 0.995 18002
5180 1 9 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.216 -0.052 18002
5181 1 9 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.463 2.209 18002
5182 1 9 . 1 1 33 33 TYR H H 395 8.774 8.774 7.722 1.052 18002
5183 1 9 . 1 1 34 34 TRP N N 396 122.638 122.638 122.289 0.349 18002
5184 1 9 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.377 -0.695 18002
5185 1 9 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.885 3.333 18002
5186 1 9 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.399 1.105 18002
5187 1 9 . 1 1 34 34 TRP H H 396 8.975 8.975 7.879 1.096 18002
5188 1 9 . 1 1 35 35 CYS N N 397 127.146 127.146 122.199 4.947 18002
5189 1 9 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.917 0.450 18002
5190 1 9 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.854 0.852 18002
5191 1 9 . 1 1 35 35 CYS H H 397 8.804 8.804 8.787 0.017 18002
5192 1 9 . 1 1 36 36 THR N N 398 110.578 110.578 116.553 -5.975 18002
5193 1 9 . 1 1 36 36 THR HA H 398 5.358 5.358 4.858 0.500 18002
5194 1 9 . 1 1 36 36 THR CA C 398 58.704 58.704 60.761 -2.057 18002
5195 1 9 . 1 1 36 36 THR CB C 398 71.833 71.833 71.025 0.808 18002
5196 1 9 . 1 1 36 36 THR H H 398 9.090 9.090 8.397 0.693 18002
5197 1 9 . 1 1 37 37 PHE N N 399 127.322 127.322 129.412 -2.090 18002
5198 1 9 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.693 0.260 18002
5199 1 9 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.019 -0.773 18002
5200 1 9 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.093 2.092 18002
5201 1 9 . 1 1 37 37 PHE H H 399 8.846 8.846 8.366 0.480 18002
5202 1 9 . 1 1 38 38 LYS N N 400 125.391 125.391 126.303 -0.912 18002
5203 1 9 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.570 -0.043 18002
5204 1 9 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.454 0.523 18002
5205 1 9 . 1 1 38 38 LYS CB C 400 35.915 35.915 34.149 1.766 18002
5206 1 9 . 1 1 38 38 LYS H H 400 8.252 8.252 8.010 0.242 18002
5207 1 9 . 1 1 39 39 ASP N N 401 125.083 125.083 119.210 5.873 18002
5208 1 9 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.325 -0.247 18002
5209 1 9 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.345 0.138 18002
5210 1 9 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.835 -1.314 18002
5211 1 9 . 1 1 39 39 ASP H H 401 9.408 9.408 8.871 0.537 18002
5212 1 9 . 1 1 40 40 THR N N 402 112.024 112.024 107.904 4.120 18002
5213 1 9 . 1 1 40 40 THR HA H 402 4.767 4.767 4.486 0.281 18002
5214 1 9 . 1 1 40 40 THR CA C 402 60.811 60.811 62.770 -1.959 18002
5215 1 9 . 1 1 40 40 THR CB C 402 68.823 68.823 69.836 -1.013 18002
5216 1 9 . 1 1 40 40 THR H H 402 8.224 8.224 7.928 0.296 18002
5217 1 9 . 1 1 41 41 SER N N 403 116.142 116.142 115.819 0.323 18002
5218 1 9 . 1 1 41 41 SER HA H 403 5.428 5.428 4.995 0.433 18002
5219 1 9 . 1 1 41 41 SER CA C 403 58.297 58.297 57.444 0.853 18002
5220 1 9 . 1 1 41 41 SER CB C 403 66.409 66.409 65.381 1.028 18002
5221 1 9 . 1 1 41 41 SER H H 403 8.197 8.197 7.740 0.457 18002
5222 1 9 . 1 1 42 42 ILE N N 404 122.292 122.292 118.463 3.829 18002
5223 1 9 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.442 0.487 18002
5224 1 9 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.309 1.495 18002
5225 1 9 . 1 1 42 42 ILE CB C 404 41.420 41.420 42.447 -1.027 18002
5226 1 9 . 1 1 42 42 ILE H H 404 8.411 8.411 7.837 0.574 18002
5227 1 9 . 1 1 43 43 SER N N 405 122.244 122.244 116.511 5.733 18002
5228 1 9 . 1 1 43 43 SER HA H 405 4.966 4.966 4.992 -0.026 18002
5229 1 9 . 1 1 43 43 SER CA C 405 57.735 57.735 57.321 0.414 18002
5230 1 9 . 1 1 43 43 SER CB C 405 65.388 65.388 65.590 -0.202 18002
5231 1 9 . 1 1 43 43 SER H H 405 8.752 8.752 8.489 0.263 18002
5232 1 9 . 1 1 44 44 CYS N N 406 120.004 120.004 123.687 -3.683 18002
5233 1 9 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.907 0.060 18002
5234 1 9 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.564 -0.506 18002
5235 1 9 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.165 0.275 18002
5236 1 9 . 1 1 44 44 CYS H H 406 8.470 8.470 8.837 -0.367 18002
5237 1 9 . 1 1 45 45 TYR N N 407 122.704 122.704 124.725 -2.021 18002
5238 1 9 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.150 -0.127 18002
5239 1 9 . 1 1 45 45 TYR CA C 407 56.983 56.983 55.825 1.158 18002
5240 1 9 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.239 1.335 18002
5241 1 9 . 1 1 45 45 TYR H H 407 10.013 10.013 8.071 1.942 18002
5242 1 9 . 1 1 46 46 LYS N N 408 121.897 121.897 122.852 -0.955 18002
5243 1 9 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.135 0.211 18002
5244 1 9 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.675 3.344 18002
5245 1 9 . 1 1 46 46 LYS CB C 408 32.712 32.712 32.867 -0.155 18002
5246 1 9 . 1 1 46 46 LYS H H 408 9.734 9.734 8.856 0.878 18002
5247 1 9 . 1 1 47 47 SER N N 409 106.720 106.720 114.573 -7.853 18002
5248 1 9 . 1 1 47 47 SER HA H 409 4.776 4.776 4.960 -0.184 18002
5249 1 9 . 1 1 47 47 SER CA C 409 57.180 57.180 56.931 0.249 18002
5250 1 9 . 1 1 47 47 SER CB C 409 65.870 65.870 65.731 0.139 18002
5251 1 9 . 1 1 47 47 SER H H 409 7.518 7.518 7.940 -0.422 18002
5252 1 9 . 1 1 48 48 LYS N N 410 122.302 122.302 123.391 -1.089 18002
5253 1 9 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.854 1.380 18002
5254 1 9 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.959 0.340 18002
5255 1 9 . 1 1 48 48 LYS H H 410 8.195 8.195 8.680 -0.485 18002
5256 1 9 . 1 1 49 49 GLU N N 411 118.983 118.983 119.473 -0.490 18002
5257 1 9 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.184 0.598 18002
5258 1 9 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.726 0.809 18002
5259 1 9 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.421 -0.733 18002
5260 1 9 . 1 1 49 49 GLU H H 411 8.752 8.752 8.506 0.246 18002
5261 1 9 . 1 1 50 50 GLU N N 412 118.384 118.384 118.418 -0.034 18002
5262 1 9 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.217 0.276 18002
5263 1 9 . 1 1 50 50 GLU CA C 412 55.789 55.789 58.191 -2.402 18002
5264 1 9 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.009 0.996 18002
5265 1 9 . 1 1 50 50 GLU H H 412 7.234 7.234 8.806 -1.572 18002
5266 1 9 . 1 1 51 51 SER N N 413 114.767 114.767 114.656 0.111 18002
5267 1 9 . 1 1 51 51 SER CA C 413 59.764 59.764 60.625 -0.861 18002
5268 1 9 . 1 1 51 51 SER CB C 413 62.965 62.965 62.635 0.330 18002
5269 1 9 . 1 1 51 51 SER H H 413 7.382 7.382 8.100 -0.718 18002
5270 1 9 . 1 1 52 52 SER N N 414 114.496 114.496 112.231 2.265 18002
5271 1 9 . 1 1 52 52 SER HA H 414 4.560 4.560 4.597 -0.037 18002
5272 1 9 . 1 1 52 52 SER CA C 414 58.574 58.574 58.243 0.331 18002
5273 1 9 . 1 1 52 52 SER CB C 414 63.829 63.829 64.492 -0.663 18002
5274 1 9 . 1 1 52 52 SER H H 414 7.682 7.682 7.492 0.190 18002
5275 1 9 . 1 1 53 53 GLY N N 415 111.107 111.107 111.026 0.081 18002
5276 1 9 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.265 -1.032 18002
5277 1 9 . 1 1 53 53 GLY H H 415 7.918 7.918 8.068 -0.150 18002
5278 1 9 . 1 1 54 54 THR N N 416 120.214 120.214 117.417 2.797 18002
5279 1 9 . 1 1 54 54 THR CB C 416 70.035 70.035 69.771 0.264 18002
5280 1 9 . 1 1 54 54 THR H H 416 8.622 8.622 8.103 0.519 18002
5281 1 9 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.522 -0.047 18002
5282 1 9 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.876 0.169 18002
5283 1 9 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.659 -1.081 18002
5284 1 9 . 1 1 56 56 ALA N N 418 125.591 125.591 124.086 1.505 18002
5285 1 9 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.114 -0.158 18002
5286 1 9 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.156 0.379 18002
5287 1 9 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.575 -0.668 18002
5288 1 9 . 1 1 56 56 ALA H H 418 8.288 8.288 8.667 -0.379 18002
5289 1 9 . 1 1 57 57 HIS N N 419 108.119 108.119 114.269 -6.150 18002
5290 1 9 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.729 -0.107 18002
5291 1 9 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.416 -1.836 18002
5292 1 9 . 1 1 57 57 HIS CB C 419 34.219 34.219 33.658 0.561 18002
5293 1 9 . 1 1 57 57 HIS H H 419 7.072 7.072 7.686 -0.614 18002
5294 1 9 . 1 1 58 58 GLN N N 420 123.083 123.083 123.104 -0.021 18002
5295 1 9 . 1 1 58 58 GLN HA H 420 5.155 5.155 5.108 0.047 18002
5296 1 9 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.810 0.694 18002
5297 1 9 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.214 2.276 18002
5298 1 9 . 1 1 58 58 GLN H H 420 8.669 8.669 8.619 0.050 18002
5299 1 9 . 1 1 59 59 MET N N 421 122.330 122.330 121.434 0.896 18002
5300 1 9 . 1 1 59 59 MET HA H 421 4.621 4.621 4.836 -0.215 18002
5301 1 9 . 1 1 59 59 MET CA C 421 54.892 54.892 54.328 0.564 18002
5302 1 9 . 1 1 59 59 MET CB C 421 35.650 35.650 36.033 -0.383 18002
5303 1 9 . 1 1 59 59 MET H H 421 8.995 8.995 7.955 1.040 18002
5304 1 9 . 1 1 60 60 ASN N N 422 123.220 123.220 118.369 4.851 18002
5305 1 9 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.769 0.179 18002
5306 1 9 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.700 -0.069 18002
5307 1 9 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.432 0.307 18002
5308 1 9 . 1 1 60 60 ASN H H 422 8.728 8.728 8.508 0.220 18002
5309 1 9 . 1 1 61 61 LEU N N 423 126.072 126.072 123.482 2.590 18002
5310 1 9 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.278 -0.162 18002
5311 1 9 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.173 1.440 18002
5312 1 9 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.090 1.367 18002
5313 1 9 . 1 1 61 61 LEU H H 423 8.942 8.942 8.353 0.589 18002
5314 1 9 . 1 1 62 62 ARG N N 424 121.977 121.977 117.036 4.941 18002
5315 1 9 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.990 0.382 18002
5316 1 9 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.776 2.258 18002
5317 1 9 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.087 -0.477 18002
5318 1 9 . 1 1 62 62 ARG H H 424 8.000 8.000 7.923 0.077 18002
5319 1 9 . 1 1 63 63 GLY N N 425 114.852 114.852 107.588 7.264 18002
5320 1 9 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.769 0.041 18002
5321 1 9 . 1 1 63 63 GLY H H 425 9.033 9.033 8.605 0.428 18002
5322 1 9 . 1 1 64 64 CYS N N 426 117.102 117.102 116.726 0.376 18002
5323 1 9 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.801 0.098 18002
5324 1 9 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.193 1.567 18002
5325 1 9 . 1 1 64 64 CYS CB C 426 28.824 28.824 28.743 0.081 18002
5326 1 9 . 1 1 64 64 CYS H H 426 8.248 8.248 7.632 0.616 18002
5327 1 9 . 1 1 65 65 GLU N N 427 119.501 119.501 120.323 -0.822 18002
5328 1 9 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.598 0.179 18002
5329 1 9 . 1 1 65 65 GLU CA C 427 55.391 55.391 54.491 0.900 18002
5330 1 9 . 1 1 65 65 GLU CB C 427 31.938 31.938 33.294 -1.356 18002
5331 1 9 . 1 1 65 65 GLU H H 427 8.449 8.449 8.990 -0.541 18002
5332 1 9 . 1 1 66 66 VAL N N 428 125.286 125.286 120.928 4.358 18002
5333 1 9 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.780 0.110 18002
5334 1 9 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.184 0.568 18002
5335 1 9 . 1 1 66 66 VAL CB C 428 33.975 33.975 35.387 -1.412 18002
5336 1 9 . 1 1 66 66 VAL H H 428 8.624 8.624 8.443 0.181 18002
5337 1 9 . 1 1 67 67 THR N N 429 124.132 124.132 122.583 1.549 18002
5338 1 9 . 1 1 67 67 THR CA C 429 59.338 59.338 59.990 -0.652 18002
5339 1 9 . 1 1 67 67 THR CB C 429 72.021 72.021 69.676 2.345 18002
5340 1 9 . 1 1 67 67 THR H H 429 9.247 9.247 8.219 1.028 18002
5341 1 9 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.541 0.108 18002
5342 1 9 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.536 0.202 18002
5343 1 9 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.131 1.437 18002
5344 1 9 . 1 1 69 69 ASP N N 431 122.066 122.066 123.464 -1.398 18002
5345 1 9 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.668 -0.021 18002
5346 1 9 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.683 -0.014 18002
5347 1 9 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.727 -0.622 18002
5348 1 9 . 1 1 69 69 ASP H H 431 8.250 8.250 8.302 -0.052 18002
5349 1 9 . 1 1 70 70 VAL N N 432 121.874 121.874 122.571 -0.697 18002
5350 1 9 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.665 -0.166 18002
5351 1 9 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.410 -0.322 18002
5352 1 9 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.783 1.249 18002
5353 1 9 . 1 1 70 70 VAL H H 432 8.305 8.305 7.917 0.388 18002
5354 1 9 . 1 1 71 71 ASN N N 433 124.366 124.366 128.228 -3.862 18002
5355 1 9 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.020 -0.338 18002
5356 1 9 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.050 0.711 18002
5357 1 9 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.541 0.738 18002
5358 1 9 . 1 1 71 71 ASN H H 433 8.637 8.637 8.246 0.391 18002
5359 1 9 . 1 1 72 72 ILE N N 434 126.786 126.786 126.726 0.060 18002
5360 1 9 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.955 -0.584 18002
5361 1 9 . 1 1 72 72 ILE CA C 434 64.518 64.518 64.397 0.121 18002
5362 1 9 . 1 1 72 72 ILE CB C 434 37.175 37.175 38.308 -1.133 18002
5363 1 9 . 1 1 72 72 ILE H H 434 8.943 8.943 8.972 -0.029 18002
5364 1 9 . 1 1 73 73 SER N N 435 118.305 118.305 115.076 3.229 18002
5365 1 9 . 1 1 73 73 SER CA C 435 61.633 61.633 60.921 0.712 18002
5366 1 9 . 1 1 73 73 SER CB C 435 62.435 62.435 63.366 -0.931 18002
5367 1 9 . 1 1 73 73 SER H H 435 8.578 8.578 8.230 0.348 18002
5368 1 9 . 1 1 74 74 GLY N N 436 107.443 107.443 109.212 -1.769 18002
5369 1 9 . 1 1 74 74 GLY CA C 436 44.861 44.861 46.025 -1.164 18002
5370 1 9 . 1 1 74 74 GLY H H 436 7.620 7.620 8.541 -0.921 18002
5371 1 9 . 1 1 75 75 GLN N N 437 116.895 116.895 116.918 -0.023 18002
5372 1 9 . 1 1 75 75 GLN HA H 437 3.290 3.290 4.486 -1.196 18002
5373 1 9 . 1 1 75 75 GLN CA C 437 56.701 56.701 55.277 1.424 18002
5374 1 9 . 1 1 75 75 GLN CB C 437 26.745 26.745 31.641 -4.896 18002
5375 1 9 . 1 1 75 75 GLN H H 437 7.798 7.798 8.177 -0.379 18002
5376 1 9 . 1 1 76 76 LYS N N 438 119.308 119.308 115.561 3.747 18002
5377 1 9 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.564 -0.422 18002
5378 1 9 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.739 -0.696 18002
5379 1 9 . 1 1 76 76 LYS CB C 438 33.945 33.945 33.007 0.938 18002
5380 1 9 . 1 1 76 76 LYS H H 438 7.522 7.522 8.063 -0.541 18002
5381 1 9 . 1 1 77 77 PHE N N 439 125.905 125.905 120.192 5.713 18002
5382 1 9 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.762 -0.551 18002
5383 1 9 . 1 1 77 77 PHE CA C 439 55.639 55.639 58.390 -2.751 18002
5384 1 9 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.462 0.467 18002
5385 1 9 . 1 1 77 77 PHE H H 439 8.461 8.461 8.841 -0.380 18002
5386 1 9 . 1 1 78 78 ASN N N 440 120.787 120.787 123.196 -2.409 18002
5387 1 9 . 1 1 78 78 ASN CA C 440 51.913 51.913 53.066 -1.153 18002
5388 1 9 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.971 -0.168 18002
5389 1 9 . 1 1 78 78 ASN H H 440 7.638 7.638 8.399 -0.761 18002
5390 1 9 . 1 1 79 79 ILE N N 441 123.421 123.421 123.711 -0.290 18002
5391 1 9 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.649 -0.478 18002
5392 1 9 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.020 1.547 18002
5393 1 9 . 1 1 79 79 ILE CB C 441 41.487 41.487 41.674 -0.187 18002
5394 1 9 . 1 1 79 79 ILE H H 441 9.550 9.550 8.339 1.211 18002
5395 1 9 . 1 1 80 80 LYS N N 442 126.267 126.267 125.830 0.437 18002
5396 1 9 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.433 0.029 18002
5397 1 9 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.083 1.300 18002
5398 1 9 . 1 1 80 80 LYS CB C 442 32.987 32.987 34.468 -1.482 18002
5399 1 9 . 1 1 80 80 LYS H H 442 8.703 8.703 8.028 0.675 18002
5400 1 9 . 1 1 81 81 LEU N N 443 125.194 125.194 123.152 2.042 18002
5401 1 9 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.948 0.324 18002
5402 1 9 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.222 0.127 18002
5403 1 9 . 1 1 81 81 LEU CB C 443 44.704 44.704 44.535 0.169 18002
5404 1 9 . 1 1 81 81 LEU H H 443 9.223 9.223 8.555 0.668 18002
5405 1 9 . 1 1 82 82 LEU N N 444 122.753 122.753 127.006 -4.253 18002
5406 1 9 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.082 -0.068 18002
5407 1 9 . 1 1 82 82 LEU CA C 444 53.918 53.918 52.887 1.031 18002
5408 1 9 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.385 -2.760 18002
5409 1 9 . 1 1 82 82 LEU H H 444 8.420 8.420 7.980 0.440 18002
5410 1 9 . 1 1 83 83 ILE N N 445 125.584 125.584 121.912 3.672 18002
5411 1 9 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.159 0.126 18002
5412 1 9 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.784 -0.748 18002
5413 1 9 . 1 1 83 83 ILE H H 445 9.010 9.010 7.997 1.013 18002
5414 1 9 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.729 0.190 18002
5415 1 9 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.581 1.452 18002
5416 1 9 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.034 0.913 18002
5417 1 9 . 1 1 85 85 VAL N N 447 119.780 119.780 117.487 2.293 18002
5418 1 9 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.555 -0.052 18002
5419 1 9 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.530 0.812 18002
5420 1 9 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.402 0.864 18002
5421 1 9 . 1 1 85 85 VAL H H 447 8.304 8.304 8.574 -0.270 18002
5422 1 9 . 1 1 86 86 ALA N N 448 125.178 125.178 121.743 3.435 18002
5423 1 9 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.171 -0.196 18002
5424 1 9 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.721 0.840 18002
5425 1 9 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.342 -0.354 18002
5426 1 9 . 1 1 86 86 ALA H H 448 8.526 8.526 8.467 0.059 18002
5427 1 9 . 1 1 87 87 GLU N N 449 114.625 114.625 118.285 -3.660 18002
5428 1 9 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.134 0.156 18002
5429 1 9 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.286 -0.555 18002
5430 1 9 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.881 -0.621 18002
5431 1 9 . 1 1 87 87 GLU H H 449 8.402 8.402 8.735 -0.333 18002
5432 1 9 . 1 1 88 88 GLY N N 450 109.432 109.432 106.448 2.984 18002
5433 1 9 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.833 1.004 18002
5434 1 9 . 1 1 88 88 GLY H H 450 7.711 7.711 7.850 -0.139 18002
5435 1 9 . 1 1 89 89 MET N N 451 121.382 121.382 119.135 2.247 18002
5436 1 9 . 1 1 89 89 MET HA H 451 5.076 5.076 5.303 -0.227 18002
5437 1 9 . 1 1 89 89 MET CA C 451 53.860 53.860 54.574 -0.714 18002
5438 1 9 . 1 1 89 89 MET CB C 451 35.942 35.942 36.824 -0.882 18002
5439 1 9 . 1 1 89 89 MET H H 451 8.355 8.355 7.873 0.482 18002
5440 1 9 . 1 1 90 90 ASN N N 452 123.538 123.538 121.807 1.731 18002
5441 1 9 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.935 0.018 18002
5442 1 9 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.556 -0.808 18002
5443 1 9 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.590 1.052 18002
5444 1 9 . 1 1 90 90 ASN H H 452 9.338 9.338 8.815 0.523 18002
5445 1 9 . 1 1 91 91 GLU N N 453 125.978 125.978 124.019 1.959 18002
5446 1 9 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.277 1.067 18002
5447 1 9 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.630 -1.357 18002
5448 1 9 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.243 1.500 18002
5449 1 9 . 1 1 91 91 GLU H H 453 8.168 8.168 8.685 -0.517 18002
5450 1 9 . 1 1 92 92 ILE N N 454 126.776 126.776 124.105 2.671 18002
5451 1 9 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.486 0.080 18002
5452 1 9 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.930 0.118 18002
5453 1 9 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.216 1.046 18002
5454 1 9 . 1 1 92 92 ILE H H 454 9.000 9.000 8.203 0.797 18002
5455 1 9 . 1 1 93 93 TRP N N 455 125.987 125.987 127.224 -1.237 18002
5456 1 9 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.966 -0.374 18002
5457 1 9 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.900 -2.110 18002
5458 1 9 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.192 1.194 18002
5459 1 9 . 1 1 93 93 TRP H H 455 9.278 9.278 9.151 0.127 18002
5460 1 9 . 1 1 94 94 LEU N N 456 120.912 120.912 121.364 -0.452 18002
5461 1 9 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.364 -0.002 18002
5462 1 9 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.635 -0.419 18002
5463 1 9 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.891 -0.297 18002
5464 1 9 . 1 1 94 94 LEU H H 456 9.534 9.534 8.118 1.416 18002
5465 1 9 . 1 1 95 95 ARG N N 457 123.669 123.669 119.998 3.671 18002
5466 1 9 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.689 0.582 18002
5467 1 9 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.718 -0.301 18002
5468 1 9 . 1 1 95 95 ARG CB C 457 33.262 33.262 33.264 -0.002 18002
5469 1 9 . 1 1 95 95 ARG H H 457 9.439 9.439 8.746 0.693 18002
5470 1 9 . 1 1 96 96 CYS N N 458 125.273 125.273 119.934 5.339 18002
5471 1 9 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.489 0.209 18002
5472 1 9 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.014 0.778 18002
5473 1 9 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.850 -1.447 18002
5474 1 9 . 1 1 96 96 CYS H H 458 8.652 8.652 8.764 -0.112 18002
5475 1 9 . 1 1 97 97 ASP N N 459 119.661 119.661 118.129 1.532 18002
5476 1 9 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.057 0.683 18002
5477 1 9 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.789 2.439 18002
5478 1 9 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.176 1.409 18002
5479 1 9 . 1 1 97 97 ASP H H 459 9.116 9.116 8.087 1.029 18002
5480 1 9 . 1 1 98 98 ASN N N 460 109.173 109.173 117.168 -7.995 18002
5481 1 9 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.633 -0.261 18002
5482 1 9 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.322 -0.308 18002
5483 1 9 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.699 0.112 18002
5484 1 9 . 1 1 98 98 ASN H H 460 7.054 7.054 7.278 -0.224 18002
5485 1 9 . 1 1 99 99 GLU N N 461 119.220 119.220 124.718 -5.498 18002
5486 1 9 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.028 0.016 18002
5487 1 9 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.248 0.520 18002
5488 1 9 . 1 1 99 99 GLU H H 461 8.937 8.937 9.235 -0.298 18002
5489 1 9 . 1 1 100 100 LYS N N 462 120.647 120.647 117.766 2.881 18002
5490 1 9 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.112 0.533 18002
5491 1 9 . 1 1 100 100 LYS CA C 462 60.536 60.536 58.604 1.932 18002
5492 1 9 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.760 0.468 18002
5493 1 9 . 1 1 100 100 LYS H H 462 8.033 8.033 8.263 -0.230 18002
5494 1 9 . 1 1 101 101 GLN N N 463 121.938 121.938 120.028 1.910 18002
5495 1 9 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.242 0.158 18002
5496 1 9 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.701 0.694 18002
5497 1 9 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.721 3.493 18002
5498 1 9 . 1 1 101 101 GLN H H 463 8.372 8.372 8.617 -0.245 18002
5499 1 9 . 1 1 102 102 TYR N N 464 117.422 117.422 120.523 -3.101 18002
5500 1 9 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.311 0.305 18002
5501 1 9 . 1 1 102 102 TYR CA C 464 61.677 61.677 59.749 1.928 18002
5502 1 9 . 1 1 102 102 TYR CB C 464 38.859 38.859 37.484 1.375 18002
5503 1 9 . 1 1 102 102 TYR H H 464 8.221 8.221 7.867 0.354 18002
5504 1 9 . 1 1 103 103 ALA N N 465 120.655 120.655 121.040 -0.385 18002
5505 1 9 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.890 -0.175 18002
5506 1 9 . 1 1 103 103 ALA CA C 465 55.913 55.913 55.034 0.879 18002
5507 1 9 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.142 0.660 18002
5508 1 9 . 1 1 103 103 ALA H H 465 8.637 8.637 7.870 0.767 18002
5509 1 9 . 1 1 104 104 HIS N N 466 112.871 112.871 117.020 -4.149 18002
5510 1 9 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.471 -0.330 18002
5511 1 9 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.712 0.915 18002
5512 1 9 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.124 -1.266 18002
5513 1 9 . 1 1 104 104 HIS H H 466 7.852 7.852 7.868 -0.016 18002
5514 1 9 . 1 1 105 105 TRP N N 467 121.317 121.317 118.344 2.973 18002
5515 1 9 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.531 -0.836 18002
5516 1 9 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.323 1.019 18002
5517 1 9 . 1 1 105 105 TRP CB C 467 27.505 27.505 28.942 -1.437 18002
5518 1 9 . 1 1 105 105 TRP H H 467 8.668 8.668 8.024 0.644 18002
5519 1 9 . 1 1 106 106 MET N N 468 122.346 122.346 119.866 2.480 18002
5520 1 9 . 1 1 106 106 MET HA H 468 4.086 4.086 4.123 -0.037 18002
5521 1 9 . 1 1 106 106 MET CA C 468 58.743 58.743 58.514 0.230 18002
5522 1 9 . 1 1 106 106 MET CB C 468 31.402 31.402 31.503 -0.102 18002
5523 1 9 . 1 1 106 106 MET H H 468 9.790 9.790 8.367 1.423 18002
5524 1 9 . 1 1 107 107 ALA N N 469 119.758 119.758 121.157 -1.399 18002
5525 1 9 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.053 -0.348 18002
5526 1 9 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.080 2.049 18002
5527 1 9 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.380 2.025 18002
5528 1 9 . 1 1 107 107 ALA H H 469 7.702 7.702 7.549 0.153 18002
5529 1 9 . 1 1 108 108 ALA N N 470 119.233 119.233 123.151 -3.918 18002
5530 1 9 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.791 -0.245 18002
5531 1 9 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.362 0.459 18002
5532 1 9 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.127 -1.395 18002
5533 1 9 . 1 1 108 108 ALA H H 470 7.156 7.156 7.757 -0.601 18002
5534 1 9 . 1 1 109 109 CYS N N 471 116.736 116.736 115.033 1.703 18002
5535 1 9 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.069 -0.012 18002
5536 1 9 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.042 3.529 18002
5537 1 9 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.527 -0.135 18002
5538 1 9 . 1 1 109 109 CYS H H 471 8.256 8.256 8.529 -0.273 18002
5539 1 9 . 1 1 110 110 ARG N N 472 118.644 118.644 120.964 -2.320 18002
5540 1 9 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.096 -0.362 18002
5541 1 9 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.038 2.167 18002
5542 1 9 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.988 0.329 18002
5543 1 9 . 1 1 110 110 ARG H H 472 8.403 8.403 7.759 0.644 18002
5544 1 9 . 1 1 111 111 LEU N N 473 121.877 121.877 120.541 1.336 18002
5545 1 9 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.574 0.226 18002
5546 1 9 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.482 2.373 18002
5547 1 9 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.953 -0.533 18002
5548 1 9 . 1 1 111 111 LEU H H 473 7.916 7.916 8.190 -0.274 18002
5549 1 9 . 1 1 112 112 ALA N N 474 122.765 122.765 120.044 2.721 18002
5550 1 9 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.841 0.639 18002
5551 1 9 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.859 0.402 18002
5552 1 9 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.111 1.764 18002
5553 1 9 . 1 1 112 112 ALA H H 474 8.393 8.393 8.751 -0.358 18002
5554 1 9 . 1 1 113 113 SER N N 475 113.613 113.613 113.400 0.213 18002
5555 1 9 . 1 1 113 113 SER HA H 475 4.782 4.782 4.189 0.593 18002
5556 1 9 . 1 1 113 113 SER CA C 475 61.090 61.090 61.224 -0.134 18002
5557 1 9 . 1 1 113 113 SER CB C 475 63.612 63.612 63.085 0.527 18002
5558 1 9 . 1 1 113 113 SER H H 475 8.150 8.150 8.122 0.028 18002
5559 1 9 . 1 1 114 114 LYS N N 476 118.734 118.734 117.599 1.135 18002
5560 1 9 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.242 0.311 18002
5561 1 9 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.454 -1.310 18002
5562 1 9 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.580 0.011 18002
5563 1 9 . 1 1 114 114 LYS H H 476 7.239 7.239 7.650 -0.411 18002
5564 1 9 . 1 1 115 115 GLY N N 477 107.818 107.818 107.947 -0.129 18002
5565 1 9 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.311 0.675 18002
5566 1 9 . 1 1 115 115 GLY H H 477 8.401 8.401 7.799 0.602 18002
5567 1 9 . 1 1 116 116 LYS N N 478 120.938 120.938 119.483 1.455 18002
5568 1 9 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.563 0.010 18002
5569 1 9 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.174 0.673 18002
5570 1 9 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.300 0.021 18002
5571 1 9 . 1 1 116 116 LYS H H 478 8.142 8.142 7.417 0.725 18002
5572 1 9 . 1 1 117 117 THR N N 479 108.076 108.076 116.272 -8.196 18002
5573 1 9 . 1 1 117 117 THR HA H 479 4.671 4.671 4.368 0.303 18002
5574 1 9 . 1 1 117 117 THR CA C 479 59.191 59.191 59.880 -0.689 18002
5575 1 9 . 1 1 117 117 THR CB C 479 72.228 72.228 69.684 2.543 18002
5576 1 9 . 1 1 117 117 THR H H 479 7.926 7.926 7.777 0.149 18002
5577 1 9 . 1 1 118 118 MET N N 480 116.403 116.403 117.289 -0.886 18002
5578 1 9 . 1 1 118 118 MET HA H 480 3.352 3.352 4.365 -1.013 18002
5579 1 9 . 1 1 118 118 MET CA C 480 57.947 57.947 56.493 1.454 18002
5580 1 9 . 1 1 118 118 MET CB C 480 33.920 33.920 31.016 2.904 18002
5581 1 9 . 1 1 118 118 MET H H 480 8.899 8.899 8.421 0.478 18002
5582 1 9 . 1 1 119 119 ALA N N 481 117.786 117.786 120.405 -2.619 18002
5583 1 9 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.455 -0.371 18002
5584 1 9 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.496 1.099 18002
5585 1 9 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.357 -0.295 18002
5586 1 9 . 1 1 119 119 ALA H H 481 7.645 7.645 7.765 -0.120 18002
5587 1 9 . 1 1 120 120 ASP N N 482 120.348 120.348 120.913 -0.565 18002
5588 1 9 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.144 3.472 18002
5589 1 9 . 1 1 120 120 ASP H H 482 7.887 7.887 7.433 0.454 18002
5590 1 9 . 1 1 121 121 SER HA H 483 4.223 4.223 4.111 0.112 18002
5591 1 9 . 1 1 121 121 SER CA C 483 61.455 61.455 60.676 0.779 18002
5592 1 9 . 1 1 121 121 SER CB C 483 62.996 62.996 62.986 0.010 18002
5593 1 9 . 1 1 122 122 SER N N 484 116.845 116.845 118.512 -1.667 18002
5594 1 9 . 1 1 122 122 SER HA H 484 4.321 4.321 4.325 -0.004 18002
5595 1 9 . 1 1 122 122 SER CA C 484 60.584 60.584 61.291 -0.707 18002
5596 1 9 . 1 1 122 122 SER CB C 484 64.314 64.314 63.380 0.934 18002
5597 1 9 . 1 1 122 122 SER H H 484 8.875 8.875 7.803 1.073 18002
5598 1 9 . 1 1 123 123 TYR N N 485 124.153 124.153 123.140 1.013 18002
5599 1 9 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.587 -0.707 18002
5600 1 9 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.914 2.400 18002
5601 1 9 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.986 -0.245 18002
5602 1 9 . 1 1 123 123 TYR H H 485 8.018 8.018 7.817 0.201 18002
5603 1 9 . 1 1 124 124 ASN N N 486 115.339 115.339 118.509 -3.170 18002
5604 1 9 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.410 -0.469 18002
5605 1 9 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.500 0.206 18002
5606 1 9 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.959 0.097 18002
5607 1 9 . 1 1 124 124 ASN H H 486 8.665 8.665 8.842 -0.177 18002
5608 1 9 . 1 1 125 125 LEU N N 487 119.454 119.454 119.359 0.095 18002
5609 1 9 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.257 -0.319 18002
5610 1 9 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.353 0.317 18002
5611 1 9 . 1 1 125 125 LEU CB C 487 41.568 41.568 42.353 -0.785 18002
5612 1 9 . 1 1 125 125 LEU H H 487 7.105 7.105 7.559 -0.454 18002
5613 1 9 . 1 1 126 126 GLU N N 488 121.189 121.189 119.329 1.860 18002
5614 1 9 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.004 0.026 18002
5615 1 9 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.383 -0.348 18002
5616 1 9 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.618 -0.533 18002
5617 1 9 . 1 1 126 126 GLU H H 488 8.053 8.053 8.256 -0.203 18002
5618 1 9 . 1 1 127 127 VAL N N 489 119.073 119.073 119.911 -0.838 18002
5619 1 9 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.885 -0.867 18002
5620 1 9 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.253 2.069 18002
5621 1 9 . 1 1 127 127 VAL CB C 489 31.659 31.659 32.196 -0.537 18002
5622 1 9 . 1 1 127 127 VAL H H 489 7.769 7.769 8.130 -0.361 18002
5623 1 9 . 1 1 128 128 GLN N N 490 116.214 116.214 117.426 -1.212 18002
5624 1 9 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.054 -0.222 18002
5625 1 9 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.334 0.422 18002
5626 1 9 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.059 0.053 18002
5627 1 9 . 1 1 128 128 GLN H H 490 7.542 7.542 7.772 -0.230 18002
5628 1 9 . 1 1 129 129 ASN N N 491 120.003 120.003 118.237 1.766 18002
5629 1 9 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.577 -0.158 18002
5630 1 9 . 1 1 129 129 ASN CA C 491 56.160 56.160 56.160 -0.000 18002
5631 1 9 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.573 -0.513 18002
5632 1 9 . 1 1 129 129 ASN H H 491 8.582 8.582 7.738 0.844 18002
5633 1 9 . 1 1 130 130 ILE N N 492 122.365 122.365 119.372 2.993 18002
5634 1 9 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.262 2.491 18002
5635 1 9 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.584 1.562 18002
5636 1 9 . 1 1 130 130 ILE H H 492 8.186 8.186 7.329 0.857 18002
5637 1 9 . 1 1 131 131 LEU N N 493 119.597 119.597 118.728 0.869 18002
5638 1 9 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.065 -0.060 18002
5639 1 9 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.249 0.610 18002
5640 1 9 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.450 0.086 18002
5641 1 9 . 1 1 131 131 LEU H H 493 8.224 8.224 7.651 0.573 18002
5642 1 9 . 1 1 132 132 SER N N 494 114.884 114.884 113.947 0.937 18002
5643 1 9 . 1 1 132 132 SER HA H 494 4.430 4.430 4.197 0.233 18002
5644 1 9 . 1 1 132 132 SER CA C 494 62.072 62.072 60.654 1.419 18002
5645 1 9 . 1 1 132 132 SER CB C 494 62.703 62.703 62.901 -0.198 18002
5646 1 9 . 1 1 132 132 SER H H 494 8.464 8.464 7.448 1.016 18002
5647 1 9 . 1 1 133 133 PHE N N 495 123.047 123.047 122.232 0.815 18002
5648 1 9 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.231 0.146 18002
5649 1 9 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.670 -0.757 18002
5650 1 9 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.397 -0.347 18002
5651 1 9 . 1 1 133 133 PHE H H 495 7.915 7.915 8.053 -0.138 18002
5652 1 9 . 1 1 134 134 LEU N N 496 119.311 119.311 118.150 1.161 18002
5653 1 9 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.029 -0.124 18002
5654 1 9 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.914 -1.313 18002
5655 1 9 . 1 1 134 134 LEU CB C 496 41.901 41.901 40.987 0.914 18002
5656 1 9 . 1 1 134 134 LEU H H 496 8.386 8.386 8.124 0.262 18002
5657 1 9 . 1 1 135 135 LYS N N 497 117.550 117.550 119.267 -1.717 18002
5658 1 9 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.055 -0.115 18002
5659 1 9 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.803 -0.528 18002
5660 1 9 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.348 0.146 18002
5661 1 9 . 1 1 135 135 LYS H H 497 7.670 7.670 7.588 0.082 18002
5662 1 9 . 1 1 136 136 MET N N 498 116.106 116.106 114.381 1.725 18002
5663 1 9 . 1 1 136 136 MET HA H 498 4.354 4.354 4.449 -0.095 18002
5664 1 9 . 1 1 136 136 MET CA C 498 55.994 55.994 57.373 -1.379 18002
5665 1 9 . 1 1 136 136 MET CB C 498 32.772 32.772 33.300 -0.528 18002
5666 1 9 . 1 1 136 136 MET H H 498 7.421 7.421 8.230 -0.809 18002
5667 1 9 . 1 1 137 137 GLN N N 499 118.651 118.651 119.633 -0.982 18002
5668 1 9 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.246 -0.062 18002
5669 1 9 . 1 1 137 137 GLN CA C 499 55.308 55.308 56.613 -1.305 18002
5670 1 9 . 1 1 137 137 GLN H H 499 7.617 7.617 7.830 -0.213 18002
5671 1 10 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.605 -0.480 18002
5672 1 10 . 1 1 3 3 HIS CA C 365 55.015 55.015 55.936 -0.921 18002
5673 1 10 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.966 1.963 18002
5674 1 10 . 1 1 4 4 MET N N 366 120.431 120.431 116.160 4.271 18002
5675 1 10 . 1 1 4 4 MET HA H 366 4.345 4.345 4.623 -0.278 18002
5676 1 10 . 1 1 4 4 MET CA C 366 55.337 55.337 55.752 -0.415 18002
5677 1 10 . 1 1 4 4 MET CB C 366 32.668 32.668 33.199 -0.531 18002
5678 1 10 . 1 1 4 4 MET H H 366 8.373 8.373 8.542 -0.169 18002
5679 1 10 . 1 1 5 5 GLY N N 367 109.318 109.318 110.412 -1.094 18002
5680 1 10 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.877 0.580 18002
5681 1 10 . 1 1 5 5 GLY H H 367 8.224 8.224 8.093 0.131 18002
5682 1 10 . 1 1 6 6 ASP N N 368 120.307 120.307 118.961 1.346 18002
5683 1 10 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.833 -0.233 18002
5684 1 10 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.956 0.557 18002
5685 1 10 . 1 1 6 6 ASP CB C 368 41.326 41.326 44.573 -3.247 18002
5686 1 10 . 1 1 6 6 ASP H H 368 8.199 8.199 7.955 0.244 18002
5687 1 10 . 1 1 7 7 ILE N N 369 120.668 120.668 119.464 1.204 18002
5688 1 10 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.074 0.144 18002
5689 1 10 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.658 -0.074 18002
5690 1 10 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.912 0.856 18002
5691 1 10 . 1 1 7 7 ILE H H 369 8.138 8.138 8.328 -0.190 18002
5692 1 10 . 1 1 8 8 THR N N 370 117.564 117.564 114.029 3.535 18002
5693 1 10 . 1 1 8 8 THR HA H 370 4.322 4.322 4.393 -0.071 18002
5694 1 10 . 1 1 8 8 THR CA C 370 62.332 62.332 61.179 1.153 18002
5695 1 10 . 1 1 8 8 THR CB C 370 69.946 69.946 69.625 0.321 18002
5696 1 10 . 1 1 8 8 THR H H 370 8.230 8.230 7.522 0.708 18002
5697 1 10 . 1 1 9 9 SER N N 371 118.467 118.467 118.135 0.332 18002
5698 1 10 . 1 1 9 9 SER HA H 371 4.445 4.445 4.730 -0.285 18002
5699 1 10 . 1 1 9 9 SER CA C 371 58.274 58.274 57.101 1.173 18002
5700 1 10 . 1 1 9 9 SER CB C 371 63.996 63.996 63.834 0.162 18002
5701 1 10 . 1 1 9 9 SER H H 371 8.158 8.158 8.480 -0.322 18002
5702 1 10 . 1 1 10 10 ILE N N 372 123.959 123.959 119.859 4.100 18002
5703 1 10 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.861 -5.145 18002
5704 1 10 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.152 2.767 18002
5705 1 10 . 1 1 10 10 ILE H H 372 8.112 8.112 8.224 -0.112 18002
5706 1 10 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.531 -0.179 18002
5707 1 10 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.732 1.449 18002
5708 1 10 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.714 0.993 18002
5709 1 10 . 1 1 12 12 GLU N N 374 119.349 119.349 121.693 -2.344 18002
5710 1 10 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.429 0.358 18002
5711 1 10 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.168 0.149 18002
5712 1 10 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.788 1.802 18002
5713 1 10 . 1 1 12 12 GLU H H 374 8.017 8.017 7.863 0.154 18002
5714 1 10 . 1 1 13 13 LEU N N 375 122.288 122.288 123.377 -1.089 18002
5715 1 10 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.500 -0.022 18002
5716 1 10 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.817 -0.887 18002
5717 1 10 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.477 1.179 18002
5718 1 10 . 1 1 13 13 LEU H H 375 8.036 8.036 8.505 -0.469 18002
5719 1 10 . 1 1 14 14 ALA N N 376 125.461 125.461 127.890 -2.429 18002
5720 1 10 . 1 1 14 14 ALA HA H 376 5.246 5.246 5.019 0.227 18002
5721 1 10 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.829 -0.084 18002
5722 1 10 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.137 -0.551 18002
5723 1 10 . 1 1 14 14 ALA H H 376 8.181 8.181 8.329 -0.148 18002
5724 1 10 . 1 1 15 15 ASP N N 377 122.242 122.242 118.803 3.439 18002
5725 1 10 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.835 -0.516 18002
5726 1 10 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.878 -0.126 18002
5727 1 10 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.295 2.344 18002
5728 1 10 . 1 1 15 15 ASP H H 377 8.326 8.326 8.867 -0.541 18002
5729 1 10 . 1 1 16 16 TYR N N 378 118.961 118.961 118.761 0.200 18002
5730 1 10 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.018 0.373 18002
5731 1 10 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.842 1.739 18002
5732 1 10 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.753 0.270 18002
5733 1 10 . 1 1 16 16 TYR H H 378 8.869 8.869 7.467 1.402 18002
5734 1 10 . 1 1 17 17 ILE N N 379 125.214 125.214 124.255 0.959 18002
5735 1 10 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.211 0.119 18002
5736 1 10 . 1 1 17 17 ILE CA C 379 58.732 58.732 60.016 -1.284 18002
5737 1 10 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.227 -0.251 18002
5738 1 10 . 1 1 17 17 ILE H H 379 8.608 8.608 8.030 0.578 18002
5739 1 10 . 1 1 18 18 LYS N N 380 122.917 122.917 126.501 -3.584 18002
5740 1 10 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.964 0.148 18002
5741 1 10 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.053 1.783 18002
5742 1 10 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.546 1.479 18002
5743 1 10 . 1 1 18 18 LYS H H 380 7.424 7.424 8.535 -1.111 18002
5744 1 10 . 1 1 19 19 VAL N N 381 122.839 122.839 120.187 2.652 18002
5745 1 10 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.832 0.431 18002
5746 1 10 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.605 0.911 18002
5747 1 10 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.925 -0.777 18002
5748 1 10 . 1 1 19 19 VAL H H 381 9.223 9.223 7.726 1.497 18002
5749 1 10 . 1 1 20 20 PHE N N 382 129.509 129.509 126.614 2.895 18002
5750 1 10 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.099 -0.256 18002
5751 1 10 . 1 1 20 20 PHE CA C 382 55.505 55.505 57.054 -1.549 18002
5752 1 10 . 1 1 20 20 PHE CB C 382 42.862 42.862 42.755 0.107 18002
5753 1 10 . 1 1 20 20 PHE H H 382 9.451 9.451 8.598 0.853 18002
5754 1 10 . 1 1 21 21 LYS N N 383 126.417 126.417 121.237 5.180 18002
5755 1 10 . 1 1 21 21 LYS CA C 383 52.841 52.841 54.398 -1.557 18002
5756 1 10 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.221 0.998 18002
5757 1 10 . 1 1 21 21 LYS H H 383 7.582 7.582 8.032 -0.450 18002
5758 1 10 . 1 1 22 22 PRO CA C 384 63.697 63.697 64.027 -0.330 18002
5759 1 10 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.572 0.397 18002
5760 1 10 . 1 1 23 23 LYS N N 385 118.026 118.026 115.267 2.759 18002
5761 1 10 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.068 0.147 18002
5762 1 10 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.800 -0.455 18002
5763 1 10 . 1 1 23 23 LYS CB C 385 33.033 33.033 31.617 1.415 18002
5764 1 10 . 1 1 23 23 LYS H H 385 8.138 8.138 7.798 0.340 18002
5765 1 10 . 1 1 24 24 LYS N N 386 120.816 120.816 122.683 -1.867 18002
5766 1 10 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.279 -0.093 18002
5767 1 10 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.071 -0.209 18002
5768 1 10 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.569 0.258 18002
5769 1 10 . 1 1 24 24 LYS H H 386 7.727 7.727 8.181 -0.454 18002
5770 1 10 . 1 1 25 25 LEU N N 387 121.214 121.214 120.757 0.457 18002
5771 1 10 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.167 0.001 18002
5772 1 10 . 1 1 25 25 LEU CA C 387 56.508 56.508 57.005 -0.497 18002
5773 1 10 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.093 -0.451 18002
5774 1 10 . 1 1 25 25 LEU H H 387 8.241 8.241 8.194 0.047 18002
5775 1 10 . 1 1 26 26 THR N N 388 112.798 112.798 109.724 3.074 18002
5776 1 10 . 1 1 26 26 THR HA H 388 4.313 4.313 4.286 0.027 18002
5777 1 10 . 1 1 26 26 THR CA C 388 61.795 61.795 62.165 -0.370 18002
5778 1 10 . 1 1 26 26 THR CB C 388 69.875 69.875 69.243 0.632 18002
5779 1 10 . 1 1 26 26 THR H H 388 7.700 7.700 7.650 0.050 18002
5780 1 10 . 1 1 27 27 LEU N N 389 124.091 124.091 120.986 3.105 18002
5781 1 10 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.553 -0.199 18002
5782 1 10 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.469 0.064 18002
5783 1 10 . 1 1 27 27 LEU CB C 389 42.298 42.298 43.578 -1.280 18002
5784 1 10 . 1 1 27 27 LEU H H 389 8.260 8.260 7.713 0.547 18002
5785 1 10 . 1 1 28 28 LYS N N 390 121.153 121.153 119.072 2.081 18002
5786 1 10 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.397 -0.077 18002
5787 1 10 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.358 -0.146 18002
5788 1 10 . 1 1 28 28 LYS CB C 390 33.675 33.675 33.540 0.135 18002
5789 1 10 . 1 1 28 28 LYS H H 390 8.202 8.202 8.488 -0.286 18002
5790 1 10 . 1 1 29 29 GLY N N 391 107.270 107.270 108.564 -1.294 18002
5791 1 10 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.779 -0.903 18002
5792 1 10 . 1 1 29 29 GLY H H 391 7.876 7.876 7.947 -0.071 18002
5793 1 10 . 1 1 30 30 TYR N N 392 118.471 118.471 125.154 -6.683 18002
5794 1 10 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.252 0.194 18002
5795 1 10 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.262 -0.215 18002
5796 1 10 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.129 2.696 18002
5797 1 10 . 1 1 30 30 TYR H H 392 8.183 8.183 8.583 -0.400 18002
5798 1 10 . 1 1 31 31 LYS N N 393 122.833 122.833 124.569 -1.736 18002
5799 1 10 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.618 -0.103 18002
5800 1 10 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.592 0.583 18002
5801 1 10 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.560 0.160 18002
5802 1 10 . 1 1 31 31 LYS H H 393 8.731 8.731 8.098 0.633 18002
5803 1 10 . 1 1 32 32 GLN N N 394 124.759 124.759 125.722 -0.963 18002
5804 1 10 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.031 0.647 18002
5805 1 10 . 1 1 32 32 GLN CA C 394 56.607 56.607 56.242 0.365 18002
5806 1 10 . 1 1 32 32 GLN CB C 394 31.048 31.048 28.523 2.525 18002
5807 1 10 . 1 1 32 32 GLN H H 394 8.776 8.776 8.727 0.049 18002
5808 1 10 . 1 1 33 33 TYR N N 395 125.112 125.112 127.078 -1.966 18002
5809 1 10 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.898 0.176 18002
5810 1 10 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.750 1.414 18002
5811 1 10 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.301 1.371 18002
5812 1 10 . 1 1 33 33 TYR H H 395 8.774 8.774 7.930 0.844 18002
5813 1 10 . 1 1 34 34 TRP N N 396 122.638 122.638 128.022 -5.384 18002
5814 1 10 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.295 -0.613 18002
5815 1 10 . 1 1 34 34 TRP CA C 396 57.218 57.218 52.916 4.302 18002
5816 1 10 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.490 1.014 18002
5817 1 10 . 1 1 34 34 TRP H H 396 8.975 8.975 7.790 1.185 18002
5818 1 10 . 1 1 35 35 CYS N N 397 127.146 127.146 124.295 2.851 18002
5819 1 10 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.776 0.591 18002
5820 1 10 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.859 1.847 18002
5821 1 10 . 1 1 35 35 CYS H H 397 8.804 8.804 8.837 -0.033 18002
5822 1 10 . 1 1 36 36 THR N N 398 110.578 110.578 113.358 -2.780 18002
5823 1 10 . 1 1 36 36 THR HA H 398 5.358 5.358 4.983 0.375 18002
5824 1 10 . 1 1 36 36 THR CA C 398 58.704 58.704 60.304 -1.600 18002
5825 1 10 . 1 1 36 36 THR CB C 398 71.833 71.833 71.663 0.170 18002
5826 1 10 . 1 1 36 36 THR H H 398 9.090 9.090 7.875 1.215 18002
5827 1 10 . 1 1 37 37 PHE N N 399 127.322 127.322 125.320 2.002 18002
5828 1 10 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.649 0.304 18002
5829 1 10 . 1 1 37 37 PHE CA C 399 56.246 56.246 58.086 -1.840 18002
5830 1 10 . 1 1 37 37 PHE CB C 399 42.185 42.185 38.590 3.595 18002
5831 1 10 . 1 1 37 37 PHE H H 399 8.846 8.846 8.326 0.520 18002
5832 1 10 . 1 1 38 38 LYS N N 400 125.391 125.391 125.019 0.372 18002
5833 1 10 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.118 0.409 18002
5834 1 10 . 1 1 38 38 LYS CA C 400 55.977 55.977 56.808 -0.831 18002
5835 1 10 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.610 2.305 18002
5836 1 10 . 1 1 38 38 LYS H H 400 8.252 8.252 8.242 0.010 18002
5837 1 10 . 1 1 39 39 ASP N N 401 125.083 125.083 117.620 7.463 18002
5838 1 10 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.378 -0.300 18002
5839 1 10 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.440 0.043 18002
5840 1 10 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.916 -1.395 18002
5841 1 10 . 1 1 39 39 ASP H H 401 9.408 9.408 8.751 0.657 18002
5842 1 10 . 1 1 40 40 THR N N 402 112.024 112.024 107.476 4.548 18002
5843 1 10 . 1 1 40 40 THR HA H 402 4.767 4.767 4.329 0.438 18002
5844 1 10 . 1 1 40 40 THR CA C 402 60.811 60.811 62.647 -1.836 18002
5845 1 10 . 1 1 40 40 THR CB C 402 68.823 68.823 69.591 -0.768 18002
5846 1 10 . 1 1 40 40 THR H H 402 8.224 8.224 7.823 0.401 18002
5847 1 10 . 1 1 41 41 SER N N 403 116.142 116.142 115.844 0.298 18002
5848 1 10 . 1 1 41 41 SER HA H 403 5.428 5.428 4.793 0.635 18002
5849 1 10 . 1 1 41 41 SER CA C 403 58.297 58.297 56.924 1.373 18002
5850 1 10 . 1 1 41 41 SER CB C 403 66.409 66.409 65.470 0.939 18002
5851 1 10 . 1 1 41 41 SER H H 403 8.197 8.197 7.634 0.563 18002
5852 1 10 . 1 1 42 42 ILE N N 404 122.292 122.292 118.800 3.492 18002
5853 1 10 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.888 0.041 18002
5854 1 10 . 1 1 42 42 ILE CA C 404 59.804 59.804 57.639 2.164 18002
5855 1 10 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.774 0.646 18002
5856 1 10 . 1 1 42 42 ILE H H 404 8.411 8.411 7.670 0.741 18002
5857 1 10 . 1 1 43 43 SER N N 405 122.244 122.244 115.808 6.436 18002
5858 1 10 . 1 1 43 43 SER HA H 405 4.966 4.966 4.679 0.287 18002
5859 1 10 . 1 1 43 43 SER CA C 405 57.735 57.735 57.087 0.648 18002
5860 1 10 . 1 1 43 43 SER CB C 405 65.388 65.388 65.687 -0.299 18002
5861 1 10 . 1 1 43 43 SER H H 405 8.752 8.752 8.304 0.448 18002
5862 1 10 . 1 1 44 44 CYS N N 406 120.004 120.004 121.948 -1.944 18002
5863 1 10 . 1 1 44 44 CYS HA H 406 4.967 4.967 5.037 -0.070 18002
5864 1 10 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.215 -1.157 18002
5865 1 10 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.233 1.207 18002
5866 1 10 . 1 1 44 44 CYS H H 406 8.470 8.470 8.410 0.060 18002
5867 1 10 . 1 1 45 45 TYR N N 407 122.704 122.704 127.913 -5.209 18002
5868 1 10 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.035 -0.012 18002
5869 1 10 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.695 -0.712 18002
5870 1 10 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.333 1.241 18002
5871 1 10 . 1 1 45 45 TYR H H 407 10.013 10.013 8.626 1.387 18002
5872 1 10 . 1 1 46 46 LYS N N 408 121.897 121.897 122.941 -1.044 18002
5873 1 10 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.692 -0.346 18002
5874 1 10 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.915 3.104 18002
5875 1 10 . 1 1 46 46 LYS CB C 408 32.712 32.712 34.266 -1.554 18002
5876 1 10 . 1 1 46 46 LYS H H 408 9.734 9.734 8.580 1.154 18002
5877 1 10 . 1 1 47 47 SER N N 409 106.720 106.720 109.426 -2.706 18002
5878 1 10 . 1 1 47 47 SER HA H 409 4.776 4.776 4.960 -0.184 18002
5879 1 10 . 1 1 47 47 SER CA C 409 57.180 57.180 57.698 -0.518 18002
5880 1 10 . 1 1 47 47 SER CB C 409 65.870 65.870 64.850 1.020 18002
5881 1 10 . 1 1 47 47 SER H H 409 7.518 7.518 7.708 -0.190 18002
5882 1 10 . 1 1 48 48 LYS N N 410 122.302 122.302 120.969 1.333 18002
5883 1 10 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.657 0.577 18002
5884 1 10 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.150 0.149 18002
5885 1 10 . 1 1 48 48 LYS H H 410 8.195 8.195 8.824 -0.629 18002
5886 1 10 . 1 1 49 49 GLU N N 411 118.983 118.983 120.897 -1.914 18002
5887 1 10 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.042 0.741 18002
5888 1 10 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.825 0.710 18002
5889 1 10 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.428 -0.740 18002
5890 1 10 . 1 1 49 49 GLU H H 411 8.752 8.752 8.080 0.672 18002
5891 1 10 . 1 1 50 50 GLU N N 412 118.384 118.384 118.554 -0.170 18002
5892 1 10 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.274 0.219 18002
5893 1 10 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.732 -0.943 18002
5894 1 10 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.005 1.000 18002
5895 1 10 . 1 1 50 50 GLU H H 412 7.234 7.234 7.708 -0.474 18002
5896 1 10 . 1 1 51 51 SER N N 413 114.767 114.767 117.626 -2.859 18002
5897 1 10 . 1 1 51 51 SER CA C 413 59.764 59.764 61.486 -1.722 18002
5898 1 10 . 1 1 51 51 SER CB C 413 62.965 62.965 63.126 -0.161 18002
5899 1 10 . 1 1 51 51 SER H H 413 7.382 7.382 8.548 -1.166 18002
5900 1 10 . 1 1 52 52 SER N N 414 114.496 114.496 115.062 -0.566 18002
5901 1 10 . 1 1 52 52 SER HA H 414 4.560 4.560 4.580 -0.020 18002
5902 1 10 . 1 1 52 52 SER CA C 414 58.574 58.574 57.565 1.009 18002
5903 1 10 . 1 1 52 52 SER CB C 414 63.829 63.829 63.292 0.537 18002
5904 1 10 . 1 1 52 52 SER H H 414 7.682 7.682 8.343 -0.661 18002
5905 1 10 . 1 1 53 53 GLY N N 415 111.107 111.107 109.099 2.008 18002
5906 1 10 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.849 -0.616 18002
5907 1 10 . 1 1 53 53 GLY H H 415 7.918 7.918 7.803 0.115 18002
5908 1 10 . 1 1 54 54 THR N N 416 120.214 120.214 114.435 5.779 18002
5909 1 10 . 1 1 54 54 THR CB C 416 70.035 70.035 70.505 -0.470 18002
5910 1 10 . 1 1 54 54 THR H H 416 8.622 8.622 8.101 0.521 18002
5911 1 10 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.128 0.347 18002
5912 1 10 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.610 -0.565 18002
5913 1 10 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.315 0.263 18002
5914 1 10 . 1 1 56 56 ALA N N 418 125.591 125.591 125.989 -0.398 18002
5915 1 10 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.066 -0.110 18002
5916 1 10 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.627 0.908 18002
5917 1 10 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.529 -0.622 18002
5918 1 10 . 1 1 56 56 ALA H H 418 8.288 8.288 8.539 -0.251 18002
5919 1 10 . 1 1 57 57 HIS N N 419 108.119 108.119 117.424 -9.305 18002
5920 1 10 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.697 -0.075 18002
5921 1 10 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.451 -0.871 18002
5922 1 10 . 1 1 57 57 HIS CB C 419 34.219 34.219 30.949 3.270 18002
5923 1 10 . 1 1 57 57 HIS H H 419 7.072 7.072 7.979 -0.907 18002
5924 1 10 . 1 1 58 58 GLN N N 420 123.083 123.083 124.099 -1.016 18002
5925 1 10 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.585 0.570 18002
5926 1 10 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.086 0.418 18002
5927 1 10 . 1 1 58 58 GLN CB C 420 32.490 32.490 29.731 2.759 18002
5928 1 10 . 1 1 58 58 GLN H H 420 8.669 8.669 8.281 0.388 18002
5929 1 10 . 1 1 59 59 MET N N 421 122.330 122.330 118.589 3.741 18002
5930 1 10 . 1 1 59 59 MET HA H 421 4.621 4.621 4.591 0.030 18002
5931 1 10 . 1 1 59 59 MET CA C 421 54.892 54.892 53.795 1.097 18002
5932 1 10 . 1 1 59 59 MET CB C 421 35.650 35.650 35.857 -0.207 18002
5933 1 10 . 1 1 59 59 MET H H 421 8.995 8.995 7.573 1.422 18002
5934 1 10 . 1 1 60 60 ASN N N 422 123.220 123.220 118.982 4.238 18002
5935 1 10 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.764 0.184 18002
5936 1 10 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.373 0.258 18002
5937 1 10 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.790 0.949 18002
5938 1 10 . 1 1 60 60 ASN H H 422 8.728 8.728 8.486 0.242 18002
5939 1 10 . 1 1 61 61 LEU N N 423 126.072 126.072 124.144 1.928 18002
5940 1 10 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.249 -0.133 18002
5941 1 10 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.461 1.152 18002
5942 1 10 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.750 0.707 18002
5943 1 10 . 1 1 61 61 LEU H H 423 8.942 8.942 8.244 0.698 18002
5944 1 10 . 1 1 62 62 ARG N N 424 121.977 121.977 116.690 5.287 18002
5945 1 10 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.942 0.430 18002
5946 1 10 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.532 2.502 18002
5947 1 10 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.042 -0.432 18002
5948 1 10 . 1 1 62 62 ARG H H 424 8.000 8.000 7.760 0.240 18002
5949 1 10 . 1 1 63 63 GLY N N 425 114.852 114.852 107.948 6.904 18002
5950 1 10 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.485 0.325 18002
5951 1 10 . 1 1 63 63 GLY H H 425 9.033 9.033 8.752 0.281 18002
5952 1 10 . 1 1 64 64 CYS N N 426 117.102 117.102 116.701 0.401 18002
5953 1 10 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.552 0.347 18002
5954 1 10 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.300 0.460 18002
5955 1 10 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.782 -0.958 18002
5956 1 10 . 1 1 64 64 CYS H H 426 8.248 8.248 7.557 0.691 18002
5957 1 10 . 1 1 65 65 GLU N N 427 119.501 119.501 121.863 -2.362 18002
5958 1 10 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.320 0.457 18002
5959 1 10 . 1 1 65 65 GLU CA C 427 55.391 55.391 56.279 -0.888 18002
5960 1 10 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.645 0.293 18002
5961 1 10 . 1 1 65 65 GLU H H 427 8.449 8.449 8.770 -0.321 18002
5962 1 10 . 1 1 66 66 VAL N N 428 125.286 125.286 123.003 2.283 18002
5963 1 10 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.367 0.523 18002
5964 1 10 . 1 1 66 66 VAL CA C 428 60.752 60.752 62.063 -1.311 18002
5965 1 10 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.987 -1.012 18002
5966 1 10 . 1 1 66 66 VAL H H 428 8.624 8.624 8.403 0.221 18002
5967 1 10 . 1 1 67 67 THR N N 429 124.132 124.132 124.885 -0.753 18002
5968 1 10 . 1 1 67 67 THR CA C 429 59.338 59.338 61.023 -1.685 18002
5969 1 10 . 1 1 67 67 THR CB C 429 72.021 72.021 70.239 1.782 18002
5970 1 10 . 1 1 67 67 THR H H 429 9.247 9.247 8.021 1.226 18002
5971 1 10 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.642 0.007 18002
5972 1 10 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.369 0.369 18002
5973 1 10 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.270 1.298 18002
5974 1 10 . 1 1 69 69 ASP N N 431 122.066 122.066 122.372 -0.306 18002
5975 1 10 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.940 -0.293 18002
5976 1 10 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.518 0.151 18002
5977 1 10 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.069 -0.964 18002
5978 1 10 . 1 1 69 69 ASP H H 431 8.250 8.250 8.452 -0.202 18002
5979 1 10 . 1 1 70 70 VAL N N 432 121.874 121.874 122.402 -0.528 18002
5980 1 10 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.707 -0.208 18002
5981 1 10 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.712 0.376 18002
5982 1 10 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.639 0.393 18002
5983 1 10 . 1 1 70 70 VAL H H 432 8.305 8.305 8.105 0.200 18002
5984 1 10 . 1 1 71 71 ASN N N 433 124.366 124.366 126.999 -2.633 18002
5985 1 10 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.895 -0.213 18002
5986 1 10 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.521 0.240 18002
5987 1 10 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.906 0.373 18002
5988 1 10 . 1 1 71 71 ASN H H 433 8.637 8.637 8.247 0.390 18002
5989 1 10 . 1 1 72 72 ILE N N 434 126.786 126.786 124.872 1.914 18002
5990 1 10 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.708 -0.337 18002
5991 1 10 . 1 1 72 72 ILE CA C 434 64.518 64.518 64.085 0.433 18002
5992 1 10 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.944 -0.769 18002
5993 1 10 . 1 1 72 72 ILE H H 434 8.943 8.943 8.815 0.128 18002
5994 1 10 . 1 1 73 73 SER N N 435 118.305 118.305 116.500 1.805 18002
5995 1 10 . 1 1 73 73 SER CA C 435 61.633 61.633 60.811 0.822 18002
5996 1 10 . 1 1 73 73 SER CB C 435 62.435 62.435 62.871 -0.436 18002
5997 1 10 . 1 1 73 73 SER H H 435 8.578 8.578 8.588 -0.010 18002
5998 1 10 . 1 1 74 74 GLY N N 436 107.443 107.443 105.932 1.511 18002
5999 1 10 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.571 0.290 18002
6000 1 10 . 1 1 74 74 GLY H H 436 7.620 7.620 7.512 0.108 18002
6001 1 10 . 1 1 75 75 GLN N N 437 116.895 116.895 117.426 -0.531 18002
6002 1 10 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.426 -0.136 18002
6003 1 10 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.163 0.538 18002
6004 1 10 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.287 1.458 18002
6005 1 10 . 1 1 75 75 GLN H H 437 7.798 7.798 7.803 -0.005 18002
6006 1 10 . 1 1 76 76 LYS N N 438 119.308 119.308 121.717 -2.409 18002
6007 1 10 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.440 -0.298 18002
6008 1 10 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.541 0.502 18002
6009 1 10 . 1 1 76 76 LYS CB C 438 33.945 33.945 33.087 0.859 18002
6010 1 10 . 1 1 76 76 LYS H H 438 7.522 7.522 7.738 -0.216 18002
6011 1 10 . 1 1 77 77 PHE N N 439 125.905 125.905 122.694 3.211 18002
6012 1 10 . 1 1 77 77 PHE HA H 439 4.211 4.211 3.949 0.262 18002
6013 1 10 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.906 -2.267 18002
6014 1 10 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.484 0.445 18002
6015 1 10 . 1 1 77 77 PHE H H 439 8.461 8.461 8.146 0.315 18002
6016 1 10 . 1 1 78 78 ASN N N 440 120.787 120.787 121.765 -0.978 18002
6017 1 10 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.455 -0.542 18002
6018 1 10 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.190 -0.387 18002
6019 1 10 . 1 1 78 78 ASN H H 440 7.638 7.638 8.139 -0.501 18002
6020 1 10 . 1 1 79 79 ILE N N 441 123.421 123.421 126.292 -2.871 18002
6021 1 10 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.224 -0.053 18002
6022 1 10 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.054 1.512 18002
6023 1 10 . 1 1 79 79 ILE CB C 441 41.487 41.487 38.379 3.108 18002
6024 1 10 . 1 1 79 79 ILE H H 441 9.550 9.550 8.285 1.265 18002
6025 1 10 . 1 1 80 80 LYS N N 442 126.267 126.267 130.710 -4.443 18002
6026 1 10 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.054 0.408 18002
6027 1 10 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.853 1.530 18002
6028 1 10 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.608 1.379 18002
6029 1 10 . 1 1 80 80 LYS H H 442 8.703 8.703 8.115 0.588 18002
6030 1 10 . 1 1 81 81 LEU N N 443 125.194 125.194 127.575 -2.381 18002
6031 1 10 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.485 0.787 18002
6032 1 10 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.308 0.041 18002
6033 1 10 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.988 1.716 18002
6034 1 10 . 1 1 81 81 LEU H H 443 9.223 9.223 7.566 1.657 18002
6035 1 10 . 1 1 82 82 LEU N N 444 122.753 122.753 126.470 -3.717 18002
6036 1 10 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.045 -0.031 18002
6037 1 10 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.416 0.502 18002
6038 1 10 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.327 -2.703 18002
6039 1 10 . 1 1 82 82 LEU H H 444 8.420 8.420 8.341 0.079 18002
6040 1 10 . 1 1 83 83 ILE N N 445 125.584 125.584 121.719 3.865 18002
6041 1 10 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.342 -0.057 18002
6042 1 10 . 1 1 83 83 ILE CB C 445 41.036 41.036 42.065 -1.028 18002
6043 1 10 . 1 1 83 83 ILE H H 445 9.010 9.010 7.924 1.086 18002
6044 1 10 . 1 1 84 84 PRO HA H 446 4.919 4.919 5.017 -0.098 18002
6045 1 10 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.311 1.722 18002
6046 1 10 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.884 0.063 18002
6047 1 10 . 1 1 85 85 VAL N N 447 119.780 119.780 117.734 2.046 18002
6048 1 10 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.307 0.196 18002
6049 1 10 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.619 0.723 18002
6050 1 10 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.365 0.901 18002
6051 1 10 . 1 1 85 85 VAL H H 447 8.304 8.304 8.366 -0.062 18002
6052 1 10 . 1 1 86 86 ALA N N 448 125.178 125.178 121.568 3.610 18002
6053 1 10 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.050 -0.075 18002
6054 1 10 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.858 0.704 18002
6055 1 10 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.422 -0.434 18002
6056 1 10 . 1 1 86 86 ALA H H 448 8.526 8.526 8.386 0.140 18002
6057 1 10 . 1 1 87 87 GLU N N 449 114.625 114.625 118.398 -3.773 18002
6058 1 10 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.130 0.160 18002
6059 1 10 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.515 -0.784 18002
6060 1 10 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.887 -0.626 18002
6061 1 10 . 1 1 87 87 GLU H H 449 8.402 8.402 8.728 -0.326 18002
6062 1 10 . 1 1 88 88 GLY N N 450 109.432 109.432 105.942 3.490 18002
6063 1 10 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.845 0.992 18002
6064 1 10 . 1 1 88 88 GLY H H 450 7.711 7.711 7.886 -0.175 18002
6065 1 10 . 1 1 89 89 MET N N 451 121.382 121.382 120.220 1.162 18002
6066 1 10 . 1 1 89 89 MET HA H 451 5.076 5.076 5.028 0.048 18002
6067 1 10 . 1 1 89 89 MET CA C 451 53.860 53.860 54.677 -0.817 18002
6068 1 10 . 1 1 89 89 MET CB C 451 35.942 35.942 37.621 -1.679 18002
6069 1 10 . 1 1 89 89 MET H H 451 8.355 8.355 7.718 0.637 18002
6070 1 10 . 1 1 90 90 ASN N N 452 123.538 123.538 122.313 1.225 18002
6071 1 10 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.918 0.035 18002
6072 1 10 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.523 -0.775 18002
6073 1 10 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.511 1.131 18002
6074 1 10 . 1 1 90 90 ASN H H 452 9.338 9.338 8.830 0.508 18002
6075 1 10 . 1 1 91 91 GLU N N 453 125.978 125.978 126.053 -0.075 18002
6076 1 10 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.157 1.187 18002
6077 1 10 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.873 -1.600 18002
6078 1 10 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.231 1.512 18002
6079 1 10 . 1 1 91 91 GLU H H 453 8.168 8.168 8.381 -0.213 18002
6080 1 10 . 1 1 92 92 ILE N N 454 126.776 126.776 126.708 0.068 18002
6081 1 10 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.395 0.171 18002
6082 1 10 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.658 0.390 18002
6083 1 10 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.120 2.142 18002
6084 1 10 . 1 1 92 92 ILE H H 454 9.000 9.000 7.550 1.450 18002
6085 1 10 . 1 1 93 93 TRP N N 455 125.987 125.987 126.862 -0.875 18002
6086 1 10 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.034 -0.442 18002
6087 1 10 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.488 -1.698 18002
6088 1 10 . 1 1 93 93 TRP CB C 455 31.386 31.386 31.881 -0.495 18002
6089 1 10 . 1 1 93 93 TRP H H 455 9.278 9.278 8.168 1.110 18002
6090 1 10 . 1 1 94 94 LEU N N 456 120.912 120.912 123.036 -2.124 18002
6091 1 10 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.163 0.199 18002
6092 1 10 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.140 0.076 18002
6093 1 10 . 1 1 94 94 LEU CB C 456 43.594 43.594 44.293 -0.699 18002
6094 1 10 . 1 1 94 94 LEU H H 456 9.534 9.534 8.344 1.190 18002
6095 1 10 . 1 1 95 95 ARG N N 457 123.669 123.669 122.207 1.462 18002
6096 1 10 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.674 0.597 18002
6097 1 10 . 1 1 95 95 ARG CA C 457 55.417 55.417 56.324 -0.907 18002
6098 1 10 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.145 1.117 18002
6099 1 10 . 1 1 95 95 ARG H H 457 9.439 9.439 7.982 1.457 18002
6100 1 10 . 1 1 96 96 CYS N N 458 125.273 125.273 118.275 6.998 18002
6101 1 10 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.534 0.164 18002
6102 1 10 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.983 -0.191 18002
6103 1 10 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.517 -1.114 18002
6104 1 10 . 1 1 96 96 CYS H H 458 8.652 8.652 8.673 -0.021 18002
6105 1 10 . 1 1 97 97 ASP N N 459 119.661 119.661 119.180 0.481 18002
6106 1 10 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.972 -0.232 18002
6107 1 10 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.905 2.323 18002
6108 1 10 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.796 1.789 18002
6109 1 10 . 1 1 97 97 ASP H H 459 9.116 9.116 8.217 0.899 18002
6110 1 10 . 1 1 98 98 ASN N N 460 109.173 109.173 116.199 -7.026 18002
6111 1 10 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.798 -0.426 18002
6112 1 10 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.127 -0.113 18002
6113 1 10 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.873 -0.062 18002
6114 1 10 . 1 1 98 98 ASN H H 460 7.054 7.054 7.102 -0.048 18002
6115 1 10 . 1 1 99 99 GLU N N 461 119.220 119.220 120.937 -1.717 18002
6116 1 10 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.557 0.487 18002
6117 1 10 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.659 0.109 18002
6118 1 10 . 1 1 99 99 GLU H H 461 8.937 8.937 9.018 -0.081 18002
6119 1 10 . 1 1 100 100 LYS N N 462 120.647 120.647 120.124 0.523 18002
6120 1 10 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.031 0.614 18002
6121 1 10 . 1 1 100 100 LYS CA C 462 60.536 60.536 58.833 1.703 18002
6122 1 10 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.789 0.439 18002
6123 1 10 . 1 1 100 100 LYS H H 462 8.033 8.033 8.146 -0.113 18002
6124 1 10 . 1 1 101 101 GLN N N 463 121.938 121.938 116.772 5.166 18002
6125 1 10 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.668 0.732 18002
6126 1 10 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.008 1.387 18002
6127 1 10 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.064 4.150 18002
6128 1 10 . 1 1 101 101 GLN H H 463 8.372 8.372 7.630 0.742 18002
6129 1 10 . 1 1 102 102 TYR N N 464 117.422 117.422 121.423 -4.001 18002
6130 1 10 . 1 1 102 102 TYR HA H 464 4.616 4.616 3.973 0.643 18002
6131 1 10 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.662 0.015 18002
6132 1 10 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.020 0.839 18002
6133 1 10 . 1 1 102 102 TYR H H 464 8.221 8.221 7.794 0.427 18002
6134 1 10 . 1 1 103 103 ALA N N 465 120.655 120.655 118.078 2.577 18002
6135 1 10 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.891 -0.176 18002
6136 1 10 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.716 1.197 18002
6137 1 10 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.745 0.057 18002
6138 1 10 . 1 1 103 103 ALA H H 465 8.637 8.637 8.020 0.617 18002
6139 1 10 . 1 1 104 104 HIS N N 466 112.871 112.871 116.521 -3.650 18002
6140 1 10 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.611 -0.470 18002
6141 1 10 . 1 1 104 104 HIS CA C 466 60.627 60.627 57.806 2.821 18002
6142 1 10 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.665 -0.807 18002
6143 1 10 . 1 1 104 104 HIS H H 466 7.852 7.852 8.166 -0.314 18002
6144 1 10 . 1 1 105 105 TRP N N 467 121.317 121.317 119.759 1.558 18002
6145 1 10 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.264 -0.569 18002
6146 1 10 . 1 1 105 105 TRP CA C 467 62.342 62.342 62.124 0.218 18002
6147 1 10 . 1 1 105 105 TRP CB C 467 27.505 27.505 28.917 -1.412 18002
6148 1 10 . 1 1 105 105 TRP H H 467 8.668 8.668 7.796 0.872 18002
6149 1 10 . 1 1 106 106 MET N N 468 122.346 122.346 117.405 4.941 18002
6150 1 10 . 1 1 106 106 MET HA H 468 4.086 4.086 4.009 0.077 18002
6151 1 10 . 1 1 106 106 MET CA C 468 58.743 58.743 58.675 0.068 18002
6152 1 10 . 1 1 106 106 MET CB C 468 31.402 31.402 30.404 0.998 18002
6153 1 10 . 1 1 106 106 MET H H 468 9.790 9.790 7.757 2.033 18002
6154 1 10 . 1 1 107 107 ALA N N 469 119.758 119.758 122.278 -2.520 18002
6155 1 10 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.857 -0.152 18002
6156 1 10 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.718 1.411 18002
6157 1 10 . 1 1 107 107 ALA CB C 469 20.405 20.405 17.982 2.423 18002
6158 1 10 . 1 1 107 107 ALA H H 469 7.702 7.702 8.007 -0.305 18002
6159 1 10 . 1 1 108 108 ALA N N 470 119.233 119.233 120.553 -1.320 18002
6160 1 10 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.916 -0.370 18002
6161 1 10 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.528 1.293 18002
6162 1 10 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.107 -1.375 18002
6163 1 10 . 1 1 108 108 ALA H H 470 7.156 7.156 7.994 -0.838 18002
6164 1 10 . 1 1 109 109 CYS N N 471 116.736 116.736 115.539 1.197 18002
6165 1 10 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.266 -0.209 18002
6166 1 10 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.002 2.569 18002
6167 1 10 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.665 0.728 18002
6168 1 10 . 1 1 109 109 CYS H H 471 8.256 8.256 8.242 0.013 18002
6169 1 10 . 1 1 110 110 ARG N N 472 118.644 118.644 119.760 -1.116 18002
6170 1 10 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.053 -0.319 18002
6171 1 10 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.397 0.807 18002
6172 1 10 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.219 0.098 18002
6173 1 10 . 1 1 110 110 ARG H H 472 8.403 8.403 7.476 0.927 18002
6174 1 10 . 1 1 111 111 LEU N N 473 121.877 121.877 118.154 3.723 18002
6175 1 10 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.271 -0.471 18002
6176 1 10 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.007 2.848 18002
6177 1 10 . 1 1 111 111 LEU CB C 473 40.420 40.420 39.825 0.595 18002
6178 1 10 . 1 1 111 111 LEU H H 473 7.916 7.916 7.557 0.359 18002
6179 1 10 . 1 1 112 112 ALA N N 474 122.765 122.765 122.439 0.326 18002
6180 1 10 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.969 0.511 18002
6181 1 10 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.885 0.376 18002
6182 1 10 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.746 2.129 18002
6183 1 10 . 1 1 112 112 ALA H H 474 8.393 8.393 7.979 0.414 18002
6184 1 10 . 1 1 113 113 SER N N 475 113.613 113.613 112.942 0.671 18002
6185 1 10 . 1 1 113 113 SER HA H 475 4.782 4.782 4.330 0.452 18002
6186 1 10 . 1 1 113 113 SER CA C 475 61.090 61.090 60.478 0.612 18002
6187 1 10 . 1 1 113 113 SER CB C 475 63.612 63.612 63.408 0.204 18002
6188 1 10 . 1 1 113 113 SER H H 475 8.150 8.150 7.846 0.304 18002
6189 1 10 . 1 1 114 114 LYS N N 476 118.734 118.734 118.706 0.028 18002
6190 1 10 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.195 0.358 18002
6191 1 10 . 1 1 114 114 LYS CA C 476 55.144 55.144 57.124 -1.980 18002
6192 1 10 . 1 1 114 114 LYS CB C 476 32.591 32.591 31.926 0.665 18002
6193 1 10 . 1 1 114 114 LYS H H 476 7.239 7.239 7.946 -0.707 18002
6194 1 10 . 1 1 115 115 GLY N N 477 107.818 107.818 107.525 0.293 18002
6195 1 10 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.352 0.633 18002
6196 1 10 . 1 1 115 115 GLY H H 477 8.401 8.401 7.655 0.746 18002
6197 1 10 . 1 1 116 116 LYS N N 478 120.938 120.938 120.862 0.076 18002
6198 1 10 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.782 -0.209 18002
6199 1 10 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.623 0.224 18002
6200 1 10 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.083 0.238 18002
6201 1 10 . 1 1 116 116 LYS H H 478 8.142 8.142 7.643 0.499 18002
6202 1 10 . 1 1 117 117 THR N N 479 108.076 108.076 114.285 -6.209 18002
6203 1 10 . 1 1 117 117 THR HA H 479 4.671 4.671 4.266 0.405 18002
6204 1 10 . 1 1 117 117 THR CA C 479 59.191 59.191 60.752 -1.562 18002
6205 1 10 . 1 1 117 117 THR CB C 479 72.228 72.228 69.772 2.456 18002
6206 1 10 . 1 1 117 117 THR H H 479 7.926 7.926 8.294 -0.368 18002
6207 1 10 . 1 1 118 118 MET N N 480 116.403 116.403 116.848 -0.445 18002
6208 1 10 . 1 1 118 118 MET HA H 480 3.352 3.352 3.876 -0.524 18002
6209 1 10 . 1 1 118 118 MET CA C 480 57.947 57.947 55.672 2.275 18002
6210 1 10 . 1 1 118 118 MET CB C 480 33.920 33.920 31.108 2.812 18002
6211 1 10 . 1 1 118 118 MET H H 480 8.899 8.899 8.521 0.378 18002
6212 1 10 . 1 1 119 119 ALA N N 481 117.786 117.786 120.169 -2.383 18002
6213 1 10 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.994 0.090 18002
6214 1 10 . 1 1 119 119 ALA CA C 481 52.595 52.595 53.585 -0.990 18002
6215 1 10 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.152 -0.090 18002
6216 1 10 . 1 1 119 119 ALA H H 481 7.645 7.645 8.142 -0.496 18002
6217 1 10 . 1 1 120 120 ASP N N 482 120.348 120.348 116.991 3.357 18002
6218 1 10 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.798 4.818 18002
6219 1 10 . 1 1 120 120 ASP H H 482 7.887 7.887 8.272 -0.385 18002
6220 1 10 . 1 1 121 121 SER HA H 483 4.223 4.223 4.175 0.048 18002
6221 1 10 . 1 1 121 121 SER CA C 483 61.455 61.455 61.528 -0.073 18002
6222 1 10 . 1 1 121 121 SER CB C 483 62.996 62.996 63.117 -0.121 18002
6223 1 10 . 1 1 122 122 SER N N 484 116.845 116.845 116.366 0.479 18002
6224 1 10 . 1 1 122 122 SER HA H 484 4.321 4.321 4.340 -0.019 18002
6225 1 10 . 1 1 122 122 SER CA C 484 60.584 60.584 59.865 0.719 18002
6226 1 10 . 1 1 122 122 SER CB C 484 64.314 64.314 63.070 1.244 18002
6227 1 10 . 1 1 122 122 SER H H 484 8.875 8.875 7.915 0.960 18002
6228 1 10 . 1 1 123 123 TYR N N 485 124.153 124.153 122.799 1.354 18002
6229 1 10 . 1 1 123 123 TYR HA H 485 3.880 3.880 3.982 -0.102 18002
6230 1 10 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.738 1.576 18002
6231 1 10 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.227 -0.486 18002
6232 1 10 . 1 1 123 123 TYR H H 485 8.018 8.018 8.148 -0.130 18002
6233 1 10 . 1 1 124 124 ASN N N 486 115.339 115.339 116.123 -0.784 18002
6234 1 10 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.226 -0.285 18002
6235 1 10 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.181 0.525 18002
6236 1 10 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.013 0.043 18002
6237 1 10 . 1 1 124 124 ASN H H 486 8.665 8.665 7.882 0.783 18002
6238 1 10 . 1 1 125 125 LEU N N 487 119.454 119.454 119.333 0.121 18002
6239 1 10 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.091 -0.153 18002
6240 1 10 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.247 0.423 18002
6241 1 10 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.815 -0.247 18002
6242 1 10 . 1 1 125 125 LEU H H 487 7.105 7.105 7.741 -0.636 18002
6243 1 10 . 1 1 126 126 GLU N N 488 121.189 121.189 117.980 3.209 18002
6244 1 10 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.116 -0.086 18002
6245 1 10 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.556 0.478 18002
6246 1 10 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.416 -0.332 18002
6247 1 10 . 1 1 126 126 GLU H H 488 8.053 8.053 7.647 0.406 18002
6248 1 10 . 1 1 127 127 VAL N N 489 119.073 119.073 118.121 0.952 18002
6249 1 10 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.526 -0.508 18002
6250 1 10 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.834 1.488 18002
6251 1 10 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.093 0.566 18002
6252 1 10 . 1 1 127 127 VAL H H 489 7.769 7.769 7.097 0.672 18002
6253 1 10 . 1 1 128 128 GLN N N 490 116.214 116.214 117.617 -1.403 18002
6254 1 10 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.005 -0.173 18002
6255 1 10 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.343 0.413 18002
6256 1 10 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.033 0.079 18002
6257 1 10 . 1 1 128 128 GLN H H 490 7.542 7.542 7.934 -0.392 18002
6258 1 10 . 1 1 129 129 ASN N N 491 120.003 120.003 117.705 2.298 18002
6259 1 10 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.664 -0.245 18002
6260 1 10 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.102 1.058 18002
6261 1 10 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.477 -0.417 18002
6262 1 10 . 1 1 129 129 ASN H H 491 8.582 8.582 8.153 0.429 18002
6263 1 10 . 1 1 130 130 ILE N N 492 122.365 122.365 121.500 0.865 18002
6264 1 10 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.971 1.782 18002
6265 1 10 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.290 1.856 18002
6266 1 10 . 1 1 130 130 ILE H H 492 8.186 8.186 7.572 0.614 18002
6267 1 10 . 1 1 131 131 LEU N N 493 119.597 119.597 119.949 -0.352 18002
6268 1 10 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.023 -0.018 18002
6269 1 10 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.229 0.630 18002
6270 1 10 . 1 1 131 131 LEU CB C 493 41.536 41.536 40.138 1.398 18002
6271 1 10 . 1 1 131 131 LEU H H 493 8.224 8.224 7.854 0.370 18002
6272 1 10 . 1 1 132 132 SER N N 494 114.884 114.884 114.969 -0.085 18002
6273 1 10 . 1 1 132 132 SER HA H 494 4.430 4.430 4.282 0.148 18002
6274 1 10 . 1 1 132 132 SER CA C 494 62.072 62.072 61.010 1.062 18002
6275 1 10 . 1 1 132 132 SER CB C 494 62.703 62.703 62.527 0.176 18002
6276 1 10 . 1 1 132 132 SER H H 494 8.464 8.464 8.277 0.187 18002
6277 1 10 . 1 1 133 133 PHE N N 495 123.047 123.047 121.104 1.943 18002
6278 1 10 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.304 0.073 18002
6279 1 10 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.460 -0.547 18002
6280 1 10 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.750 0.300 18002
6281 1 10 . 1 1 133 133 PHE H H 495 7.915 7.915 9.263 -1.348 18002
6282 1 10 . 1 1 134 134 LEU N N 496 119.311 119.311 119.668 -0.357 18002
6283 1 10 . 1 1 134 134 LEU HA H 496 3.905 3.905 3.994 -0.089 18002
6284 1 10 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.834 -0.233 18002
6285 1 10 . 1 1 134 134 LEU CB C 496 41.901 41.901 40.707 1.194 18002
6286 1 10 . 1 1 134 134 LEU H H 496 8.386 8.386 7.769 0.617 18002
6287 1 10 . 1 1 135 135 LYS N N 497 117.550 117.550 118.329 -0.779 18002
6288 1 10 . 1 1 135 135 LYS HA H 497 3.940 3.940 3.995 -0.055 18002
6289 1 10 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.859 -0.584 18002
6290 1 10 . 1 1 135 135 LYS CB C 497 32.494 32.494 31.987 0.507 18002
6291 1 10 . 1 1 135 135 LYS H H 497 7.670 7.670 7.685 -0.015 18002
6292 1 10 . 1 1 136 136 MET N N 498 116.106 116.106 112.355 3.751 18002
6293 1 10 . 1 1 136 136 MET HA H 498 4.354 4.354 4.666 -0.312 18002
6294 1 10 . 1 1 136 136 MET CA C 498 55.994 55.994 54.968 1.026 18002
6295 1 10 . 1 1 136 136 MET CB C 498 32.772 32.772 31.973 0.799 18002
6296 1 10 . 1 1 136 136 MET H H 498 7.421 7.421 7.386 0.035 18002
6297 1 10 . 1 1 137 137 GLN N N 499 118.651 118.651 120.723 -2.072 18002
6298 1 10 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.836 0.348 18002
6299 1 10 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.199 -2.891 18002
6300 1 10 . 1 1 137 137 GLN H H 499 7.617 7.617 8.072 -0.455 18002
6301 1 11 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.345 -0.220 18002
6302 1 11 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.414 -1.399 18002
6303 1 11 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.055 2.874 18002
6304 1 11 . 1 1 4 4 MET N N 366 120.431 120.431 121.448 -1.017 18002
6305 1 11 . 1 1 4 4 MET HA H 366 4.345 4.345 4.127 0.218 18002
6306 1 11 . 1 1 4 4 MET CA C 366 55.337 55.337 55.638 -0.301 18002
6307 1 11 . 1 1 4 4 MET CB C 366 32.668 32.668 32.855 -0.187 18002
6308 1 11 . 1 1 4 4 MET H H 366 8.373 8.373 8.250 0.123 18002
6309 1 11 . 1 1 5 5 GLY N N 367 109.318 109.318 111.896 -2.578 18002
6310 1 11 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.326 0.131 18002
6311 1 11 . 1 1 5 5 GLY H H 367 8.224 8.224 8.416 -0.192 18002
6312 1 11 . 1 1 6 6 ASP N N 368 120.307 120.307 117.753 2.554 18002
6313 1 11 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.354 0.246 18002
6314 1 11 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.297 0.216 18002
6315 1 11 . 1 1 6 6 ASP CB C 368 41.326 41.326 39.129 2.197 18002
6316 1 11 . 1 1 6 6 ASP H H 368 8.199 8.199 8.434 -0.235 18002
6317 1 11 . 1 1 7 7 ILE N N 369 120.668 120.668 115.430 5.238 18002
6318 1 11 . 1 1 7 7 ILE HA H 369 4.218 4.218 3.882 0.336 18002
6319 1 11 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.589 -1.005 18002
6320 1 11 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.117 0.652 18002
6321 1 11 . 1 1 7 7 ILE H H 369 8.138 8.138 7.861 0.277 18002
6322 1 11 . 1 1 8 8 THR N N 370 117.564 117.564 116.868 0.696 18002
6323 1 11 . 1 1 8 8 THR HA H 370 4.322 4.322 4.330 -0.008 18002
6324 1 11 . 1 1 8 8 THR CA C 370 62.332 62.332 60.791 1.541 18002
6325 1 11 . 1 1 8 8 THR CB C 370 69.946 69.946 67.836 2.110 18002
6326 1 11 . 1 1 8 8 THR H H 370 8.230 8.230 7.749 0.481 18002
6327 1 11 . 1 1 9 9 SER N N 371 118.467 118.467 121.863 -3.396 18002
6328 1 11 . 1 1 9 9 SER HA H 371 4.445 4.445 4.221 0.224 18002
6329 1 11 . 1 1 9 9 SER CA C 371 58.274 58.274 59.046 -0.772 18002
6330 1 11 . 1 1 9 9 SER CB C 371 63.996 63.996 63.278 0.718 18002
6331 1 11 . 1 1 9 9 SER H H 371 8.158 8.158 7.981 0.177 18002
6332 1 11 . 1 1 10 10 ILE N N 372 123.959 123.959 120.286 3.673 18002
6333 1 11 . 1 1 10 10 ILE CA C 372 58.716 58.716 64.124 -5.408 18002
6334 1 11 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.279 2.640 18002
6335 1 11 . 1 1 10 10 ILE H H 372 8.112 8.112 8.258 -0.146 18002
6336 1 11 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.484 -0.132 18002
6337 1 11 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.459 1.722 18002
6338 1 11 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.178 1.529 18002
6339 1 11 . 1 1 12 12 GLU N N 374 119.349 119.349 121.693 -2.344 18002
6340 1 11 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.410 0.377 18002
6341 1 11 . 1 1 12 12 GLU CA C 374 55.317 55.317 56.126 -0.809 18002
6342 1 11 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.748 2.843 18002
6343 1 11 . 1 1 12 12 GLU H H 374 8.017 8.017 7.979 0.038 18002
6344 1 11 . 1 1 13 13 LEU N N 375 122.288 122.288 125.683 -3.395 18002
6345 1 11 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.630 -0.152 18002
6346 1 11 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.906 -0.976 18002
6347 1 11 . 1 1 13 13 LEU CB C 375 44.656 44.656 44.334 0.322 18002
6348 1 11 . 1 1 13 13 LEU H H 375 8.036 8.036 8.582 -0.546 18002
6349 1 11 . 1 1 14 14 ALA N N 376 125.461 125.461 128.113 -2.652 18002
6350 1 11 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.830 0.416 18002
6351 1 11 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.763 -0.018 18002
6352 1 11 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.966 -0.380 18002
6353 1 11 . 1 1 14 14 ALA H H 376 8.181 8.181 8.290 -0.109 18002
6354 1 11 . 1 1 15 15 ASP N N 377 122.242 122.242 118.621 3.621 18002
6355 1 11 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.866 -0.547 18002
6356 1 11 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.646 0.106 18002
6357 1 11 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.527 2.112 18002
6358 1 11 . 1 1 15 15 ASP H H 377 8.326 8.326 8.886 -0.560 18002
6359 1 11 . 1 1 16 16 TYR N N 378 118.961 118.961 118.139 0.822 18002
6360 1 11 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.154 0.237 18002
6361 1 11 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.863 2.718 18002
6362 1 11 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.188 -0.165 18002
6363 1 11 . 1 1 16 16 TYR H H 378 8.869 8.869 7.488 1.381 18002
6364 1 11 . 1 1 17 17 ILE N N 379 125.214 125.214 122.458 2.756 18002
6365 1 11 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.276 0.054 18002
6366 1 11 . 1 1 17 17 ILE CA C 379 58.732 58.732 60.358 -1.626 18002
6367 1 11 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.480 -1.504 18002
6368 1 11 . 1 1 17 17 ILE H H 379 8.608 8.608 7.848 0.760 18002
6369 1 11 . 1 1 18 18 LYS N N 380 122.917 122.917 122.608 0.309 18002
6370 1 11 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.277 -0.165 18002
6371 1 11 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.449 1.387 18002
6372 1 11 . 1 1 18 18 LYS CB C 380 35.025 35.025 36.410 -1.385 18002
6373 1 11 . 1 1 18 18 LYS H H 380 7.424 7.424 8.305 -0.881 18002
6374 1 11 . 1 1 19 19 VAL N N 381 122.839 122.839 119.834 3.005 18002
6375 1 11 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.412 0.851 18002
6376 1 11 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.361 1.155 18002
6377 1 11 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.485 -0.337 18002
6378 1 11 . 1 1 19 19 VAL H H 381 9.223 9.223 7.983 1.240 18002
6379 1 11 . 1 1 20 20 PHE N N 382 129.509 129.509 125.900 3.609 18002
6380 1 11 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.934 -0.091 18002
6381 1 11 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.388 -0.883 18002
6382 1 11 . 1 1 20 20 PHE CB C 382 42.862 42.862 42.043 0.819 18002
6383 1 11 . 1 1 20 20 PHE H H 382 9.451 9.451 8.474 0.977 18002
6384 1 11 . 1 1 21 21 LYS N N 383 126.417 126.417 124.031 2.386 18002
6385 1 11 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.928 -0.087 18002
6386 1 11 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.527 0.692 18002
6387 1 11 . 1 1 21 21 LYS H H 383 7.582 7.582 7.714 -0.132 18002
6388 1 11 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.653 0.044 18002
6389 1 11 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.703 0.265 18002
6390 1 11 . 1 1 23 23 LYS N N 385 118.026 118.026 115.996 2.030 18002
6391 1 11 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.965 0.250 18002
6392 1 11 . 1 1 23 23 LYS CA C 385 56.345 56.345 57.026 -0.681 18002
6393 1 11 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.321 0.712 18002
6394 1 11 . 1 1 23 23 LYS H H 385 8.138 8.138 7.831 0.307 18002
6395 1 11 . 1 1 24 24 LYS N N 386 120.816 120.816 123.277 -2.461 18002
6396 1 11 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.282 -0.096 18002
6397 1 11 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.236 -0.374 18002
6398 1 11 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.412 0.415 18002
6399 1 11 . 1 1 24 24 LYS H H 386 7.727 7.727 8.276 -0.549 18002
6400 1 11 . 1 1 25 25 LEU N N 387 121.214 121.214 120.911 0.303 18002
6401 1 11 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.575 -0.407 18002
6402 1 11 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.666 -0.158 18002
6403 1 11 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.131 -0.489 18002
6404 1 11 . 1 1 25 25 LEU H H 387 8.241 8.241 8.139 0.102 18002
6405 1 11 . 1 1 26 26 THR N N 388 112.798 112.798 115.097 -2.299 18002
6406 1 11 . 1 1 26 26 THR HA H 388 4.313 4.313 4.386 -0.073 18002
6407 1 11 . 1 1 26 26 THR CA C 388 61.795 61.795 62.320 -0.525 18002
6408 1 11 . 1 1 26 26 THR CB C 388 69.875 69.875 69.463 0.412 18002
6409 1 11 . 1 1 26 26 THR H H 388 7.700 7.700 7.879 -0.179 18002
6410 1 11 . 1 1 27 27 LEU N N 389 124.091 124.091 116.634 7.457 18002
6411 1 11 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.629 -0.275 18002
6412 1 11 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.867 0.666 18002
6413 1 11 . 1 1 27 27 LEU CB C 389 42.298 42.298 43.312 -1.014 18002
6414 1 11 . 1 1 27 27 LEU H H 389 8.260 8.260 7.984 0.276 18002
6415 1 11 . 1 1 28 28 LYS N N 390 121.153 121.153 118.782 2.371 18002
6416 1 11 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.294 0.026 18002
6417 1 11 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.149 0.062 18002
6418 1 11 . 1 1 28 28 LYS CB C 390 33.675 33.675 33.799 -0.124 18002
6419 1 11 . 1 1 28 28 LYS H H 390 8.202 8.202 8.507 -0.305 18002
6420 1 11 . 1 1 29 29 GLY N N 391 107.270 107.270 108.684 -1.414 18002
6421 1 11 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.201 -0.326 18002
6422 1 11 . 1 1 29 29 GLY H H 391 7.876 7.876 7.927 -0.051 18002
6423 1 11 . 1 1 30 30 TYR N N 392 118.471 118.471 120.288 -1.817 18002
6424 1 11 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.223 0.223 18002
6425 1 11 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.767 -0.720 18002
6426 1 11 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.796 3.029 18002
6427 1 11 . 1 1 30 30 TYR H H 392 8.183 8.183 8.894 -0.711 18002
6428 1 11 . 1 1 31 31 LYS N N 393 122.833 122.833 122.367 0.466 18002
6429 1 11 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.505 0.010 18002
6430 1 11 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.111 1.062 18002
6431 1 11 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.816 -0.096 18002
6432 1 11 . 1 1 31 31 LYS H H 393 8.731 8.731 7.503 1.228 18002
6433 1 11 . 1 1 32 32 GLN N N 394 124.759 124.759 122.023 2.736 18002
6434 1 11 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.412 0.266 18002
6435 1 11 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.028 1.579 18002
6436 1 11 . 1 1 32 32 GLN CB C 394 31.048 31.048 28.576 2.472 18002
6437 1 11 . 1 1 32 32 GLN H H 394 8.776 8.776 8.432 0.344 18002
6438 1 11 . 1 1 33 33 TYR N N 395 125.112 125.112 125.347 -0.235 18002
6439 1 11 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.165 0.909 18002
6440 1 11 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.190 0.975 18002
6441 1 11 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.535 2.137 18002
6442 1 11 . 1 1 33 33 TYR H H 395 8.774 8.774 8.564 0.210 18002
6443 1 11 . 1 1 34 34 TRP N N 396 122.638 122.638 125.452 -2.814 18002
6444 1 11 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.415 -0.733 18002
6445 1 11 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.846 3.372 18002
6446 1 11 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.559 0.945 18002
6447 1 11 . 1 1 34 34 TRP H H 396 8.975 8.975 7.461 1.514 18002
6448 1 11 . 1 1 35 35 CYS N N 397 127.146 127.146 121.767 5.379 18002
6449 1 11 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.688 0.679 18002
6450 1 11 . 1 1 35 35 CYS CB C 397 31.706 31.706 31.437 0.269 18002
6451 1 11 . 1 1 35 35 CYS H H 397 8.804 8.804 8.821 -0.017 18002
6452 1 11 . 1 1 36 36 THR N N 398 110.578 110.578 114.117 -3.539 18002
6453 1 11 . 1 1 36 36 THR HA H 398 5.358 5.358 4.887 0.471 18002
6454 1 11 . 1 1 36 36 THR CA C 398 58.704 58.704 60.961 -2.257 18002
6455 1 11 . 1 1 36 36 THR CB C 398 71.833 71.833 71.044 0.789 18002
6456 1 11 . 1 1 36 36 THR H H 398 9.090 9.090 8.105 0.985 18002
6457 1 11 . 1 1 37 37 PHE N N 399 127.322 127.322 129.037 -1.715 18002
6458 1 11 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.679 0.274 18002
6459 1 11 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.393 -1.147 18002
6460 1 11 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.520 2.665 18002
6461 1 11 . 1 1 37 37 PHE H H 399 8.846 8.846 8.210 0.636 18002
6462 1 11 . 1 1 38 38 LYS N N 400 125.391 125.391 126.249 -0.858 18002
6463 1 11 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.557 -0.030 18002
6464 1 11 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.467 0.511 18002
6465 1 11 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.846 2.068 18002
6466 1 11 . 1 1 38 38 LYS H H 400 8.252 8.252 8.266 -0.014 18002
6467 1 11 . 1 1 39 39 ASP N N 401 125.083 125.083 117.872 7.211 18002
6468 1 11 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.379 -0.301 18002
6469 1 11 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.426 0.057 18002
6470 1 11 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.632 -1.111 18002
6471 1 11 . 1 1 39 39 ASP H H 401 9.408 9.408 8.886 0.522 18002
6472 1 11 . 1 1 40 40 THR N N 402 112.024 112.024 106.606 5.418 18002
6473 1 11 . 1 1 40 40 THR HA H 402 4.767 4.767 4.521 0.246 18002
6474 1 11 . 1 1 40 40 THR CA C 402 60.811 60.811 62.781 -1.970 18002
6475 1 11 . 1 1 40 40 THR CB C 402 68.823 68.823 69.986 -1.163 18002
6476 1 11 . 1 1 40 40 THR H H 402 8.224 8.224 7.853 0.371 18002
6477 1 11 . 1 1 41 41 SER N N 403 116.142 116.142 116.124 0.018 18002
6478 1 11 . 1 1 41 41 SER HA H 403 5.428 5.428 4.926 0.502 18002
6479 1 11 . 1 1 41 41 SER CA C 403 58.297 58.297 56.951 1.346 18002
6480 1 11 . 1 1 41 41 SER CB C 403 66.409 66.409 65.264 1.145 18002
6481 1 11 . 1 1 41 41 SER H H 403 8.197 8.197 7.716 0.481 18002
6482 1 11 . 1 1 42 42 ILE N N 404 122.292 122.292 118.927 3.365 18002
6483 1 11 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.908 0.021 18002
6484 1 11 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.130 1.674 18002
6485 1 11 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.932 0.488 18002
6486 1 11 . 1 1 42 42 ILE H H 404 8.411 8.411 7.751 0.660 18002
6487 1 11 . 1 1 43 43 SER N N 405 122.244 122.244 116.055 6.189 18002
6488 1 11 . 1 1 43 43 SER HA H 405 4.966 4.966 4.836 0.130 18002
6489 1 11 . 1 1 43 43 SER CA C 405 57.735 57.735 57.740 -0.006 18002
6490 1 11 . 1 1 43 43 SER CB C 405 65.388 65.388 65.700 -0.312 18002
6491 1 11 . 1 1 43 43 SER H H 405 8.752 8.752 8.338 0.414 18002
6492 1 11 . 1 1 44 44 CYS N N 406 120.004 120.004 122.847 -2.843 18002
6493 1 11 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.896 0.071 18002
6494 1 11 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.909 -0.851 18002
6495 1 11 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.802 0.638 18002
6496 1 11 . 1 1 44 44 CYS H H 406 8.470 8.470 8.657 -0.187 18002
6497 1 11 . 1 1 45 45 TYR N N 407 122.704 122.704 124.321 -1.617 18002
6498 1 11 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.135 -0.112 18002
6499 1 11 . 1 1 45 45 TYR CA C 407 56.983 56.983 56.315 0.668 18002
6500 1 11 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.243 1.331 18002
6501 1 11 . 1 1 45 45 TYR H H 407 10.013 10.013 8.000 2.013 18002
6502 1 11 . 1 1 46 46 LYS N N 408 121.897 121.897 121.430 0.467 18002
6503 1 11 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.525 -0.179 18002
6504 1 11 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.161 3.858 18002
6505 1 11 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.109 -0.397 18002
6506 1 11 . 1 1 46 46 LYS H H 408 9.734 9.734 8.867 0.867 18002
6507 1 11 . 1 1 47 47 SER N N 409 106.720 106.720 110.861 -4.141 18002
6508 1 11 . 1 1 47 47 SER HA H 409 4.776 4.776 4.986 -0.209 18002
6509 1 11 . 1 1 47 47 SER CA C 409 57.180 57.180 57.961 -0.781 18002
6510 1 11 . 1 1 47 47 SER CB C 409 65.870 65.870 65.231 0.639 18002
6511 1 11 . 1 1 47 47 SER H H 409 7.518 7.518 8.004 -0.486 18002
6512 1 11 . 1 1 48 48 LYS N N 410 122.302 122.302 121.777 0.525 18002
6513 1 11 . 1 1 48 48 LYS CA C 410 59.234 59.234 56.452 2.782 18002
6514 1 11 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.404 0.895 18002
6515 1 11 . 1 1 48 48 LYS H H 410 8.195 8.195 8.771 -0.576 18002
6516 1 11 . 1 1 49 49 GLU N N 411 118.983 118.983 119.957 -0.974 18002
6517 1 11 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.011 0.771 18002
6518 1 11 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.916 0.619 18002
6519 1 11 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.592 -0.904 18002
6520 1 11 . 1 1 49 49 GLU H H 411 8.752 8.752 7.899 0.853 18002
6521 1 11 . 1 1 50 50 GLU N N 412 118.384 118.384 118.509 -0.125 18002
6522 1 11 . 1 1 50 50 GLU HA H 412 4.493 4.493 3.932 0.561 18002
6523 1 11 . 1 1 50 50 GLU CA C 412 55.789 55.789 58.740 -2.951 18002
6524 1 11 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.564 0.441 18002
6525 1 11 . 1 1 50 50 GLU H H 412 7.234 7.234 8.164 -0.930 18002
6526 1 11 . 1 1 51 51 SER N N 413 114.767 114.767 113.507 1.260 18002
6527 1 11 . 1 1 51 51 SER CA C 413 59.764 59.764 60.464 -0.700 18002
6528 1 11 . 1 1 51 51 SER CB C 413 62.965 62.965 61.982 0.983 18002
6529 1 11 . 1 1 51 51 SER H H 413 7.382 7.382 8.186 -0.804 18002
6530 1 11 . 1 1 52 52 SER N N 414 114.496 114.496 119.109 -4.613 18002
6531 1 11 . 1 1 52 52 SER HA H 414 4.560 4.560 4.476 0.084 18002
6532 1 11 . 1 1 52 52 SER CA C 414 58.574 58.574 58.812 -0.238 18002
6533 1 11 . 1 1 52 52 SER CB C 414 63.829 63.829 63.564 0.265 18002
6534 1 11 . 1 1 52 52 SER H H 414 7.682 7.682 8.114 -0.432 18002
6535 1 11 . 1 1 53 53 GLY N N 415 111.107 111.107 109.634 1.473 18002
6536 1 11 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.247 -0.014 18002
6537 1 11 . 1 1 53 53 GLY H H 415 7.918 7.918 7.188 0.730 18002
6538 1 11 . 1 1 54 54 THR N N 416 120.214 120.214 115.274 4.940 18002
6539 1 11 . 1 1 54 54 THR CB C 416 70.035 70.035 70.456 -0.421 18002
6540 1 11 . 1 1 54 54 THR H H 416 8.622 8.622 8.144 0.478 18002
6541 1 11 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.557 -0.082 18002
6542 1 11 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.135 -0.090 18002
6543 1 11 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.511 -0.934 18002
6544 1 11 . 1 1 56 56 ALA N N 418 125.591 125.591 124.864 0.727 18002
6545 1 11 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.992 -0.036 18002
6546 1 11 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.142 0.393 18002
6547 1 11 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.471 -0.564 18002
6548 1 11 . 1 1 56 56 ALA H H 418 8.288 8.288 8.230 0.058 18002
6549 1 11 . 1 1 57 57 HIS N N 419 108.119 108.119 116.074 -7.955 18002
6550 1 11 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.737 -0.115 18002
6551 1 11 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.587 -1.008 18002
6552 1 11 . 1 1 57 57 HIS CB C 419 34.219 34.219 33.155 1.064 18002
6553 1 11 . 1 1 57 57 HIS H H 419 7.072 7.072 7.661 -0.589 18002
6554 1 11 . 1 1 58 58 GLN N N 420 123.083 123.083 122.053 1.030 18002
6555 1 11 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.782 0.373 18002
6556 1 11 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.004 0.500 18002
6557 1 11 . 1 1 58 58 GLN CB C 420 32.490 32.490 29.792 2.698 18002
6558 1 11 . 1 1 58 58 GLN H H 420 8.669 8.669 8.704 -0.035 18002
6559 1 11 . 1 1 59 59 MET N N 421 122.330 122.330 119.421 2.909 18002
6560 1 11 . 1 1 59 59 MET HA H 421 4.621 4.621 4.779 -0.158 18002
6561 1 11 . 1 1 59 59 MET CA C 421 54.892 54.892 53.451 1.441 18002
6562 1 11 . 1 1 59 59 MET CB C 421 35.650 35.650 36.486 -0.836 18002
6563 1 11 . 1 1 59 59 MET H H 421 8.995 8.995 7.955 1.040 18002
6564 1 11 . 1 1 60 60 ASN N N 422 123.220 123.220 119.018 4.202 18002
6565 1 11 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.610 0.338 18002
6566 1 11 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.729 -0.098 18002
6567 1 11 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.209 0.530 18002
6568 1 11 . 1 1 60 60 ASN H H 422 8.728 8.728 8.452 0.276 18002
6569 1 11 . 1 1 61 61 LEU N N 423 126.072 126.072 122.544 3.528 18002
6570 1 11 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.260 -0.144 18002
6571 1 11 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.397 2.216 18002
6572 1 11 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.375 1.082 18002
6573 1 11 . 1 1 61 61 LEU H H 423 8.942 8.942 8.341 0.601 18002
6574 1 11 . 1 1 62 62 ARG N N 424 121.977 121.977 119.498 2.479 18002
6575 1 11 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.017 0.355 18002
6576 1 11 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.533 1.501 18002
6577 1 11 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.345 -0.735 18002
6578 1 11 . 1 1 62 62 ARG H H 424 8.000 8.000 7.610 0.390 18002
6579 1 11 . 1 1 63 63 GLY N N 425 114.852 114.852 113.792 1.060 18002
6580 1 11 . 1 1 63 63 GLY CA C 425 45.810 45.810 44.563 1.247 18002
6581 1 11 . 1 1 63 63 GLY H H 425 9.033 9.033 9.067 -0.034 18002
6582 1 11 . 1 1 64 64 CYS N N 426 117.102 117.102 117.466 -0.364 18002
6583 1 11 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.772 0.127 18002
6584 1 11 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.425 1.335 18002
6585 1 11 . 1 1 64 64 CYS CB C 426 28.824 28.824 30.115 -1.291 18002
6586 1 11 . 1 1 64 64 CYS H H 426 8.248 8.248 7.611 0.637 18002
6587 1 11 . 1 1 65 65 GLU N N 427 119.501 119.501 120.486 -0.985 18002
6588 1 11 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.458 0.319 18002
6589 1 11 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.570 -0.179 18002
6590 1 11 . 1 1 65 65 GLU CB C 427 31.938 31.938 32.671 -0.733 18002
6591 1 11 . 1 1 65 65 GLU H H 427 8.449 8.449 8.860 -0.411 18002
6592 1 11 . 1 1 66 66 VAL N N 428 125.286 125.286 120.899 4.387 18002
6593 1 11 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.503 0.387 18002
6594 1 11 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.492 -0.740 18002
6595 1 11 . 1 1 66 66 VAL CB C 428 33.975 33.975 35.013 -1.038 18002
6596 1 11 . 1 1 66 66 VAL H H 428 8.624 8.624 8.511 0.113 18002
6597 1 11 . 1 1 67 67 THR N N 429 124.132 124.132 124.562 -0.430 18002
6598 1 11 . 1 1 67 67 THR CA C 429 59.338 59.338 60.397 -1.059 18002
6599 1 11 . 1 1 67 67 THR CB C 429 72.021 72.021 70.852 1.169 18002
6600 1 11 . 1 1 67 67 THR H H 429 9.247 9.247 8.171 1.076 18002
6601 1 11 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.518 0.131 18002
6602 1 11 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.772 -0.034 18002
6603 1 11 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.451 1.117 18002
6604 1 11 . 1 1 69 69 ASP N N 431 122.066 122.066 123.343 -1.277 18002
6605 1 11 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.995 -0.348 18002
6606 1 11 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.042 0.627 18002
6607 1 11 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.178 -0.073 18002
6608 1 11 . 1 1 69 69 ASP H H 431 8.250 8.250 8.721 -0.471 18002
6609 1 11 . 1 1 70 70 VAL N N 432 121.874 121.874 122.296 -0.422 18002
6610 1 11 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.643 -0.144 18002
6611 1 11 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.577 0.511 18002
6612 1 11 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.696 0.336 18002
6613 1 11 . 1 1 70 70 VAL H H 432 8.305 8.305 8.066 0.239 18002
6614 1 11 . 1 1 71 71 ASN N N 433 124.366 124.366 127.753 -3.387 18002
6615 1 11 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.834 -0.152 18002
6616 1 11 . 1 1 71 71 ASN CA C 433 52.761 52.761 51.739 1.022 18002
6617 1 11 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.606 1.673 18002
6618 1 11 . 1 1 71 71 ASN H H 433 8.637 8.637 8.106 0.531 18002
6619 1 11 . 1 1 72 72 ILE N N 434 126.786 126.786 123.442 3.344 18002
6620 1 11 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.596 -0.225 18002
6621 1 11 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.675 0.843 18002
6622 1 11 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.775 -0.600 18002
6623 1 11 . 1 1 72 72 ILE H H 434 8.943 8.943 8.207 0.736 18002
6624 1 11 . 1 1 73 73 SER N N 435 118.305 118.305 115.055 3.250 18002
6625 1 11 . 1 1 73 73 SER CA C 435 61.633 61.633 60.632 1.001 18002
6626 1 11 . 1 1 73 73 SER CB C 435 62.435 62.435 62.733 -0.298 18002
6627 1 11 . 1 1 73 73 SER H H 435 8.578 8.578 8.438 0.140 18002
6628 1 11 . 1 1 74 74 GLY N N 436 107.443 107.443 105.035 2.408 18002
6629 1 11 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.752 0.109 18002
6630 1 11 . 1 1 74 74 GLY H H 436 7.620 7.620 7.432 0.188 18002
6631 1 11 . 1 1 75 75 GLN N N 437 116.895 116.895 115.832 1.063 18002
6632 1 11 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.352 -0.062 18002
6633 1 11 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.589 0.112 18002
6634 1 11 . 1 1 75 75 GLN CB C 437 26.745 26.745 26.263 0.482 18002
6635 1 11 . 1 1 75 75 GLN H H 437 7.798 7.798 7.920 -0.122 18002
6636 1 11 . 1 1 76 76 LYS N N 438 119.308 119.308 120.100 -0.792 18002
6637 1 11 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.229 -0.087 18002
6638 1 11 . 1 1 76 76 LYS CA C 438 55.043 55.043 56.407 -1.364 18002
6639 1 11 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.898 2.047 18002
6640 1 11 . 1 1 76 76 LYS H H 438 7.522 7.522 7.340 0.182 18002
6641 1 11 . 1 1 77 77 PHE N N 439 125.905 125.905 124.809 1.096 18002
6642 1 11 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.424 -0.213 18002
6643 1 11 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.572 -1.933 18002
6644 1 11 . 1 1 77 77 PHE CB C 439 38.929 38.929 39.374 -0.445 18002
6645 1 11 . 1 1 77 77 PHE H H 439 8.461 8.461 8.289 0.172 18002
6646 1 11 . 1 1 78 78 ASN N N 440 120.787 120.787 123.337 -2.550 18002
6647 1 11 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.124 -0.211 18002
6648 1 11 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.645 0.158 18002
6649 1 11 . 1 1 78 78 ASN H H 440 7.638 7.638 8.419 -0.781 18002
6650 1 11 . 1 1 79 79 ILE N N 441 123.421 123.421 125.429 -2.008 18002
6651 1 11 . 1 1 79 79 ILE HA H 441 4.171 4.171 3.792 0.379 18002
6652 1 11 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.593 0.974 18002
6653 1 11 . 1 1 79 79 ILE CB C 441 41.487 41.487 36.371 5.115 18002
6654 1 11 . 1 1 79 79 ILE H H 441 9.550 9.550 8.889 0.661 18002
6655 1 11 . 1 1 80 80 LYS N N 442 126.267 126.267 129.065 -2.798 18002
6656 1 11 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.461 0.001 18002
6657 1 11 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.054 1.329 18002
6658 1 11 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.872 1.115 18002
6659 1 11 . 1 1 80 80 LYS H H 442 8.703 8.703 8.026 0.677 18002
6660 1 11 . 1 1 81 81 LEU N N 443 125.194 125.194 127.248 -2.054 18002
6661 1 11 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.567 0.705 18002
6662 1 11 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.482 -0.133 18002
6663 1 11 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.618 1.086 18002
6664 1 11 . 1 1 81 81 LEU H H 443 9.223 9.223 8.549 0.674 18002
6665 1 11 . 1 1 82 82 LEU N N 444 122.753 122.753 126.466 -3.713 18002
6666 1 11 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.222 -0.208 18002
6667 1 11 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.753 0.165 18002
6668 1 11 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.821 -3.197 18002
6669 1 11 . 1 1 82 82 LEU H H 444 8.420 8.420 7.916 0.504 18002
6670 1 11 . 1 1 83 83 ILE N N 445 125.584 125.584 121.783 3.801 18002
6671 1 11 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.408 -0.123 18002
6672 1 11 . 1 1 83 83 ILE CB C 445 41.036 41.036 42.023 -0.987 18002
6673 1 11 . 1 1 83 83 ILE H H 445 9.010 9.010 8.036 0.974 18002
6674 1 11 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.855 0.064 18002
6675 1 11 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.388 1.645 18002
6676 1 11 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.805 0.142 18002
6677 1 11 . 1 1 85 85 VAL N N 447 119.780 119.780 118.812 0.968 18002
6678 1 11 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.521 -0.018 18002
6679 1 11 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.711 0.631 18002
6680 1 11 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.580 0.686 18002
6681 1 11 . 1 1 85 85 VAL H H 447 8.304 8.304 8.183 0.121 18002
6682 1 11 . 1 1 86 86 ALA N N 448 125.178 125.178 121.932 3.246 18002
6683 1 11 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.150 -0.175 18002
6684 1 11 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.733 0.829 18002
6685 1 11 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.305 -0.317 18002
6686 1 11 . 1 1 86 86 ALA H H 448 8.526 8.526 8.500 0.026 18002
6687 1 11 . 1 1 87 87 GLU N N 449 114.625 114.625 117.389 -2.764 18002
6688 1 11 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.125 0.165 18002
6689 1 11 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.336 -0.605 18002
6690 1 11 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.752 -0.492 18002
6691 1 11 . 1 1 87 87 GLU H H 449 8.402 8.402 8.602 -0.200 18002
6692 1 11 . 1 1 88 88 GLY N N 450 109.432 109.432 106.587 2.845 18002
6693 1 11 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.801 1.036 18002
6694 1 11 . 1 1 88 88 GLY H H 450 7.711 7.711 7.488 0.223 18002
6695 1 11 . 1 1 89 89 MET N N 451 121.382 121.382 120.454 0.928 18002
6696 1 11 . 1 1 89 89 MET HA H 451 5.076 5.076 4.975 0.101 18002
6697 1 11 . 1 1 89 89 MET CA C 451 53.860 53.860 54.765 -0.905 18002
6698 1 11 . 1 1 89 89 MET CB C 451 35.942 35.942 37.358 -1.416 18002
6699 1 11 . 1 1 89 89 MET H H 451 8.355 8.355 7.895 0.460 18002
6700 1 11 . 1 1 90 90 ASN N N 452 123.538 123.538 123.419 0.119 18002
6701 1 11 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.846 0.107 18002
6702 1 11 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.475 -0.727 18002
6703 1 11 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.102 1.540 18002
6704 1 11 . 1 1 90 90 ASN H H 452 9.338 9.338 8.950 0.388 18002
6705 1 11 . 1 1 91 91 GLU N N 453 125.978 125.978 124.346 1.632 18002
6706 1 11 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.376 0.968 18002
6707 1 11 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.652 -1.379 18002
6708 1 11 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.542 1.201 18002
6709 1 11 . 1 1 91 91 GLU H H 453 8.168 8.168 8.344 -0.176 18002
6710 1 11 . 1 1 92 92 ILE N N 454 126.776 126.776 124.741 2.035 18002
6711 1 11 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.981 0.585 18002
6712 1 11 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.134 -0.086 18002
6713 1 11 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.625 1.637 18002
6714 1 11 . 1 1 92 92 ILE H H 454 9.000 9.000 8.701 0.299 18002
6715 1 11 . 1 1 93 93 TRP N N 455 125.987 125.987 124.813 1.174 18002
6716 1 11 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.448 -0.856 18002
6717 1 11 . 1 1 93 93 TRP CA C 455 53.790 53.790 54.907 -1.117 18002
6718 1 11 . 1 1 93 93 TRP CB C 455 31.386 31.386 32.967 -1.581 18002
6719 1 11 . 1 1 93 93 TRP H H 455 9.278 9.278 7.379 1.899 18002
6720 1 11 . 1 1 94 94 LEU N N 456 120.912 120.912 119.261 1.651 18002
6721 1 11 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.604 0.758 18002
6722 1 11 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.476 -0.260 18002
6723 1 11 . 1 1 94 94 LEU CB C 456 43.594 43.594 44.993 -1.399 18002
6724 1 11 . 1 1 94 94 LEU H H 456 9.534 9.534 8.170 1.364 18002
6725 1 11 . 1 1 95 95 ARG N N 457 123.669 123.669 122.308 1.361 18002
6726 1 11 . 1 1 95 95 ARG HA H 457 5.271 5.271 5.501 -0.230 18002
6727 1 11 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.798 -0.381 18002
6728 1 11 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.679 0.583 18002
6729 1 11 . 1 1 95 95 ARG H H 457 9.439 9.439 8.657 0.782 18002
6730 1 11 . 1 1 96 96 CYS N N 458 125.273 125.273 120.001 5.272 18002
6731 1 11 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.804 -0.106 18002
6732 1 11 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.322 1.470 18002
6733 1 11 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.533 -1.130 18002
6734 1 11 . 1 1 96 96 CYS H H 458 8.652 8.652 8.642 0.010 18002
6735 1 11 . 1 1 97 97 ASP N N 459 119.661 119.661 119.696 -0.035 18002
6736 1 11 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.846 -0.106 18002
6737 1 11 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.290 2.938 18002
6738 1 11 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.889 1.696 18002
6739 1 11 . 1 1 97 97 ASP H H 459 9.116 9.116 8.427 0.689 18002
6740 1 11 . 1 1 98 98 ASN N N 460 109.173 109.173 116.238 -7.065 18002
6741 1 11 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.635 -0.263 18002
6742 1 11 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.030 -0.016 18002
6743 1 11 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.984 0.827 18002
6744 1 11 . 1 1 98 98 ASN H H 460 7.054 7.054 6.766 0.288 18002
6745 1 11 . 1 1 99 99 GLU N N 461 119.220 119.220 120.885 -1.665 18002
6746 1 11 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.719 0.325 18002
6747 1 11 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.598 0.170 18002
6748 1 11 . 1 1 99 99 GLU H H 461 8.937 8.937 8.954 -0.017 18002
6749 1 11 . 1 1 100 100 LYS N N 462 120.647 120.647 120.141 0.506 18002
6750 1 11 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.120 0.525 18002
6751 1 11 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.608 0.928 18002
6752 1 11 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.997 0.231 18002
6753 1 11 . 1 1 100 100 LYS H H 462 8.033 8.033 8.272 -0.239 18002
6754 1 11 . 1 1 101 101 GLN N N 463 121.938 121.938 118.292 3.646 18002
6755 1 11 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.978 0.422 18002
6756 1 11 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.262 0.133 18002
6757 1 11 . 1 1 101 101 GLN CB C 463 32.214 32.214 27.958 4.256 18002
6758 1 11 . 1 1 101 101 GLN H H 463 8.372 8.372 8.210 0.162 18002
6759 1 11 . 1 1 102 102 TYR N N 464 117.422 117.422 119.790 -2.368 18002
6760 1 11 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.164 0.452 18002
6761 1 11 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.537 0.140 18002
6762 1 11 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.200 0.659 18002
6763 1 11 . 1 1 102 102 TYR H H 464 8.221 8.221 7.654 0.567 18002
6764 1 11 . 1 1 103 103 ALA N N 465 120.655 120.655 120.262 0.393 18002
6765 1 11 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.875 -0.160 18002
6766 1 11 . 1 1 103 103 ALA CA C 465 55.913 55.913 55.467 0.446 18002
6767 1 11 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.198 0.604 18002
6768 1 11 . 1 1 103 103 ALA H H 465 8.637 8.637 7.923 0.714 18002
6769 1 11 . 1 1 104 104 HIS N N 466 112.871 112.871 117.384 -4.513 18002
6770 1 11 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.109 0.032 18002
6771 1 11 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.072 0.555 18002
6772 1 11 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.835 -0.977 18002
6773 1 11 . 1 1 104 104 HIS H H 466 7.852 7.852 7.847 0.005 18002
6774 1 11 . 1 1 105 105 TRP N N 467 121.317 121.317 118.847 2.470 18002
6775 1 11 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.272 -0.577 18002
6776 1 11 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.922 0.419 18002
6777 1 11 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.084 -1.579 18002
6778 1 11 . 1 1 105 105 TRP H H 467 8.668 8.668 7.859 0.809 18002
6779 1 11 . 1 1 106 106 MET N N 468 122.346 122.346 118.119 4.227 18002
6780 1 11 . 1 1 106 106 MET HA H 468 4.086 4.086 3.870 0.216 18002
6781 1 11 . 1 1 106 106 MET CA C 468 58.743 58.743 58.122 0.621 18002
6782 1 11 . 1 1 106 106 MET CB C 468 31.402 31.402 31.363 0.039 18002
6783 1 11 . 1 1 106 106 MET H H 468 9.790 9.790 8.603 1.187 18002
6784 1 11 . 1 1 107 107 ALA N N 469 119.758 119.758 120.920 -1.162 18002
6785 1 11 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.979 -0.274 18002
6786 1 11 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.940 1.189 18002
6787 1 11 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.279 2.126 18002
6788 1 11 . 1 1 107 107 ALA H H 469 7.702 7.702 8.275 -0.573 18002
6789 1 11 . 1 1 108 108 ALA N N 470 119.233 119.233 121.652 -2.419 18002
6790 1 11 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.871 -0.325 18002
6791 1 11 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.109 0.712 18002
6792 1 11 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.063 -1.331 18002
6793 1 11 . 1 1 108 108 ALA H H 470 7.156 7.156 8.145 -0.989 18002
6794 1 11 . 1 1 109 109 CYS N N 471 116.736 116.736 113.299 3.437 18002
6795 1 11 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.439 -0.382 18002
6796 1 11 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.062 3.509 18002
6797 1 11 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.756 0.636 18002
6798 1 11 . 1 1 109 109 CYS H H 471 8.256 8.256 8.719 -0.463 18002
6799 1 11 . 1 1 110 110 ARG N N 472 118.644 118.644 121.679 -3.035 18002
6800 1 11 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.150 -0.416 18002
6801 1 11 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.561 1.643 18002
6802 1 11 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.077 0.240 18002
6803 1 11 . 1 1 110 110 ARG H H 472 8.403 8.403 7.801 0.602 18002
6804 1 11 . 1 1 111 111 LEU N N 473 121.877 121.877 116.904 4.973 18002
6805 1 11 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.315 -0.515 18002
6806 1 11 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.270 2.585 18002
6807 1 11 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.025 0.395 18002
6808 1 11 . 1 1 111 111 LEU H H 473 7.916 7.916 7.974 -0.058 18002
6809 1 11 . 1 1 112 112 ALA N N 474 122.765 122.765 122.676 0.089 18002
6810 1 11 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.202 0.278 18002
6811 1 11 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.704 0.557 18002
6812 1 11 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.019 1.856 18002
6813 1 11 . 1 1 112 112 ALA H H 474 8.393 8.393 7.874 0.519 18002
6814 1 11 . 1 1 113 113 SER N N 475 113.613 113.613 114.398 -0.785 18002
6815 1 11 . 1 1 113 113 SER HA H 475 4.782 4.782 4.221 0.561 18002
6816 1 11 . 1 1 113 113 SER CA C 475 61.090 61.090 61.461 -0.371 18002
6817 1 11 . 1 1 113 113 SER CB C 475 63.612 63.612 63.099 0.513 18002
6818 1 11 . 1 1 113 113 SER H H 475 8.150 8.150 7.869 0.281 18002
6819 1 11 . 1 1 114 114 LYS N N 476 118.734 118.734 118.102 0.632 18002
6820 1 11 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.163 0.390 18002
6821 1 11 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.516 -1.372 18002
6822 1 11 . 1 1 114 114 LYS CB C 476 32.591 32.591 31.846 0.745 18002
6823 1 11 . 1 1 114 114 LYS H H 476 7.239 7.239 7.644 -0.405 18002
6824 1 11 . 1 1 115 115 GLY N N 477 107.818 107.818 107.757 0.061 18002
6825 1 11 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.603 0.383 18002
6826 1 11 . 1 1 115 115 GLY H H 477 8.401 8.401 7.901 0.500 18002
6827 1 11 . 1 1 116 116 LYS N N 478 120.938 120.938 119.401 1.537 18002
6828 1 11 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.645 -0.072 18002
6829 1 11 . 1 1 116 116 LYS CA C 478 54.847 54.847 53.547 1.300 18002
6830 1 11 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.413 -0.091 18002
6831 1 11 . 1 1 116 116 LYS H H 478 8.142 8.142 7.379 0.763 18002
6832 1 11 . 1 1 117 117 THR N N 479 108.076 108.076 115.076 -7.000 18002
6833 1 11 . 1 1 117 117 THR HA H 479 4.671 4.671 4.259 0.412 18002
6834 1 11 . 1 1 117 117 THR CA C 479 59.191 59.191 59.901 -0.710 18002
6835 1 11 . 1 1 117 117 THR CB C 479 72.228 72.228 70.066 2.162 18002
6836 1 11 . 1 1 117 117 THR H H 479 7.926 7.926 8.154 -0.228 18002
6837 1 11 . 1 1 118 118 MET N N 480 116.403 116.403 118.402 -1.999 18002
6838 1 11 . 1 1 118 118 MET HA H 480 3.352 3.352 4.283 -0.931 18002
6839 1 11 . 1 1 118 118 MET CA C 480 57.947 57.947 56.263 1.684 18002
6840 1 11 . 1 1 118 118 MET CB C 480 33.920 33.920 31.587 2.333 18002
6841 1 11 . 1 1 118 118 MET H H 480 8.899 8.899 8.388 0.511 18002
6842 1 11 . 1 1 119 119 ALA N N 481 117.786 117.786 119.474 -1.688 18002
6843 1 11 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.925 0.159 18002
6844 1 11 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.337 1.258 18002
6845 1 11 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.956 0.106 18002
6846 1 11 . 1 1 119 119 ALA H H 481 7.645 7.645 7.375 0.270 18002
6847 1 11 . 1 1 120 120 ASP N N 482 120.348 120.348 119.442 0.906 18002
6848 1 11 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.885 2.731 18002
6849 1 11 . 1 1 120 120 ASP H H 482 7.887 7.887 7.322 0.565 18002
6850 1 11 . 1 1 121 121 SER HA H 483 4.223 4.223 4.474 -0.251 18002
6851 1 11 . 1 1 121 121 SER CA C 483 61.455 61.455 60.492 0.963 18002
6852 1 11 . 1 1 121 121 SER CB C 483 62.996 62.996 63.452 -0.456 18002
6853 1 11 . 1 1 122 122 SER N N 484 116.845 116.845 117.059 -0.214 18002
6854 1 11 . 1 1 122 122 SER HA H 484 4.321 4.321 4.430 -0.109 18002
6855 1 11 . 1 1 122 122 SER CA C 484 60.584 60.584 59.448 1.136 18002
6856 1 11 . 1 1 122 122 SER CB C 484 64.314 64.314 63.063 1.250 18002
6857 1 11 . 1 1 122 122 SER H H 484 8.875 8.875 8.030 0.845 18002
6858 1 11 . 1 1 123 123 TYR N N 485 124.153 124.153 120.840 3.313 18002
6859 1 11 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.203 -0.323 18002
6860 1 11 . 1 1 123 123 TYR CA C 485 63.314 63.314 58.425 4.889 18002
6861 1 11 . 1 1 123 123 TYR CB C 485 37.741 37.741 36.558 1.183 18002
6862 1 11 . 1 1 123 123 TYR H H 485 8.018 8.018 8.562 -0.544 18002
6863 1 11 . 1 1 124 124 ASN N N 486 115.339 115.339 118.270 -2.931 18002
6864 1 11 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.617 0.324 18002
6865 1 11 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.537 1.169 18002
6866 1 11 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.484 0.572 18002
6867 1 11 . 1 1 124 124 ASN H H 486 8.665 8.665 7.517 1.148 18002
6868 1 11 . 1 1 125 125 LEU N N 487 119.454 119.454 118.475 0.979 18002
6869 1 11 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.156 -0.218 18002
6870 1 11 . 1 1 125 125 LEU CA C 487 57.670 57.670 56.756 0.914 18002
6871 1 11 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.921 -0.353 18002
6872 1 11 . 1 1 125 125 LEU H H 487 7.105 7.105 7.900 -0.795 18002
6873 1 11 . 1 1 126 126 GLU N N 488 121.189 121.189 119.603 1.586 18002
6874 1 11 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.011 0.019 18002
6875 1 11 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.444 -0.409 18002
6876 1 11 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.557 -0.472 18002
6877 1 11 . 1 1 126 126 GLU H H 488 8.053 8.053 7.806 0.247 18002
6878 1 11 . 1 1 127 127 VAL N N 489 119.073 119.073 116.594 2.479 18002
6879 1 11 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.770 -0.752 18002
6880 1 11 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.873 1.449 18002
6881 1 11 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.805 -0.146 18002
6882 1 11 . 1 1 127 127 VAL H H 489 7.769 7.769 7.859 -0.090 18002
6883 1 11 . 1 1 128 128 GLN N N 490 116.214 116.214 117.991 -1.777 18002
6884 1 11 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.021 -0.189 18002
6885 1 11 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.317 0.439 18002
6886 1 11 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.688 0.424 18002
6887 1 11 . 1 1 128 128 GLN H H 490 7.542 7.542 7.740 -0.198 18002
6888 1 11 . 1 1 129 129 ASN N N 491 120.003 120.003 119.166 0.837 18002
6889 1 11 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.701 -0.282 18002
6890 1 11 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.714 0.446 18002
6891 1 11 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.007 0.053 18002
6892 1 11 . 1 1 129 129 ASN H H 491 8.582 8.582 7.549 1.033 18002
6893 1 11 . 1 1 130 130 ILE N N 492 122.365 122.365 119.919 2.446 18002
6894 1 11 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.248 2.505 18002
6895 1 11 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.636 1.510 18002
6896 1 11 . 1 1 130 130 ILE H H 492 8.186 8.186 7.420 0.766 18002
6897 1 11 . 1 1 131 131 LEU N N 493 119.597 119.597 119.881 -0.284 18002
6898 1 11 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.036 -0.031 18002
6899 1 11 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.809 0.050 18002
6900 1 11 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.877 -0.341 18002
6901 1 11 . 1 1 131 131 LEU H H 493 8.224 8.224 7.667 0.557 18002
6902 1 11 . 1 1 132 132 SER N N 494 114.884 114.884 115.539 -0.655 18002
6903 1 11 . 1 1 132 132 SER HA H 494 4.430 4.430 4.185 0.245 18002
6904 1 11 . 1 1 132 132 SER CA C 494 62.072 62.072 61.920 0.152 18002
6905 1 11 . 1 1 132 132 SER CB C 494 62.703 62.703 62.926 -0.223 18002
6906 1 11 . 1 1 132 132 SER H H 494 8.464 8.464 8.175 0.289 18002
6907 1 11 . 1 1 133 133 PHE N N 495 123.047 123.047 119.021 4.026 18002
6908 1 11 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.407 -0.030 18002
6909 1 11 . 1 1 133 133 PHE CA C 495 60.913 60.913 60.414 0.499 18002
6910 1 11 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.645 0.405 18002
6911 1 11 . 1 1 133 133 PHE H H 495 7.915 7.915 8.086 -0.171 18002
6912 1 11 . 1 1 134 134 LEU N N 496 119.311 119.311 119.657 -0.346 18002
6913 1 11 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.205 -0.300 18002
6914 1 11 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.882 -0.281 18002
6915 1 11 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.991 -0.090 18002
6916 1 11 . 1 1 134 134 LEU H H 496 8.386 8.386 7.286 1.100 18002
6917 1 11 . 1 1 135 135 LYS N N 497 117.550 117.550 118.447 -0.897 18002
6918 1 11 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.137 -0.197 18002
6919 1 11 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.903 -0.628 18002
6920 1 11 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.754 -0.260 18002
6921 1 11 . 1 1 135 135 LYS H H 497 7.670 7.670 7.443 0.227 18002
6922 1 11 . 1 1 136 136 MET N N 498 116.106 116.106 113.715 2.391 18002
6923 1 11 . 1 1 136 136 MET HA H 498 4.354 4.354 4.617 -0.263 18002
6924 1 11 . 1 1 136 136 MET CA C 498 55.994 55.994 54.741 1.253 18002
6925 1 11 . 1 1 136 136 MET CB C 498 32.772 32.772 32.189 0.583 18002
6926 1 11 . 1 1 136 136 MET H H 498 7.421 7.421 7.397 0.024 18002
6927 1 11 . 1 1 137 137 GLN N N 499 118.651 118.651 121.151 -2.500 18002
6928 1 11 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.199 -0.015 18002
6929 1 11 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.192 -2.884 18002
6930 1 11 . 1 1 137 137 GLN H H 499 7.617 7.617 7.945 -0.328 18002
6931 1 12 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.595 -0.470 18002
6932 1 12 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.662 -1.647 18002
6933 1 12 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.562 1.367 18002
6934 1 12 . 1 1 4 4 MET N N 366 120.431 120.431 119.927 0.504 18002
6935 1 12 . 1 1 4 4 MET HA H 366 4.345 4.345 4.583 -0.238 18002
6936 1 12 . 1 1 4 4 MET CA C 366 55.337 55.337 55.962 -0.625 18002
6937 1 12 . 1 1 4 4 MET CB C 366 32.668 32.668 32.672 -0.004 18002
6938 1 12 . 1 1 4 4 MET H H 366 8.373 8.373 8.017 0.356 18002
6939 1 12 . 1 1 5 5 GLY N N 367 109.318 109.318 108.030 1.288 18002
6940 1 12 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.900 0.557 18002
6941 1 12 . 1 1 5 5 GLY H H 367 8.224 8.224 8.332 -0.108 18002
6942 1 12 . 1 1 6 6 ASP N N 368 120.307 120.307 120.861 -0.554 18002
6943 1 12 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.925 -0.325 18002
6944 1 12 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.174 1.339 18002
6945 1 12 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.233 0.093 18002
6946 1 12 . 1 1 6 6 ASP H H 368 8.199 8.199 8.242 -0.043 18002
6947 1 12 . 1 1 7 7 ILE N N 369 120.668 120.668 117.255 3.413 18002
6948 1 12 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.037 0.181 18002
6949 1 12 . 1 1 7 7 ILE CA C 369 61.584 61.584 63.018 -1.434 18002
6950 1 12 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.966 0.802 18002
6951 1 12 . 1 1 7 7 ILE H H 369 8.138 8.138 8.083 0.055 18002
6952 1 12 . 1 1 8 8 THR N N 370 117.564 117.564 112.380 5.184 18002
6953 1 12 . 1 1 8 8 THR HA H 370 4.322 4.322 4.348 -0.026 18002
6954 1 12 . 1 1 8 8 THR CA C 370 62.332 62.332 62.087 0.245 18002
6955 1 12 . 1 1 8 8 THR CB C 370 69.946 69.946 68.818 1.128 18002
6956 1 12 . 1 1 8 8 THR H H 370 8.230 8.230 7.990 0.240 18002
6957 1 12 . 1 1 9 9 SER N N 371 118.467 118.467 116.733 1.734 18002
6958 1 12 . 1 1 9 9 SER HA H 371 4.445 4.445 4.233 0.212 18002
6959 1 12 . 1 1 9 9 SER CA C 371 58.274 58.274 59.712 -1.438 18002
6960 1 12 . 1 1 9 9 SER CB C 371 63.996 63.996 62.148 1.848 18002
6961 1 12 . 1 1 9 9 SER H H 371 8.158 8.158 8.360 -0.202 18002
6962 1 12 . 1 1 10 10 ILE N N 372 123.959 123.959 119.949 4.010 18002
6963 1 12 . 1 1 10 10 ILE CA C 372 58.716 58.716 62.838 -4.122 18002
6964 1 12 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.706 2.213 18002
6965 1 12 . 1 1 10 10 ILE H H 372 8.112 8.112 7.839 0.273 18002
6966 1 12 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.667 -0.315 18002
6967 1 12 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.927 1.254 18002
6968 1 12 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.149 1.558 18002
6969 1 12 . 1 1 12 12 GLU N N 374 119.349 119.349 121.230 -1.881 18002
6970 1 12 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.505 0.282 18002
6971 1 12 . 1 1 12 12 GLU CA C 374 55.317 55.317 54.520 0.797 18002
6972 1 12 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.509 2.083 18002
6973 1 12 . 1 1 12 12 GLU H H 374 8.017 8.017 7.719 0.298 18002
6974 1 12 . 1 1 13 13 LEU N N 375 122.288 122.288 121.695 0.593 18002
6975 1 12 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.608 -0.130 18002
6976 1 12 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.233 -0.303 18002
6977 1 12 . 1 1 13 13 LEU CB C 375 44.656 44.656 44.063 0.593 18002
6978 1 12 . 1 1 13 13 LEU H H 375 8.036 8.036 8.647 -0.611 18002
6979 1 12 . 1 1 14 14 ALA N N 376 125.461 125.461 127.023 -1.562 18002
6980 1 12 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.919 0.327 18002
6981 1 12 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.405 0.340 18002
6982 1 12 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.057 -0.471 18002
6983 1 12 . 1 1 14 14 ALA H H 376 8.181 8.181 8.165 0.016 18002
6984 1 12 . 1 1 15 15 ASP N N 377 122.242 122.242 119.254 2.988 18002
6985 1 12 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.642 -0.323 18002
6986 1 12 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.812 -0.060 18002
6987 1 12 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.474 2.165 18002
6988 1 12 . 1 1 15 15 ASP H H 377 8.326 8.326 8.411 -0.085 18002
6989 1 12 . 1 1 16 16 TYR N N 378 118.961 118.961 119.089 -0.128 18002
6990 1 12 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.910 0.481 18002
6991 1 12 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.002 2.579 18002
6992 1 12 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.696 -0.673 18002
6993 1 12 . 1 1 16 16 TYR H H 378 8.869 8.869 8.382 0.487 18002
6994 1 12 . 1 1 17 17 ILE N N 379 125.214 125.214 118.052 7.162 18002
6995 1 12 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.603 -0.273 18002
6996 1 12 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.849 -0.117 18002
6997 1 12 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.740 -0.764 18002
6998 1 12 . 1 1 17 17 ILE H H 379 8.608 8.608 8.144 0.464 18002
6999 1 12 . 1 1 18 18 LYS N N 380 122.917 122.917 120.227 2.690 18002
7000 1 12 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.070 0.042 18002
7001 1 12 . 1 1 18 18 LYS CA C 380 55.836 55.836 53.923 1.913 18002
7002 1 12 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.329 0.696 18002
7003 1 12 . 1 1 18 18 LYS H H 380 7.424 7.424 7.993 -0.569 18002
7004 1 12 . 1 1 19 19 VAL N N 381 122.839 122.839 118.732 4.107 18002
7005 1 12 . 1 1 19 19 VAL HA H 381 5.263 5.263 5.268 -0.005 18002
7006 1 12 . 1 1 19 19 VAL CA C 381 61.516 61.516 58.880 2.636 18002
7007 1 12 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.126 0.022 18002
7008 1 12 . 1 1 19 19 VAL H H 381 9.223 9.223 7.746 1.477 18002
7009 1 12 . 1 1 20 20 PHE N N 382 129.509 129.509 119.711 9.798 18002
7010 1 12 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.203 -0.360 18002
7011 1 12 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.364 -0.859 18002
7012 1 12 . 1 1 20 20 PHE CB C 382 42.862 42.862 42.288 0.573 18002
7013 1 12 . 1 1 20 20 PHE H H 382 9.451 9.451 7.723 1.728 18002
7014 1 12 . 1 1 21 21 LYS N N 383 126.417 126.417 118.767 7.650 18002
7015 1 12 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.573 0.268 18002
7016 1 12 . 1 1 21 21 LYS CB C 383 33.219 33.219 33.225 -0.006 18002
7017 1 12 . 1 1 21 21 LYS H H 383 7.582 7.582 8.671 -1.089 18002
7018 1 12 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.760 -0.063 18002
7019 1 12 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.557 0.412 18002
7020 1 12 . 1 1 23 23 LYS N N 385 118.026 118.026 114.913 3.113 18002
7021 1 12 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.045 0.170 18002
7022 1 12 . 1 1 23 23 LYS CA C 385 56.345 56.345 57.145 -0.800 18002
7023 1 12 . 1 1 23 23 LYS CB C 385 33.033 33.033 30.175 2.858 18002
7024 1 12 . 1 1 23 23 LYS H H 385 8.138 8.138 8.067 0.071 18002
7025 1 12 . 1 1 24 24 LYS N N 386 120.816 120.816 122.776 -1.960 18002
7026 1 12 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.215 -0.029 18002
7027 1 12 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.005 -0.143 18002
7028 1 12 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.610 0.217 18002
7029 1 12 . 1 1 24 24 LYS H H 386 7.727 7.727 8.550 -0.823 18002
7030 1 12 . 1 1 25 25 LEU N N 387 121.214 121.214 120.317 0.897 18002
7031 1 12 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.162 0.006 18002
7032 1 12 . 1 1 25 25 LEU CA C 387 56.508 56.508 57.031 -0.523 18002
7033 1 12 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.992 -0.350 18002
7034 1 12 . 1 1 25 25 LEU H H 387 8.241 8.241 8.086 0.155 18002
7035 1 12 . 1 1 26 26 THR N N 388 112.798 112.798 108.052 4.746 18002
7036 1 12 . 1 1 26 26 THR HA H 388 4.313 4.313 4.370 -0.057 18002
7037 1 12 . 1 1 26 26 THR CA C 388 61.795 61.795 61.985 -0.190 18002
7038 1 12 . 1 1 26 26 THR CB C 388 69.875 69.875 69.734 0.141 18002
7039 1 12 . 1 1 26 26 THR H H 388 7.700 7.700 7.852 -0.152 18002
7040 1 12 . 1 1 27 27 LEU N N 389 124.091 124.091 117.495 6.596 18002
7041 1 12 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.834 -0.480 18002
7042 1 12 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.703 0.830 18002
7043 1 12 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.214 0.084 18002
7044 1 12 . 1 1 27 27 LEU H H 389 8.260 8.260 7.627 0.633 18002
7045 1 12 . 1 1 28 28 LYS N N 390 121.153 121.153 119.100 2.053 18002
7046 1 12 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.109 0.211 18002
7047 1 12 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.809 -0.598 18002
7048 1 12 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.794 0.881 18002
7049 1 12 . 1 1 28 28 LYS H H 390 8.202 8.202 8.439 -0.237 18002
7050 1 12 . 1 1 29 29 GLY N N 391 107.270 107.270 107.118 0.152 18002
7051 1 12 . 1 1 29 29 GLY CA C 391 44.875 44.875 44.942 -0.067 18002
7052 1 12 . 1 1 29 29 GLY H H 391 7.876 7.876 8.036 -0.160 18002
7053 1 12 . 1 1 30 30 TYR N N 392 118.471 118.471 118.385 0.086 18002
7054 1 12 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.146 0.300 18002
7055 1 12 . 1 1 30 30 TYR CA C 392 59.047 59.047 60.632 -1.585 18002
7056 1 12 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.918 1.907 18002
7057 1 12 . 1 1 30 30 TYR H H 392 8.183 8.183 8.445 -0.262 18002
7058 1 12 . 1 1 31 31 LYS N N 393 122.833 122.833 118.817 4.016 18002
7059 1 12 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.530 -0.015 18002
7060 1 12 . 1 1 31 31 LYS CA C 393 55.174 55.174 55.752 -0.578 18002
7061 1 12 . 1 1 31 31 LYS CB C 393 35.720 35.720 33.455 2.265 18002
7062 1 12 . 1 1 31 31 LYS H H 393 8.731 8.731 7.705 1.026 18002
7063 1 12 . 1 1 32 32 GLN N N 394 124.759 124.759 118.341 6.418 18002
7064 1 12 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.581 0.097 18002
7065 1 12 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.386 1.221 18002
7066 1 12 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.349 1.699 18002
7067 1 12 . 1 1 32 32 GLN H H 394 8.776 8.776 8.404 0.372 18002
7068 1 12 . 1 1 33 33 TYR N N 395 125.112 125.112 125.741 -0.629 18002
7069 1 12 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.788 0.286 18002
7070 1 12 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.473 -0.309 18002
7071 1 12 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.504 2.168 18002
7072 1 12 . 1 1 33 33 TYR H H 395 8.774 8.774 8.487 0.287 18002
7073 1 12 . 1 1 34 34 TRP N N 396 122.638 122.638 125.722 -3.084 18002
7074 1 12 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.613 -0.931 18002
7075 1 12 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.646 3.572 18002
7076 1 12 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.618 0.886 18002
7077 1 12 . 1 1 34 34 TRP H H 396 8.975 8.975 8.594 0.381 18002
7078 1 12 . 1 1 35 35 CYS N N 397 127.146 127.146 125.594 1.552 18002
7079 1 12 . 1 1 35 35 CYS CA C 397 57.367 57.367 58.461 -1.094 18002
7080 1 12 . 1 1 35 35 CYS CB C 397 31.706 31.706 31.344 0.362 18002
7081 1 12 . 1 1 35 35 CYS H H 397 8.804 8.804 8.954 -0.150 18002
7082 1 12 . 1 1 36 36 THR N N 398 110.578 110.578 113.358 -2.780 18002
7083 1 12 . 1 1 36 36 THR HA H 398 5.358 5.358 5.072 0.286 18002
7084 1 12 . 1 1 36 36 THR CA C 398 58.704 58.704 60.371 -1.667 18002
7085 1 12 . 1 1 36 36 THR CB C 398 71.833 71.833 71.130 0.703 18002
7086 1 12 . 1 1 36 36 THR H H 398 9.090 9.090 8.062 1.028 18002
7087 1 12 . 1 1 37 37 PHE N N 399 127.322 127.322 121.234 6.088 18002
7088 1 12 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.517 0.436 18002
7089 1 12 . 1 1 37 37 PHE CA C 399 56.246 56.246 58.184 -1.938 18002
7090 1 12 . 1 1 37 37 PHE CB C 399 42.185 42.185 41.091 1.094 18002
7091 1 12 . 1 1 37 37 PHE H H 399 8.846 8.846 8.036 0.810 18002
7092 1 12 . 1 1 38 38 LYS N N 400 125.391 125.391 122.904 2.487 18002
7093 1 12 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.585 -0.058 18002
7094 1 12 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.483 0.494 18002
7095 1 12 . 1 1 38 38 LYS CB C 400 35.915 35.915 34.500 1.415 18002
7096 1 12 . 1 1 38 38 LYS H H 400 8.252 8.252 9.100 -0.848 18002
7097 1 12 . 1 1 39 39 ASP N N 401 125.083 125.083 127.195 -2.112 18002
7098 1 12 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.187 -0.109 18002
7099 1 12 . 1 1 39 39 ASP CA C 401 57.483 57.483 58.032 -0.549 18002
7100 1 12 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.967 -0.446 18002
7101 1 12 . 1 1 39 39 ASP H H 401 9.408 9.408 8.915 0.493 18002
7102 1 12 . 1 1 40 40 THR N N 402 112.024 112.024 114.017 -1.993 18002
7103 1 12 . 1 1 40 40 THR HA H 402 4.767 4.767 4.578 0.189 18002
7104 1 12 . 1 1 40 40 THR CA C 402 60.811 60.811 61.033 -0.222 18002
7105 1 12 . 1 1 40 40 THR CB C 402 68.823 68.823 69.771 -0.948 18002
7106 1 12 . 1 1 40 40 THR H H 402 8.224 8.224 8.204 0.020 18002
7107 1 12 . 1 1 41 41 SER N N 403 116.142 116.142 115.054 1.088 18002
7108 1 12 . 1 1 41 41 SER HA H 403 5.428 5.428 4.709 0.719 18002
7109 1 12 . 1 1 41 41 SER CA C 403 58.297 58.297 56.811 1.486 18002
7110 1 12 . 1 1 41 41 SER CB C 403 66.409 66.409 66.552 -0.143 18002
7111 1 12 . 1 1 41 41 SER H H 403 8.197 8.197 8.612 -0.415 18002
7112 1 12 . 1 1 42 42 ILE N N 404 122.292 122.292 119.929 2.363 18002
7113 1 12 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.255 0.674 18002
7114 1 12 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.512 1.292 18002
7115 1 12 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.846 0.574 18002
7116 1 12 . 1 1 42 42 ILE H H 404 8.411 8.411 8.218 0.193 18002
7117 1 12 . 1 1 43 43 SER N N 405 122.244 122.244 117.300 4.944 18002
7118 1 12 . 1 1 43 43 SER HA H 405 4.966 4.966 4.640 0.326 18002
7119 1 12 . 1 1 43 43 SER CA C 405 57.735 57.735 57.560 0.175 18002
7120 1 12 . 1 1 43 43 SER CB C 405 65.388 65.388 64.504 0.884 18002
7121 1 12 . 1 1 43 43 SER H H 405 8.752 8.752 8.348 0.404 18002
7122 1 12 . 1 1 44 44 CYS N N 406 120.004 120.004 125.410 -5.406 18002
7123 1 12 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.481 0.486 18002
7124 1 12 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.009 -0.951 18002
7125 1 12 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.038 1.402 18002
7126 1 12 . 1 1 44 44 CYS H H 406 8.470 8.470 8.503 -0.033 18002
7127 1 12 . 1 1 45 45 TYR N N 407 122.704 122.704 127.186 -4.482 18002
7128 1 12 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.875 0.148 18002
7129 1 12 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.272 -0.289 18002
7130 1 12 . 1 1 45 45 TYR CB C 407 41.574 41.574 41.388 0.186 18002
7131 1 12 . 1 1 45 45 TYR H H 407 10.013 10.013 8.410 1.603 18002
7132 1 12 . 1 1 46 46 LYS N N 408 121.897 121.897 122.510 -0.613 18002
7133 1 12 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.682 -0.336 18002
7134 1 12 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.611 2.408 18002
7135 1 12 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.898 -1.186 18002
7136 1 12 . 1 1 46 46 LYS H H 408 9.734 9.734 10.054 -0.320 18002
7137 1 12 . 1 1 47 47 SER N N 409 106.720 106.720 111.675 -4.955 18002
7138 1 12 . 1 1 47 47 SER HA H 409 4.776 4.776 4.566 0.210 18002
7139 1 12 . 1 1 47 47 SER CA C 409 57.180 57.180 59.871 -2.691 18002
7140 1 12 . 1 1 47 47 SER CB C 409 65.870 65.870 63.254 2.616 18002
7141 1 12 . 1 1 47 47 SER H H 409 7.518 7.518 8.139 -0.621 18002
7142 1 12 . 1 1 48 48 LYS N N 410 122.302 122.302 121.212 1.090 18002
7143 1 12 . 1 1 48 48 LYS CA C 410 59.234 59.234 56.780 2.454 18002
7144 1 12 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.289 0.010 18002
7145 1 12 . 1 1 48 48 LYS H H 410 8.195 8.195 8.405 -0.210 18002
7146 1 12 . 1 1 49 49 GLU N N 411 118.983 118.983 119.295 -0.312 18002
7147 1 12 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.139 0.643 18002
7148 1 12 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.796 0.739 18002
7149 1 12 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.398 -0.710 18002
7150 1 12 . 1 1 49 49 GLU H H 411 8.752 8.752 8.634 0.118 18002
7151 1 12 . 1 1 50 50 GLU N N 412 118.384 118.384 116.917 1.467 18002
7152 1 12 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.426 0.067 18002
7153 1 12 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.153 -1.364 18002
7154 1 12 . 1 1 50 50 GLU CB C 412 30.005 30.005 30.048 -0.043 18002
7155 1 12 . 1 1 50 50 GLU H H 412 7.234 7.234 8.442 -1.208 18002
7156 1 12 . 1 1 51 51 SER N N 413 114.767 114.767 114.331 0.436 18002
7157 1 12 . 1 1 51 51 SER CA C 413 59.764 59.764 61.106 -1.342 18002
7158 1 12 . 1 1 51 51 SER CB C 413 62.965 62.965 62.422 0.543 18002
7159 1 12 . 1 1 51 51 SER H H 413 7.382 7.382 8.186 -0.804 18002
7160 1 12 . 1 1 52 52 SER N N 414 114.496 114.496 118.982 -4.486 18002
7161 1 12 . 1 1 52 52 SER HA H 414 4.560 4.560 4.674 -0.114 18002
7162 1 12 . 1 1 52 52 SER CA C 414 58.574 58.574 57.915 0.659 18002
7163 1 12 . 1 1 52 52 SER CB C 414 63.829 63.829 64.149 -0.320 18002
7164 1 12 . 1 1 52 52 SER H H 414 7.682 7.682 8.528 -0.846 18002
7165 1 12 . 1 1 53 53 GLY N N 415 111.107 111.107 110.301 0.806 18002
7166 1 12 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.026 -0.793 18002
7167 1 12 . 1 1 53 53 GLY H H 415 7.918 7.918 7.729 0.189 18002
7168 1 12 . 1 1 54 54 THR N N 416 120.214 120.214 115.346 4.868 18002
7169 1 12 . 1 1 54 54 THR CB C 416 70.035 70.035 70.452 -0.417 18002
7170 1 12 . 1 1 54 54 THR H H 416 8.622 8.622 8.034 0.588 18002
7171 1 12 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.843 0.632 18002
7172 1 12 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.350 0.695 18002
7173 1 12 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.872 -0.294 18002
7174 1 12 . 1 1 56 56 ALA N N 418 125.591 125.591 123.887 1.704 18002
7175 1 12 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.000 -0.044 18002
7176 1 12 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.069 0.466 18002
7177 1 12 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.452 -0.545 18002
7178 1 12 . 1 1 56 56 ALA H H 418 8.288 8.288 8.016 0.272 18002
7179 1 12 . 1 1 57 57 HIS N N 419 108.119 108.119 115.771 -7.652 18002
7180 1 12 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.602 0.020 18002
7181 1 12 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.464 -0.884 18002
7182 1 12 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.387 2.832 18002
7183 1 12 . 1 1 57 57 HIS H H 419 7.072 7.072 7.909 -0.837 18002
7184 1 12 . 1 1 58 58 GLN N N 420 123.083 123.083 125.103 -2.020 18002
7185 1 12 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.483 0.672 18002
7186 1 12 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.610 0.894 18002
7187 1 12 . 1 1 58 58 GLN CB C 420 32.490 32.490 29.198 3.292 18002
7188 1 12 . 1 1 58 58 GLN H H 420 8.669 8.669 8.165 0.504 18002
7189 1 12 . 1 1 59 59 MET N N 421 122.330 122.330 121.676 0.654 18002
7190 1 12 . 1 1 59 59 MET HA H 421 4.621 4.621 4.572 0.049 18002
7191 1 12 . 1 1 59 59 MET CA C 421 54.892 54.892 53.009 1.883 18002
7192 1 12 . 1 1 59 59 MET CB C 421 35.650 35.650 37.595 -1.945 18002
7193 1 12 . 1 1 59 59 MET H H 421 8.995 8.995 8.161 0.834 18002
7194 1 12 . 1 1 60 60 ASN N N 422 123.220 123.220 120.741 2.479 18002
7195 1 12 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.639 0.309 18002
7196 1 12 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.648 -0.017 18002
7197 1 12 . 1 1 60 60 ASN CB C 422 38.739 38.739 36.952 1.788 18002
7198 1 12 . 1 1 60 60 ASN H H 422 8.728 8.728 8.748 -0.020 18002
7199 1 12 . 1 1 61 61 LEU N N 423 126.072 126.072 123.175 2.897 18002
7200 1 12 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.103 0.013 18002
7201 1 12 . 1 1 61 61 LEU CA C 423 56.613 56.613 56.138 0.475 18002
7202 1 12 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.731 0.726 18002
7203 1 12 . 1 1 61 61 LEU H H 423 8.942 8.942 7.713 1.229 18002
7204 1 12 . 1 1 62 62 ARG N N 424 121.977 121.977 116.111 5.866 18002
7205 1 12 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.946 0.426 18002
7206 1 12 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.586 2.448 18002
7207 1 12 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.127 -0.517 18002
7208 1 12 . 1 1 62 62 ARG H H 424 8.000 8.000 7.762 0.238 18002
7209 1 12 . 1 1 63 63 GLY N N 425 114.852 114.852 108.807 6.045 18002
7210 1 12 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.693 0.117 18002
7211 1 12 . 1 1 63 63 GLY H H 425 9.033 9.033 8.501 0.532 18002
7212 1 12 . 1 1 64 64 CYS N N 426 117.102 117.102 116.558 0.544 18002
7213 1 12 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.575 0.324 18002
7214 1 12 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.551 1.209 18002
7215 1 12 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.376 -0.552 18002
7216 1 12 . 1 1 64 64 CYS H H 426 8.248 8.248 7.850 0.398 18002
7217 1 12 . 1 1 65 65 GLU N N 427 119.501 119.501 122.025 -2.524 18002
7218 1 12 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.383 0.394 18002
7219 1 12 . 1 1 65 65 GLU CA C 427 55.391 55.391 56.355 -0.964 18002
7220 1 12 . 1 1 65 65 GLU CB C 427 31.938 31.938 30.999 0.939 18002
7221 1 12 . 1 1 65 65 GLU H H 427 8.449 8.449 8.772 -0.323 18002
7222 1 12 . 1 1 66 66 VAL N N 428 125.286 125.286 124.974 0.312 18002
7223 1 12 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.388 0.502 18002
7224 1 12 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.123 -0.372 18002
7225 1 12 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.836 -0.861 18002
7226 1 12 . 1 1 66 66 VAL H H 428 8.624 8.624 8.447 0.177 18002
7227 1 12 . 1 1 67 67 THR N N 429 124.132 124.132 124.705 -0.573 18002
7228 1 12 . 1 1 67 67 THR CA C 429 59.338 59.338 60.381 -1.043 18002
7229 1 12 . 1 1 67 67 THR CB C 429 72.021 72.021 70.120 1.901 18002
7230 1 12 . 1 1 67 67 THR H H 429 9.247 9.247 8.236 1.011 18002
7231 1 12 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.692 -0.043 18002
7232 1 12 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.458 0.280 18002
7233 1 12 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.517 1.050 18002
7234 1 12 . 1 1 69 69 ASP N N 431 122.066 122.066 123.025 -0.959 18002
7235 1 12 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.769 -0.122 18002
7236 1 12 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.324 0.345 18002
7237 1 12 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.977 -0.873 18002
7238 1 12 . 1 1 69 69 ASP H H 431 8.250 8.250 8.477 -0.227 18002
7239 1 12 . 1 1 70 70 VAL N N 432 121.874 121.874 121.987 -0.113 18002
7240 1 12 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.561 -0.062 18002
7241 1 12 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.627 0.461 18002
7242 1 12 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.725 1.307 18002
7243 1 12 . 1 1 70 70 VAL H H 432 8.305 8.305 7.888 0.417 18002
7244 1 12 . 1 1 71 71 ASN N N 433 124.366 124.366 127.386 -3.020 18002
7245 1 12 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.837 -0.155 18002
7246 1 12 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.689 0.072 18002
7247 1 12 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.682 0.597 18002
7248 1 12 . 1 1 71 71 ASN H H 433 8.637 8.637 7.960 0.677 18002
7249 1 12 . 1 1 72 72 ILE N N 434 126.786 126.786 123.756 3.030 18002
7250 1 12 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.827 -0.456 18002
7251 1 12 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.161 1.357 18002
7252 1 12 . 1 1 72 72 ILE CB C 434 37.175 37.175 36.832 0.343 18002
7253 1 12 . 1 1 72 72 ILE H H 434 8.943 8.943 8.784 0.159 18002
7254 1 12 . 1 1 73 73 SER N N 435 118.305 118.305 118.413 -0.108 18002
7255 1 12 . 1 1 73 73 SER CA C 435 61.633 61.633 61.012 0.621 18002
7256 1 12 . 1 1 73 73 SER CB C 435 62.435 62.435 62.630 -0.195 18002
7257 1 12 . 1 1 73 73 SER H H 435 8.578 8.578 8.415 0.163 18002
7258 1 12 . 1 1 74 74 GLY N N 436 107.443 107.443 104.613 2.830 18002
7259 1 12 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.505 0.356 18002
7260 1 12 . 1 1 74 74 GLY H H 436 7.620 7.620 7.968 -0.348 18002
7261 1 12 . 1 1 75 75 GLN N N 437 116.895 116.895 116.834 0.061 18002
7262 1 12 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.610 -0.320 18002
7263 1 12 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.664 0.037 18002
7264 1 12 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.691 1.054 18002
7265 1 12 . 1 1 75 75 GLN H H 437 7.798 7.798 7.570 0.228 18002
7266 1 12 . 1 1 76 76 LYS N N 438 119.308 119.308 119.576 -0.268 18002
7267 1 12 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.442 -0.300 18002
7268 1 12 . 1 1 76 76 LYS CA C 438 55.043 55.043 55.342 -0.299 18002
7269 1 12 . 1 1 76 76 LYS CB C 438 33.945 33.945 32.322 1.623 18002
7270 1 12 . 1 1 76 76 LYS H H 438 7.522 7.522 7.565 -0.043 18002
7271 1 12 . 1 1 77 77 PHE N N 439 125.905 125.905 124.416 1.489 18002
7272 1 12 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.145 0.066 18002
7273 1 12 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.925 -2.286 18002
7274 1 12 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.473 0.456 18002
7275 1 12 . 1 1 77 77 PHE H H 439 8.461 8.461 8.482 -0.021 18002
7276 1 12 . 1 1 78 78 ASN N N 440 120.787 120.787 122.866 -2.079 18002
7277 1 12 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.151 -0.238 18002
7278 1 12 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.394 -0.591 18002
7279 1 12 . 1 1 78 78 ASN H H 440 7.638 7.638 8.133 -0.495 18002
7280 1 12 . 1 1 79 79 ILE N N 441 123.421 123.421 126.166 -2.745 18002
7281 1 12 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.391 -0.220 18002
7282 1 12 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.741 1.826 18002
7283 1 12 . 1 1 79 79 ILE CB C 441 41.487 41.487 38.914 2.573 18002
7284 1 12 . 1 1 79 79 ILE H H 441 9.550 9.550 8.450 1.100 18002
7285 1 12 . 1 1 80 80 LYS N N 442 126.267 126.267 129.910 -3.643 18002
7286 1 12 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.155 0.307 18002
7287 1 12 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.626 1.757 18002
7288 1 12 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.908 1.079 18002
7289 1 12 . 1 1 80 80 LYS H H 442 8.703 8.703 8.328 0.375 18002
7290 1 12 . 1 1 81 81 LEU N N 443 125.194 125.194 128.553 -3.359 18002
7291 1 12 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.771 0.501 18002
7292 1 12 . 1 1 81 81 LEU CA C 443 53.349 53.349 52.843 0.506 18002
7293 1 12 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.871 1.833 18002
7294 1 12 . 1 1 81 81 LEU H H 443 9.223 9.223 7.567 1.656 18002
7295 1 12 . 1 1 82 82 LEU N N 444 122.753 122.753 127.636 -4.883 18002
7296 1 12 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.041 -0.027 18002
7297 1 12 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.101 0.817 18002
7298 1 12 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.509 -2.885 18002
7299 1 12 . 1 1 82 82 LEU H H 444 8.420 8.420 7.698 0.722 18002
7300 1 12 . 1 1 83 83 ILE N N 445 125.584 125.584 121.842 3.742 18002
7301 1 12 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.272 0.013 18002
7302 1 12 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.993 -0.957 18002
7303 1 12 . 1 1 83 83 ILE H H 445 9.010 9.010 7.879 1.131 18002
7304 1 12 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.865 0.054 18002
7305 1 12 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.308 1.725 18002
7306 1 12 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.522 0.425 18002
7307 1 12 . 1 1 85 85 VAL N N 447 119.780 119.780 116.514 3.266 18002
7308 1 12 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.549 -0.046 18002
7309 1 12 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.693 0.649 18002
7310 1 12 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.461 0.805 18002
7311 1 12 . 1 1 85 85 VAL H H 447 8.304 8.304 8.458 -0.154 18002
7312 1 12 . 1 1 86 86 ALA N N 448 125.178 125.178 122.265 2.913 18002
7313 1 12 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.135 -0.160 18002
7314 1 12 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.749 0.812 18002
7315 1 12 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.322 -0.334 18002
7316 1 12 . 1 1 86 86 ALA H H 448 8.526 8.526 8.524 0.002 18002
7317 1 12 . 1 1 87 87 GLU N N 449 114.625 114.625 118.333 -3.708 18002
7318 1 12 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.128 0.162 18002
7319 1 12 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.471 -0.740 18002
7320 1 12 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.905 -0.645 18002
7321 1 12 . 1 1 87 87 GLU H H 449 8.402 8.402 8.735 -0.333 18002
7322 1 12 . 1 1 88 88 GLY N N 450 109.432 109.432 105.959 3.473 18002
7323 1 12 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.870 0.967 18002
7324 1 12 . 1 1 88 88 GLY H H 450 7.711 7.711 7.848 -0.137 18002
7325 1 12 . 1 1 89 89 MET N N 451 121.382 121.382 120.023 1.359 18002
7326 1 12 . 1 1 89 89 MET HA H 451 5.076 5.076 5.042 0.034 18002
7327 1 12 . 1 1 89 89 MET CA C 451 53.860 53.860 54.619 -0.759 18002
7328 1 12 . 1 1 89 89 MET CB C 451 35.942 35.942 37.470 -1.528 18002
7329 1 12 . 1 1 89 89 MET H H 451 8.355 8.355 7.838 0.517 18002
7330 1 12 . 1 1 90 90 ASN N N 452 123.538 123.538 122.231 1.307 18002
7331 1 12 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.915 0.038 18002
7332 1 12 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.662 -0.914 18002
7333 1 12 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.441 1.201 18002
7334 1 12 . 1 1 90 90 ASN H H 452 9.338 9.338 8.780 0.558 18002
7335 1 12 . 1 1 91 91 GLU N N 453 125.978 125.978 125.689 0.289 18002
7336 1 12 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.196 1.148 18002
7337 1 12 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.700 -1.427 18002
7338 1 12 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.300 1.443 18002
7339 1 12 . 1 1 91 91 GLU H H 453 8.168 8.168 8.184 -0.016 18002
7340 1 12 . 1 1 92 92 ILE N N 454 126.776 126.776 124.170 2.606 18002
7341 1 12 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.221 0.345 18002
7342 1 12 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.113 -0.065 18002
7343 1 12 . 1 1 92 92 ILE CB C 454 42.262 42.262 42.475 -0.213 18002
7344 1 12 . 1 1 92 92 ILE H H 454 9.000 9.000 7.369 1.631 18002
7345 1 12 . 1 1 93 93 TRP N N 455 125.987 125.987 123.920 2.067 18002
7346 1 12 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.788 -0.196 18002
7347 1 12 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.501 -1.711 18002
7348 1 12 . 1 1 93 93 TRP CB C 455 31.386 31.386 29.833 1.553 18002
7349 1 12 . 1 1 93 93 TRP H H 455 9.278 9.278 8.103 1.175 18002
7350 1 12 . 1 1 94 94 LEU N N 456 120.912 120.912 123.344 -2.432 18002
7351 1 12 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.150 0.212 18002
7352 1 12 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.671 -0.455 18002
7353 1 12 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.253 0.341 18002
7354 1 12 . 1 1 94 94 LEU H H 456 9.534 9.534 7.890 1.644 18002
7355 1 12 . 1 1 95 95 ARG N N 457 123.669 123.669 119.554 4.115 18002
7356 1 12 . 1 1 95 95 ARG HA H 457 5.271 5.271 5.411 -0.140 18002
7357 1 12 . 1 1 95 95 ARG CA C 457 55.417 55.417 54.471 0.945 18002
7358 1 12 . 1 1 95 95 ARG CB C 457 33.262 33.262 34.167 -0.905 18002
7359 1 12 . 1 1 95 95 ARG H H 457 9.439 9.439 8.135 1.304 18002
7360 1 12 . 1 1 96 96 CYS N N 458 125.273 125.273 120.823 4.450 18002
7361 1 12 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.180 -0.482 18002
7362 1 12 . 1 1 96 96 CYS CA C 458 58.792 58.792 56.806 1.986 18002
7363 1 12 . 1 1 96 96 CYS CB C 458 30.403 30.403 30.728 -0.325 18002
7364 1 12 . 1 1 96 96 CYS H H 458 8.652 8.652 8.498 0.154 18002
7365 1 12 . 1 1 97 97 ASP N N 459 119.661 119.661 121.308 -1.647 18002
7366 1 12 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.993 -0.253 18002
7367 1 12 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.018 3.210 18002
7368 1 12 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.683 0.902 18002
7369 1 12 . 1 1 97 97 ASP H H 459 9.116 9.116 8.079 1.037 18002
7370 1 12 . 1 1 98 98 ASN N N 460 109.173 109.173 115.894 -6.721 18002
7371 1 12 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.805 -0.433 18002
7372 1 12 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.184 -0.170 18002
7373 1 12 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.602 1.209 18002
7374 1 12 . 1 1 98 98 ASN H H 460 7.054 7.054 6.878 0.176 18002
7375 1 12 . 1 1 99 99 GLU N N 461 119.220 119.220 119.491 -0.271 18002
7376 1 12 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.024 0.020 18002
7377 1 12 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.554 0.214 18002
7378 1 12 . 1 1 99 99 GLU H H 461 8.937 8.937 9.009 -0.072 18002
7379 1 12 . 1 1 100 100 LYS N N 462 120.647 120.647 120.291 0.356 18002
7380 1 12 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.078 0.567 18002
7381 1 12 . 1 1 100 100 LYS CA C 462 60.536 60.536 60.020 0.515 18002
7382 1 12 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.797 0.431 18002
7383 1 12 . 1 1 100 100 LYS H H 462 8.033 8.033 8.465 -0.432 18002
7384 1 12 . 1 1 101 101 GLN N N 463 121.938 121.938 118.852 3.086 18002
7385 1 12 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.899 0.501 18002
7386 1 12 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.231 0.164 18002
7387 1 12 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.211 4.003 18002
7388 1 12 . 1 1 101 101 GLN H H 463 8.372 8.372 8.031 0.341 18002
7389 1 12 . 1 1 102 102 TYR N N 464 117.422 117.422 121.198 -3.776 18002
7390 1 12 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.101 0.515 18002
7391 1 12 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.848 -0.171 18002
7392 1 12 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.372 0.487 18002
7393 1 12 . 1 1 102 102 TYR H H 464 8.221 8.221 7.781 0.440 18002
7394 1 12 . 1 1 103 103 ALA N N 465 120.655 120.655 119.155 1.500 18002
7395 1 12 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.002 -0.287 18002
7396 1 12 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.772 1.141 18002
7397 1 12 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.417 0.385 18002
7398 1 12 . 1 1 103 103 ALA H H 465 8.637 8.637 8.401 0.236 18002
7399 1 12 . 1 1 104 104 HIS N N 466 112.871 112.871 118.900 -6.029 18002
7400 1 12 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.545 -0.404 18002
7401 1 12 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.341 0.286 18002
7402 1 12 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.882 -1.024 18002
7403 1 12 . 1 1 104 104 HIS H H 466 7.852 7.852 8.883 -1.031 18002
7404 1 12 . 1 1 105 105 TRP N N 467 121.317 121.317 119.917 1.400 18002
7405 1 12 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.525 -0.830 18002
7406 1 12 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.932 1.410 18002
7407 1 12 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.145 -1.640 18002
7408 1 12 . 1 1 105 105 TRP H H 467 8.668 8.668 7.882 0.786 18002
7409 1 12 . 1 1 106 106 MET N N 468 122.346 122.346 118.552 3.794 18002
7410 1 12 . 1 1 106 106 MET HA H 468 4.086 4.086 3.863 0.223 18002
7411 1 12 . 1 1 106 106 MET CA C 468 58.743 58.743 59.672 -0.929 18002
7412 1 12 . 1 1 106 106 MET CB C 468 31.402 31.402 31.588 -0.186 18002
7413 1 12 . 1 1 106 106 MET H H 468 9.790 9.790 8.648 1.142 18002
7414 1 12 . 1 1 107 107 ALA N N 469 119.758 119.758 120.093 -0.335 18002
7415 1 12 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.876 -0.171 18002
7416 1 12 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.780 1.349 18002
7417 1 12 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.007 2.398 18002
7418 1 12 . 1 1 107 107 ALA H H 469 7.702 7.702 7.607 0.095 18002
7419 1 12 . 1 1 108 108 ALA N N 470 119.233 119.233 122.126 -2.893 18002
7420 1 12 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.879 -0.333 18002
7421 1 12 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.245 0.576 18002
7422 1 12 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.085 -1.353 18002
7423 1 12 . 1 1 108 108 ALA H H 470 7.156 7.156 7.589 -0.433 18002
7424 1 12 . 1 1 109 109 CYS N N 471 116.736 116.736 118.103 -1.367 18002
7425 1 12 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.254 -0.197 18002
7426 1 12 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.592 2.979 18002
7427 1 12 . 1 1 109 109 CYS CB C 471 27.393 27.393 25.795 1.598 18002
7428 1 12 . 1 1 109 109 CYS H H 471 8.256 8.256 8.854 -0.598 18002
7429 1 12 . 1 1 110 110 ARG N N 472 118.644 118.644 119.550 -0.906 18002
7430 1 12 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.062 -0.328 18002
7431 1 12 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.475 1.729 18002
7432 1 12 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.948 0.369 18002
7433 1 12 . 1 1 110 110 ARG H H 472 8.403 8.403 7.680 0.723 18002
7434 1 12 . 1 1 111 111 LEU N N 473 121.877 121.877 122.449 -0.572 18002
7435 1 12 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.072 -0.272 18002
7436 1 12 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.623 2.232 18002
7437 1 12 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.322 -0.902 18002
7438 1 12 . 1 1 111 111 LEU H H 473 7.916 7.916 8.540 -0.624 18002
7439 1 12 . 1 1 112 112 ALA N N 474 122.765 122.765 119.468 3.297 18002
7440 1 12 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.909 0.571 18002
7441 1 12 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.698 0.563 18002
7442 1 12 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.016 1.859 18002
7443 1 12 . 1 1 112 112 ALA H H 474 8.393 8.393 8.792 -0.399 18002
7444 1 12 . 1 1 113 113 SER N N 475 113.613 113.613 112.355 1.258 18002
7445 1 12 . 1 1 113 113 SER HA H 475 4.782 4.782 4.244 0.538 18002
7446 1 12 . 1 1 113 113 SER CA C 475 61.090 61.090 60.743 0.347 18002
7447 1 12 . 1 1 113 113 SER CB C 475 63.612 63.612 63.290 0.322 18002
7448 1 12 . 1 1 113 113 SER H H 475 8.150 8.150 7.915 0.235 18002
7449 1 12 . 1 1 114 114 LYS N N 476 118.734 118.734 118.956 -0.222 18002
7450 1 12 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.164 0.389 18002
7451 1 12 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.962 -1.818 18002
7452 1 12 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.691 -0.100 18002
7453 1 12 . 1 1 114 114 LYS H H 476 7.239 7.239 8.219 -0.980 18002
7454 1 12 . 1 1 115 115 GLY N N 477 107.818 107.818 106.226 1.592 18002
7455 1 12 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.187 0.799 18002
7456 1 12 . 1 1 115 115 GLY H H 477 8.401 8.401 7.748 0.653 18002
7457 1 12 . 1 1 116 116 LYS N N 478 120.938 120.938 120.065 0.873 18002
7458 1 12 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.570 0.003 18002
7459 1 12 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.579 0.268 18002
7460 1 12 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.258 0.063 18002
7461 1 12 . 1 1 116 116 LYS H H 478 8.142 8.142 7.501 0.641 18002
7462 1 12 . 1 1 117 117 THR N N 479 108.076 108.076 116.570 -8.494 18002
7463 1 12 . 1 1 117 117 THR HA H 479 4.671 4.671 4.202 0.469 18002
7464 1 12 . 1 1 117 117 THR CA C 479 59.191 59.191 61.076 -1.885 18002
7465 1 12 . 1 1 117 117 THR CB C 479 72.228 72.228 69.843 2.385 18002
7466 1 12 . 1 1 117 117 THR H H 479 7.926 7.926 8.189 -0.263 18002
7467 1 12 . 1 1 118 118 MET N N 480 116.403 116.403 119.129 -2.726 18002
7468 1 12 . 1 1 118 118 MET HA H 480 3.352 3.352 3.783 -0.431 18002
7469 1 12 . 1 1 118 118 MET CA C 480 57.947 57.947 55.849 2.098 18002
7470 1 12 . 1 1 118 118 MET CB C 480 33.920 33.920 30.954 2.966 18002
7471 1 12 . 1 1 118 118 MET H H 480 8.899 8.899 8.468 0.431 18002
7472 1 12 . 1 1 119 119 ALA N N 481 117.786 117.786 121.198 -3.412 18002
7473 1 12 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.951 0.133 18002
7474 1 12 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.230 -1.635 18002
7475 1 12 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.319 -0.257 18002
7476 1 12 . 1 1 119 119 ALA H H 481 7.645 7.645 8.306 -0.661 18002
7477 1 12 . 1 1 120 120 ASP N N 482 120.348 120.348 114.530 5.818 18002
7478 1 12 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.515 5.101 18002
7479 1 12 . 1 1 120 120 ASP H H 482 7.887 7.887 8.338 -0.451 18002
7480 1 12 . 1 1 121 121 SER HA H 483 4.223 4.223 4.209 0.014 18002
7481 1 12 . 1 1 121 121 SER CA C 483 61.455 61.455 61.581 -0.126 18002
7482 1 12 . 1 1 121 121 SER CB C 483 62.996 62.996 63.040 -0.044 18002
7483 1 12 . 1 1 122 122 SER N N 484 116.845 116.845 115.452 1.393 18002
7484 1 12 . 1 1 122 122 SER HA H 484 4.321 4.321 4.518 -0.197 18002
7485 1 12 . 1 1 122 122 SER CA C 484 60.584 60.584 58.971 1.613 18002
7486 1 12 . 1 1 122 122 SER CB C 484 64.314 64.314 62.825 1.488 18002
7487 1 12 . 1 1 122 122 SER H H 484 8.875 8.875 8.149 0.726 18002
7488 1 12 . 1 1 123 123 TYR N N 485 124.153 124.153 122.301 1.852 18002
7489 1 12 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.347 -0.467 18002
7490 1 12 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.366 1.948 18002
7491 1 12 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.018 -0.277 18002
7492 1 12 . 1 1 123 123 TYR H H 485 8.018 8.018 8.308 -0.290 18002
7493 1 12 . 1 1 124 124 ASN N N 486 115.339 115.339 117.220 -1.881 18002
7494 1 12 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.406 -0.465 18002
7495 1 12 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.336 0.370 18002
7496 1 12 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.424 -0.368 18002
7497 1 12 . 1 1 124 124 ASN H H 486 8.665 8.665 7.814 0.851 18002
7498 1 12 . 1 1 125 125 LEU N N 487 119.454 119.454 121.700 -2.246 18002
7499 1 12 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.084 -0.146 18002
7500 1 12 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.358 0.312 18002
7501 1 12 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.867 -0.299 18002
7502 1 12 . 1 1 125 125 LEU H H 487 7.105 7.105 7.900 -0.795 18002
7503 1 12 . 1 1 126 126 GLU N N 488 121.189 121.189 119.054 2.135 18002
7504 1 12 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.868 0.162 18002
7505 1 12 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.694 -0.659 18002
7506 1 12 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.616 -0.531 18002
7507 1 12 . 1 1 126 126 GLU H H 488 8.053 8.053 8.135 -0.082 18002
7508 1 12 . 1 1 127 127 VAL N N 489 119.073 119.073 116.350 2.723 18002
7509 1 12 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.711 -0.693 18002
7510 1 12 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.924 1.398 18002
7511 1 12 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.518 0.141 18002
7512 1 12 . 1 1 127 127 VAL H H 489 7.769 7.769 7.003 0.766 18002
7513 1 12 . 1 1 128 128 GLN N N 490 116.214 116.214 118.595 -2.381 18002
7514 1 12 . 1 1 128 128 GLN HA H 490 3.832 3.832 3.994 -0.162 18002
7515 1 12 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.490 0.266 18002
7516 1 12 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.650 0.462 18002
7517 1 12 . 1 1 128 128 GLN H H 490 7.542 7.542 7.923 -0.381 18002
7518 1 12 . 1 1 129 129 ASN N N 491 120.003 120.003 117.291 2.712 18002
7519 1 12 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.693 -0.274 18002
7520 1 12 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.404 0.756 18002
7521 1 12 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.380 -0.320 18002
7522 1 12 . 1 1 129 129 ASN H H 491 8.582 8.582 7.771 0.811 18002
7523 1 12 . 1 1 130 130 ILE N N 492 122.365 122.365 120.875 1.490 18002
7524 1 12 . 1 1 130 130 ILE CA C 492 65.753 65.753 62.195 3.558 18002
7525 1 12 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.074 1.072 18002
7526 1 12 . 1 1 130 130 ILE H H 492 8.186 8.186 7.747 0.439 18002
7527 1 12 . 1 1 131 131 LEU N N 493 119.597 119.597 120.432 -0.835 18002
7528 1 12 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.951 0.054 18002
7529 1 12 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.428 0.431 18002
7530 1 12 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.247 0.289 18002
7531 1 12 . 1 1 131 131 LEU H H 493 8.224 8.224 7.991 0.233 18002
7532 1 12 . 1 1 132 132 SER N N 494 114.884 114.884 115.648 -0.764 18002
7533 1 12 . 1 1 132 132 SER HA H 494 4.430 4.430 4.140 0.290 18002
7534 1 12 . 1 1 132 132 SER CA C 494 62.072 62.072 62.141 -0.069 18002
7535 1 12 . 1 1 132 132 SER CB C 494 62.703 62.703 62.593 0.110 18002
7536 1 12 . 1 1 132 132 SER H H 494 8.464 8.464 7.835 0.629 18002
7537 1 12 . 1 1 133 133 PHE N N 495 123.047 123.047 120.082 2.965 18002
7538 1 12 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.245 0.132 18002
7539 1 12 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.543 -0.630 18002
7540 1 12 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.663 0.388 18002
7541 1 12 . 1 1 133 133 PHE H H 495 7.915 7.915 8.325 -0.410 18002
7542 1 12 . 1 1 134 134 LEU N N 496 119.311 119.311 119.603 -0.292 18002
7543 1 12 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.090 -0.185 18002
7544 1 12 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.878 -0.277 18002
7545 1 12 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.403 0.498 18002
7546 1 12 . 1 1 134 134 LEU H H 496 8.386 8.386 7.701 0.685 18002
7547 1 12 . 1 1 135 135 LYS N N 497 117.550 117.550 121.791 -4.241 18002
7548 1 12 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.099 -0.159 18002
7549 1 12 . 1 1 135 135 LYS CA C 497 58.275 58.275 59.066 -0.791 18002
7550 1 12 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.348 0.146 18002
7551 1 12 . 1 1 135 135 LYS H H 497 7.670 7.670 8.390 -0.720 18002
7552 1 12 . 1 1 136 136 MET N N 498 116.106 116.106 112.556 3.550 18002
7553 1 12 . 1 1 136 136 MET HA H 498 4.354 4.354 4.780 -0.426 18002
7554 1 12 . 1 1 136 136 MET CA C 498 55.994 55.994 54.735 1.259 18002
7555 1 12 . 1 1 136 136 MET CB C 498 32.772 32.772 33.824 -1.052 18002
7556 1 12 . 1 1 136 136 MET H H 498 7.421 7.421 7.379 0.042 18002
7557 1 12 . 1 1 137 137 GLN N N 499 118.651 118.651 121.091 -2.440 18002
7558 1 12 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.989 0.195 18002
7559 1 12 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.307 -2.999 18002
7560 1 12 . 1 1 137 137 GLN H H 499 7.617 7.617 8.481 -0.864 18002
7561 1 13 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.328 -0.203 18002
7562 1 13 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.082 -1.067 18002
7563 1 13 . 1 1 3 3 HIS CB C 365 31.929 31.929 26.675 5.254 18002
7564 1 13 . 1 1 4 4 MET N N 366 120.431 120.431 121.064 -0.633 18002
7565 1 13 . 1 1 4 4 MET HA H 366 4.345 4.345 4.354 -0.009 18002
7566 1 13 . 1 1 4 4 MET CA C 366 55.337 55.337 57.107 -1.770 18002
7567 1 13 . 1 1 4 4 MET CB C 366 32.668 32.668 32.327 0.341 18002
7568 1 13 . 1 1 4 4 MET H H 366 8.373 8.373 8.491 -0.118 18002
7569 1 13 . 1 1 5 5 GLY N N 367 109.318 109.318 112.713 -3.395 18002
7570 1 13 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.051 0.406 18002
7571 1 13 . 1 1 5 5 GLY H H 367 8.224 8.224 8.803 -0.579 18002
7572 1 13 . 1 1 6 6 ASP N N 368 120.307 120.307 121.181 -0.874 18002
7573 1 13 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.659 -0.059 18002
7574 1 13 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.229 1.284 18002
7575 1 13 . 1 1 6 6 ASP CB C 368 41.326 41.326 40.650 0.676 18002
7576 1 13 . 1 1 6 6 ASP H H 368 8.199 8.199 7.996 0.203 18002
7577 1 13 . 1 1 7 7 ILE N N 369 120.668 120.668 115.627 5.041 18002
7578 1 13 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.136 0.082 18002
7579 1 13 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.487 -0.903 18002
7580 1 13 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.154 0.614 18002
7581 1 13 . 1 1 7 7 ILE H H 369 8.138 8.138 7.976 0.162 18002
7582 1 13 . 1 1 8 8 THR N N 370 117.564 117.564 115.084 2.480 18002
7583 1 13 . 1 1 8 8 THR HA H 370 4.322 4.322 4.445 -0.123 18002
7584 1 13 . 1 1 8 8 THR CA C 370 62.332 62.332 61.740 0.592 18002
7585 1 13 . 1 1 8 8 THR CB C 370 69.946 69.946 68.923 1.023 18002
7586 1 13 . 1 1 8 8 THR H H 370 8.230 8.230 7.983 0.247 18002
7587 1 13 . 1 1 9 9 SER N N 371 118.467 118.467 116.983 1.484 18002
7588 1 13 . 1 1 9 9 SER HA H 371 4.445 4.445 4.057 0.388 18002
7589 1 13 . 1 1 9 9 SER CA C 371 58.274 58.274 59.312 -1.038 18002
7590 1 13 . 1 1 9 9 SER CB C 371 63.996 63.996 62.414 1.582 18002
7591 1 13 . 1 1 9 9 SER H H 371 8.158 8.158 8.045 0.113 18002
7592 1 13 . 1 1 10 10 ILE N N 372 123.959 123.959 118.743 5.216 18002
7593 1 13 . 1 1 10 10 ILE CA C 372 58.716 58.716 64.198 -5.482 18002
7594 1 13 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.362 2.557 18002
7595 1 13 . 1 1 10 10 ILE H H 372 8.112 8.112 8.784 -0.672 18002
7596 1 13 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.609 -0.257 18002
7597 1 13 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.487 1.694 18002
7598 1 13 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.215 1.492 18002
7599 1 13 . 1 1 12 12 GLU N N 374 119.349 119.349 121.862 -2.513 18002
7600 1 13 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.640 0.147 18002
7601 1 13 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.243 0.074 18002
7602 1 13 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.969 2.622 18002
7603 1 13 . 1 1 12 12 GLU H H 374 8.017 8.017 8.030 -0.013 18002
7604 1 13 . 1 1 13 13 LEU N N 375 122.288 122.288 127.158 -4.870 18002
7605 1 13 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.480 -0.002 18002
7606 1 13 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.504 -1.574 18002
7607 1 13 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.116 1.540 18002
7608 1 13 . 1 1 13 13 LEU H H 375 8.036 8.036 8.531 -0.495 18002
7609 1 13 . 1 1 14 14 ALA N N 376 125.461 125.461 127.818 -2.357 18002
7610 1 13 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.620 0.626 18002
7611 1 13 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.805 -0.060 18002
7612 1 13 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.811 -0.225 18002
7613 1 13 . 1 1 14 14 ALA H H 376 8.181 8.181 8.230 -0.049 18002
7614 1 13 . 1 1 15 15 ASP N N 377 122.242 122.242 119.225 3.017 18002
7615 1 13 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.575 -0.256 18002
7616 1 13 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.642 0.110 18002
7617 1 13 . 1 1 15 15 ASP CB C 377 46.639 46.639 43.459 3.180 18002
7618 1 13 . 1 1 15 15 ASP H H 377 8.326 8.326 8.678 -0.352 18002
7619 1 13 . 1 1 16 16 TYR N N 378 118.961 118.961 118.128 0.833 18002
7620 1 13 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.882 0.509 18002
7621 1 13 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.637 1.944 18002
7622 1 13 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.089 -0.066 18002
7623 1 13 . 1 1 16 16 TYR H H 378 8.869 8.869 8.231 0.638 18002
7624 1 13 . 1 1 17 17 ILE N N 379 125.214 125.214 123.551 1.663 18002
7625 1 13 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.301 0.029 18002
7626 1 13 . 1 1 17 17 ILE CA C 379 58.732 58.732 59.239 -0.507 18002
7627 1 13 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.688 -0.712 18002
7628 1 13 . 1 1 17 17 ILE H H 379 8.608 8.608 8.431 0.177 18002
7629 1 13 . 1 1 18 18 LYS N N 380 122.917 122.917 124.549 -1.632 18002
7630 1 13 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.795 0.317 18002
7631 1 13 . 1 1 18 18 LYS CA C 380 55.836 55.836 55.282 0.554 18002
7632 1 13 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.972 0.053 18002
7633 1 13 . 1 1 18 18 LYS H H 380 7.424 7.424 8.365 -0.941 18002
7634 1 13 . 1 1 19 19 VAL N N 381 122.839 122.839 124.227 -1.388 18002
7635 1 13 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.666 0.597 18002
7636 1 13 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.749 1.766 18002
7637 1 13 . 1 1 19 19 VAL CB C 381 35.148 35.148 36.108 -0.960 18002
7638 1 13 . 1 1 19 19 VAL H H 381 9.223 9.223 8.610 0.613 18002
7639 1 13 . 1 1 20 20 PHE N N 382 129.509 129.509 121.185 8.324 18002
7640 1 13 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.057 -0.214 18002
7641 1 13 . 1 1 20 20 PHE CA C 382 55.505 55.505 54.113 1.392 18002
7642 1 13 . 1 1 20 20 PHE CB C 382 42.862 42.862 39.204 3.658 18002
7643 1 13 . 1 1 20 20 PHE H H 382 9.451 9.451 8.568 0.883 18002
7644 1 13 . 1 1 21 21 LYS N N 383 126.417 126.417 126.598 -0.181 18002
7645 1 13 . 1 1 21 21 LYS CA C 383 52.841 52.841 55.090 -2.248 18002
7646 1 13 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.697 0.522 18002
7647 1 13 . 1 1 21 21 LYS H H 383 7.582 7.582 8.716 -1.134 18002
7648 1 13 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.339 1.358 18002
7649 1 13 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.465 -0.496 18002
7650 1 13 . 1 1 23 23 LYS N N 385 118.026 118.026 119.175 -1.149 18002
7651 1 13 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.417 -0.202 18002
7652 1 13 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.015 0.330 18002
7653 1 13 . 1 1 23 23 LYS CB C 385 33.033 33.033 33.521 -0.488 18002
7654 1 13 . 1 1 23 23 LYS H H 385 8.138 8.138 7.586 0.552 18002
7655 1 13 . 1 1 24 24 LYS N N 386 120.816 120.816 120.823 -0.007 18002
7656 1 13 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.132 0.054 18002
7657 1 13 . 1 1 24 24 LYS CA C 386 56.862 56.862 58.346 -1.484 18002
7658 1 13 . 1 1 24 24 LYS CB C 386 32.827 32.827 31.433 1.394 18002
7659 1 13 . 1 1 24 24 LYS H H 386 7.727 7.727 8.455 -0.728 18002
7660 1 13 . 1 1 25 25 LEU N N 387 121.214 121.214 120.564 0.650 18002
7661 1 13 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.022 0.146 18002
7662 1 13 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.712 -0.204 18002
7663 1 13 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.458 0.184 18002
7664 1 13 . 1 1 25 25 LEU H H 387 8.241 8.241 8.018 0.223 18002
7665 1 13 . 1 1 26 26 THR N N 388 112.798 112.798 112.642 0.156 18002
7666 1 13 . 1 1 26 26 THR HA H 388 4.313 4.313 4.294 0.019 18002
7667 1 13 . 1 1 26 26 THR CA C 388 61.795 61.795 62.277 -0.482 18002
7668 1 13 . 1 1 26 26 THR CB C 388 69.875 69.875 68.706 1.169 18002
7669 1 13 . 1 1 26 26 THR H H 388 7.700 7.700 7.955 -0.255 18002
7670 1 13 . 1 1 27 27 LEU N N 389 124.091 124.091 123.731 0.360 18002
7671 1 13 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.642 -0.288 18002
7672 1 13 . 1 1 27 27 LEU CA C 389 55.533 55.533 54.400 1.133 18002
7673 1 13 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.697 -0.399 18002
7674 1 13 . 1 1 27 27 LEU H H 389 8.260 8.260 7.683 0.577 18002
7675 1 13 . 1 1 28 28 LYS N N 390 121.153 121.153 119.346 1.807 18002
7676 1 13 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.044 0.276 18002
7677 1 13 . 1 1 28 28 LYS CA C 390 56.211 56.211 58.812 -2.601 18002
7678 1 13 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.250 1.425 18002
7679 1 13 . 1 1 28 28 LYS H H 390 8.202 8.202 8.479 -0.277 18002
7680 1 13 . 1 1 29 29 GLY N N 391 107.270 107.270 107.506 -0.236 18002
7681 1 13 . 1 1 29 29 GLY CA C 391 44.875 44.875 46.336 -1.461 18002
7682 1 13 . 1 1 29 29 GLY H H 391 7.876 7.876 8.204 -0.328 18002
7683 1 13 . 1 1 30 30 TYR N N 392 118.471 118.471 125.103 -6.632 18002
7684 1 13 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.445 0.001 18002
7685 1 13 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.779 -0.731 18002
7686 1 13 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.304 2.521 18002
7687 1 13 . 1 1 30 30 TYR H H 392 8.183 8.183 8.558 -0.375 18002
7688 1 13 . 1 1 31 31 LYS N N 393 122.833 122.833 126.613 -3.780 18002
7689 1 13 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.683 -0.168 18002
7690 1 13 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.429 0.745 18002
7691 1 13 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.328 -0.608 18002
7692 1 13 . 1 1 31 31 LYS H H 393 8.731 8.731 8.477 0.254 18002
7693 1 13 . 1 1 32 32 GLN N N 394 124.759 124.759 123.427 1.332 18002
7694 1 13 . 1 1 32 32 GLN HA H 394 4.678 4.678 5.134 -0.456 18002
7695 1 13 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.282 2.325 18002
7696 1 13 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.698 0.350 18002
7697 1 13 . 1 1 32 32 GLN H H 394 8.776 8.776 8.580 0.196 18002
7698 1 13 . 1 1 33 33 TYR N N 395 125.112 125.112 121.697 3.415 18002
7699 1 13 . 1 1 33 33 TYR HA H 395 5.074 5.074 5.159 -0.085 18002
7700 1 13 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.520 1.644 18002
7701 1 13 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.995 1.677 18002
7702 1 13 . 1 1 33 33 TYR H H 395 8.774 8.774 7.657 1.117 18002
7703 1 13 . 1 1 34 34 TRP N N 396 122.638 122.638 123.228 -0.590 18002
7704 1 13 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.377 -0.695 18002
7705 1 13 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.184 4.034 18002
7706 1 13 . 1 1 34 34 TRP CB C 396 29.504 29.504 29.971 -0.467 18002
7707 1 13 . 1 1 34 34 TRP H H 396 8.975 8.975 8.022 0.953 18002
7708 1 13 . 1 1 35 35 CYS N N 397 127.146 127.146 119.290 7.856 18002
7709 1 13 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.520 -0.153 18002
7710 1 13 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.951 0.755 18002
7711 1 13 . 1 1 35 35 CYS H H 397 8.804 8.804 8.996 -0.192 18002
7712 1 13 . 1 1 36 36 THR N N 398 110.578 110.578 115.223 -4.645 18002
7713 1 13 . 1 1 36 36 THR HA H 398 5.358 5.358 4.840 0.518 18002
7714 1 13 . 1 1 36 36 THR CA C 398 58.704 58.704 61.406 -2.702 18002
7715 1 13 . 1 1 36 36 THR CB C 398 71.833 71.833 70.684 1.149 18002
7716 1 13 . 1 1 36 36 THR H H 398 9.090 9.090 8.310 0.780 18002
7717 1 13 . 1 1 37 37 PHE N N 399 127.322 127.322 130.140 -2.818 18002
7718 1 13 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.668 0.285 18002
7719 1 13 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.590 -1.345 18002
7720 1 13 . 1 1 37 37 PHE CB C 399 42.185 42.185 41.395 0.791 18002
7721 1 13 . 1 1 37 37 PHE H H 399 8.846 8.846 8.223 0.623 18002
7722 1 13 . 1 1 38 38 LYS N N 400 125.391 125.391 126.565 -1.174 18002
7723 1 13 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.837 -0.310 18002
7724 1 13 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.256 1.721 18002
7725 1 13 . 1 1 38 38 LYS CB C 400 35.915 35.915 36.025 -0.110 18002
7726 1 13 . 1 1 38 38 LYS H H 400 8.252 8.252 7.730 0.522 18002
7727 1 13 . 1 1 39 39 ASP N N 401 125.083 125.083 122.379 2.704 18002
7728 1 13 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.237 -0.159 18002
7729 1 13 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.535 -0.052 18002
7730 1 13 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.816 -0.295 18002
7731 1 13 . 1 1 39 39 ASP H H 401 9.408 9.408 8.985 0.423 18002
7732 1 13 . 1 1 40 40 THR N N 402 112.024 112.024 115.463 -3.439 18002
7733 1 13 . 1 1 40 40 THR HA H 402 4.767 4.767 4.592 0.175 18002
7734 1 13 . 1 1 40 40 THR CA C 402 60.811 60.811 61.314 -0.503 18002
7735 1 13 . 1 1 40 40 THR CB C 402 68.823 68.823 69.538 -0.715 18002
7736 1 13 . 1 1 40 40 THR H H 402 8.224 8.224 8.131 0.093 18002
7737 1 13 . 1 1 41 41 SER N N 403 116.142 116.142 114.484 1.658 18002
7738 1 13 . 1 1 41 41 SER HA H 403 5.428 5.428 4.675 0.753 18002
7739 1 13 . 1 1 41 41 SER CA C 403 58.297 58.297 56.942 1.355 18002
7740 1 13 . 1 1 41 41 SER CB C 403 66.409 66.409 66.623 -0.214 18002
7741 1 13 . 1 1 41 41 SER H H 403 8.197 8.197 7.895 0.302 18002
7742 1 13 . 1 1 42 42 ILE N N 404 122.292 122.292 121.066 1.226 18002
7743 1 13 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.543 0.386 18002
7744 1 13 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.772 1.032 18002
7745 1 13 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.986 0.433 18002
7746 1 13 . 1 1 42 42 ILE H H 404 8.411 8.411 8.159 0.252 18002
7747 1 13 . 1 1 43 43 SER N N 405 122.244 122.244 117.513 4.731 18002
7748 1 13 . 1 1 43 43 SER HA H 405 4.966 4.966 4.804 0.162 18002
7749 1 13 . 1 1 43 43 SER CA C 405 57.735 57.735 57.085 0.650 18002
7750 1 13 . 1 1 43 43 SER CB C 405 65.388 65.388 64.808 0.580 18002
7751 1 13 . 1 1 43 43 SER H H 405 8.752 8.752 8.230 0.522 18002
7752 1 13 . 1 1 44 44 CYS N N 406 120.004 120.004 125.707 -5.703 18002
7753 1 13 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.863 0.104 18002
7754 1 13 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.038 -0.980 18002
7755 1 13 . 1 1 44 44 CYS CB C 406 29.440 29.440 27.893 1.547 18002
7756 1 13 . 1 1 44 44 CYS H H 406 8.470 8.470 8.160 0.310 18002
7757 1 13 . 1 1 45 45 TYR N N 407 122.704 122.704 129.139 -6.435 18002
7758 1 13 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.885 0.138 18002
7759 1 13 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.734 -0.751 18002
7760 1 13 . 1 1 45 45 TYR CB C 407 41.574 41.574 42.790 -1.216 18002
7761 1 13 . 1 1 45 45 TYR H H 407 10.013 10.013 8.261 1.752 18002
7762 1 13 . 1 1 46 46 LYS N N 408 121.897 121.897 121.823 0.074 18002
7763 1 13 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.580 -0.234 18002
7764 1 13 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.694 2.325 18002
7765 1 13 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.669 -0.957 18002
7766 1 13 . 1 1 46 46 LYS H H 408 9.734 9.734 9.031 0.703 18002
7767 1 13 . 1 1 47 47 SER N N 409 106.720 106.720 112.402 -5.682 18002
7768 1 13 . 1 1 47 47 SER HA H 409 4.776 4.776 4.784 -0.008 18002
7769 1 13 . 1 1 47 47 SER CA C 409 57.180 57.180 57.787 -0.607 18002
7770 1 13 . 1 1 47 47 SER CB C 409 65.870 65.870 65.451 0.419 18002
7771 1 13 . 1 1 47 47 SER H H 409 7.518 7.518 7.998 -0.480 18002
7772 1 13 . 1 1 48 48 LYS N N 410 122.302 122.302 123.166 -0.864 18002
7773 1 13 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.331 0.903 18002
7774 1 13 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.907 0.392 18002
7775 1 13 . 1 1 48 48 LYS H H 410 8.195 8.195 9.193 -0.998 18002
7776 1 13 . 1 1 49 49 GLU N N 411 118.983 118.983 119.819 -0.836 18002
7777 1 13 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.141 0.641 18002
7778 1 13 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.694 0.841 18002
7779 1 13 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.358 -0.670 18002
7780 1 13 . 1 1 49 49 GLU H H 411 8.752 8.752 8.560 0.192 18002
7781 1 13 . 1 1 50 50 GLU N N 412 118.384 118.384 119.010 -0.626 18002
7782 1 13 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.544 -0.051 18002
7783 1 13 . 1 1 50 50 GLU CA C 412 55.789 55.789 55.619 0.170 18002
7784 1 13 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.000 1.005 18002
7785 1 13 . 1 1 50 50 GLU H H 412 7.234 7.234 8.053 -0.819 18002
7786 1 13 . 1 1 51 51 SER N N 413 114.767 114.767 117.277 -2.510 18002
7787 1 13 . 1 1 51 51 SER CA C 413 59.764 59.764 61.150 -1.385 18002
7788 1 13 . 1 1 51 51 SER CB C 413 62.965 62.965 63.228 -0.263 18002
7789 1 13 . 1 1 51 51 SER H H 413 7.382 7.382 7.820 -0.438 18002
7790 1 13 . 1 1 52 52 SER N N 414 114.496 114.496 114.517 -0.021 18002
7791 1 13 . 1 1 52 52 SER HA H 414 4.560 4.560 4.627 -0.067 18002
7792 1 13 . 1 1 52 52 SER CA C 414 58.574 58.574 57.949 0.625 18002
7793 1 13 . 1 1 52 52 SER CB C 414 63.829 63.829 63.496 0.333 18002
7794 1 13 . 1 1 52 52 SER H H 414 7.682 7.682 8.214 -0.532 18002
7795 1 13 . 1 1 53 53 GLY N N 415 111.107 111.107 110.030 1.077 18002
7796 1 13 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.992 -0.759 18002
7797 1 13 . 1 1 53 53 GLY H H 415 7.918 7.918 8.058 -0.140 18002
7798 1 13 . 1 1 54 54 THR N N 416 120.214 120.214 117.154 3.060 18002
7799 1 13 . 1 1 54 54 THR CB C 416 70.035 70.035 70.046 -0.011 18002
7800 1 13 . 1 1 54 54 THR H H 416 8.622 8.622 8.219 0.403 18002
7801 1 13 . 1 1 55 55 PRO HA H 417 4.475 4.475 3.981 0.494 18002
7802 1 13 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.017 0.028 18002
7803 1 13 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.687 -0.109 18002
7804 1 13 . 1 1 56 56 ALA N N 418 125.591 125.591 128.313 -2.722 18002
7805 1 13 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.037 -0.081 18002
7806 1 13 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.770 0.765 18002
7807 1 13 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.237 -0.330 18002
7808 1 13 . 1 1 56 56 ALA H H 418 8.288 8.288 8.381 -0.093 18002
7809 1 13 . 1 1 57 57 HIS N N 419 108.119 108.119 114.853 -6.734 18002
7810 1 13 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.692 -0.070 18002
7811 1 13 . 1 1 57 57 HIS CA C 419 54.580 54.580 54.731 -0.151 18002
7812 1 13 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.581 1.638 18002
7813 1 13 . 1 1 57 57 HIS H H 419 7.072 7.072 7.975 -0.903 18002
7814 1 13 . 1 1 58 58 GLN N N 420 123.083 123.083 122.034 1.049 18002
7815 1 13 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.723 0.432 18002
7816 1 13 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.523 -0.019 18002
7817 1 13 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.362 2.128 18002
7818 1 13 . 1 1 58 58 GLN H H 420 8.669 8.669 8.572 0.097 18002
7819 1 13 . 1 1 59 59 MET N N 421 122.330 122.330 121.556 0.774 18002
7820 1 13 . 1 1 59 59 MET HA H 421 4.621 4.621 4.809 -0.188 18002
7821 1 13 . 1 1 59 59 MET CA C 421 54.892 54.892 53.624 1.268 18002
7822 1 13 . 1 1 59 59 MET CB C 421 35.650 35.650 36.124 -0.474 18002
7823 1 13 . 1 1 59 59 MET H H 421 8.995 8.995 8.189 0.806 18002
7824 1 13 . 1 1 60 60 ASN N N 422 123.220 123.220 118.691 4.529 18002
7825 1 13 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.953 -0.005 18002
7826 1 13 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.683 -0.052 18002
7827 1 13 . 1 1 60 60 ASN CB C 422 38.739 38.739 39.087 -0.348 18002
7828 1 13 . 1 1 60 60 ASN H H 422 8.728 8.728 8.503 0.225 18002
7829 1 13 . 1 1 61 61 LEU N N 423 126.072 126.072 118.397 7.675 18002
7830 1 13 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.430 -0.314 18002
7831 1 13 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.004 2.610 18002
7832 1 13 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.353 1.104 18002
7833 1 13 . 1 1 61 61 LEU H H 423 8.942 8.942 8.622 0.320 18002
7834 1 13 . 1 1 62 62 ARG N N 424 121.977 121.977 121.018 0.959 18002
7835 1 13 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.129 0.243 18002
7836 1 13 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.433 1.601 18002
7837 1 13 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.184 -0.574 18002
7838 1 13 . 1 1 62 62 ARG H H 424 8.000 8.000 7.626 0.374 18002
7839 1 13 . 1 1 63 63 GLY N N 425 114.852 114.852 114.143 0.709 18002
7840 1 13 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.323 0.487 18002
7841 1 13 . 1 1 63 63 GLY H H 425 9.033 9.033 8.795 0.238 18002
7842 1 13 . 1 1 64 64 CYS N N 426 117.102 117.102 118.023 -0.921 18002
7843 1 13 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.466 0.433 18002
7844 1 13 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.391 1.369 18002
7845 1 13 . 1 1 64 64 CYS CB C 426 28.824 28.824 28.477 0.347 18002
7846 1 13 . 1 1 64 64 CYS H H 426 8.248 8.248 7.717 0.531 18002
7847 1 13 . 1 1 65 65 GLU N N 427 119.501 119.501 121.992 -2.491 18002
7848 1 13 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.364 0.413 18002
7849 1 13 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.535 -0.144 18002
7850 1 13 . 1 1 65 65 GLU CB C 427 31.938 31.938 30.348 1.590 18002
7851 1 13 . 1 1 65 65 GLU H H 427 8.449 8.449 8.795 -0.346 18002
7852 1 13 . 1 1 66 66 VAL N N 428 125.286 125.286 126.948 -1.662 18002
7853 1 13 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.238 0.652 18002
7854 1 13 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.452 -0.700 18002
7855 1 13 . 1 1 66 66 VAL CB C 428 33.975 33.975 32.692 1.283 18002
7856 1 13 . 1 1 66 66 VAL H H 428 8.624 8.624 8.356 0.268 18002
7857 1 13 . 1 1 67 67 THR N N 429 124.132 124.132 124.141 -0.009 18002
7858 1 13 . 1 1 67 67 THR CA C 429 59.338 59.338 60.139 -0.801 18002
7859 1 13 . 1 1 67 67 THR CB C 429 72.021 72.021 69.955 2.066 18002
7860 1 13 . 1 1 67 67 THR H H 429 9.247 9.247 8.129 1.118 18002
7861 1 13 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.715 -0.066 18002
7862 1 13 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.483 0.255 18002
7863 1 13 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.867 0.701 18002
7864 1 13 . 1 1 69 69 ASP N N 431 122.066 122.066 122.352 -0.286 18002
7865 1 13 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.856 -0.209 18002
7866 1 13 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.701 -0.032 18002
7867 1 13 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.955 -1.850 18002
7868 1 13 . 1 1 69 69 ASP H H 431 8.250 8.250 8.598 -0.348 18002
7869 1 13 . 1 1 70 70 VAL N N 432 121.874 121.874 123.540 -1.666 18002
7870 1 13 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.737 -0.238 18002
7871 1 13 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.341 -0.253 18002
7872 1 13 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.349 -0.317 18002
7873 1 13 . 1 1 70 70 VAL H H 432 8.305 8.305 8.363 -0.058 18002
7874 1 13 . 1 1 71 71 ASN N N 433 124.366 124.366 127.248 -2.882 18002
7875 1 13 . 1 1 71 71 ASN HA H 433 4.682 4.682 5.015 -0.333 18002
7876 1 13 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.097 0.664 18002
7877 1 13 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.748 1.532 18002
7878 1 13 . 1 1 71 71 ASN H H 433 8.637 8.637 8.470 0.167 18002
7879 1 13 . 1 1 72 72 ILE N N 434 126.786 126.786 125.083 1.703 18002
7880 1 13 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.582 -0.211 18002
7881 1 13 . 1 1 72 72 ILE CA C 434 64.518 64.518 64.454 0.064 18002
7882 1 13 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.878 -0.703 18002
7883 1 13 . 1 1 72 72 ILE H H 434 8.943 8.943 8.673 0.270 18002
7884 1 13 . 1 1 73 73 SER N N 435 118.305 118.305 115.425 2.880 18002
7885 1 13 . 1 1 73 73 SER CA C 435 61.633 61.633 60.814 0.819 18002
7886 1 13 . 1 1 73 73 SER CB C 435 62.435 62.435 63.179 -0.744 18002
7887 1 13 . 1 1 73 73 SER H H 435 8.578 8.578 8.500 0.078 18002
7888 1 13 . 1 1 74 74 GLY N N 436 107.443 107.443 105.349 2.094 18002
7889 1 13 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.809 0.052 18002
7890 1 13 . 1 1 74 74 GLY H H 436 7.620 7.620 7.772 -0.152 18002
7891 1 13 . 1 1 75 75 GLN N N 437 116.895 116.895 117.329 -0.434 18002
7892 1 13 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.367 -0.077 18002
7893 1 13 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.233 0.468 18002
7894 1 13 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.590 1.155 18002
7895 1 13 . 1 1 75 75 GLN H H 437 7.798 7.798 7.916 -0.118 18002
7896 1 13 . 1 1 76 76 LYS N N 438 119.308 119.308 119.672 -0.364 18002
7897 1 13 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.129 0.013 18002
7898 1 13 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.935 0.108 18002
7899 1 13 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.622 2.323 18002
7900 1 13 . 1 1 76 76 LYS H H 438 7.522 7.522 7.036 0.486 18002
7901 1 13 . 1 1 77 77 PHE N N 439 125.905 125.905 122.197 3.708 18002
7902 1 13 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.034 0.177 18002
7903 1 13 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.657 -1.018 18002
7904 1 13 . 1 1 77 77 PHE CB C 439 38.929 38.929 36.770 2.159 18002
7905 1 13 . 1 1 77 77 PHE H H 439 8.461 8.461 7.026 1.435 18002
7906 1 13 . 1 1 78 78 ASN N N 440 120.787 120.787 121.489 -0.702 18002
7907 1 13 . 1 1 78 78 ASN CA C 440 51.913 51.913 51.893 0.020 18002
7908 1 13 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.797 -0.994 18002
7909 1 13 . 1 1 78 78 ASN H H 440 7.638 7.638 8.085 -0.447 18002
7910 1 13 . 1 1 79 79 ILE N N 441 123.421 123.421 120.777 2.644 18002
7911 1 13 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.696 -0.525 18002
7912 1 13 . 1 1 79 79 ILE CA C 441 61.567 61.567 58.889 2.678 18002
7913 1 13 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.004 2.483 18002
7914 1 13 . 1 1 79 79 ILE H H 441 9.550 9.550 8.683 0.867 18002
7915 1 13 . 1 1 80 80 LYS N N 442 126.267 126.267 126.896 -0.629 18002
7916 1 13 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.144 0.318 18002
7917 1 13 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.283 2.100 18002
7918 1 13 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.248 0.739 18002
7919 1 13 . 1 1 80 80 LYS H H 442 8.703 8.703 8.596 0.107 18002
7920 1 13 . 1 1 81 81 LEU N N 443 125.194 125.194 127.654 -2.460 18002
7921 1 13 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.639 0.633 18002
7922 1 13 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.520 -0.171 18002
7923 1 13 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.517 2.187 18002
7924 1 13 . 1 1 81 81 LEU H H 443 9.223 9.223 7.778 1.445 18002
7925 1 13 . 1 1 82 82 LEU N N 444 122.753 122.753 127.127 -4.374 18002
7926 1 13 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.342 -0.328 18002
7927 1 13 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.271 0.647 18002
7928 1 13 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.607 -2.983 18002
7929 1 13 . 1 1 82 82 LEU H H 444 8.420 8.420 8.038 0.382 18002
7930 1 13 . 1 1 83 83 ILE N N 445 125.584 125.584 121.864 3.720 18002
7931 1 13 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.278 0.007 18002
7932 1 13 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.989 -0.953 18002
7933 1 13 . 1 1 83 83 ILE H H 445 9.010 9.010 7.914 1.096 18002
7934 1 13 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.727 0.192 18002
7935 1 13 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.455 1.578 18002
7936 1 13 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.663 0.284 18002
7937 1 13 . 1 1 85 85 VAL N N 447 119.780 119.780 119.351 0.429 18002
7938 1 13 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.526 -0.023 18002
7939 1 13 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.797 0.545 18002
7940 1 13 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.482 0.784 18002
7941 1 13 . 1 1 85 85 VAL H H 447 8.304 8.304 7.719 0.585 18002
7942 1 13 . 1 1 86 86 ALA N N 448 125.178 125.178 121.879 3.299 18002
7943 1 13 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.169 -0.194 18002
7944 1 13 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.574 0.987 18002
7945 1 13 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.341 -0.353 18002
7946 1 13 . 1 1 86 86 ALA H H 448 8.526 8.526 8.465 0.061 18002
7947 1 13 . 1 1 87 87 GLU N N 449 114.625 114.625 117.597 -2.972 18002
7948 1 13 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.131 0.159 18002
7949 1 13 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.471 -0.740 18002
7950 1 13 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.820 -0.560 18002
7951 1 13 . 1 1 87 87 GLU H H 449 8.402 8.402 8.582 -0.180 18002
7952 1 13 . 1 1 88 88 GLY N N 450 109.432 109.432 106.522 2.910 18002
7953 1 13 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.752 1.085 18002
7954 1 13 . 1 1 88 88 GLY H H 450 7.711 7.711 7.435 0.276 18002
7955 1 13 . 1 1 89 89 MET N N 451 121.382 121.382 120.571 0.811 18002
7956 1 13 . 1 1 89 89 MET HA H 451 5.076 5.076 4.773 0.303 18002
7957 1 13 . 1 1 89 89 MET CA C 451 53.860 53.860 55.028 -1.168 18002
7958 1 13 . 1 1 89 89 MET CB C 451 35.942 35.942 37.405 -1.463 18002
7959 1 13 . 1 1 89 89 MET H H 451 8.355 8.355 7.905 0.450 18002
7960 1 13 . 1 1 90 90 ASN N N 452 123.538 123.538 123.725 -0.187 18002
7961 1 13 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.946 0.007 18002
7962 1 13 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.495 -0.747 18002
7963 1 13 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.962 1.680 18002
7964 1 13 . 1 1 90 90 ASN H H 452 9.338 9.338 8.839 0.499 18002
7965 1 13 . 1 1 91 91 GLU N N 453 125.978 125.978 123.619 2.359 18002
7966 1 13 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.212 1.132 18002
7967 1 13 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.365 -1.092 18002
7968 1 13 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.046 1.697 18002
7969 1 13 . 1 1 91 91 GLU H H 453 8.168 8.168 8.075 0.093 18002
7970 1 13 . 1 1 92 92 ILE N N 454 126.776 126.776 125.793 0.983 18002
7971 1 13 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.310 0.256 18002
7972 1 13 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.972 0.076 18002
7973 1 13 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.720 1.542 18002
7974 1 13 . 1 1 92 92 ILE H H 454 9.000 9.000 7.979 1.021 18002
7975 1 13 . 1 1 93 93 TRP N N 455 125.987 125.987 126.136 -0.149 18002
7976 1 13 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.959 -0.367 18002
7977 1 13 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.624 -1.834 18002
7978 1 13 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.508 0.878 18002
7979 1 13 . 1 1 93 93 TRP H H 455 9.278 9.278 8.383 0.895 18002
7980 1 13 . 1 1 94 94 LEU N N 456 120.912 120.912 123.843 -2.931 18002
7981 1 13 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.570 0.792 18002
7982 1 13 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.950 -0.734 18002
7983 1 13 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.694 0.900 18002
7984 1 13 . 1 1 94 94 LEU H H 456 9.534 9.534 7.993 1.541 18002
7985 1 13 . 1 1 95 95 ARG N N 457 123.669 123.669 121.804 1.865 18002
7986 1 13 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.546 0.725 18002
7987 1 13 . 1 1 95 95 ARG CA C 457 55.417 55.417 56.090 -0.673 18002
7988 1 13 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.443 0.819 18002
7989 1 13 . 1 1 95 95 ARG H H 457 9.439 9.439 8.609 0.830 18002
7990 1 13 . 1 1 96 96 CYS N N 458 125.273 125.273 121.067 4.206 18002
7991 1 13 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.002 -0.304 18002
7992 1 13 . 1 1 96 96 CYS CA C 458 58.792 58.792 59.232 -0.440 18002
7993 1 13 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.890 1.512 18002
7994 1 13 . 1 1 96 96 CYS H H 458 8.652 8.652 8.549 0.103 18002
7995 1 13 . 1 1 97 97 ASP N N 459 119.661 119.661 120.779 -1.118 18002
7996 1 13 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.738 0.002 18002
7997 1 13 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.505 1.723 18002
7998 1 13 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.735 1.850 18002
7999 1 13 . 1 1 97 97 ASP H H 459 9.116 9.116 9.039 0.077 18002
8000 1 13 . 1 1 98 98 ASN N N 460 109.173 109.173 114.532 -5.359 18002
8001 1 13 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.608 -0.236 18002
8002 1 13 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.435 -0.422 18002
8003 1 13 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.688 1.123 18002
8004 1 13 . 1 1 98 98 ASN H H 460 7.054 7.054 7.427 -0.373 18002
8005 1 13 . 1 1 99 99 GLU N N 461 119.220 119.220 119.548 -0.328 18002
8006 1 13 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.305 0.739 18002
8007 1 13 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.313 0.455 18002
8008 1 13 . 1 1 99 99 GLU H H 461 8.937 8.937 8.575 0.362 18002
8009 1 13 . 1 1 100 100 LYS N N 462 120.647 120.647 118.049 2.598 18002
8010 1 13 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.926 0.719 18002
8011 1 13 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.509 1.027 18002
8012 1 13 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.657 0.572 18002
8013 1 13 . 1 1 100 100 LYS H H 462 8.033 8.033 8.247 -0.214 18002
8014 1 13 . 1 1 101 101 GLN N N 463 121.938 121.938 118.930 3.008 18002
8015 1 13 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.963 0.437 18002
8016 1 13 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.963 0.432 18002
8017 1 13 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.510 3.704 18002
8018 1 13 . 1 1 101 101 GLN H H 463 8.372 8.372 7.475 0.897 18002
8019 1 13 . 1 1 102 102 TYR N N 464 117.422 117.422 120.155 -2.733 18002
8020 1 13 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.103 0.513 18002
8021 1 13 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.755 0.922 18002
8022 1 13 . 1 1 102 102 TYR CB C 464 38.859 38.859 37.921 0.938 18002
8023 1 13 . 1 1 102 102 TYR H H 464 8.221 8.221 7.608 0.613 18002
8024 1 13 . 1 1 103 103 ALA N N 465 120.655 120.655 118.940 1.715 18002
8025 1 13 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.929 -0.214 18002
8026 1 13 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.834 1.079 18002
8027 1 13 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.696 0.106 18002
8028 1 13 . 1 1 103 103 ALA H H 465 8.637 8.637 7.629 1.008 18002
8029 1 13 . 1 1 104 104 HIS N N 466 112.871 112.871 115.496 -2.625 18002
8030 1 13 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.579 -0.438 18002
8031 1 13 . 1 1 104 104 HIS CA C 466 60.627 60.627 58.478 2.149 18002
8032 1 13 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.629 -1.771 18002
8033 1 13 . 1 1 104 104 HIS H H 466 7.852 7.852 7.982 -0.130 18002
8034 1 13 . 1 1 105 105 TRP N N 467 121.317 121.317 120.186 1.131 18002
8035 1 13 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.406 -0.711 18002
8036 1 13 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.863 0.479 18002
8037 1 13 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.288 -1.783 18002
8038 1 13 . 1 1 105 105 TRP H H 467 8.668 8.668 8.009 0.659 18002
8039 1 13 . 1 1 106 106 MET N N 468 122.346 122.346 118.726 3.620 18002
8040 1 13 . 1 1 106 106 MET HA H 468 4.086 4.086 3.848 0.238 18002
8041 1 13 . 1 1 106 106 MET CA C 468 58.743 58.743 59.054 -0.312 18002
8042 1 13 . 1 1 106 106 MET CB C 468 31.402 31.402 31.592 -0.190 18002
8043 1 13 . 1 1 106 106 MET H H 468 9.790 9.790 7.865 1.925 18002
8044 1 13 . 1 1 107 107 ALA N N 469 119.758 119.758 121.258 -1.500 18002
8045 1 13 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.089 -0.384 18002
8046 1 13 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.619 1.510 18002
8047 1 13 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.314 2.091 18002
8048 1 13 . 1 1 107 107 ALA H H 469 7.702 7.702 7.726 -0.024 18002
8049 1 13 . 1 1 108 108 ALA N N 470 119.233 119.233 121.747 -2.514 18002
8050 1 13 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.901 -0.355 18002
8051 1 13 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.969 0.851 18002
8052 1 13 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.983 -1.251 18002
8053 1 13 . 1 1 108 108 ALA H H 470 7.156 7.156 7.931 -0.775 18002
8054 1 13 . 1 1 109 109 CYS N N 471 116.736 116.736 117.860 -1.124 18002
8055 1 13 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.059 -0.002 18002
8056 1 13 . 1 1 109 109 CYS CA C 471 64.571 64.571 63.051 1.520 18002
8057 1 13 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.192 0.201 18002
8058 1 13 . 1 1 109 109 CYS H H 471 8.256 8.256 8.747 -0.491 18002
8059 1 13 . 1 1 110 110 ARG N N 472 118.644 118.644 120.154 -1.510 18002
8060 1 13 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.007 -0.273 18002
8061 1 13 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.901 1.303 18002
8062 1 13 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.946 0.371 18002
8063 1 13 . 1 1 110 110 ARG H H 472 8.403 8.403 7.669 0.734 18002
8064 1 13 . 1 1 111 111 LEU N N 473 121.877 121.877 118.822 3.055 18002
8065 1 13 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.167 -0.367 18002
8066 1 13 . 1 1 111 111 LEU CA C 473 59.855 59.855 58.099 1.756 18002
8067 1 13 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.982 -0.562 18002
8068 1 13 . 1 1 111 111 LEU H H 473 7.916 7.916 7.869 0.047 18002
8069 1 13 . 1 1 112 112 ALA N N 474 122.765 122.765 121.608 1.157 18002
8070 1 13 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.821 0.659 18002
8071 1 13 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.563 0.698 18002
8072 1 13 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.572 2.304 18002
8073 1 13 . 1 1 112 112 ALA H H 474 8.393 8.393 8.817 -0.424 18002
8074 1 13 . 1 1 113 113 SER N N 475 113.613 113.613 112.249 1.364 18002
8075 1 13 . 1 1 113 113 SER HA H 475 4.782 4.782 4.318 0.464 18002
8076 1 13 . 1 1 113 113 SER CA C 475 61.090 61.090 59.555 1.535 18002
8077 1 13 . 1 1 113 113 SER CB C 475 63.612 63.612 63.191 0.421 18002
8078 1 13 . 1 1 113 113 SER H H 475 8.150 8.150 7.720 0.430 18002
8079 1 13 . 1 1 114 114 LYS N N 476 118.734 118.734 118.205 0.529 18002
8080 1 13 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.186 0.367 18002
8081 1 13 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.744 -1.600 18002
8082 1 13 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.304 0.287 18002
8083 1 13 . 1 1 114 114 LYS H H 476 7.239 7.239 8.034 -0.795 18002
8084 1 13 . 1 1 115 115 GLY N N 477 107.818 107.818 106.396 1.422 18002
8085 1 13 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.333 0.653 18002
8086 1 13 . 1 1 115 115 GLY H H 477 8.401 8.401 7.746 0.655 18002
8087 1 13 . 1 1 116 116 LYS N N 478 120.938 120.938 120.427 0.511 18002
8088 1 13 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.610 -0.037 18002
8089 1 13 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.417 0.430 18002
8090 1 13 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.162 0.159 18002
8091 1 13 . 1 1 116 116 LYS H H 478 8.142 8.142 7.423 0.719 18002
8092 1 13 . 1 1 117 117 THR N N 479 108.076 108.076 116.127 -8.051 18002
8093 1 13 . 1 1 117 117 THR HA H 479 4.671 4.671 4.219 0.452 18002
8094 1 13 . 1 1 117 117 THR CA C 479 59.191 59.191 60.615 -1.424 18002
8095 1 13 . 1 1 117 117 THR CB C 479 72.228 72.228 69.215 3.013 18002
8096 1 13 . 1 1 117 117 THR H H 479 7.926 7.926 8.176 -0.250 18002
8097 1 13 . 1 1 118 118 MET N N 480 116.403 116.403 118.244 -1.841 18002
8098 1 13 . 1 1 118 118 MET HA H 480 3.352 3.352 3.871 -0.519 18002
8099 1 13 . 1 1 118 118 MET CA C 480 57.947 57.947 55.548 2.398 18002
8100 1 13 . 1 1 118 118 MET CB C 480 33.920 33.920 31.555 2.365 18002
8101 1 13 . 1 1 118 118 MET H H 480 8.899 8.899 8.389 0.510 18002
8102 1 13 . 1 1 119 119 ALA N N 481 117.786 117.786 120.999 -3.213 18002
8103 1 13 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.969 0.115 18002
8104 1 13 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.103 -1.508 18002
8105 1 13 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.062 0.000 18002
8106 1 13 . 1 1 119 119 ALA H H 481 7.645 7.645 8.087 -0.442 18002
8107 1 13 . 1 1 120 120 ASP N N 482 120.348 120.348 116.818 3.530 18002
8108 1 13 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.322 5.293 18002
8109 1 13 . 1 1 120 120 ASP H H 482 7.887 7.887 8.258 -0.371 18002
8110 1 13 . 1 1 121 121 SER HA H 483 4.223 4.223 4.108 0.115 18002
8111 1 13 . 1 1 121 121 SER CA C 483 61.455 61.455 62.445 -0.990 18002
8112 1 13 . 1 1 121 121 SER CB C 483 62.996 62.996 62.968 0.028 18002
8113 1 13 . 1 1 122 122 SER N N 484 116.845 116.845 115.115 1.730 18002
8114 1 13 . 1 1 122 122 SER HA H 484 4.321 4.321 4.284 0.037 18002
8115 1 13 . 1 1 122 122 SER CA C 484 60.584 60.584 60.265 0.319 18002
8116 1 13 . 1 1 122 122 SER CB C 484 64.314 64.314 62.805 1.509 18002
8117 1 13 . 1 1 122 122 SER H H 484 8.875 8.875 8.374 0.501 18002
8118 1 13 . 1 1 123 123 TYR N N 485 124.153 124.153 122.033 2.120 18002
8119 1 13 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.004 -0.124 18002
8120 1 13 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.213 2.101 18002
8121 1 13 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.120 -0.379 18002
8122 1 13 . 1 1 123 123 TYR H H 485 8.018 8.018 8.338 -0.320 18002
8123 1 13 . 1 1 124 124 ASN N N 486 115.339 115.339 116.954 -1.615 18002
8124 1 13 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.027 -0.086 18002
8125 1 13 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.104 0.602 18002
8126 1 13 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.157 -0.101 18002
8127 1 13 . 1 1 124 124 ASN H H 486 8.665 8.665 7.951 0.714 18002
8128 1 13 . 1 1 125 125 LEU N N 487 119.454 119.454 118.328 1.126 18002
8129 1 13 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.003 -0.065 18002
8130 1 13 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.941 -0.271 18002
8131 1 13 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.296 0.272 18002
8132 1 13 . 1 1 125 125 LEU H H 487 7.105 7.105 7.785 -0.680 18002
8133 1 13 . 1 1 126 126 GLU N N 488 121.189 121.189 118.435 2.754 18002
8134 1 13 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.952 0.078 18002
8135 1 13 . 1 1 126 126 GLU CA C 488 59.035 59.035 58.999 0.035 18002
8136 1 13 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.694 -0.609 18002
8137 1 13 . 1 1 126 126 GLU H H 488 8.053 8.053 7.474 0.579 18002
8138 1 13 . 1 1 127 127 VAL N N 489 119.073 119.073 116.579 2.494 18002
8139 1 13 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.606 -0.588 18002
8140 1 13 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.950 1.372 18002
8141 1 13 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.279 0.380 18002
8142 1 13 . 1 1 127 127 VAL H H 489 7.769 7.769 7.194 0.575 18002
8143 1 13 . 1 1 128 128 GLN N N 490 116.214 116.214 117.491 -1.277 18002
8144 1 13 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.108 -0.276 18002
8145 1 13 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.142 0.614 18002
8146 1 13 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.855 0.257 18002
8147 1 13 . 1 1 128 128 GLN H H 490 7.542 7.542 8.388 -0.846 18002
8148 1 13 . 1 1 129 129 ASN N N 491 120.003 120.003 119.354 0.649 18002
8149 1 13 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.661 -0.242 18002
8150 1 13 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.682 0.478 18002
8151 1 13 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.534 -0.474 18002
8152 1 13 . 1 1 129 129 ASN H H 491 8.582 8.582 7.945 0.637 18002
8153 1 13 . 1 1 130 130 ILE N N 492 122.365 122.365 119.873 2.492 18002
8154 1 13 . 1 1 130 130 ILE CA C 492 65.753 65.753 65.155 0.598 18002
8155 1 13 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.645 0.501 18002
8156 1 13 . 1 1 130 130 ILE H H 492 8.186 8.186 7.406 0.780 18002
8157 1 13 . 1 1 131 131 LEU N N 493 119.597 119.597 119.967 -0.370 18002
8158 1 13 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.009 -0.004 18002
8159 1 13 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.285 0.574 18002
8160 1 13 . 1 1 131 131 LEU CB C 493 41.536 41.536 40.454 1.082 18002
8161 1 13 . 1 1 131 131 LEU H H 493 8.224 8.224 7.906 0.318 18002
8162 1 13 . 1 1 132 132 SER N N 494 114.884 114.884 112.872 2.012 18002
8163 1 13 . 1 1 132 132 SER HA H 494 4.430 4.430 4.250 0.180 18002
8164 1 13 . 1 1 132 132 SER CA C 494 62.072 62.072 60.987 1.085 18002
8165 1 13 . 1 1 132 132 SER CB C 494 62.703 62.703 63.123 -0.420 18002
8166 1 13 . 1 1 132 132 SER H H 494 8.464 8.464 7.622 0.842 18002
8167 1 13 . 1 1 133 133 PHE N N 495 123.047 123.047 120.468 2.579 18002
8168 1 13 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.395 -0.018 18002
8169 1 13 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.501 -0.588 18002
8170 1 13 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.848 -0.798 18002
8171 1 13 . 1 1 133 133 PHE H H 495 7.915 7.915 7.929 -0.014 18002
8172 1 13 . 1 1 134 134 LEU N N 496 119.311 119.311 117.822 1.489 18002
8173 1 13 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.242 -0.337 18002
8174 1 13 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.753 -0.152 18002
8175 1 13 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.289 0.612 18002
8176 1 13 . 1 1 134 134 LEU H H 496 8.386 8.386 8.645 -0.259 18002
8177 1 13 . 1 1 135 135 LYS N N 497 117.550 117.550 118.362 -0.812 18002
8178 1 13 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.266 -0.326 18002
8179 1 13 . 1 1 135 135 LYS CA C 497 58.275 58.275 57.721 0.554 18002
8180 1 13 . 1 1 135 135 LYS CB C 497 32.494 32.494 33.163 -0.670 18002
8181 1 13 . 1 1 135 135 LYS H H 497 7.670 7.670 7.656 0.014 18002
8182 1 13 . 1 1 136 136 MET N N 498 116.106 116.106 114.374 1.732 18002
8183 1 13 . 1 1 136 136 MET HA H 498 4.354 4.354 4.622 -0.268 18002
8184 1 13 . 1 1 136 136 MET CA C 498 55.994 55.994 55.480 0.514 18002
8185 1 13 . 1 1 136 136 MET CB C 498 32.772 32.772 33.407 -0.635 18002
8186 1 13 . 1 1 136 136 MET H H 498 7.421 7.421 7.820 -0.399 18002
8187 1 13 . 1 1 137 137 GLN N N 499 118.651 118.651 121.178 -2.527 18002
8188 1 13 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.001 0.183 18002
8189 1 13 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.240 -2.932 18002
8190 1 13 . 1 1 137 137 GLN H H 499 7.617 7.617 7.988 -0.371 18002
8191 1 14 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.665 -0.540 18002
8192 1 14 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.028 -1.013 18002
8193 1 14 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.102 1.827 18002
8194 1 14 . 1 1 4 4 MET N N 366 120.431 120.431 120.629 -0.198 18002
8195 1 14 . 1 1 4 4 MET HA H 366 4.345 4.345 4.594 -0.249 18002
8196 1 14 . 1 1 4 4 MET CA C 366 55.337 55.337 55.304 0.033 18002
8197 1 14 . 1 1 4 4 MET CB C 366 32.668 32.668 34.058 -1.390 18002
8198 1 14 . 1 1 4 4 MET H H 366 8.373 8.373 8.326 0.047 18002
8199 1 14 . 1 1 5 5 GLY N N 367 109.318 109.318 106.701 2.617 18002
8200 1 14 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.299 0.158 18002
8201 1 14 . 1 1 5 5 GLY H H 367 8.224 8.224 8.390 -0.166 18002
8202 1 14 . 1 1 6 6 ASP N N 368 120.307 120.307 120.316 -0.009 18002
8203 1 14 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.892 -0.292 18002
8204 1 14 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.875 0.638 18002
8205 1 14 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.536 -0.210 18002
8206 1 14 . 1 1 6 6 ASP H H 368 8.199 8.199 8.183 0.016 18002
8207 1 14 . 1 1 7 7 ILE N N 369 120.668 120.668 117.513 3.155 18002
8208 1 14 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.209 0.009 18002
8209 1 14 . 1 1 7 7 ILE CA C 369 61.584 61.584 63.260 -1.676 18002
8210 1 14 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.359 1.409 18002
8211 1 14 . 1 1 7 7 ILE H H 369 8.138 8.138 8.026 0.112 18002
8212 1 14 . 1 1 8 8 THR N N 370 117.564 117.564 115.686 1.878 18002
8213 1 14 . 1 1 8 8 THR HA H 370 4.322 4.322 4.349 -0.027 18002
8214 1 14 . 1 1 8 8 THR CA C 370 62.332 62.332 61.704 0.628 18002
8215 1 14 . 1 1 8 8 THR CB C 370 69.946 69.946 69.752 0.194 18002
8216 1 14 . 1 1 8 8 THR H H 370 8.230 8.230 7.697 0.533 18002
8217 1 14 . 1 1 9 9 SER N N 371 118.467 118.467 116.763 1.704 18002
8218 1 14 . 1 1 9 9 SER HA H 371 4.445 4.445 4.292 0.153 18002
8219 1 14 . 1 1 9 9 SER CA C 371 58.274 58.274 59.143 -0.869 18002
8220 1 14 . 1 1 9 9 SER CB C 371 63.996 63.996 61.911 2.085 18002
8221 1 14 . 1 1 9 9 SER H H 371 8.158 8.158 8.361 -0.203 18002
8222 1 14 . 1 1 10 10 ILE N N 372 123.959 123.959 118.526 5.433 18002
8223 1 14 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.360 -4.644 18002
8224 1 14 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.266 2.653 18002
8225 1 14 . 1 1 10 10 ILE H H 372 8.112 8.112 8.157 -0.045 18002
8226 1 14 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.582 -0.230 18002
8227 1 14 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.524 1.657 18002
8228 1 14 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.276 1.431 18002
8229 1 14 . 1 1 12 12 GLU N N 374 119.349 119.349 122.455 -3.106 18002
8230 1 14 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.721 0.066 18002
8231 1 14 . 1 1 12 12 GLU CA C 374 55.317 55.317 54.818 0.499 18002
8232 1 14 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.149 2.442 18002
8233 1 14 . 1 1 12 12 GLU H H 374 8.017 8.017 8.169 -0.152 18002
8234 1 14 . 1 1 13 13 LEU N N 375 122.288 122.288 126.562 -4.274 18002
8235 1 14 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.574 -0.096 18002
8236 1 14 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.297 -1.367 18002
8237 1 14 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.184 1.472 18002
8238 1 14 . 1 1 13 13 LEU H H 375 8.036 8.036 8.463 -0.427 18002
8239 1 14 . 1 1 14 14 ALA N N 376 125.461 125.461 128.022 -2.561 18002
8240 1 14 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.841 0.405 18002
8241 1 14 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.412 0.333 18002
8242 1 14 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.173 -0.587 18002
8243 1 14 . 1 1 14 14 ALA H H 376 8.181 8.181 8.258 -0.077 18002
8244 1 14 . 1 1 15 15 ASP N N 377 122.242 122.242 118.568 3.674 18002
8245 1 14 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.777 -0.458 18002
8246 1 14 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.416 0.336 18002
8247 1 14 . 1 1 15 15 ASP CB C 377 46.639 46.639 42.576 4.063 18002
8248 1 14 . 1 1 15 15 ASP H H 377 8.326 8.326 8.815 -0.489 18002
8249 1 14 . 1 1 16 16 TYR N N 378 118.961 118.961 117.726 1.235 18002
8250 1 14 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.756 0.635 18002
8251 1 14 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.695 1.886 18002
8252 1 14 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.041 -0.018 18002
8253 1 14 . 1 1 16 16 TYR H H 378 8.869 8.869 7.190 1.679 18002
8254 1 14 . 1 1 17 17 ILE N N 379 125.214 125.214 122.610 2.604 18002
8255 1 14 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.292 0.038 18002
8256 1 14 . 1 1 17 17 ILE CA C 379 58.732 58.732 60.462 -1.730 18002
8257 1 14 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.003 -1.027 18002
8258 1 14 . 1 1 17 17 ILE H H 379 8.608 8.608 8.300 0.308 18002
8259 1 14 . 1 1 18 18 LYS N N 380 122.917 122.917 127.340 -4.423 18002
8260 1 14 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.939 0.172 18002
8261 1 14 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.453 1.383 18002
8262 1 14 . 1 1 18 18 LYS CB C 380 35.025 35.025 32.984 2.041 18002
8263 1 14 . 1 1 18 18 LYS H H 380 7.424 7.424 8.461 -1.037 18002
8264 1 14 . 1 1 19 19 VAL N N 381 122.839 122.839 122.870 -0.031 18002
8265 1 14 . 1 1 19 19 VAL HA H 381 5.263 5.263 3.937 1.326 18002
8266 1 14 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.216 1.300 18002
8267 1 14 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.093 0.055 18002
8268 1 14 . 1 1 19 19 VAL H H 381 9.223 9.223 8.096 1.127 18002
8269 1 14 . 1 1 20 20 PHE N N 382 129.509 129.509 124.434 5.075 18002
8270 1 14 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.908 -0.065 18002
8271 1 14 . 1 1 20 20 PHE CA C 382 55.505 55.505 53.871 1.634 18002
8272 1 14 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.628 2.234 18002
8273 1 14 . 1 1 20 20 PHE H H 382 9.451 9.451 7.665 1.786 18002
8274 1 14 . 1 1 21 21 LYS N N 383 126.417 126.417 119.420 6.997 18002
8275 1 14 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.965 -0.124 18002
8276 1 14 . 1 1 21 21 LYS CB C 383 33.219 33.219 33.904 -0.685 18002
8277 1 14 . 1 1 21 21 LYS H H 383 7.582 7.582 8.205 -0.623 18002
8278 1 14 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.750 -0.053 18002
8279 1 14 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.052 -0.083 18002
8280 1 14 . 1 1 23 23 LYS N N 385 118.026 118.026 113.775 4.251 18002
8281 1 14 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.105 0.110 18002
8282 1 14 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.746 -0.401 18002
8283 1 14 . 1 1 23 23 LYS CB C 385 33.033 33.033 33.078 -0.045 18002
8284 1 14 . 1 1 23 23 LYS H H 385 8.138 8.138 8.046 0.092 18002
8285 1 14 . 1 1 24 24 LYS N N 386 120.816 120.816 122.600 -1.784 18002
8286 1 14 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.064 0.122 18002
8287 1 14 . 1 1 24 24 LYS CA C 386 56.862 56.862 58.727 -1.865 18002
8288 1 14 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.452 0.375 18002
8289 1 14 . 1 1 24 24 LYS H H 386 7.727 7.727 8.440 -0.713 18002
8290 1 14 . 1 1 25 25 LEU N N 387 121.214 121.214 118.766 2.448 18002
8291 1 14 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.583 -0.415 18002
8292 1 14 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.873 -0.365 18002
8293 1 14 . 1 1 25 25 LEU CB C 387 41.642 41.642 43.016 -1.374 18002
8294 1 14 . 1 1 25 25 LEU H H 387 8.241 8.241 8.228 0.013 18002
8295 1 14 . 1 1 26 26 THR N N 388 112.798 112.798 111.384 1.414 18002
8296 1 14 . 1 1 26 26 THR HA H 388 4.313 4.313 4.286 0.027 18002
8297 1 14 . 1 1 26 26 THR CA C 388 61.795 61.795 62.621 -0.826 18002
8298 1 14 . 1 1 26 26 THR CB C 388 69.875 69.875 68.221 1.654 18002
8299 1 14 . 1 1 26 26 THR H H 388 7.700 7.700 7.796 -0.096 18002
8300 1 14 . 1 1 27 27 LEU N N 389 124.091 124.091 126.965 -2.874 18002
8301 1 14 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.852 -0.498 18002
8302 1 14 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.177 0.356 18002
8303 1 14 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.483 -0.185 18002
8304 1 14 . 1 1 27 27 LEU H H 389 8.260 8.260 8.361 -0.101 18002
8305 1 14 . 1 1 28 28 LYS N N 390 121.153 121.153 119.714 1.439 18002
8306 1 14 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.495 -0.175 18002
8307 1 14 . 1 1 28 28 LYS CA C 390 56.211 56.211 55.922 0.289 18002
8308 1 14 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.696 0.979 18002
8309 1 14 . 1 1 28 28 LYS H H 390 8.202 8.202 7.961 0.241 18002
8310 1 14 . 1 1 29 29 GLY N N 391 107.270 107.270 108.285 -1.015 18002
8311 1 14 . 1 1 29 29 GLY CA C 391 44.875 44.875 44.922 -0.047 18002
8312 1 14 . 1 1 29 29 GLY H H 391 7.876 7.876 8.143 -0.267 18002
8313 1 14 . 1 1 30 30 TYR N N 392 118.471 118.471 125.299 -6.828 18002
8314 1 14 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.239 0.207 18002
8315 1 14 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.774 -0.727 18002
8316 1 14 . 1 1 30 30 TYR CB C 392 39.825 39.825 38.250 1.575 18002
8317 1 14 . 1 1 30 30 TYR H H 392 8.183 8.183 8.495 -0.312 18002
8318 1 14 . 1 1 31 31 LYS N N 393 122.833 122.833 126.620 -3.787 18002
8319 1 14 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.720 -0.205 18002
8320 1 14 . 1 1 31 31 LYS CA C 393 55.174 55.174 55.159 0.015 18002
8321 1 14 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.460 -0.740 18002
8322 1 14 . 1 1 31 31 LYS H H 393 8.731 8.731 8.389 0.342 18002
8323 1 14 . 1 1 32 32 GLN N N 394 124.759 124.759 126.147 -1.388 18002
8324 1 14 . 1 1 32 32 GLN HA H 394 4.678 4.678 5.065 -0.387 18002
8325 1 14 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.974 0.633 18002
8326 1 14 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.830 1.218 18002
8327 1 14 . 1 1 32 32 GLN H H 394 8.776 8.776 8.931 -0.155 18002
8328 1 14 . 1 1 33 33 TYR N N 395 125.112 125.112 126.843 -1.731 18002
8329 1 14 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.983 0.091 18002
8330 1 14 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.538 0.626 18002
8331 1 14 . 1 1 33 33 TYR CB C 395 42.672 42.672 42.296 0.376 18002
8332 1 14 . 1 1 33 33 TYR H H 395 8.774 8.774 8.902 -0.128 18002
8333 1 14 . 1 1 34 34 TRP N N 396 122.638 122.638 128.376 -5.738 18002
8334 1 14 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.167 -0.485 18002
8335 1 14 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.879 3.339 18002
8336 1 14 . 1 1 34 34 TRP CB C 396 29.504 29.504 29.407 0.097 18002
8337 1 14 . 1 1 34 34 TRP H H 396 8.975 8.975 8.118 0.857 18002
8338 1 14 . 1 1 35 35 CYS N N 397 127.146 127.146 121.357 5.789 18002
8339 1 14 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.013 0.354 18002
8340 1 14 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.541 1.165 18002
8341 1 14 . 1 1 35 35 CYS H H 397 8.804 8.804 8.620 0.184 18002
8342 1 14 . 1 1 36 36 THR N N 398 110.578 110.578 114.008 -3.430 18002
8343 1 14 . 1 1 36 36 THR HA H 398 5.358 5.358 4.877 0.481 18002
8344 1 14 . 1 1 36 36 THR CA C 398 58.704 58.704 60.894 -2.190 18002
8345 1 14 . 1 1 36 36 THR CB C 398 71.833 71.833 71.008 0.825 18002
8346 1 14 . 1 1 36 36 THR H H 398 9.090 9.090 7.885 1.205 18002
8347 1 14 . 1 1 37 37 PHE N N 399 127.322 127.322 128.193 -0.871 18002
8348 1 14 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.602 0.351 18002
8349 1 14 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.370 -1.125 18002
8350 1 14 . 1 1 37 37 PHE CB C 399 42.185 42.185 41.383 0.802 18002
8351 1 14 . 1 1 37 37 PHE H H 399 8.846 8.846 8.147 0.699 18002
8352 1 14 . 1 1 38 38 LYS N N 400 125.391 125.391 125.588 -0.197 18002
8353 1 14 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.768 -0.241 18002
8354 1 14 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.063 0.914 18002
8355 1 14 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.912 0.003 18002
8356 1 14 . 1 1 38 38 LYS H H 400 8.252 8.252 8.116 0.136 18002
8357 1 14 . 1 1 39 39 ASP N N 401 125.083 125.083 124.574 0.509 18002
8358 1 14 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.241 -0.163 18002
8359 1 14 . 1 1 39 39 ASP CA C 401 57.483 57.483 58.001 -0.518 18002
8360 1 14 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.936 -0.415 18002
8361 1 14 . 1 1 39 39 ASP H H 401 9.408 9.408 9.106 0.302 18002
8362 1 14 . 1 1 40 40 THR N N 402 112.024 112.024 115.000 -2.976 18002
8363 1 14 . 1 1 40 40 THR HA H 402 4.767 4.767 4.664 0.103 18002
8364 1 14 . 1 1 40 40 THR CA C 402 60.811 60.811 61.153 -0.342 18002
8365 1 14 . 1 1 40 40 THR CB C 402 68.823 68.823 69.209 -0.386 18002
8366 1 14 . 1 1 40 40 THR H H 402 8.224 8.224 8.138 0.086 18002
8367 1 14 . 1 1 41 41 SER N N 403 116.142 116.142 116.591 -0.449 18002
8368 1 14 . 1 1 41 41 SER HA H 403 5.428 5.428 4.884 0.544 18002
8369 1 14 . 1 1 41 41 SER CA C 403 58.297 58.297 56.647 1.650 18002
8370 1 14 . 1 1 41 41 SER CB C 403 66.409 66.409 66.144 0.265 18002
8371 1 14 . 1 1 41 41 SER H H 403 8.197 8.197 8.588 -0.391 18002
8372 1 14 . 1 1 42 42 ILE N N 404 122.292 122.292 122.547 -0.255 18002
8373 1 14 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.370 0.559 18002
8374 1 14 . 1 1 42 42 ILE CA C 404 59.804 59.804 59.358 0.446 18002
8375 1 14 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.088 1.332 18002
8376 1 14 . 1 1 42 42 ILE H H 404 8.411 8.411 8.022 0.389 18002
8377 1 14 . 1 1 43 43 SER N N 405 122.244 122.244 117.242 5.002 18002
8378 1 14 . 1 1 43 43 SER HA H 405 4.966 4.966 4.681 0.285 18002
8379 1 14 . 1 1 43 43 SER CA C 405 57.735 57.735 57.053 0.682 18002
8380 1 14 . 1 1 43 43 SER CB C 405 65.388 65.388 65.027 0.361 18002
8381 1 14 . 1 1 43 43 SER H H 405 8.752 8.752 8.101 0.651 18002
8382 1 14 . 1 1 44 44 CYS N N 406 120.004 120.004 126.419 -6.415 18002
8383 1 14 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.638 0.329 18002
8384 1 14 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.204 -1.146 18002
8385 1 14 . 1 1 44 44 CYS CB C 406 29.440 29.440 27.683 1.757 18002
8386 1 14 . 1 1 44 44 CYS H H 406 8.470 8.470 7.864 0.606 18002
8387 1 14 . 1 1 45 45 TYR N N 407 122.704 122.704 127.519 -4.815 18002
8388 1 14 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.606 0.417 18002
8389 1 14 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.704 -0.721 18002
8390 1 14 . 1 1 45 45 TYR CB C 407 41.574 41.574 41.517 0.057 18002
8391 1 14 . 1 1 45 45 TYR H H 407 10.013 10.013 7.990 2.023 18002
8392 1 14 . 1 1 46 46 LYS N N 408 121.897 121.897 122.935 -1.038 18002
8393 1 14 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.757 -0.411 18002
8394 1 14 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.840 2.179 18002
8395 1 14 . 1 1 46 46 LYS CB C 408 32.712 32.712 34.217 -1.505 18002
8396 1 14 . 1 1 46 46 LYS H H 408 9.734 9.734 9.526 0.208 18002
8397 1 14 . 1 1 47 47 SER N N 409 106.720 106.720 111.715 -4.995 18002
8398 1 14 . 1 1 47 47 SER HA H 409 4.776 4.776 4.730 0.046 18002
8399 1 14 . 1 1 47 47 SER CA C 409 57.180 57.180 59.224 -2.044 18002
8400 1 14 . 1 1 47 47 SER CB C 409 65.870 65.870 62.855 3.015 18002
8401 1 14 . 1 1 47 47 SER H H 409 7.518 7.518 8.235 -0.717 18002
8402 1 14 . 1 1 48 48 LYS N N 410 122.302 122.302 121.467 0.835 18002
8403 1 14 . 1 1 48 48 LYS CA C 410 59.234 59.234 59.122 0.112 18002
8404 1 14 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.871 0.428 18002
8405 1 14 . 1 1 48 48 LYS H H 410 8.195 8.195 8.573 -0.378 18002
8406 1 14 . 1 1 49 49 GLU N N 411 118.983 118.983 119.759 -0.776 18002
8407 1 14 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.078 0.704 18002
8408 1 14 . 1 1 49 49 GLU CA C 411 59.535 59.535 59.572 -0.036 18002
8409 1 14 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.006 -0.318 18002
8410 1 14 . 1 1 49 49 GLU H H 411 8.752 8.752 8.931 -0.179 18002
8411 1 14 . 1 1 50 50 GLU N N 412 118.384 118.384 119.446 -1.062 18002
8412 1 14 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.262 0.231 18002
8413 1 14 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.989 -2.200 18002
8414 1 14 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.048 0.957 18002
8415 1 14 . 1 1 50 50 GLU H H 412 7.234 7.234 7.945 -0.711 18002
8416 1 14 . 1 1 51 51 SER N N 413 114.767 114.767 116.508 -1.741 18002
8417 1 14 . 1 1 51 51 SER CA C 413 59.764 59.764 61.005 -1.241 18002
8418 1 14 . 1 1 51 51 SER CB C 413 62.965 62.965 63.334 -0.369 18002
8419 1 14 . 1 1 51 51 SER H H 413 7.382 7.382 8.541 -1.159 18002
8420 1 14 . 1 1 52 52 SER N N 414 114.496 114.496 114.423 0.073 18002
8421 1 14 . 1 1 52 52 SER HA H 414 4.560 4.560 4.685 -0.125 18002
8422 1 14 . 1 1 52 52 SER CA C 414 58.574 58.574 57.362 1.212 18002
8423 1 14 . 1 1 52 52 SER CB C 414 63.829 63.829 64.311 -0.482 18002
8424 1 14 . 1 1 52 52 SER H H 414 7.682 7.682 7.580 0.102 18002
8425 1 14 . 1 1 53 53 GLY N N 415 111.107 111.107 109.261 1.846 18002
8426 1 14 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.879 -0.646 18002
8427 1 14 . 1 1 53 53 GLY H H 415 7.918 7.918 7.807 0.111 18002
8428 1 14 . 1 1 54 54 THR N N 416 120.214 120.214 117.312 2.902 18002
8429 1 14 . 1 1 54 54 THR CB C 416 70.035 70.035 70.008 0.027 18002
8430 1 14 . 1 1 54 54 THR H H 416 8.622 8.622 8.117 0.505 18002
8431 1 14 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.078 0.397 18002
8432 1 14 . 1 1 55 55 PRO CA C 417 63.045 63.045 63.444 -0.399 18002
8433 1 14 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.940 -0.362 18002
8434 1 14 . 1 1 56 56 ALA N N 418 125.591 125.591 124.075 1.516 18002
8435 1 14 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.978 -0.022 18002
8436 1 14 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.962 0.574 18002
8437 1 14 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.573 -0.666 18002
8438 1 14 . 1 1 56 56 ALA H H 418 8.288 8.288 7.985 0.303 18002
8439 1 14 . 1 1 57 57 HIS N N 419 108.119 108.119 111.762 -3.643 18002
8440 1 14 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.544 0.078 18002
8441 1 14 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.714 -1.134 18002
8442 1 14 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.517 2.702 18002
8443 1 14 . 1 1 57 57 HIS H H 419 7.072 7.072 7.781 -0.709 18002
8444 1 14 . 1 1 58 58 GLN N N 420 123.083 123.083 121.686 1.397 18002
8445 1 14 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.717 0.438 18002
8446 1 14 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.111 0.393 18002
8447 1 14 . 1 1 58 58 GLN CB C 420 32.490 32.490 29.900 2.590 18002
8448 1 14 . 1 1 58 58 GLN H H 420 8.669 8.669 8.782 -0.113 18002
8449 1 14 . 1 1 59 59 MET N N 421 122.330 122.330 122.057 0.273 18002
8450 1 14 . 1 1 59 59 MET HA H 421 4.621 4.621 4.719 -0.098 18002
8451 1 14 . 1 1 59 59 MET CA C 421 54.892 54.892 54.156 0.736 18002
8452 1 14 . 1 1 59 59 MET CB C 421 35.650 35.650 35.963 -0.313 18002
8453 1 14 . 1 1 59 59 MET H H 421 8.995 8.995 8.210 0.785 18002
8454 1 14 . 1 1 60 60 ASN N N 422 123.220 123.220 118.756 4.464 18002
8455 1 14 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.717 0.231 18002
8456 1 14 . 1 1 60 60 ASN CA C 422 52.631 52.631 53.105 -0.474 18002
8457 1 14 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.701 1.038 18002
8458 1 14 . 1 1 60 60 ASN H H 422 8.728 8.728 8.583 0.145 18002
8459 1 14 . 1 1 61 61 LEU N N 423 126.072 126.072 121.109 4.963 18002
8460 1 14 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.289 -0.173 18002
8461 1 14 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.481 2.132 18002
8462 1 14 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.135 1.322 18002
8463 1 14 . 1 1 61 61 LEU H H 423 8.942 8.942 8.173 0.769 18002
8464 1 14 . 1 1 62 62 ARG N N 424 121.977 121.977 121.386 0.591 18002
8465 1 14 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.039 0.333 18002
8466 1 14 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.499 1.535 18002
8467 1 14 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.236 -0.626 18002
8468 1 14 . 1 1 62 62 ARG H H 424 8.000 8.000 7.723 0.277 18002
8469 1 14 . 1 1 63 63 GLY N N 425 114.852 114.852 113.753 1.099 18002
8470 1 14 . 1 1 63 63 GLY CA C 425 45.810 45.810 44.666 1.145 18002
8471 1 14 . 1 1 63 63 GLY H H 425 9.033 9.033 8.984 0.049 18002
8472 1 14 . 1 1 64 64 CYS N N 426 117.102 117.102 118.067 -0.965 18002
8473 1 14 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.604 0.295 18002
8474 1 14 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.243 0.517 18002
8475 1 14 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.064 -0.240 18002
8476 1 14 . 1 1 64 64 CYS H H 426 8.248 8.248 7.670 0.578 18002
8477 1 14 . 1 1 65 65 GLU N N 427 119.501 119.501 121.015 -1.514 18002
8478 1 14 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.632 0.145 18002
8479 1 14 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.344 0.047 18002
8480 1 14 . 1 1 65 65 GLU CB C 427 31.938 31.938 32.282 -0.344 18002
8481 1 14 . 1 1 65 65 GLU H H 427 8.449 8.449 8.860 -0.411 18002
8482 1 14 . 1 1 66 66 VAL N N 428 125.286 125.286 120.658 4.628 18002
8483 1 14 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.547 0.343 18002
8484 1 14 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.806 -0.054 18002
8485 1 14 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.491 0.484 18002
8486 1 14 . 1 1 66 66 VAL H H 428 8.624 8.624 8.485 0.139 18002
8487 1 14 . 1 1 67 67 THR N N 429 124.132 124.132 122.389 1.743 18002
8488 1 14 . 1 1 67 67 THR CA C 429 59.338 59.338 60.586 -1.248 18002
8489 1 14 . 1 1 67 67 THR CB C 429 72.021 72.021 69.752 2.269 18002
8490 1 14 . 1 1 67 67 THR H H 429 9.247 9.247 8.312 0.935 18002
8491 1 14 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.676 -0.027 18002
8492 1 14 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.346 0.391 18002
8493 1 14 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.804 0.764 18002
8494 1 14 . 1 1 69 69 ASP N N 431 122.066 122.066 121.710 0.356 18002
8495 1 14 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.917 -0.270 18002
8496 1 14 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.410 0.259 18002
8497 1 14 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.919 -1.814 18002
8498 1 14 . 1 1 69 69 ASP H H 431 8.250 8.250 8.600 -0.350 18002
8499 1 14 . 1 1 70 70 VAL N N 432 121.874 121.874 123.486 -1.612 18002
8500 1 14 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.658 -0.159 18002
8501 1 14 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.989 0.099 18002
8502 1 14 . 1 1 70 70 VAL CB C 432 35.032 35.032 35.044 -0.012 18002
8503 1 14 . 1 1 70 70 VAL H H 432 8.305 8.305 8.263 0.042 18002
8504 1 14 . 1 1 71 71 ASN N N 433 124.366 124.366 126.987 -2.621 18002
8505 1 14 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.947 -0.265 18002
8506 1 14 . 1 1 71 71 ASN CA C 433 52.761 52.761 51.632 1.129 18002
8507 1 14 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.795 0.484 18002
8508 1 14 . 1 1 71 71 ASN H H 433 8.637 8.637 8.168 0.469 18002
8509 1 14 . 1 1 72 72 ILE N N 434 126.786 126.786 124.462 2.324 18002
8510 1 14 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.865 -0.494 18002
8511 1 14 . 1 1 72 72 ILE CA C 434 64.518 64.518 62.249 2.269 18002
8512 1 14 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.786 -0.611 18002
8513 1 14 . 1 1 72 72 ILE H H 434 8.943 8.943 8.877 0.066 18002
8514 1 14 . 1 1 73 73 SER N N 435 118.305 118.305 116.728 1.577 18002
8515 1 14 . 1 1 73 73 SER CA C 435 61.633 61.633 60.715 0.918 18002
8516 1 14 . 1 1 73 73 SER CB C 435 62.435 62.435 63.001 -0.565 18002
8517 1 14 . 1 1 73 73 SER H H 435 8.578 8.578 8.537 0.041 18002
8518 1 14 . 1 1 74 74 GLY N N 436 107.443 107.443 105.214 2.229 18002
8519 1 14 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.474 0.387 18002
8520 1 14 . 1 1 74 74 GLY H H 436 7.620 7.620 8.022 -0.402 18002
8521 1 14 . 1 1 75 75 GLN N N 437 116.895 116.895 116.943 -0.048 18002
8522 1 14 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.496 -0.206 18002
8523 1 14 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.352 0.349 18002
8524 1 14 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.589 1.156 18002
8525 1 14 . 1 1 75 75 GLN H H 437 7.798 7.798 7.228 0.570 18002
8526 1 14 . 1 1 76 76 LYS N N 438 119.308 119.308 120.502 -1.194 18002
8527 1 14 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.260 -0.118 18002
8528 1 14 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.243 0.800 18002
8529 1 14 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.930 2.015 18002
8530 1 14 . 1 1 76 76 LYS H H 438 7.522 7.522 7.707 -0.185 18002
8531 1 14 . 1 1 77 77 PHE N N 439 125.905 125.905 121.513 4.392 18002
8532 1 14 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.268 -0.057 18002
8533 1 14 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.133 -0.493 18002
8534 1 14 . 1 1 77 77 PHE CB C 439 38.929 38.929 37.380 1.550 18002
8535 1 14 . 1 1 77 77 PHE H H 439 8.461 8.461 7.083 1.378 18002
8536 1 14 . 1 1 78 78 ASN N N 440 120.787 120.787 121.501 -0.714 18002
8537 1 14 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.058 -0.145 18002
8538 1 14 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.105 -0.302 18002
8539 1 14 . 1 1 78 78 ASN H H 440 7.638 7.638 8.059 -0.421 18002
8540 1 14 . 1 1 79 79 ILE N N 441 123.421 123.421 124.038 -0.617 18002
8541 1 14 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.137 0.034 18002
8542 1 14 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.356 1.211 18002
8543 1 14 . 1 1 79 79 ILE CB C 441 41.487 41.487 36.827 4.660 18002
8544 1 14 . 1 1 79 79 ILE H H 441 9.550 9.550 8.850 0.700 18002
8545 1 14 . 1 1 80 80 LYS N N 442 126.267 126.267 128.598 -2.331 18002
8546 1 14 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.671 -0.209 18002
8547 1 14 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.294 2.089 18002
8548 1 14 . 1 1 80 80 LYS CB C 442 32.987 32.987 33.573 -0.586 18002
8549 1 14 . 1 1 80 80 LYS H H 442 8.703 8.703 8.245 0.458 18002
8550 1 14 . 1 1 81 81 LEU N N 443 125.194 125.194 125.782 -0.588 18002
8551 1 14 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.979 0.293 18002
8552 1 14 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.237 0.112 18002
8553 1 14 . 1 1 81 81 LEU CB C 443 44.704 44.704 44.458 0.246 18002
8554 1 14 . 1 1 81 81 LEU H H 443 9.223 9.223 7.954 1.269 18002
8555 1 14 . 1 1 82 82 LEU N N 444 122.753 122.753 124.640 -1.887 18002
8556 1 14 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.208 -0.194 18002
8557 1 14 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.589 0.329 18002
8558 1 14 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.611 -2.987 18002
8559 1 14 . 1 1 82 82 LEU H H 444 8.420 8.420 8.000 0.420 18002
8560 1 14 . 1 1 83 83 ILE N N 445 125.584 125.584 121.801 3.783 18002
8561 1 14 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.298 -0.013 18002
8562 1 14 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.942 -0.906 18002
8563 1 14 . 1 1 83 83 ILE H H 445 9.010 9.010 8.012 0.998 18002
8564 1 14 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.759 0.160 18002
8565 1 14 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.245 1.788 18002
8566 1 14 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.648 0.298 18002
8567 1 14 . 1 1 85 85 VAL N N 447 119.780 119.780 116.825 2.955 18002
8568 1 14 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.504 -0.001 18002
8569 1 14 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.936 0.406 18002
8570 1 14 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.120 1.146 18002
8571 1 14 . 1 1 85 85 VAL H H 447 8.304 8.304 8.025 0.279 18002
8572 1 14 . 1 1 86 86 ALA N N 448 125.178 125.178 122.504 2.674 18002
8573 1 14 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.157 -0.182 18002
8574 1 14 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.418 1.143 18002
8575 1 14 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.556 -0.568 18002
8576 1 14 . 1 1 86 86 ALA H H 448 8.526 8.526 8.366 0.160 18002
8577 1 14 . 1 1 87 87 GLU N N 449 114.625 114.625 118.288 -3.663 18002
8578 1 14 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.136 0.154 18002
8579 1 14 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.325 -0.594 18002
8580 1 14 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.890 -0.630 18002
8581 1 14 . 1 1 87 87 GLU H H 449 8.402 8.402 8.632 -0.230 18002
8582 1 14 . 1 1 88 88 GLY N N 450 109.432 109.432 106.494 2.938 18002
8583 1 14 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.839 0.998 18002
8584 1 14 . 1 1 88 88 GLY H H 450 7.711 7.711 7.783 -0.072 18002
8585 1 14 . 1 1 89 89 MET N N 451 121.382 121.382 120.396 0.986 18002
8586 1 14 . 1 1 89 89 MET HA H 451 5.076 5.076 4.876 0.200 18002
8587 1 14 . 1 1 89 89 MET CA C 451 53.860 53.860 55.278 -1.418 18002
8588 1 14 . 1 1 89 89 MET CB C 451 35.942 35.942 36.826 -0.884 18002
8589 1 14 . 1 1 89 89 MET H H 451 8.355 8.355 8.064 0.291 18002
8590 1 14 . 1 1 90 90 ASN N N 452 123.538 123.538 123.236 0.302 18002
8591 1 14 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.907 0.046 18002
8592 1 14 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.739 -0.991 18002
8593 1 14 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.808 1.834 18002
8594 1 14 . 1 1 90 90 ASN H H 452 9.338 9.338 8.873 0.465 18002
8595 1 14 . 1 1 91 91 GLU N N 453 125.978 125.978 123.930 2.048 18002
8596 1 14 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.102 1.242 18002
8597 1 14 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.258 -0.985 18002
8598 1 14 . 1 1 91 91 GLU CB C 453 31.743 31.743 29.705 2.038 18002
8599 1 14 . 1 1 91 91 GLU H H 453 8.168 8.168 8.028 0.140 18002
8600 1 14 . 1 1 92 92 ILE N N 454 126.776 126.776 123.988 2.788 18002
8601 1 14 . 1 1 92 92 ILE HA H 454 4.566 4.566 2.998 1.568 18002
8602 1 14 . 1 1 92 92 ILE CA C 454 60.048 60.048 58.066 1.982 18002
8603 1 14 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.622 1.640 18002
8604 1 14 . 1 1 92 92 ILE H H 454 9.000 9.000 8.253 0.747 18002
8605 1 14 . 1 1 93 93 TRP N N 455 125.987 125.987 122.773 3.214 18002
8606 1 14 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.148 -0.556 18002
8607 1 14 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.522 -1.732 18002
8608 1 14 . 1 1 93 93 TRP CB C 455 31.386 31.386 31.319 0.067 18002
8609 1 14 . 1 1 93 93 TRP H H 455 9.278 9.278 7.986 1.292 18002
8610 1 14 . 1 1 94 94 LEU N N 456 120.912 120.912 121.658 -0.746 18002
8611 1 14 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.638 0.724 18002
8612 1 14 . 1 1 94 94 LEU CA C 456 53.216 53.216 52.885 0.331 18002
8613 1 14 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.493 0.101 18002
8614 1 14 . 1 1 94 94 LEU H H 456 9.534 9.534 8.360 1.174 18002
8615 1 14 . 1 1 95 95 ARG N N 457 123.669 123.669 121.148 2.521 18002
8616 1 14 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.326 0.945 18002
8617 1 14 . 1 1 95 95 ARG CA C 457 55.417 55.417 56.074 -0.657 18002
8618 1 14 . 1 1 95 95 ARG CB C 457 33.262 33.262 31.675 1.587 18002
8619 1 14 . 1 1 95 95 ARG H H 457 9.439 9.439 7.912 1.527 18002
8620 1 14 . 1 1 96 96 CYS N N 458 125.273 125.273 120.098 5.175 18002
8621 1 14 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.381 -0.683 18002
8622 1 14 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.533 1.259 18002
8623 1 14 . 1 1 96 96 CYS CB C 458 30.403 30.403 29.931 0.472 18002
8624 1 14 . 1 1 96 96 CYS H H 458 8.652 8.652 8.427 0.225 18002
8625 1 14 . 1 1 97 97 ASP N N 459 119.661 119.661 120.389 -0.728 18002
8626 1 14 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.826 -0.086 18002
8627 1 14 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.993 1.235 18002
8628 1 14 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.670 0.915 18002
8629 1 14 . 1 1 97 97 ASP H H 459 9.116 9.116 9.299 -0.183 18002
8630 1 14 . 1 1 98 98 ASN N N 460 109.173 109.173 114.584 -5.411 18002
8631 1 14 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.392 -0.020 18002
8632 1 14 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.582 -0.568 18002
8633 1 14 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.044 1.767 18002
8634 1 14 . 1 1 98 98 ASN H H 460 7.054 7.054 7.433 -0.379 18002
8635 1 14 . 1 1 99 99 GLU N N 461 119.220 119.220 118.351 0.869 18002
8636 1 14 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.127 0.917 18002
8637 1 14 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.019 0.749 18002
8638 1 14 . 1 1 99 99 GLU H H 461 8.937 8.937 8.233 0.704 18002
8639 1 14 . 1 1 100 100 LYS N N 462 120.647 120.647 119.494 1.153 18002
8640 1 14 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.818 0.827 18002
8641 1 14 . 1 1 100 100 LYS CA C 462 60.536 60.536 58.940 1.596 18002
8642 1 14 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.839 0.389 18002
8643 1 14 . 1 1 100 100 LYS H H 462 8.033 8.033 7.757 0.276 18002
8644 1 14 . 1 1 101 101 GLN N N 463 121.938 121.938 118.956 2.982 18002
8645 1 14 . 1 1 101 101 GLN HA H 463 4.400 4.400 3.482 0.918 18002
8646 1 14 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.627 0.768 18002
8647 1 14 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.459 3.755 18002
8648 1 14 . 1 1 101 101 GLN H H 463 8.372 8.372 8.439 -0.067 18002
8649 1 14 . 1 1 102 102 TYR N N 464 117.422 117.422 119.523 -2.101 18002
8650 1 14 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.016 0.600 18002
8651 1 14 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.089 0.588 18002
8652 1 14 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.079 0.780 18002
8653 1 14 . 1 1 102 102 TYR H H 464 8.221 8.221 7.523 0.698 18002
8654 1 14 . 1 1 103 103 ALA N N 465 120.655 120.655 118.500 2.155 18002
8655 1 14 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.032 -0.317 18002
8656 1 14 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.817 1.096 18002
8657 1 14 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.242 0.560 18002
8658 1 14 . 1 1 103 103 ALA H H 465 8.637 8.637 7.684 0.953 18002
8659 1 14 . 1 1 104 104 HIS N N 466 112.871 112.871 117.742 -4.871 18002
8660 1 14 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.543 -0.402 18002
8661 1 14 . 1 1 104 104 HIS CA C 466 60.627 60.627 57.906 2.721 18002
8662 1 14 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.684 -0.826 18002
8663 1 14 . 1 1 104 104 HIS H H 466 7.852 7.852 7.658 0.194 18002
8664 1 14 . 1 1 105 105 TRP N N 467 121.317 121.317 118.598 2.719 18002
8665 1 14 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.614 -0.919 18002
8666 1 14 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.465 1.877 18002
8667 1 14 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.206 -1.701 18002
8668 1 14 . 1 1 105 105 TRP H H 467 8.668 8.668 7.896 0.772 18002
8669 1 14 . 1 1 106 106 MET N N 468 122.346 122.346 120.041 2.305 18002
8670 1 14 . 1 1 106 106 MET HA H 468 4.086 4.086 4.074 0.012 18002
8671 1 14 . 1 1 106 106 MET CA C 468 58.743 58.743 58.542 0.201 18002
8672 1 14 . 1 1 106 106 MET CB C 468 31.402 31.402 31.391 0.011 18002
8673 1 14 . 1 1 106 106 MET H H 468 9.790 9.790 8.177 1.613 18002
8674 1 14 . 1 1 107 107 ALA N N 469 119.758 119.758 120.575 -0.817 18002
8675 1 14 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.165 -0.460 18002
8676 1 14 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.318 1.811 18002
8677 1 14 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.414 1.991 18002
8678 1 14 . 1 1 107 107 ALA H H 469 7.702 7.702 7.749 -0.047 18002
8679 1 14 . 1 1 108 108 ALA N N 470 119.233 119.233 122.639 -3.406 18002
8680 1 14 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.873 -0.327 18002
8681 1 14 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.283 0.538 18002
8682 1 14 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.155 -1.423 18002
8683 1 14 . 1 1 108 108 ALA H H 470 7.156 7.156 7.846 -0.690 18002
8684 1 14 . 1 1 109 109 CYS N N 471 116.736 116.736 115.235 1.501 18002
8685 1 14 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.062 -0.005 18002
8686 1 14 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.662 2.909 18002
8687 1 14 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.541 -0.148 18002
8688 1 14 . 1 1 109 109 CYS H H 471 8.256 8.256 8.661 -0.405 18002
8689 1 14 . 1 1 110 110 ARG N N 472 118.644 118.644 121.548 -2.904 18002
8690 1 14 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.084 -0.350 18002
8691 1 14 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.830 1.374 18002
8692 1 14 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.345 -0.028 18002
8693 1 14 . 1 1 110 110 ARG H H 472 8.403 8.403 7.443 0.960 18002
8694 1 14 . 1 1 111 111 LEU N N 473 121.877 121.877 119.488 2.389 18002
8695 1 14 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.920 -0.120 18002
8696 1 14 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.543 2.312 18002
8697 1 14 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.206 -0.787 18002
8698 1 14 . 1 1 111 111 LEU H H 473 7.916 7.916 8.020 -0.103 18002
8699 1 14 . 1 1 112 112 ALA N N 474 122.765 122.765 121.764 1.001 18002
8700 1 14 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.975 0.505 18002
8701 1 14 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.851 0.410 18002
8702 1 14 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.288 1.587 18002
8703 1 14 . 1 1 112 112 ALA H H 474 8.393 8.393 8.163 0.230 18002
8704 1 14 . 1 1 113 113 SER N N 475 113.613 113.613 114.407 -0.794 18002
8705 1 14 . 1 1 113 113 SER HA H 475 4.782 4.782 4.099 0.682 18002
8706 1 14 . 1 1 113 113 SER CA C 475 61.090 61.090 61.484 -0.394 18002
8707 1 14 . 1 1 113 113 SER CB C 475 63.612 63.612 62.798 0.814 18002
8708 1 14 . 1 1 113 113 SER H H 475 8.150 8.150 8.466 -0.316 18002
8709 1 14 . 1 1 114 114 LYS N N 476 118.734 118.734 117.281 1.453 18002
8710 1 14 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.345 0.208 18002
8711 1 14 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.205 -1.061 18002
8712 1 14 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.138 0.453 18002
8713 1 14 . 1 1 114 114 LYS H H 476 7.239 7.239 7.515 -0.276 18002
8714 1 14 . 1 1 115 115 GLY N N 477 107.818 107.818 108.821 -1.003 18002
8715 1 14 . 1 1 115 115 GLY CA C 477 45.986 45.986 46.311 -0.325 18002
8716 1 14 . 1 1 115 115 GLY H H 477 8.401 8.401 8.784 -0.383 18002
8717 1 14 . 1 1 116 116 LYS N N 478 120.938 120.938 122.464 -1.526 18002
8718 1 14 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.228 0.345 18002
8719 1 14 . 1 1 116 116 LYS CA C 478 54.847 54.847 55.734 -0.887 18002
8720 1 14 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.250 1.071 18002
8721 1 14 . 1 1 116 116 LYS H H 478 8.142 8.142 7.877 0.265 18002
8722 1 14 . 1 1 117 117 THR N N 479 108.076 108.076 115.785 -7.709 18002
8723 1 14 . 1 1 117 117 THR HA H 479 4.671 4.671 4.288 0.383 18002
8724 1 14 . 1 1 117 117 THR CA C 479 59.191 59.191 59.881 -0.690 18002
8725 1 14 . 1 1 117 117 THR CB C 479 72.228 72.228 69.950 2.278 18002
8726 1 14 . 1 1 117 117 THR H H 479 7.926 7.926 7.548 0.378 18002
8727 1 14 . 1 1 118 118 MET N N 480 116.403 116.403 119.473 -3.070 18002
8728 1 14 . 1 1 118 118 MET HA H 480 3.352 3.352 3.750 -0.398 18002
8729 1 14 . 1 1 118 118 MET CA C 480 57.947 57.947 56.011 1.935 18002
8730 1 14 . 1 1 118 118 MET CB C 480 33.920 33.920 31.681 2.239 18002
8731 1 14 . 1 1 118 118 MET H H 480 8.899 8.899 8.533 0.366 18002
8732 1 14 . 1 1 119 119 ALA N N 481 117.786 117.786 121.226 -3.440 18002
8733 1 14 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.974 0.110 18002
8734 1 14 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.554 -1.959 18002
8735 1 14 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.135 -0.073 18002
8736 1 14 . 1 1 119 119 ALA H H 481 7.645 7.645 8.307 -0.662 18002
8737 1 14 . 1 1 120 120 ASP N N 482 120.348 120.348 112.933 7.415 18002
8738 1 14 . 1 1 120 120 ASP CB C 482 44.616 44.616 40.173 4.443 18002
8739 1 14 . 1 1 120 120 ASP H H 482 7.887 7.887 7.633 0.254 18002
8740 1 14 . 1 1 121 121 SER HA H 483 4.223 4.223 4.262 -0.039 18002
8741 1 14 . 1 1 121 121 SER CA C 483 61.455 61.455 60.882 0.573 18002
8742 1 14 . 1 1 121 121 SER CB C 483 62.996 62.996 63.111 -0.115 18002
8743 1 14 . 1 1 122 122 SER N N 484 116.845 116.845 116.683 0.162 18002
8744 1 14 . 1 1 122 122 SER HA H 484 4.321 4.321 4.199 0.122 18002
8745 1 14 . 1 1 122 122 SER CA C 484 60.584 60.584 61.386 -0.802 18002
8746 1 14 . 1 1 122 122 SER CB C 484 64.314 64.314 62.630 1.685 18002
8747 1 14 . 1 1 122 122 SER H H 484 8.875 8.875 8.513 0.362 18002
8748 1 14 . 1 1 123 123 TYR N N 485 124.153 124.153 120.095 4.058 18002
8749 1 14 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.238 -0.358 18002
8750 1 14 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.919 2.394 18002
8751 1 14 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.939 -0.198 18002
8752 1 14 . 1 1 123 123 TYR H H 485 8.018 8.018 8.693 -0.675 18002
8753 1 14 . 1 1 124 124 ASN N N 486 115.339 115.339 117.710 -2.371 18002
8754 1 14 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.307 -0.366 18002
8755 1 14 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.529 1.177 18002
8756 1 14 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.352 -0.296 18002
8757 1 14 . 1 1 124 124 ASN H H 486 8.665 8.665 7.829 0.836 18002
8758 1 14 . 1 1 125 125 LEU N N 487 119.454 119.454 120.339 -0.885 18002
8759 1 14 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.100 -0.162 18002
8760 1 14 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.257 0.413 18002
8761 1 14 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.518 0.050 18002
8762 1 14 . 1 1 125 125 LEU H H 487 7.105 7.105 8.612 -1.507 18002
8763 1 14 . 1 1 126 126 GLU N N 488 121.189 121.189 118.554 2.635 18002
8764 1 14 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.070 -0.040 18002
8765 1 14 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.577 -0.541 18002
8766 1 14 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.812 -0.727 18002
8767 1 14 . 1 1 126 126 GLU H H 488 8.053 8.053 8.115 -0.062 18002
8768 1 14 . 1 1 127 127 VAL N N 489 119.073 119.073 116.354 2.719 18002
8769 1 14 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.745 -0.727 18002
8770 1 14 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.862 1.460 18002
8771 1 14 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.378 0.281 18002
8772 1 14 . 1 1 127 127 VAL H H 489 7.769 7.769 7.089 0.680 18002
8773 1 14 . 1 1 128 128 GLN N N 490 116.214 116.214 116.645 -0.431 18002
8774 1 14 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.062 -0.230 18002
8775 1 14 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.192 0.564 18002
8776 1 14 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.046 0.066 18002
8777 1 14 . 1 1 128 128 GLN H H 490 7.542 7.542 7.733 -0.191 18002
8778 1 14 . 1 1 129 129 ASN N N 491 120.003 120.003 119.130 0.873 18002
8779 1 14 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.641 -0.222 18002
8780 1 14 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.535 0.625 18002
8781 1 14 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.544 -0.483 18002
8782 1 14 . 1 1 129 129 ASN H H 491 8.582 8.582 7.634 0.948 18002
8783 1 14 . 1 1 130 130 ILE N N 492 122.365 122.365 120.615 1.750 18002
8784 1 14 . 1 1 130 130 ILE CA C 492 65.753 65.753 65.097 0.655 18002
8785 1 14 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.520 0.626 18002
8786 1 14 . 1 1 130 130 ILE H H 492 8.186 8.186 7.406 0.780 18002
8787 1 14 . 1 1 131 131 LEU N N 493 119.597 119.597 120.452 -0.855 18002
8788 1 14 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.959 0.046 18002
8789 1 14 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.404 0.455 18002
8790 1 14 . 1 1 131 131 LEU CB C 493 41.536 41.536 40.361 1.175 18002
8791 1 14 . 1 1 131 131 LEU H H 493 8.224 8.224 7.872 0.352 18002
8792 1 14 . 1 1 132 132 SER N N 494 114.884 114.884 113.787 1.097 18002
8793 1 14 . 1 1 132 132 SER HA H 494 4.430 4.430 4.341 0.089 18002
8794 1 14 . 1 1 132 132 SER CA C 494 62.072 62.072 61.463 0.609 18002
8795 1 14 . 1 1 132 132 SER CB C 494 62.703 62.703 63.169 -0.466 18002
8796 1 14 . 1 1 132 132 SER H H 494 8.464 8.464 7.994 0.470 18002
8797 1 14 . 1 1 133 133 PHE N N 495 123.047 123.047 120.497 2.550 18002
8798 1 14 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.513 -0.136 18002
8799 1 14 . 1 1 133 133 PHE CA C 495 60.913 60.913 59.560 1.353 18002
8800 1 14 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.079 -0.029 18002
8801 1 14 . 1 1 133 133 PHE H H 495 7.915 7.915 7.859 0.056 18002
8802 1 14 . 1 1 134 134 LEU N N 496 119.311 119.311 120.147 -0.836 18002
8803 1 14 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.294 -0.389 18002
8804 1 14 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.934 -0.333 18002
8805 1 14 . 1 1 134 134 LEU CB C 496 41.901 41.901 42.014 -0.113 18002
8806 1 14 . 1 1 134 134 LEU H H 496 8.386 8.386 8.678 -0.292 18002
8807 1 14 . 1 1 135 135 LYS N N 497 117.550 117.550 117.131 0.419 18002
8808 1 14 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.217 -0.277 18002
8809 1 14 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.567 -0.292 18002
8810 1 14 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.555 -0.061 18002
8811 1 14 . 1 1 135 135 LYS H H 497 7.670 7.670 7.553 0.117 18002
8812 1 14 . 1 1 136 136 MET N N 498 116.106 116.106 117.751 -1.645 18002
8813 1 14 . 1 1 136 136 MET HA H 498 4.354 4.354 4.583 -0.229 18002
8814 1 14 . 1 1 136 136 MET CA C 498 55.994 55.994 55.046 0.948 18002
8815 1 14 . 1 1 136 136 MET CB C 498 32.772 32.772 32.119 0.653 18002
8816 1 14 . 1 1 136 136 MET H H 498 7.421 7.421 7.505 -0.084 18002
8817 1 14 . 1 1 137 137 GLN N N 499 118.651 118.651 119.134 -0.483 18002
8818 1 14 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.200 -0.016 18002
8819 1 14 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.794 -2.486 18002
8820 1 14 . 1 1 137 137 GLN H H 499 7.617 7.617 7.730 -0.113 18002
8821 1 15 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.664 -0.539 18002
8822 1 15 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.079 -1.064 18002
8823 1 15 . 1 1 3 3 HIS CB C 365 31.929 31.929 31.205 0.724 18002
8824 1 15 . 1 1 4 4 MET N N 366 120.431 120.431 120.169 0.262 18002
8825 1 15 . 1 1 4 4 MET HA H 366 4.345 4.345 4.245 0.100 18002
8826 1 15 . 1 1 4 4 MET CA C 366 55.337 55.337 55.743 -0.406 18002
8827 1 15 . 1 1 4 4 MET CB C 366 32.668 32.668 32.072 0.596 18002
8828 1 15 . 1 1 4 4 MET H H 366 8.373 8.373 8.012 0.361 18002
8829 1 15 . 1 1 5 5 GLY N N 367 109.318 109.318 109.380 -0.062 18002
8830 1 15 . 1 1 5 5 GLY CA C 367 45.457 45.457 44.357 1.100 18002
8831 1 15 . 1 1 5 5 GLY H H 367 8.224 8.224 7.772 0.452 18002
8832 1 15 . 1 1 6 6 ASP N N 368 120.307 120.307 119.720 0.587 18002
8833 1 15 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.751 -0.151 18002
8834 1 15 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.474 1.038 18002
8835 1 15 . 1 1 6 6 ASP CB C 368 41.326 41.326 42.592 -1.266 18002
8836 1 15 . 1 1 6 6 ASP H H 368 8.199 8.199 8.192 0.007 18002
8837 1 15 . 1 1 7 7 ILE N N 369 120.668 120.668 117.845 2.823 18002
8838 1 15 . 1 1 7 7 ILE HA H 369 4.218 4.218 3.921 0.297 18002
8839 1 15 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.236 -0.652 18002
8840 1 15 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.438 1.330 18002
8841 1 15 . 1 1 7 7 ILE H H 369 8.138 8.138 8.353 -0.215 18002
8842 1 15 . 1 1 8 8 THR N N 370 117.564 117.564 108.515 9.049 18002
8843 1 15 . 1 1 8 8 THR HA H 370 4.322 4.322 3.983 0.339 18002
8844 1 15 . 1 1 8 8 THR CA C 370 62.332 62.332 63.092 -0.760 18002
8845 1 15 . 1 1 8 8 THR CB C 370 69.946 69.946 68.642 1.304 18002
8846 1 15 . 1 1 8 8 THR H H 370 8.230 8.230 7.651 0.579 18002
8847 1 15 . 1 1 9 9 SER N N 371 118.467 118.467 112.787 5.680 18002
8848 1 15 . 1 1 9 9 SER HA H 371 4.445 4.445 4.054 0.391 18002
8849 1 15 . 1 1 9 9 SER CA C 371 58.274 58.274 59.638 -1.364 18002
8850 1 15 . 1 1 9 9 SER CB C 371 63.996 63.996 62.166 1.830 18002
8851 1 15 . 1 1 9 9 SER H H 371 8.158 8.158 8.724 -0.566 18002
8852 1 15 . 1 1 10 10 ILE N N 372 123.959 123.959 117.761 6.198 18002
8853 1 15 . 1 1 10 10 ILE CA C 372 58.716 58.716 64.118 -5.402 18002
8854 1 15 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.455 2.464 18002
8855 1 15 . 1 1 10 10 ILE H H 372 8.112 8.112 7.768 0.344 18002
8856 1 15 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.625 -0.273 18002
8857 1 15 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.541 1.640 18002
8858 1 15 . 1 1 11 11 PRO CB C 373 31.707 31.707 29.940 1.767 18002
8859 1 15 . 1 1 12 12 GLU N N 374 119.349 119.349 121.016 -1.667 18002
8860 1 15 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.579 0.208 18002
8861 1 15 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.335 -0.018 18002
8862 1 15 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.882 2.709 18002
8863 1 15 . 1 1 12 12 GLU H H 374 8.017 8.017 7.955 0.062 18002
8864 1 15 . 1 1 13 13 LEU N N 375 122.288 122.288 125.761 -3.473 18002
8865 1 15 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.416 0.062 18002
8866 1 15 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.917 -0.987 18002
8867 1 15 . 1 1 13 13 LEU CB C 375 44.656 44.656 42.901 1.756 18002
8868 1 15 . 1 1 13 13 LEU H H 375 8.036 8.036 8.521 -0.485 18002
8869 1 15 . 1 1 14 14 ALA N N 376 125.461 125.461 127.206 -1.745 18002
8870 1 15 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.749 0.497 18002
8871 1 15 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.644 0.101 18002
8872 1 15 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.946 -0.360 18002
8873 1 15 . 1 1 14 14 ALA H H 376 8.181 8.181 7.931 0.250 18002
8874 1 15 . 1 1 15 15 ASP N N 377 122.242 122.242 118.387 3.855 18002
8875 1 15 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.476 -0.157 18002
8876 1 15 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.219 0.533 18002
8877 1 15 . 1 1 15 15 ASP CB C 377 46.639 46.639 43.781 2.858 18002
8878 1 15 . 1 1 15 15 ASP H H 377 8.326 8.326 8.519 -0.193 18002
8879 1 15 . 1 1 16 16 TYR N N 378 118.961 118.961 118.803 0.158 18002
8880 1 15 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.707 0.684 18002
8881 1 15 . 1 1 16 16 TYR CA C 378 59.581 59.581 58.711 0.870 18002
8882 1 15 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.992 0.031 18002
8883 1 15 . 1 1 16 16 TYR H H 378 8.869 8.869 8.055 0.814 18002
8884 1 15 . 1 1 17 17 ILE N N 379 125.214 125.214 120.647 4.567 18002
8885 1 15 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.463 -0.133 18002
8886 1 15 . 1 1 17 17 ILE CA C 379 58.732 58.732 59.858 -1.127 18002
8887 1 15 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.779 -1.803 18002
8888 1 15 . 1 1 17 17 ILE H H 379 8.608 8.608 8.407 0.201 18002
8889 1 15 . 1 1 18 18 LYS N N 380 122.917 122.917 124.352 -1.435 18002
8890 1 15 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.196 -0.084 18002
8891 1 15 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.864 0.972 18002
8892 1 15 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.867 -0.841 18002
8893 1 15 . 1 1 18 18 LYS H H 380 7.424 7.424 8.396 -0.972 18002
8894 1 15 . 1 1 19 19 VAL N N 381 122.839 122.839 122.571 0.268 18002
8895 1 15 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.432 0.831 18002
8896 1 15 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.475 2.041 18002
8897 1 15 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.165 -0.017 18002
8898 1 15 . 1 1 19 19 VAL H H 381 9.223 9.223 8.027 1.196 18002
8899 1 15 . 1 1 20 20 PHE N N 382 129.509 129.509 125.745 3.764 18002
8900 1 15 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.523 0.320 18002
8901 1 15 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.303 0.202 18002
8902 1 15 . 1 1 20 20 PHE CB C 382 42.862 42.862 38.743 4.119 18002
8903 1 15 . 1 1 20 20 PHE H H 382 9.451 9.451 8.486 0.965 18002
8904 1 15 . 1 1 21 21 LYS N N 383 126.417 126.417 127.389 -0.972 18002
8905 1 15 . 1 1 21 21 LYS CA C 383 52.841 52.841 53.190 -0.349 18002
8906 1 15 . 1 1 21 21 LYS CB C 383 33.219 33.219 31.217 2.002 18002
8907 1 15 . 1 1 21 21 LYS H H 383 7.582 7.582 8.233 -0.651 18002
8908 1 15 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.977 0.720 18002
8909 1 15 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.789 0.180 18002
8910 1 15 . 1 1 23 23 LYS N N 385 118.026 118.026 116.690 1.336 18002
8911 1 15 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.015 0.200 18002
8912 1 15 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.872 -0.527 18002
8913 1 15 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.298 0.735 18002
8914 1 15 . 1 1 23 23 LYS H H 385 8.138 8.138 7.626 0.512 18002
8915 1 15 . 1 1 24 24 LYS N N 386 120.816 120.816 122.239 -1.423 18002
8916 1 15 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.139 0.047 18002
8917 1 15 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.725 -0.863 18002
8918 1 15 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.606 0.221 18002
8919 1 15 . 1 1 24 24 LYS H H 386 7.727 7.727 8.255 -0.528 18002
8920 1 15 . 1 1 25 25 LEU N N 387 121.214 121.214 119.910 1.304 18002
8921 1 15 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.426 -0.258 18002
8922 1 15 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.486 0.021 18002
8923 1 15 . 1 1 25 25 LEU CB C 387 41.642 41.642 43.011 -1.369 18002
8924 1 15 . 1 1 25 25 LEU H H 387 8.241 8.241 7.920 0.321 18002
8925 1 15 . 1 1 26 26 THR N N 388 112.798 112.798 109.053 3.745 18002
8926 1 15 . 1 1 26 26 THR HA H 388 4.313 4.313 4.378 -0.065 18002
8927 1 15 . 1 1 26 26 THR CA C 388 61.795 61.795 62.055 -0.260 18002
8928 1 15 . 1 1 26 26 THR CB C 388 69.875 69.875 67.766 2.109 18002
8929 1 15 . 1 1 26 26 THR H H 388 7.700 7.700 7.650 0.050 18002
8930 1 15 . 1 1 27 27 LEU N N 389 124.091 124.091 121.232 2.859 18002
8931 1 15 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.564 -0.210 18002
8932 1 15 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.620 -0.087 18002
8933 1 15 . 1 1 27 27 LEU CB C 389 42.298 42.298 40.958 1.340 18002
8934 1 15 . 1 1 27 27 LEU H H 389 8.260 8.260 7.968 0.292 18002
8935 1 15 . 1 1 28 28 LYS N N 390 121.153 121.153 119.949 1.204 18002
8936 1 15 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.437 -0.117 18002
8937 1 15 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.156 0.055 18002
8938 1 15 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.853 0.822 18002
8939 1 15 . 1 1 28 28 LYS H H 390 8.202 8.202 8.251 -0.049 18002
8940 1 15 . 1 1 29 29 GLY N N 391 107.270 107.270 110.323 -3.053 18002
8941 1 15 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.843 -0.968 18002
8942 1 15 . 1 1 29 29 GLY H H 391 7.876 7.876 7.876 -0.000 18002
8943 1 15 . 1 1 30 30 TYR N N 392 118.471 118.471 120.266 -1.795 18002
8944 1 15 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.302 0.144 18002
8945 1 15 . 1 1 30 30 TYR CA C 392 59.047 59.047 60.051 -1.004 18002
8946 1 15 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.785 3.040 18002
8947 1 15 . 1 1 30 30 TYR H H 392 8.183 8.183 8.409 -0.226 18002
8948 1 15 . 1 1 31 31 LYS N N 393 122.833 122.833 120.436 2.397 18002
8949 1 15 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.690 -0.175 18002
8950 1 15 . 1 1 31 31 LYS CA C 393 55.174 55.174 55.084 0.090 18002
8951 1 15 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.333 1.387 18002
8952 1 15 . 1 1 31 31 LYS H H 393 8.731 8.731 7.659 1.072 18002
8953 1 15 . 1 1 32 32 GLN N N 394 124.759 124.759 119.250 5.509 18002
8954 1 15 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.960 -0.282 18002
8955 1 15 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.271 2.336 18002
8956 1 15 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.773 1.275 18002
8957 1 15 . 1 1 32 32 GLN H H 394 8.776 8.776 8.405 0.371 18002
8958 1 15 . 1 1 33 33 TYR N N 395 125.112 125.112 124.433 0.679 18002
8959 1 15 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.224 0.850 18002
8960 1 15 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.641 -0.477 18002
8961 1 15 . 1 1 33 33 TYR CB C 395 42.672 42.672 39.380 3.292 18002
8962 1 15 . 1 1 33 33 TYR H H 395 8.774 8.774 7.868 0.906 18002
8963 1 15 . 1 1 34 34 TRP N N 396 122.638 122.638 125.291 -2.653 18002
8964 1 15 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.310 -0.628 18002
8965 1 15 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.855 3.364 18002
8966 1 15 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.474 1.030 18002
8967 1 15 . 1 1 34 34 TRP H H 396 8.975 8.975 8.207 0.768 18002
8968 1 15 . 1 1 35 35 CYS N N 397 127.146 127.146 125.316 1.830 18002
8969 1 15 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.773 -0.406 18002
8970 1 15 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.202 1.504 18002
8971 1 15 . 1 1 35 35 CYS H H 397 8.804 8.804 9.027 -0.223 18002
8972 1 15 . 1 1 36 36 THR N N 398 110.578 110.578 116.188 -5.610 18002
8973 1 15 . 1 1 36 36 THR HA H 398 5.358 5.358 4.974 0.384 18002
8974 1 15 . 1 1 36 36 THR CA C 398 58.704 58.704 60.908 -2.204 18002
8975 1 15 . 1 1 36 36 THR CB C 398 71.833 71.833 71.183 0.650 18002
8976 1 15 . 1 1 36 36 THR H H 398 9.090 9.090 8.201 0.889 18002
8977 1 15 . 1 1 37 37 PHE N N 399 127.322 127.322 128.059 -0.737 18002
8978 1 15 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.683 0.270 18002
8979 1 15 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.677 -1.431 18002
8980 1 15 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.770 2.415 18002
8981 1 15 . 1 1 37 37 PHE H H 399 8.846 8.846 8.292 0.554 18002
8982 1 15 . 1 1 38 38 LYS N N 400 125.391 125.391 127.154 -1.763 18002
8983 1 15 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.421 0.106 18002
8984 1 15 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.819 0.158 18002
8985 1 15 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.285 2.630 18002
8986 1 15 . 1 1 38 38 LYS H H 400 8.252 8.252 7.706 0.546 18002
8987 1 15 . 1 1 39 39 ASP N N 401 125.083 125.083 118.572 6.511 18002
8988 1 15 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.391 -0.313 18002
8989 1 15 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.627 -0.144 18002
8990 1 15 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.884 -1.363 18002
8991 1 15 . 1 1 39 39 ASP H H 401 9.408 9.408 8.702 0.706 18002
8992 1 15 . 1 1 40 40 THR N N 402 112.024 112.024 104.057 7.967 18002
8993 1 15 . 1 1 40 40 THR HA H 402 4.767 4.767 4.455 0.312 18002
8994 1 15 . 1 1 40 40 THR CA C 402 60.811 60.811 62.873 -2.062 18002
8995 1 15 . 1 1 40 40 THR CB C 402 68.823 68.823 70.791 -1.968 18002
8996 1 15 . 1 1 40 40 THR H H 402 8.224 8.224 7.812 0.412 18002
8997 1 15 . 1 1 41 41 SER N N 403 116.142 116.142 115.927 0.215 18002
8998 1 15 . 1 1 41 41 SER HA H 403 5.428 5.428 4.690 0.738 18002
8999 1 15 . 1 1 41 41 SER CA C 403 58.297 58.297 57.005 1.292 18002
9000 1 15 . 1 1 41 41 SER CB C 403 66.409 66.409 65.385 1.024 18002
9001 1 15 . 1 1 41 41 SER H H 403 8.197 8.197 7.523 0.674 18002
9002 1 15 . 1 1 42 42 ILE N N 404 122.292 122.292 121.170 1.122 18002
9003 1 15 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.577 0.352 18002
9004 1 15 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.970 0.834 18002
9005 1 15 . 1 1 42 42 ILE CB C 404 41.420 41.420 41.298 0.122 18002
9006 1 15 . 1 1 42 42 ILE H H 404 8.411 8.411 7.867 0.544 18002
9007 1 15 . 1 1 43 43 SER N N 405 122.244 122.244 118.791 3.453 18002
9008 1 15 . 1 1 43 43 SER HA H 405 4.966 4.966 4.654 0.312 18002
9009 1 15 . 1 1 43 43 SER CA C 405 57.735 57.735 57.124 0.611 18002
9010 1 15 . 1 1 43 43 SER CB C 405 65.388 65.388 65.257 0.131 18002
9011 1 15 . 1 1 43 43 SER H H 405 8.752 8.752 8.278 0.474 18002
9012 1 15 . 1 1 44 44 CYS N N 406 120.004 120.004 120.490 -0.486 18002
9013 1 15 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.389 0.578 18002
9014 1 15 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.317 -0.259 18002
9015 1 15 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.844 0.596 18002
9016 1 15 . 1 1 44 44 CYS H H 406 8.470 8.470 8.251 0.219 18002
9017 1 15 . 1 1 45 45 TYR N N 407 122.704 122.704 125.535 -2.831 18002
9018 1 15 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.021 0.002 18002
9019 1 15 . 1 1 45 45 TYR CA C 407 56.983 56.983 55.901 1.082 18002
9020 1 15 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.156 1.418 18002
9021 1 15 . 1 1 45 45 TYR H H 407 10.013 10.013 8.770 1.243 18002
9022 1 15 . 1 1 46 46 LYS N N 408 121.897 121.897 122.196 -0.299 18002
9023 1 15 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.479 -0.133 18002
9024 1 15 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.357 3.662 18002
9025 1 15 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.001 -0.289 18002
9026 1 15 . 1 1 46 46 LYS H H 408 9.734 9.734 8.800 0.934 18002
9027 1 15 . 1 1 47 47 SER N N 409 106.720 106.720 113.426 -6.706 18002
9028 1 15 . 1 1 47 47 SER HA H 409 4.776 4.776 4.966 -0.190 18002
9029 1 15 . 1 1 47 47 SER CA C 409 57.180 57.180 57.719 -0.539 18002
9030 1 15 . 1 1 47 47 SER CB C 409 65.870 65.870 65.744 0.126 18002
9031 1 15 . 1 1 47 47 SER H H 409 7.518 7.518 7.788 -0.270 18002
9032 1 15 . 1 1 48 48 LYS N N 410 122.302 122.302 121.571 0.731 18002
9033 1 15 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.693 1.541 18002
9034 1 15 . 1 1 48 48 LYS CB C 410 32.299 32.299 32.029 0.271 18002
9035 1 15 . 1 1 48 48 LYS H H 410 8.195 8.195 8.867 -0.672 18002
9036 1 15 . 1 1 49 49 GLU N N 411 118.983 118.983 119.560 -0.577 18002
9037 1 15 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.212 0.570 18002
9038 1 15 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.696 0.839 18002
9039 1 15 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.628 -0.940 18002
9040 1 15 . 1 1 49 49 GLU H H 411 8.752 8.752 8.418 0.334 18002
9041 1 15 . 1 1 50 50 GLU N N 412 118.384 118.384 118.395 -0.011 18002
9042 1 15 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.270 0.223 18002
9043 1 15 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.458 -1.669 18002
9044 1 15 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.400 0.605 18002
9045 1 15 . 1 1 50 50 GLU H H 412 7.234 7.234 8.057 -0.823 18002
9046 1 15 . 1 1 51 51 SER N N 413 114.767 114.767 113.691 1.076 18002
9047 1 15 . 1 1 51 51 SER CA C 413 59.764 59.764 60.303 -0.540 18002
9048 1 15 . 1 1 51 51 SER CB C 413 62.965 62.965 63.182 -0.217 18002
9049 1 15 . 1 1 51 51 SER H H 413 7.382 7.382 7.817 -0.435 18002
9050 1 15 . 1 1 52 52 SER N N 414 114.496 114.496 112.456 2.040 18002
9051 1 15 . 1 1 52 52 SER HA H 414 4.560 4.560 4.619 -0.059 18002
9052 1 15 . 1 1 52 52 SER CA C 414 58.574 58.574 58.428 0.146 18002
9053 1 15 . 1 1 52 52 SER CB C 414 63.829 63.829 65.483 -1.654 18002
9054 1 15 . 1 1 52 52 SER H H 414 7.682 7.682 7.610 0.072 18002
9055 1 15 . 1 1 53 53 GLY N N 415 111.107 111.107 111.822 -0.715 18002
9056 1 15 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.184 -0.951 18002
9057 1 15 . 1 1 53 53 GLY H H 415 7.918 7.918 7.589 0.329 18002
9058 1 15 . 1 1 54 54 THR N N 416 120.214 120.214 117.726 2.488 18002
9059 1 15 . 1 1 54 54 THR CB C 416 70.035 70.035 70.993 -0.957 18002
9060 1 15 . 1 1 54 54 THR H H 416 8.622 8.622 8.152 0.470 18002
9061 1 15 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.555 -0.080 18002
9062 1 15 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.502 0.542 18002
9063 1 15 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.400 -0.822 18002
9064 1 15 . 1 1 56 56 ALA N N 418 125.591 125.591 123.978 1.613 18002
9065 1 15 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.142 -0.186 18002
9066 1 15 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.987 0.548 18002
9067 1 15 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.477 -0.570 18002
9068 1 15 . 1 1 56 56 ALA H H 418 8.288 8.288 8.279 0.009 18002
9069 1 15 . 1 1 57 57 HIS N N 419 108.119 108.119 116.075 -7.956 18002
9070 1 15 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.687 -0.065 18002
9071 1 15 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.520 -1.940 18002
9072 1 15 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.509 1.710 18002
9073 1 15 . 1 1 57 57 HIS H H 419 7.072 7.072 7.645 -0.573 18002
9074 1 15 . 1 1 58 58 GLN N N 420 123.083 123.083 123.535 -0.452 18002
9075 1 15 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.922 0.233 18002
9076 1 15 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.437 1.067 18002
9077 1 15 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.023 2.467 18002
9078 1 15 . 1 1 58 58 GLN H H 420 8.669 8.669 8.127 0.542 18002
9079 1 15 . 1 1 59 59 MET N N 421 122.330 122.330 118.875 3.455 18002
9080 1 15 . 1 1 59 59 MET HA H 421 4.621 4.621 4.708 -0.087 18002
9081 1 15 . 1 1 59 59 MET CA C 421 54.892 54.892 54.451 0.441 18002
9082 1 15 . 1 1 59 59 MET CB C 421 35.650 35.650 35.936 -0.286 18002
9083 1 15 . 1 1 59 59 MET H H 421 8.995 8.995 8.235 0.760 18002
9084 1 15 . 1 1 60 60 ASN N N 422 123.220 123.220 119.438 3.782 18002
9085 1 15 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.590 0.358 18002
9086 1 15 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.748 -0.117 18002
9087 1 15 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.659 1.080 18002
9088 1 15 . 1 1 60 60 ASN H H 422 8.728 8.728 8.533 0.195 18002
9089 1 15 . 1 1 61 61 LEU N N 423 126.072 126.072 122.066 4.006 18002
9090 1 15 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.106 0.010 18002
9091 1 15 . 1 1 61 61 LEU CA C 423 56.613 56.613 56.191 0.422 18002
9092 1 15 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.538 0.918 18002
9093 1 15 . 1 1 61 61 LEU H H 423 8.942 8.942 7.898 1.044 18002
9094 1 15 . 1 1 62 62 ARG N N 424 121.977 121.977 117.277 4.700 18002
9095 1 15 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.002 0.370 18002
9096 1 15 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.959 2.075 18002
9097 1 15 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.002 -0.392 18002
9098 1 15 . 1 1 62 62 ARG H H 424 8.000 8.000 7.880 0.120 18002
9099 1 15 . 1 1 63 63 GLY N N 425 114.852 114.852 111.047 3.805 18002
9100 1 15 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.163 0.647 18002
9101 1 15 . 1 1 63 63 GLY H H 425 9.033 9.033 8.884 0.149 18002
9102 1 15 . 1 1 64 64 CYS N N 426 117.102 117.102 118.804 -1.702 18002
9103 1 15 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.271 0.628 18002
9104 1 15 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.922 -0.162 18002
9105 1 15 . 1 1 64 64 CYS CB C 426 28.824 28.824 26.799 2.025 18002
9106 1 15 . 1 1 64 64 CYS H H 426 8.248 8.248 7.885 0.363 18002
9107 1 15 . 1 1 65 65 GLU N N 427 119.501 119.501 124.157 -4.656 18002
9108 1 15 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.317 0.460 18002
9109 1 15 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.885 -0.494 18002
9110 1 15 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.688 0.250 18002
9111 1 15 . 1 1 65 65 GLU H H 427 8.449 8.449 8.763 -0.314 18002
9112 1 15 . 1 1 66 66 VAL N N 428 125.286 125.286 121.183 4.103 18002
9113 1 15 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.517 0.373 18002
9114 1 15 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.011 -0.259 18002
9115 1 15 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.882 -0.907 18002
9116 1 15 . 1 1 66 66 VAL H H 428 8.624 8.624 8.428 0.196 18002
9117 1 15 . 1 1 67 67 THR N N 429 124.132 124.132 123.485 0.647 18002
9118 1 15 . 1 1 67 67 THR CA C 429 59.338 59.338 59.534 -0.196 18002
9119 1 15 . 1 1 67 67 THR CB C 429 72.021 72.021 69.322 2.699 18002
9120 1 15 . 1 1 67 67 THR H H 429 9.247 9.247 8.407 0.840 18002
9121 1 15 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.601 0.048 18002
9122 1 15 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.816 -0.078 18002
9123 1 15 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.053 1.515 18002
9124 1 15 . 1 1 69 69 ASP N N 431 122.066 122.066 124.308 -2.242 18002
9125 1 15 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.735 -0.088 18002
9126 1 15 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.701 -0.032 18002
9127 1 15 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.184 -0.078 18002
9128 1 15 . 1 1 69 69 ASP H H 431 8.250 8.250 8.456 -0.206 18002
9129 1 15 . 1 1 70 70 VAL N N 432 121.874 121.874 122.762 -0.888 18002
9130 1 15 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.533 -0.034 18002
9131 1 15 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.537 0.551 18002
9132 1 15 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.526 0.506 18002
9133 1 15 . 1 1 70 70 VAL H H 432 8.305 8.305 8.007 0.298 18002
9134 1 15 . 1 1 71 71 ASN N N 433 124.366 124.366 126.261 -1.895 18002
9135 1 15 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.920 -0.238 18002
9136 1 15 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.366 0.395 18002
9137 1 15 . 1 1 71 71 ASN CB C 433 40.279 40.279 40.975 -0.696 18002
9138 1 15 . 1 1 71 71 ASN H H 433 8.637 8.637 8.063 0.574 18002
9139 1 15 . 1 1 72 72 ILE N N 434 126.786 126.786 122.963 3.823 18002
9140 1 15 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.734 -0.363 18002
9141 1 15 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.343 1.175 18002
9142 1 15 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.977 -0.802 18002
9143 1 15 . 1 1 72 72 ILE H H 434 8.943 8.943 8.689 0.254 18002
9144 1 15 . 1 1 73 73 SER N N 435 118.305 118.305 116.551 1.754 18002
9145 1 15 . 1 1 73 73 SER CA C 435 61.633 61.633 61.029 0.604 18002
9146 1 15 . 1 1 73 73 SER CB C 435 62.435 62.435 63.019 -0.584 18002
9147 1 15 . 1 1 73 73 SER H H 435 8.578 8.578 8.503 0.075 18002
9148 1 15 . 1 1 74 74 GLY N N 436 107.443 107.443 104.535 2.908 18002
9149 1 15 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.578 0.283 18002
9150 1 15 . 1 1 74 74 GLY H H 436 7.620 7.620 7.795 -0.175 18002
9151 1 15 . 1 1 75 75 GLN N N 437 116.895 116.895 115.981 0.914 18002
9152 1 15 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.360 -0.070 18002
9153 1 15 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.283 0.418 18002
9154 1 15 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.480 1.265 18002
9155 1 15 . 1 1 75 75 GLN H H 437 7.798 7.798 7.646 0.152 18002
9156 1 15 . 1 1 76 76 LYS N N 438 119.308 119.308 119.392 -0.084 18002
9157 1 15 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.231 -0.089 18002
9158 1 15 . 1 1 76 76 LYS CA C 438 55.043 55.043 56.057 -1.014 18002
9159 1 15 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.840 2.106 18002
9160 1 15 . 1 1 76 76 LYS H H 438 7.522 7.522 7.437 0.085 18002
9161 1 15 . 1 1 77 77 PHE N N 439 125.905 125.905 124.576 1.329 18002
9162 1 15 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.054 0.157 18002
9163 1 15 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.483 -1.844 18002
9164 1 15 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.796 0.133 18002
9165 1 15 . 1 1 77 77 PHE H H 439 8.461 8.461 8.155 0.306 18002
9166 1 15 . 1 1 78 78 ASN N N 440 120.787 120.787 122.276 -1.489 18002
9167 1 15 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.263 -0.350 18002
9168 1 15 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.026 -0.223 18002
9169 1 15 . 1 1 78 78 ASN H H 440 7.638 7.638 8.353 -0.715 18002
9170 1 15 . 1 1 79 79 ILE N N 441 123.421 123.421 126.179 -2.758 18002
9171 1 15 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.579 -0.408 18002
9172 1 15 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.297 2.270 18002
9173 1 15 . 1 1 79 79 ILE CB C 441 41.487 41.487 40.769 0.718 18002
9174 1 15 . 1 1 79 79 ILE H H 441 9.550 9.550 8.633 0.917 18002
9175 1 15 . 1 1 80 80 LYS N N 442 126.267 126.267 129.392 -3.125 18002
9176 1 15 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.661 -0.199 18002
9177 1 15 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.463 0.920 18002
9178 1 15 . 1 1 80 80 LYS CB C 442 32.987 32.987 33.239 -0.252 18002
9179 1 15 . 1 1 80 80 LYS H H 442 8.703 8.703 8.119 0.584 18002
9180 1 15 . 1 1 81 81 LEU N N 443 125.194 125.194 126.631 -1.437 18002
9181 1 15 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.728 0.544 18002
9182 1 15 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.313 0.036 18002
9183 1 15 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.218 1.486 18002
9184 1 15 . 1 1 81 81 LEU H H 443 9.223 9.223 8.787 0.436 18002
9185 1 15 . 1 1 82 82 LEU N N 444 122.753 122.753 127.666 -4.913 18002
9186 1 15 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.425 -0.411 18002
9187 1 15 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.485 0.433 18002
9188 1 15 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.215 -2.591 18002
9189 1 15 . 1 1 82 82 LEU H H 444 8.420 8.420 8.309 0.111 18002
9190 1 15 . 1 1 83 83 ILE N N 445 125.584 125.584 120.438 5.146 18002
9191 1 15 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.097 0.188 18002
9192 1 15 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.839 -0.803 18002
9193 1 15 . 1 1 83 83 ILE H H 445 9.010 9.010 8.690 0.320 18002
9194 1 15 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.927 -0.008 18002
9195 1 15 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.373 1.660 18002
9196 1 15 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.863 0.084 18002
9197 1 15 . 1 1 85 85 VAL N N 447 119.780 119.780 118.471 1.309 18002
9198 1 15 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.529 -0.026 18002
9199 1 15 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.573 0.769 18002
9200 1 15 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.754 0.512 18002
9201 1 15 . 1 1 85 85 VAL H H 447 8.304 8.304 8.264 0.040 18002
9202 1 15 . 1 1 86 86 ALA N N 448 125.178 125.178 122.220 2.958 18002
9203 1 15 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.122 -0.147 18002
9204 1 15 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.802 0.759 18002
9205 1 15 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.245 -0.257 18002
9206 1 15 . 1 1 86 86 ALA H H 448 8.526 8.526 8.533 -0.007 18002
9207 1 15 . 1 1 87 87 GLU N N 449 114.625 114.625 117.461 -2.836 18002
9208 1 15 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.118 0.172 18002
9209 1 15 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.357 -0.626 18002
9210 1 15 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.764 -0.504 18002
9211 1 15 . 1 1 87 87 GLU H H 449 8.402 8.402 8.606 -0.204 18002
9212 1 15 . 1 1 88 88 GLY N N 450 109.432 109.432 106.356 3.076 18002
9213 1 15 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.807 1.030 18002
9214 1 15 . 1 1 88 88 GLY H H 450 7.711 7.711 7.538 0.173 18002
9215 1 15 . 1 1 89 89 MET N N 451 121.382 121.382 120.074 1.308 18002
9216 1 15 . 1 1 89 89 MET HA H 451 5.076 5.076 5.123 -0.047 18002
9217 1 15 . 1 1 89 89 MET CA C 451 53.860 53.860 54.280 -0.420 18002
9218 1 15 . 1 1 89 89 MET CB C 451 35.942 35.942 37.562 -1.621 18002
9219 1 15 . 1 1 89 89 MET H H 451 8.355 8.355 7.696 0.659 18002
9220 1 15 . 1 1 90 90 ASN N N 452 123.538 123.538 121.025 2.513 18002
9221 1 15 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.785 0.168 18002
9222 1 15 . 1 1 90 90 ASN CA C 452 51.748 51.748 51.660 0.088 18002
9223 1 15 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.041 2.601 18002
9224 1 15 . 1 1 90 90 ASN H H 452 9.338 9.338 9.004 0.334 18002
9225 1 15 . 1 1 91 91 GLU N N 453 125.978 125.978 124.679 1.299 18002
9226 1 15 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.203 1.141 18002
9227 1 15 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.727 -1.454 18002
9228 1 15 . 1 1 91 91 GLU CB C 453 31.743 31.743 29.796 1.947 18002
9229 1 15 . 1 1 91 91 GLU H H 453 8.168 8.168 7.959 0.209 18002
9230 1 15 . 1 1 92 92 ILE N N 454 126.776 126.776 125.876 0.900 18002
9231 1 15 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.811 0.755 18002
9232 1 15 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.775 0.273 18002
9233 1 15 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.901 0.360 18002
9234 1 15 . 1 1 92 92 ILE H H 454 9.000 9.000 7.874 1.126 18002
9235 1 15 . 1 1 93 93 TRP N N 455 125.987 125.987 121.692 4.295 18002
9236 1 15 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.078 -0.486 18002
9237 1 15 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.117 -1.327 18002
9238 1 15 . 1 1 93 93 TRP CB C 455 31.386 31.386 31.989 -0.603 18002
9239 1 15 . 1 1 93 93 TRP H H 455 9.278 9.278 7.582 1.696 18002
9240 1 15 . 1 1 94 94 LEU N N 456 120.912 120.912 117.756 3.156 18002
9241 1 15 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.646 0.716 18002
9242 1 15 . 1 1 94 94 LEU CA C 456 53.216 53.216 52.840 0.376 18002
9243 1 15 . 1 1 94 94 LEU CB C 456 43.594 43.594 44.828 -1.234 18002
9244 1 15 . 1 1 94 94 LEU H H 456 9.534 9.534 7.862 1.672 18002
9245 1 15 . 1 1 95 95 ARG N N 457 123.669 123.669 121.745 1.924 18002
9246 1 15 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.545 0.726 18002
9247 1 15 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.688 -0.271 18002
9248 1 15 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.087 1.175 18002
9249 1 15 . 1 1 95 95 ARG H H 457 9.439 9.439 9.026 0.413 18002
9250 1 15 . 1 1 96 96 CYS N N 458 125.273 125.273 120.859 4.414 18002
9251 1 15 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.855 -0.157 18002
9252 1 15 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.488 0.304 18002
9253 1 15 . 1 1 96 96 CYS CB C 458 30.403 30.403 29.358 1.045 18002
9254 1 15 . 1 1 96 96 CYS H H 458 8.652 8.652 8.589 0.063 18002
9255 1 15 . 1 1 97 97 ASP N N 459 119.661 119.661 121.170 -1.509 18002
9256 1 15 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.626 0.114 18002
9257 1 15 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.275 1.953 18002
9258 1 15 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.814 1.771 18002
9259 1 15 . 1 1 97 97 ASP H H 459 9.116 9.116 8.692 0.424 18002
9260 1 15 . 1 1 98 98 ASN N N 460 109.173 109.173 113.346 -4.173 18002
9261 1 15 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.211 0.161 18002
9262 1 15 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.254 -0.240 18002
9263 1 15 . 1 1 98 98 ASN CB C 460 40.811 40.811 38.984 1.827 18002
9264 1 15 . 1 1 98 98 ASN H H 460 7.054 7.054 7.013 0.041 18002
9265 1 15 . 1 1 99 99 GLU N N 461 119.220 119.220 118.763 0.457 18002
9266 1 15 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.524 0.520 18002
9267 1 15 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.749 0.019 18002
9268 1 15 . 1 1 99 99 GLU H H 461 8.937 8.937 8.987 -0.050 18002
9269 1 15 . 1 1 100 100 LYS N N 462 120.647 120.647 119.815 0.832 18002
9270 1 15 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.981 0.664 18002
9271 1 15 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.965 0.571 18002
9272 1 15 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.439 0.789 18002
9273 1 15 . 1 1 100 100 LYS H H 462 8.033 8.033 8.321 -0.288 18002
9274 1 15 . 1 1 101 101 GLN N N 463 121.938 121.938 119.191 2.747 18002
9275 1 15 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.233 0.167 18002
9276 1 15 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.106 0.289 18002
9277 1 15 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.527 3.687 18002
9278 1 15 . 1 1 101 101 GLN H H 463 8.372 8.372 7.893 0.479 18002
9279 1 15 . 1 1 102 102 TYR N N 464 117.422 117.422 120.194 -2.772 18002
9280 1 15 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.127 0.489 18002
9281 1 15 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.195 0.482 18002
9282 1 15 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.222 0.637 18002
9283 1 15 . 1 1 102 102 TYR H H 464 8.221 8.221 7.725 0.496 18002
9284 1 15 . 1 1 103 103 ALA N N 465 120.655 120.655 118.937 1.718 18002
9285 1 15 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.973 -0.258 18002
9286 1 15 . 1 1 103 103 ALA CA C 465 55.913 55.913 55.052 0.861 18002
9287 1 15 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.210 0.592 18002
9288 1 15 . 1 1 103 103 ALA H H 465 8.637 8.637 8.247 0.390 18002
9289 1 15 . 1 1 104 104 HIS N N 466 112.871 112.871 117.970 -5.099 18002
9290 1 15 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.556 -0.415 18002
9291 1 15 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.180 1.447 18002
9292 1 15 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.220 -1.362 18002
9293 1 15 . 1 1 104 104 HIS H H 466 7.852 7.852 7.697 0.155 18002
9294 1 15 . 1 1 105 105 TRP N N 467 121.317 121.317 119.684 1.633 18002
9295 1 15 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.519 -0.824 18002
9296 1 15 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.388 1.954 18002
9297 1 15 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.629 -2.124 18002
9298 1 15 . 1 1 105 105 TRP H H 467 8.668 8.668 8.177 0.491 18002
9299 1 15 . 1 1 106 106 MET N N 468 122.346 122.346 119.847 2.499 18002
9300 1 15 . 1 1 106 106 MET HA H 468 4.086 4.086 3.983 0.103 18002
9301 1 15 . 1 1 106 106 MET CA C 468 58.743 58.743 58.302 0.441 18002
9302 1 15 . 1 1 106 106 MET CB C 468 31.402 31.402 31.481 -0.079 18002
9303 1 15 . 1 1 106 106 MET H H 468 9.790 9.790 8.279 1.511 18002
9304 1 15 . 1 1 107 107 ALA N N 469 119.758 119.758 120.131 -0.373 18002
9305 1 15 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.223 -0.518 18002
9306 1 15 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.080 2.049 18002
9307 1 15 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.360 2.045 18002
9308 1 15 . 1 1 107 107 ALA H H 469 7.702 7.702 7.612 0.090 18002
9309 1 15 . 1 1 108 108 ALA N N 470 119.233 119.233 122.846 -3.613 18002
9310 1 15 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.850 -0.304 18002
9311 1 15 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.483 0.338 18002
9312 1 15 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.224 -1.492 18002
9313 1 15 . 1 1 108 108 ALA H H 470 7.156 7.156 7.730 -0.574 18002
9314 1 15 . 1 1 109 109 CYS N N 471 116.736 116.736 115.508 1.228 18002
9315 1 15 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.234 -0.177 18002
9316 1 15 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.209 3.362 18002
9317 1 15 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.746 0.647 18002
9318 1 15 . 1 1 109 109 CYS H H 471 8.256 8.256 8.593 -0.337 18002
9319 1 15 . 1 1 110 110 ARG N N 472 118.644 118.644 121.557 -2.913 18002
9320 1 15 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.051 -0.317 18002
9321 1 15 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.253 0.951 18002
9322 1 15 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.338 -0.021 18002
9323 1 15 . 1 1 110 110 ARG H H 472 8.403 8.403 7.284 1.119 18002
9324 1 15 . 1 1 111 111 LEU N N 473 121.877 121.877 118.685 3.192 18002
9325 1 15 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.133 -0.333 18002
9326 1 15 . 1 1 111 111 LEU CA C 473 59.855 59.855 58.184 1.671 18002
9327 1 15 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.909 -0.489 18002
9328 1 15 . 1 1 111 111 LEU H H 473 7.916 7.916 7.762 0.154 18002
9329 1 15 . 1 1 112 112 ALA N N 474 122.765 122.765 121.193 1.572 18002
9330 1 15 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.751 0.729 18002
9331 1 15 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.690 0.571 18002
9332 1 15 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.908 1.967 18002
9333 1 15 . 1 1 112 112 ALA H H 474 8.393 8.393 8.850 -0.457 18002
9334 1 15 . 1 1 113 113 SER N N 475 113.613 113.613 111.183 2.430 18002
9335 1 15 . 1 1 113 113 SER HA H 475 4.782 4.782 4.394 0.388 18002
9336 1 15 . 1 1 113 113 SER CA C 475 61.090 61.090 59.543 1.547 18002
9337 1 15 . 1 1 113 113 SER CB C 475 63.612 63.612 63.545 0.067 18002
9338 1 15 . 1 1 113 113 SER H H 475 8.150 8.150 7.643 0.507 18002
9339 1 15 . 1 1 114 114 LYS N N 476 118.734 118.734 118.543 0.191 18002
9340 1 15 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.195 0.358 18002
9341 1 15 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.834 -1.690 18002
9342 1 15 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.140 0.451 18002
9343 1 15 . 1 1 114 114 LYS H H 476 7.239 7.239 8.146 -0.907 18002
9344 1 15 . 1 1 115 115 GLY N N 477 107.818 107.818 106.194 1.624 18002
9345 1 15 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.041 0.945 18002
9346 1 15 . 1 1 115 115 GLY H H 477 8.401 8.401 7.763 0.638 18002
9347 1 15 . 1 1 116 116 LYS N N 478 120.938 120.938 121.586 -0.648 18002
9348 1 15 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.516 0.057 18002
9349 1 15 . 1 1 116 116 LYS CA C 478 54.847 54.847 53.908 0.939 18002
9350 1 15 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.058 0.263 18002
9351 1 15 . 1 1 116 116 LYS H H 478 8.142 8.142 7.692 0.450 18002
9352 1 15 . 1 1 117 117 THR N N 479 108.076 108.076 118.010 -9.934 18002
9353 1 15 . 1 1 117 117 THR HA H 479 4.671 4.671 3.936 0.735 18002
9354 1 15 . 1 1 117 117 THR CA C 479 59.191 59.191 63.135 -3.944 18002
9355 1 15 . 1 1 117 117 THR CB C 479 72.228 72.228 68.993 3.236 18002
9356 1 15 . 1 1 117 117 THR H H 479 7.926 7.926 8.201 -0.275 18002
9357 1 15 . 1 1 118 118 MET N N 480 116.403 116.403 126.817 -10.414 18002
9358 1 15 . 1 1 118 118 MET HA H 480 3.352 3.352 4.555 -1.203 18002
9359 1 15 . 1 1 118 118 MET CA C 480 57.947 57.947 53.617 4.330 18002
9360 1 15 . 1 1 118 118 MET CB C 480 33.920 33.920 33.265 0.655 18002
9361 1 15 . 1 1 118 118 MET H H 480 8.899 8.899 8.409 0.490 18002
9362 1 15 . 1 1 119 119 ALA N N 481 117.786 117.786 124.645 -6.859 18002
9363 1 15 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.025 0.059 18002
9364 1 15 . 1 1 119 119 ALA CA C 481 52.595 52.595 52.896 -0.301 18002
9365 1 15 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.662 0.400 18002
9366 1 15 . 1 1 119 119 ALA H H 481 7.645 7.645 8.288 -0.643 18002
9367 1 15 . 1 1 120 120 ASP N N 482 120.348 120.348 118.618 1.730 18002
9368 1 15 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.400 3.216 18002
9369 1 15 . 1 1 120 120 ASP H H 482 7.887 7.887 7.299 0.588 18002
9370 1 15 . 1 1 121 121 SER HA H 483 4.223 4.223 4.130 0.093 18002
9371 1 15 . 1 1 121 121 SER CA C 483 61.455 61.455 62.279 -0.824 18002
9372 1 15 . 1 1 121 121 SER CB C 483 62.996 62.996 62.743 0.253 18002
9373 1 15 . 1 1 122 122 SER N N 484 116.845 116.845 117.497 -0.652 18002
9374 1 15 . 1 1 122 122 SER HA H 484 4.321 4.321 4.147 0.174 18002
9375 1 15 . 1 1 122 122 SER CA C 484 60.584 60.584 61.207 -0.623 18002
9376 1 15 . 1 1 122 122 SER CB C 484 64.314 64.314 62.603 1.711 18002
9377 1 15 . 1 1 122 122 SER H H 484 8.875 8.875 8.107 0.768 18002
9378 1 15 . 1 1 123 123 TYR N N 485 124.153 124.153 122.420 1.733 18002
9379 1 15 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.338 -0.458 18002
9380 1 15 . 1 1 123 123 TYR CA C 485 63.314 63.314 61.041 2.273 18002
9381 1 15 . 1 1 123 123 TYR CB C 485 37.741 37.741 38.302 -0.561 18002
9382 1 15 . 1 1 123 123 TYR H H 485 8.018 8.018 7.519 0.499 18002
9383 1 15 . 1 1 124 124 ASN N N 486 115.339 115.339 118.110 -2.771 18002
9384 1 15 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.955 -0.014 18002
9385 1 15 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.858 0.848 18002
9386 1 15 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.624 0.432 18002
9387 1 15 . 1 1 124 124 ASN H H 486 8.665 8.665 7.626 1.039 18002
9388 1 15 . 1 1 125 125 LEU N N 487 119.454 119.454 118.625 0.829 18002
9389 1 15 . 1 1 125 125 LEU HA H 487 3.938 3.938 3.970 -0.032 18002
9390 1 15 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.986 -0.316 18002
9391 1 15 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.592 -0.024 18002
9392 1 15 . 1 1 125 125 LEU H H 487 7.105 7.105 7.868 -0.763 18002
9393 1 15 . 1 1 126 126 GLU N N 488 121.189 121.189 116.902 4.287 18002
9394 1 15 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.930 0.100 18002
9395 1 15 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.038 -0.002 18002
9396 1 15 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.640 -0.555 18002
9397 1 15 . 1 1 126 126 GLU H H 488 8.053 8.053 7.301 0.752 18002
9398 1 15 . 1 1 127 127 VAL N N 489 119.073 119.073 120.142 -1.069 18002
9399 1 15 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.649 -0.631 18002
9400 1 15 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.034 2.288 18002
9401 1 15 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.683 -0.024 18002
9402 1 15 . 1 1 127 127 VAL H H 489 7.769 7.769 7.198 0.571 18002
9403 1 15 . 1 1 128 128 GLN N N 490 116.214 116.214 117.443 -1.229 18002
9404 1 15 . 1 1 128 128 GLN HA H 490 3.832 3.832 3.945 -0.113 18002
9405 1 15 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.606 0.150 18002
9406 1 15 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.666 0.446 18002
9407 1 15 . 1 1 128 128 GLN H H 490 7.542 7.542 7.840 -0.298 18002
9408 1 15 . 1 1 129 129 ASN N N 491 120.003 120.003 118.896 1.107 18002
9409 1 15 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.548 -0.129 18002
9410 1 15 . 1 1 129 129 ASN CA C 491 56.160 56.160 56.179 -0.019 18002
9411 1 15 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.373 -0.313 18002
9412 1 15 . 1 1 129 129 ASN H H 491 8.582 8.582 7.261 1.321 18002
9413 1 15 . 1 1 130 130 ILE N N 492 122.365 122.365 120.675 1.690 18002
9414 1 15 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.593 2.160 18002
9415 1 15 . 1 1 130 130 ILE CB C 492 38.146 38.146 36.888 1.258 18002
9416 1 15 . 1 1 130 130 ILE H H 492 8.186 8.186 7.347 0.839 18002
9417 1 15 . 1 1 131 131 LEU N N 493 119.597 119.597 119.386 0.211 18002
9418 1 15 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.087 -0.082 18002
9419 1 15 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.030 0.829 18002
9420 1 15 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.761 -0.225 18002
9421 1 15 . 1 1 131 131 LEU H H 493 8.224 8.224 7.954 0.270 18002
9422 1 15 . 1 1 132 132 SER N N 494 114.884 114.884 115.112 -0.228 18002
9423 1 15 . 1 1 132 132 SER HA H 494 4.430 4.430 4.298 0.132 18002
9424 1 15 . 1 1 132 132 SER CA C 494 62.072 62.072 61.227 0.845 18002
9425 1 15 . 1 1 132 132 SER CB C 494 62.703 62.703 63.327 -0.624 18002
9426 1 15 . 1 1 132 132 SER H H 494 8.464 8.464 7.330 1.134 18002
9427 1 15 . 1 1 133 133 PHE N N 495 123.047 123.047 121.129 1.918 18002
9428 1 15 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.252 0.125 18002
9429 1 15 . 1 1 133 133 PHE CA C 495 60.913 60.913 60.691 0.222 18002
9430 1 15 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.916 0.133 18002
9431 1 15 . 1 1 133 133 PHE H H 495 7.915 7.915 8.810 -0.895 18002
9432 1 15 . 1 1 134 134 LEU N N 496 119.311 119.311 117.116 2.195 18002
9433 1 15 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.188 -0.283 18002
9434 1 15 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.011 -0.410 18002
9435 1 15 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.333 0.569 18002
9436 1 15 . 1 1 134 134 LEU H H 496 8.386 8.386 7.992 0.394 18002
9437 1 15 . 1 1 135 135 LYS N N 497 117.550 117.550 118.976 -1.426 18002
9438 1 15 . 1 1 135 135 LYS HA H 497 3.940 3.940 3.650 0.290 18002
9439 1 15 . 1 1 135 135 LYS CA C 497 58.275 58.275 57.886 0.389 18002
9440 1 15 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.106 0.388 18002
9441 1 15 . 1 1 135 135 LYS H H 497 7.670 7.670 7.497 0.173 18002
9442 1 15 . 1 1 136 136 MET N N 498 116.106 116.106 116.782 -0.676 18002
9443 1 15 . 1 1 136 136 MET HA H 498 4.354 4.354 4.254 0.100 18002
9444 1 15 . 1 1 136 136 MET CA C 498 55.994 55.994 57.811 -1.817 18002
9445 1 15 . 1 1 136 136 MET CB C 498 32.772 32.772 32.994 -0.222 18002
9446 1 15 . 1 1 136 136 MET H H 498 7.421 7.421 7.319 0.102 18002
9447 1 15 . 1 1 137 137 GLN N N 499 118.651 118.651 114.580 4.071 18002
9448 1 15 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.393 -0.209 18002
9449 1 15 . 1 1 137 137 GLN CA C 499 55.308 55.308 55.346 -0.038 18002
9450 1 15 . 1 1 137 137 GLN H H 499 7.617 7.617 7.598 0.019 18002
9451 1 16 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.258 -0.133 18002
9452 1 16 . 1 1 3 3 HIS CA C 365 55.015 55.015 58.621 -3.606 18002
9453 1 16 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.305 2.624 18002
9454 1 16 . 1 1 4 4 MET N N 366 120.431 120.431 117.559 2.872 18002
9455 1 16 . 1 1 4 4 MET HA H 366 4.345 4.345 4.503 -0.158 18002
9456 1 16 . 1 1 4 4 MET CA C 366 55.337 55.337 55.761 -0.424 18002
9457 1 16 . 1 1 4 4 MET CB C 366 32.668 32.668 34.643 -1.975 18002
9458 1 16 . 1 1 4 4 MET H H 366 8.373 8.373 8.520 -0.147 18002
9459 1 16 . 1 1 5 5 GLY N N 367 109.318 109.318 107.049 2.269 18002
9460 1 16 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.241 0.216 18002
9461 1 16 . 1 1 5 5 GLY H H 367 8.224 8.224 8.319 -0.095 18002
9462 1 16 . 1 1 6 6 ASP N N 368 120.307 120.307 118.704 1.603 18002
9463 1 16 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.744 -0.144 18002
9464 1 16 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.363 1.150 18002
9465 1 16 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.471 -0.145 18002
9466 1 16 . 1 1 6 6 ASP H H 368 8.199 8.199 7.947 0.252 18002
9467 1 16 . 1 1 7 7 ILE N N 369 120.668 120.668 119.554 1.114 18002
9468 1 16 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.198 0.020 18002
9469 1 16 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.930 -1.346 18002
9470 1 16 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.787 -0.019 18002
9471 1 16 . 1 1 7 7 ILE H H 369 8.138 8.138 8.711 -0.573 18002
9472 1 16 . 1 1 8 8 THR N N 370 117.564 117.564 112.500 5.064 18002
9473 1 16 . 1 1 8 8 THR HA H 370 4.322 4.322 4.355 -0.033 18002
9474 1 16 . 1 1 8 8 THR CA C 370 62.332 62.332 61.922 0.410 18002
9475 1 16 . 1 1 8 8 THR CB C 370 69.946 69.946 68.704 1.242 18002
9476 1 16 . 1 1 8 8 THR H H 370 8.230 8.230 8.177 0.053 18002
9477 1 16 . 1 1 9 9 SER N N 371 118.467 118.467 116.846 1.621 18002
9478 1 16 . 1 1 9 9 SER HA H 371 4.445 4.445 4.307 0.138 18002
9479 1 16 . 1 1 9 9 SER CA C 371 58.274 58.274 58.661 -0.387 18002
9480 1 16 . 1 1 9 9 SER CB C 371 63.996 63.996 62.905 1.091 18002
9481 1 16 . 1 1 9 9 SER H H 371 8.158 8.158 7.917 0.241 18002
9482 1 16 . 1 1 10 10 ILE N N 372 123.959 123.959 120.966 2.993 18002
9483 1 16 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.732 -5.016 18002
9484 1 16 . 1 1 10 10 ILE CB C 372 38.919 38.919 35.217 3.702 18002
9485 1 16 . 1 1 10 10 ILE H H 372 8.112 8.112 8.172 -0.060 18002
9486 1 16 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.535 -0.183 18002
9487 1 16 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.425 1.756 18002
9488 1 16 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.298 1.409 18002
9489 1 16 . 1 1 12 12 GLU N N 374 119.349 119.349 119.387 -0.038 18002
9490 1 16 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.323 0.464 18002
9491 1 16 . 1 1 12 12 GLU CA C 374 55.317 55.317 56.716 -1.399 18002
9492 1 16 . 1 1 12 12 GLU CB C 374 33.591 33.591 29.788 3.803 18002
9493 1 16 . 1 1 12 12 GLU H H 374 8.017 8.017 7.833 0.184 18002
9494 1 16 . 1 1 13 13 LEU N N 375 122.288 122.288 125.196 -2.908 18002
9495 1 16 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.693 -0.215 18002
9496 1 16 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.007 -1.077 18002
9497 1 16 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.788 0.868 18002
9498 1 16 . 1 1 13 13 LEU H H 375 8.036 8.036 8.330 -0.294 18002
9499 1 16 . 1 1 14 14 ALA N N 376 125.461 125.461 128.155 -2.694 18002
9500 1 16 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.579 0.667 18002
9501 1 16 . 1 1 14 14 ALA CA C 376 51.745 51.745 52.164 -0.419 18002
9502 1 16 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.180 -0.594 18002
9503 1 16 . 1 1 14 14 ALA H H 376 8.181 8.181 8.272 -0.091 18002
9504 1 16 . 1 1 15 15 ASP N N 377 122.242 122.242 120.158 2.084 18002
9505 1 16 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.978 -0.659 18002
9506 1 16 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.255 0.497 18002
9507 1 16 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.637 2.002 18002
9508 1 16 . 1 1 15 15 ASP H H 377 8.326 8.326 8.610 -0.284 18002
9509 1 16 . 1 1 16 16 TYR N N 378 118.961 118.961 118.550 0.411 18002
9510 1 16 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.091 0.300 18002
9511 1 16 . 1 1 16 16 TYR CA C 378 59.581 59.581 55.604 3.977 18002
9512 1 16 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.276 -0.253 18002
9513 1 16 . 1 1 16 16 TYR H H 378 8.869 8.869 7.666 1.203 18002
9514 1 16 . 1 1 17 17 ILE N N 379 125.214 125.214 120.601 4.613 18002
9515 1 16 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.549 -0.219 18002
9516 1 16 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.724 0.008 18002
9517 1 16 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.924 -0.948 18002
9518 1 16 . 1 1 17 17 ILE H H 379 8.608 8.608 7.789 0.819 18002
9519 1 16 . 1 1 18 18 LYS N N 380 122.917 122.917 123.278 -0.361 18002
9520 1 16 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.655 0.457 18002
9521 1 16 . 1 1 18 18 LYS CA C 380 55.836 55.836 55.387 0.449 18002
9522 1 16 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.818 1.207 18002
9523 1 16 . 1 1 18 18 LYS H H 380 7.424 7.424 8.304 -0.880 18002
9524 1 16 . 1 1 19 19 VAL N N 381 122.839 122.839 123.039 -0.200 18002
9525 1 16 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.808 0.455 18002
9526 1 16 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.571 1.945 18002
9527 1 16 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.157 -0.009 18002
9528 1 16 . 1 1 19 19 VAL H H 381 9.223 9.223 7.805 1.418 18002
9529 1 16 . 1 1 20 20 PHE N N 382 129.509 129.509 126.940 2.569 18002
9530 1 16 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.196 -0.353 18002
9531 1 16 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.091 -0.586 18002
9532 1 16 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.588 2.274 18002
9533 1 16 . 1 1 20 20 PHE H H 382 9.451 9.451 8.015 1.436 18002
9534 1 16 . 1 1 21 21 LYS N N 383 126.417 126.417 126.329 0.088 18002
9535 1 16 . 1 1 21 21 LYS CA C 383 52.841 52.841 53.937 -1.095 18002
9536 1 16 . 1 1 21 21 LYS CB C 383 33.219 33.219 31.073 2.147 18002
9537 1 16 . 1 1 21 21 LYS H H 383 7.582 7.582 8.091 -0.509 18002
9538 1 16 . 1 1 22 22 PRO CA C 384 63.697 63.697 64.006 -0.309 18002
9539 1 16 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.128 -0.159 18002
9540 1 16 . 1 1 23 23 LYS N N 385 118.026 118.026 115.017 3.009 18002
9541 1 16 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.376 -0.161 18002
9542 1 16 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.322 0.024 18002
9543 1 16 . 1 1 23 23 LYS CB C 385 33.033 33.033 34.103 -1.070 18002
9544 1 16 . 1 1 23 23 LYS H H 385 8.138 8.138 7.928 0.210 18002
9545 1 16 . 1 1 24 24 LYS N N 386 120.816 120.816 123.902 -3.086 18002
9546 1 16 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.603 -0.417 18002
9547 1 16 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.072 -0.210 18002
9548 1 16 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.902 -0.075 18002
9549 1 16 . 1 1 24 24 LYS H H 386 7.727 7.727 8.512 -0.785 18002
9550 1 16 . 1 1 25 25 LEU N N 387 121.214 121.214 120.893 0.321 18002
9551 1 16 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.573 -0.405 18002
9552 1 16 . 1 1 25 25 LEU CA C 387 56.508 56.508 54.395 2.113 18002
9553 1 16 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.418 -0.776 18002
9554 1 16 . 1 1 25 25 LEU H H 387 8.241 8.241 7.859 0.382 18002
9555 1 16 . 1 1 26 26 THR N N 388 112.798 112.798 114.169 -1.371 18002
9556 1 16 . 1 1 26 26 THR HA H 388 4.313 4.313 4.141 0.172 18002
9557 1 16 . 1 1 26 26 THR CA C 388 61.795 61.795 63.334 -1.538 18002
9558 1 16 . 1 1 26 26 THR CB C 388 69.875 69.875 69.127 0.748 18002
9559 1 16 . 1 1 26 26 THR H H 388 7.700 7.700 7.800 -0.100 18002
9560 1 16 . 1 1 27 27 LEU N N 389 124.091 124.091 123.301 0.790 18002
9561 1 16 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.718 -0.364 18002
9562 1 16 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.275 0.258 18002
9563 1 16 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.461 -0.163 18002
9564 1 16 . 1 1 27 27 LEU H H 389 8.260 8.260 8.055 0.205 18002
9565 1 16 . 1 1 28 28 LYS N N 390 121.153 121.153 119.421 1.732 18002
9566 1 16 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.513 -0.193 18002
9567 1 16 . 1 1 28 28 LYS CA C 390 56.211 56.211 55.896 0.315 18002
9568 1 16 . 1 1 28 28 LYS CB C 390 33.675 33.675 31.941 1.734 18002
9569 1 16 . 1 1 28 28 LYS H H 390 8.202 8.202 7.679 0.523 18002
9570 1 16 . 1 1 29 29 GLY N N 391 107.270 107.270 110.206 -2.936 18002
9571 1 16 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.281 -0.406 18002
9572 1 16 . 1 1 29 29 GLY H H 391 7.876 7.876 8.473 -0.597 18002
9573 1 16 . 1 1 30 30 TYR N N 392 118.471 118.471 126.969 -8.498 18002
9574 1 16 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.473 -0.027 18002
9575 1 16 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.802 -0.755 18002
9576 1 16 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.471 2.354 18002
9577 1 16 . 1 1 30 30 TYR H H 392 8.183 8.183 7.878 0.305 18002
9578 1 16 . 1 1 31 31 LYS N N 393 122.833 122.833 122.550 0.283 18002
9579 1 16 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.696 -0.181 18002
9580 1 16 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.330 0.844 18002
9581 1 16 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.576 1.144 18002
9582 1 16 . 1 1 31 31 LYS H H 393 8.731 8.731 7.759 0.972 18002
9583 1 16 . 1 1 32 32 GLN N N 394 124.759 124.759 118.791 5.968 18002
9584 1 16 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.561 0.117 18002
9585 1 16 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.820 1.787 18002
9586 1 16 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.215 0.833 18002
9587 1 16 . 1 1 32 32 GLN H H 394 8.776 8.776 8.289 0.487 18002
9588 1 16 . 1 1 33 33 TYR N N 395 125.112 125.112 124.349 0.763 18002
9589 1 16 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.271 0.803 18002
9590 1 16 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.309 -0.145 18002
9591 1 16 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.104 2.568 18002
9592 1 16 . 1 1 33 33 TYR H H 395 8.774 8.774 7.943 0.831 18002
9593 1 16 . 1 1 34 34 TRP N N 396 122.638 122.638 122.782 -0.144 18002
9594 1 16 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.496 -0.814 18002
9595 1 16 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.981 3.237 18002
9596 1 16 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.650 0.854 18002
9597 1 16 . 1 1 34 34 TRP H H 396 8.975 8.975 8.058 0.917 18002
9598 1 16 . 1 1 35 35 CYS N N 397 127.146 127.146 124.894 2.252 18002
9599 1 16 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.837 -0.470 18002
9600 1 16 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.844 1.862 18002
9601 1 16 . 1 1 35 35 CYS H H 397 8.804 8.804 9.244 -0.440 18002
9602 1 16 . 1 1 36 36 THR N N 398 110.578 110.578 116.032 -5.454 18002
9603 1 16 . 1 1 36 36 THR HA H 398 5.358 5.358 4.778 0.580 18002
9604 1 16 . 1 1 36 36 THR CA C 398 58.704 58.704 61.494 -2.790 18002
9605 1 16 . 1 1 36 36 THR CB C 398 71.833 71.833 70.900 0.933 18002
9606 1 16 . 1 1 36 36 THR H H 398 9.090 9.090 8.222 0.868 18002
9607 1 16 . 1 1 37 37 PHE N N 399 127.322 127.322 129.097 -1.775 18002
9608 1 16 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.634 0.319 18002
9609 1 16 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.728 -1.482 18002
9610 1 16 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.702 2.483 18002
9611 1 16 . 1 1 37 37 PHE H H 399 8.846 8.846 8.326 0.520 18002
9612 1 16 . 1 1 38 38 LYS N N 400 125.391 125.391 127.204 -1.813 18002
9613 1 16 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.414 0.113 18002
9614 1 16 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.721 0.256 18002
9615 1 16 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.408 2.507 18002
9616 1 16 . 1 1 38 38 LYS H H 400 8.252 8.252 8.024 0.228 18002
9617 1 16 . 1 1 39 39 ASP N N 401 125.083 125.083 116.775 8.308 18002
9618 1 16 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.370 -0.292 18002
9619 1 16 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.515 -0.032 18002
9620 1 16 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.906 -1.385 18002
9621 1 16 . 1 1 39 39 ASP H H 401 9.408 9.408 8.823 0.585 18002
9622 1 16 . 1 1 40 40 THR N N 402 112.024 112.024 102.769 9.255 18002
9623 1 16 . 1 1 40 40 THR HA H 402 4.767 4.767 4.526 0.241 18002
9624 1 16 . 1 1 40 40 THR CA C 402 60.811 60.811 61.748 -0.937 18002
9625 1 16 . 1 1 40 40 THR CB C 402 68.823 68.823 70.094 -1.271 18002
9626 1 16 . 1 1 40 40 THR H H 402 8.224 8.224 8.078 0.146 18002
9627 1 16 . 1 1 41 41 SER N N 403 116.142 116.142 115.845 0.297 18002
9628 1 16 . 1 1 41 41 SER HA H 403 5.428 5.428 4.759 0.669 18002
9629 1 16 . 1 1 41 41 SER CA C 403 58.297 58.297 57.475 0.822 18002
9630 1 16 . 1 1 41 41 SER CB C 403 66.409 66.409 65.416 0.993 18002
9631 1 16 . 1 1 41 41 SER H H 403 8.197 8.197 7.586 0.611 18002
9632 1 16 . 1 1 42 42 ILE N N 404 122.292 122.292 119.499 2.793 18002
9633 1 16 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.769 0.160 18002
9634 1 16 . 1 1 42 42 ILE CA C 404 59.804 59.804 57.698 2.106 18002
9635 1 16 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.598 0.822 18002
9636 1 16 . 1 1 42 42 ILE H H 404 8.411 8.411 7.747 0.664 18002
9637 1 16 . 1 1 43 43 SER N N 405 122.244 122.244 115.374 6.870 18002
9638 1 16 . 1 1 43 43 SER HA H 405 4.966 4.966 4.730 0.236 18002
9639 1 16 . 1 1 43 43 SER CA C 405 57.735 57.735 56.961 0.774 18002
9640 1 16 . 1 1 43 43 SER CB C 405 65.388 65.388 65.597 -0.209 18002
9641 1 16 . 1 1 43 43 SER H H 405 8.752 8.752 8.233 0.519 18002
9642 1 16 . 1 1 44 44 CYS N N 406 120.004 120.004 121.895 -1.891 18002
9643 1 16 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.782 0.185 18002
9644 1 16 . 1 1 44 44 CYS CA C 406 57.058 57.058 58.313 -1.255 18002
9645 1 16 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.390 0.050 18002
9646 1 16 . 1 1 44 44 CYS H H 406 8.470 8.470 8.221 0.249 18002
9647 1 16 . 1 1 45 45 TYR N N 407 122.704 122.704 126.306 -3.602 18002
9648 1 16 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.884 0.139 18002
9649 1 16 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.039 -0.056 18002
9650 1 16 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.786 0.788 18002
9651 1 16 . 1 1 45 45 TYR H H 407 10.013 10.013 8.772 1.241 18002
9652 1 16 . 1 1 46 46 LYS N N 408 121.897 121.897 122.195 -0.298 18002
9653 1 16 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.139 0.207 18002
9654 1 16 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.236 3.784 18002
9655 1 16 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.245 -0.533 18002
9656 1 16 . 1 1 46 46 LYS H H 408 9.734 9.734 8.880 0.854 18002
9657 1 16 . 1 1 47 47 SER N N 409 106.720 106.720 112.265 -5.545 18002
9658 1 16 . 1 1 47 47 SER HA H 409 4.776 4.776 4.860 -0.084 18002
9659 1 16 . 1 1 47 47 SER CA C 409 57.180 57.180 57.506 -0.326 18002
9660 1 16 . 1 1 47 47 SER CB C 409 65.870 65.870 65.841 0.029 18002
9661 1 16 . 1 1 47 47 SER H H 409 7.518 7.518 7.854 -0.336 18002
9662 1 16 . 1 1 48 48 LYS N N 410 122.302 122.302 122.348 -0.046 18002
9663 1 16 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.202 1.032 18002
9664 1 16 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.956 0.343 18002
9665 1 16 . 1 1 48 48 LYS H H 410 8.195 8.195 9.059 -0.864 18002
9666 1 16 . 1 1 49 49 GLU N N 411 118.983 118.983 118.581 0.402 18002
9667 1 16 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.192 0.590 18002
9668 1 16 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.413 1.122 18002
9669 1 16 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.560 -0.872 18002
9670 1 16 . 1 1 49 49 GLU H H 411 8.752 8.752 8.434 0.318 18002
9671 1 16 . 1 1 50 50 GLU N N 412 118.384 118.384 117.530 0.854 18002
9672 1 16 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.492 0.002 18002
9673 1 16 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.833 -1.044 18002
9674 1 16 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.945 0.060 18002
9675 1 16 . 1 1 50 50 GLU H H 412 7.234 7.234 7.598 -0.364 18002
9676 1 16 . 1 1 51 51 SER N N 413 114.767 114.767 116.009 -1.242 18002
9677 1 16 . 1 1 51 51 SER CA C 413 59.764 59.764 60.696 -0.932 18002
9678 1 16 . 1 1 51 51 SER CB C 413 62.965 62.965 62.469 0.496 18002
9679 1 16 . 1 1 51 51 SER H H 413 7.382 7.382 8.003 -0.621 18002
9680 1 16 . 1 1 52 52 SER N N 414 114.496 114.496 113.669 0.827 18002
9681 1 16 . 1 1 52 52 SER HA H 414 4.560 4.560 4.621 -0.061 18002
9682 1 16 . 1 1 52 52 SER CA C 414 58.574 58.574 58.199 0.375 18002
9683 1 16 . 1 1 52 52 SER CB C 414 63.829 63.829 64.448 -0.619 18002
9684 1 16 . 1 1 52 52 SER H H 414 7.682 7.682 7.748 -0.066 18002
9685 1 16 . 1 1 53 53 GLY N N 415 111.107 111.107 111.018 0.089 18002
9686 1 16 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.300 -1.067 18002
9687 1 16 . 1 1 53 53 GLY H H 415 7.918 7.918 8.410 -0.492 18002
9688 1 16 . 1 1 54 54 THR N N 416 120.214 120.214 117.608 2.606 18002
9689 1 16 . 1 1 54 54 THR CB C 416 70.035 70.035 70.515 -0.480 18002
9690 1 16 . 1 1 54 54 THR H H 416 8.622 8.622 8.182 0.440 18002
9691 1 16 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.431 0.044 18002
9692 1 16 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.358 0.688 18002
9693 1 16 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.275 -0.697 18002
9694 1 16 . 1 1 56 56 ALA N N 418 125.591 125.591 123.300 2.291 18002
9695 1 16 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.091 -0.135 18002
9696 1 16 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.793 0.742 18002
9697 1 16 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.513 -0.606 18002
9698 1 16 . 1 1 56 56 ALA H H 418 8.288 8.288 8.062 0.226 18002
9699 1 16 . 1 1 57 57 HIS N N 419 108.119 108.119 117.194 -9.075 18002
9700 1 16 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.777 -0.155 18002
9701 1 16 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.169 -1.589 18002
9702 1 16 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.827 2.392 18002
9703 1 16 . 1 1 57 57 HIS H H 419 7.072 7.072 7.829 -0.757 18002
9704 1 16 . 1 1 58 58 GLN N N 420 123.083 123.083 123.475 -0.392 18002
9705 1 16 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.729 0.426 18002
9706 1 16 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.689 0.815 18002
9707 1 16 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.135 2.355 18002
9708 1 16 . 1 1 58 58 GLN H H 420 8.669 8.669 8.333 0.336 18002
9709 1 16 . 1 1 59 59 MET N N 421 122.330 122.330 118.461 3.869 18002
9710 1 16 . 1 1 59 59 MET HA H 421 4.621 4.621 4.767 -0.146 18002
9711 1 16 . 1 1 59 59 MET CA C 421 54.892 54.892 54.635 0.257 18002
9712 1 16 . 1 1 59 59 MET CB C 421 35.650 35.650 36.060 -0.410 18002
9713 1 16 . 1 1 59 59 MET H H 421 8.995 8.995 8.188 0.807 18002
9714 1 16 . 1 1 60 60 ASN N N 422 123.220 123.220 119.150 4.070 18002
9715 1 16 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.657 0.291 18002
9716 1 16 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.945 -0.314 18002
9717 1 16 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.185 0.554 18002
9718 1 16 . 1 1 60 60 ASN H H 422 8.728 8.728 8.590 0.138 18002
9719 1 16 . 1 1 61 61 LEU N N 423 126.072 126.072 124.424 1.648 18002
9720 1 16 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.274 -0.158 18002
9721 1 16 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.209 1.404 18002
9722 1 16 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.671 0.786 18002
9723 1 16 . 1 1 61 61 LEU H H 423 8.942 8.942 8.422 0.520 18002
9724 1 16 . 1 1 62 62 ARG N N 424 121.977 121.977 116.537 5.440 18002
9725 1 16 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.138 0.234 18002
9726 1 16 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.572 2.462 18002
9727 1 16 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.089 -0.479 18002
9728 1 16 . 1 1 62 62 ARG H H 424 8.000 8.000 7.669 0.331 18002
9729 1 16 . 1 1 63 63 GLY N N 425 114.852 114.852 108.094 6.758 18002
9730 1 16 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.397 0.413 18002
9731 1 16 . 1 1 63 63 GLY H H 425 9.033 9.033 8.568 0.465 18002
9732 1 16 . 1 1 64 64 CYS N N 426 117.102 117.102 116.899 0.203 18002
9733 1 16 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.531 0.368 18002
9734 1 16 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.364 0.396 18002
9735 1 16 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.140 -0.316 18002
9736 1 16 . 1 1 64 64 CYS H H 426 8.248 8.248 7.608 0.640 18002
9737 1 16 . 1 1 65 65 GLU N N 427 119.501 119.501 122.158 -2.657 18002
9738 1 16 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.447 0.330 18002
9739 1 16 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.222 0.169 18002
9740 1 16 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.282 0.656 18002
9741 1 16 . 1 1 65 65 GLU H H 427 8.449 8.449 8.765 -0.316 18002
9742 1 16 . 1 1 66 66 VAL N N 428 125.286 125.286 119.898 5.388 18002
9743 1 16 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.530 0.360 18002
9744 1 16 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.476 0.276 18002
9745 1 16 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.181 -0.206 18002
9746 1 16 . 1 1 66 66 VAL H H 428 8.624 8.624 8.212 0.412 18002
9747 1 16 . 1 1 67 67 THR N N 429 124.132 124.132 122.018 2.114 18002
9748 1 16 . 1 1 67 67 THR CA C 429 59.338 59.338 60.235 -0.897 18002
9749 1 16 . 1 1 67 67 THR CB C 429 72.021 72.021 70.133 1.888 18002
9750 1 16 . 1 1 67 67 THR H H 429 9.247 9.247 8.193 1.054 18002
9751 1 16 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.456 0.193 18002
9752 1 16 . 1 1 68 68 PRO CA C 430 62.738 62.738 63.197 -0.459 18002
9753 1 16 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.185 1.383 18002
9754 1 16 . 1 1 69 69 ASP N N 431 122.066 122.066 122.457 -0.391 18002
9755 1 16 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.829 -0.182 18002
9756 1 16 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.758 -0.089 18002
9757 1 16 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.800 -0.695 18002
9758 1 16 . 1 1 69 69 ASP H H 431 8.250 8.250 8.768 -0.518 18002
9759 1 16 . 1 1 70 70 VAL N N 432 121.874 121.874 123.360 -1.486 18002
9760 1 16 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.679 -0.180 18002
9761 1 16 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.202 -0.114 18002
9762 1 16 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.329 0.703 18002
9763 1 16 . 1 1 70 70 VAL H H 432 8.305 8.305 8.178 0.127 18002
9764 1 16 . 1 1 71 71 ASN N N 433 124.366 124.366 128.427 -4.061 18002
9765 1 16 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.963 -0.281 18002
9766 1 16 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.310 0.451 18002
9767 1 16 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.881 1.398 18002
9768 1 16 . 1 1 71 71 ASN H H 433 8.637 8.637 8.454 0.183 18002
9769 1 16 . 1 1 72 72 ILE N N 434 126.786 126.786 121.433 5.353 18002
9770 1 16 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.691 -0.320 18002
9771 1 16 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.374 1.144 18002
9772 1 16 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.383 -0.208 18002
9773 1 16 . 1 1 72 72 ILE H H 434 8.943 8.943 8.154 0.789 18002
9774 1 16 . 1 1 73 73 SER N N 435 118.305 118.305 116.137 2.168 18002
9775 1 16 . 1 1 73 73 SER CA C 435 61.633 61.633 60.180 1.453 18002
9776 1 16 . 1 1 73 73 SER CB C 435 62.435 62.435 62.927 -0.492 18002
9777 1 16 . 1 1 73 73 SER H H 435 8.578 8.578 8.107 0.471 18002
9778 1 16 . 1 1 74 74 GLY N N 436 107.443 107.443 106.195 1.248 18002
9779 1 16 . 1 1 74 74 GLY CA C 436 44.861 44.861 45.163 -0.302 18002
9780 1 16 . 1 1 74 74 GLY H H 436 7.620 7.620 7.306 0.314 18002
9781 1 16 . 1 1 75 75 GLN N N 437 116.895 116.895 115.772 1.123 18002
9782 1 16 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.584 -0.294 18002
9783 1 16 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.609 0.092 18002
9784 1 16 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.936 0.809 18002
9785 1 16 . 1 1 75 75 GLN H H 437 7.798 7.798 7.624 0.174 18002
9786 1 16 . 1 1 76 76 LYS N N 438 119.308 119.308 119.262 0.046 18002
9787 1 16 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.448 -0.306 18002
9788 1 16 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.956 0.087 18002
9789 1 16 . 1 1 76 76 LYS CB C 438 33.945 33.945 35.209 -1.264 18002
9790 1 16 . 1 1 76 76 LYS H H 438 7.522 7.522 7.701 -0.179 18002
9791 1 16 . 1 1 77 77 PHE N N 439 125.905 125.905 121.418 4.487 18002
9792 1 16 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.237 -0.026 18002
9793 1 16 . 1 1 77 77 PHE CA C 439 55.639 55.639 55.554 0.085 18002
9794 1 16 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.152 0.777 18002
9795 1 16 . 1 1 77 77 PHE H H 439 8.461 8.461 8.764 -0.303 18002
9796 1 16 . 1 1 78 78 ASN N N 440 120.787 120.787 121.550 -0.763 18002
9797 1 16 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.346 -0.433 18002
9798 1 16 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.481 0.322 18002
9799 1 16 . 1 1 78 78 ASN H H 440 7.638 7.638 8.432 -0.794 18002
9800 1 16 . 1 1 79 79 ILE N N 441 123.421 123.421 125.126 -1.705 18002
9801 1 16 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.112 0.059 18002
9802 1 16 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.613 0.954 18002
9803 1 16 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.842 1.645 18002
9804 1 16 . 1 1 79 79 ILE H H 441 9.550 9.550 8.682 0.868 18002
9805 1 16 . 1 1 80 80 LYS N N 442 126.267 126.267 129.587 -3.320 18002
9806 1 16 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.371 0.091 18002
9807 1 16 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.011 2.372 18002
9808 1 16 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.589 0.398 18002
9809 1 16 . 1 1 80 80 LYS H H 442 8.703 8.703 7.977 0.726 18002
9810 1 16 . 1 1 81 81 LEU N N 443 125.194 125.194 127.741 -2.547 18002
9811 1 16 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.707 0.565 18002
9812 1 16 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.297 0.052 18002
9813 1 16 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.456 2.248 18002
9814 1 16 . 1 1 81 81 LEU H H 443 9.223 9.223 7.834 1.389 18002
9815 1 16 . 1 1 82 82 LEU N N 444 122.753 122.753 127.093 -4.340 18002
9816 1 16 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.196 -0.182 18002
9817 1 16 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.009 0.909 18002
9818 1 16 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.635 -3.011 18002
9819 1 16 . 1 1 82 82 LEU H H 444 8.420 8.420 7.707 0.713 18002
9820 1 16 . 1 1 83 83 ILE N N 445 125.584 125.584 120.915 4.669 18002
9821 1 16 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.342 -0.056 18002
9822 1 16 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.894 -0.858 18002
9823 1 16 . 1 1 83 83 ILE H H 445 9.010 9.010 7.987 1.023 18002
9824 1 16 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.638 0.281 18002
9825 1 16 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.269 1.764 18002
9826 1 16 . 1 1 84 84 PRO CB C 446 31.947 31.947 32.036 -0.089 18002
9827 1 16 . 1 1 85 85 VAL N N 447 119.780 119.780 118.751 1.029 18002
9828 1 16 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.509 -0.006 18002
9829 1 16 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.953 0.389 18002
9830 1 16 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.192 1.074 18002
9831 1 16 . 1 1 85 85 VAL H H 447 8.304 8.304 7.975 0.329 18002
9832 1 16 . 1 1 86 86 ALA N N 448 125.178 125.178 122.154 3.024 18002
9833 1 16 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.185 -0.210 18002
9834 1 16 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.322 1.239 18002
9835 1 16 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.564 -0.577 18002
9836 1 16 . 1 1 86 86 ALA H H 448 8.526 8.526 8.339 0.187 18002
9837 1 16 . 1 1 87 87 GLU N N 449 114.625 114.625 118.427 -3.802 18002
9838 1 16 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.132 0.158 18002
9839 1 16 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.346 -0.615 18002
9840 1 16 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.884 -0.624 18002
9841 1 16 . 1 1 87 87 GLU H H 449 8.402 8.402 8.627 -0.225 18002
9842 1 16 . 1 1 88 88 GLY N N 450 109.432 109.432 106.544 2.888 18002
9843 1 16 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.831 1.006 18002
9844 1 16 . 1 1 88 88 GLY H H 450 7.711 7.711 7.777 -0.066 18002
9845 1 16 . 1 1 89 89 MET N N 451 121.382 121.382 120.475 0.907 18002
9846 1 16 . 1 1 89 89 MET HA H 451 5.076 5.076 4.819 0.257 18002
9847 1 16 . 1 1 89 89 MET CA C 451 53.860 53.860 55.352 -1.492 18002
9848 1 16 . 1 1 89 89 MET CB C 451 35.942 35.942 36.727 -0.785 18002
9849 1 16 . 1 1 89 89 MET H H 451 8.355 8.355 8.063 0.292 18002
9850 1 16 . 1 1 90 90 ASN N N 452 123.538 123.538 123.447 0.091 18002
9851 1 16 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.903 0.050 18002
9852 1 16 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.737 -0.989 18002
9853 1 16 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.767 1.875 18002
9854 1 16 . 1 1 90 90 ASN H H 452 9.338 9.338 8.974 0.364 18002
9855 1 16 . 1 1 91 91 GLU N N 453 125.978 125.978 123.471 2.507 18002
9856 1 16 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.232 1.112 18002
9857 1 16 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.134 -0.861 18002
9858 1 16 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.301 1.442 18002
9859 1 16 . 1 1 91 91 GLU H H 453 8.168 8.168 8.030 0.138 18002
9860 1 16 . 1 1 92 92 ILE N N 454 126.776 126.776 124.526 2.250 18002
9861 1 16 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.337 0.229 18002
9862 1 16 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.818 0.230 18002
9863 1 16 . 1 1 92 92 ILE CB C 454 42.262 42.262 42.138 0.124 18002
9864 1 16 . 1 1 92 92 ILE H H 454 9.000 9.000 7.815 1.185 18002
9865 1 16 . 1 1 93 93 TRP N N 455 125.987 125.987 121.945 4.042 18002
9866 1 16 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.918 -0.326 18002
9867 1 16 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.864 -2.074 18002
9868 1 16 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.940 0.446 18002
9869 1 16 . 1 1 93 93 TRP H H 455 9.278 9.278 8.155 1.123 18002
9870 1 16 . 1 1 94 94 LEU N N 456 120.912 120.912 122.739 -1.827 18002
9871 1 16 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.617 0.745 18002
9872 1 16 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.954 -0.738 18002
9873 1 16 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.742 0.852 18002
9874 1 16 . 1 1 94 94 LEU H H 456 9.534 9.534 8.013 1.521 18002
9875 1 16 . 1 1 95 95 ARG N N 457 123.669 123.669 121.223 2.446 18002
9876 1 16 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.409 0.862 18002
9877 1 16 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.275 0.142 18002
9878 1 16 . 1 1 95 95 ARG CB C 457 33.262 33.262 31.213 2.049 18002
9879 1 16 . 1 1 95 95 ARG H H 457 9.439 9.439 8.631 0.808 18002
9880 1 16 . 1 1 96 96 CYS N N 458 125.273 125.273 123.688 1.585 18002
9881 1 16 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.789 -0.091 18002
9882 1 16 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.360 0.432 18002
9883 1 16 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.887 1.516 18002
9884 1 16 . 1 1 96 96 CYS H H 458 8.652 8.652 8.519 0.133 18002
9885 1 16 . 1 1 97 97 ASP N N 459 119.661 119.661 122.696 -3.035 18002
9886 1 16 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.646 0.094 18002
9887 1 16 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.776 1.452 18002
9888 1 16 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.083 1.502 18002
9889 1 16 . 1 1 97 97 ASP H H 459 9.116 9.116 8.746 0.370 18002
9890 1 16 . 1 1 98 98 ASN N N 460 109.173 109.173 114.385 -5.212 18002
9891 1 16 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.784 -0.412 18002
9892 1 16 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.565 -0.551 18002
9893 1 16 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.111 0.700 18002
9894 1 16 . 1 1 98 98 ASN H H 460 7.054 7.054 7.425 -0.371 18002
9895 1 16 . 1 1 99 99 GLU N N 461 119.220 119.220 120.295 -1.075 18002
9896 1 16 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.751 0.293 18002
9897 1 16 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.473 0.295 18002
9898 1 16 . 1 1 99 99 GLU H H 461 8.937 8.937 8.746 0.191 18002
9899 1 16 . 1 1 100 100 LYS N N 462 120.647 120.647 119.763 0.884 18002
9900 1 16 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.038 0.607 18002
9901 1 16 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.749 0.787 18002
9902 1 16 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.838 0.390 18002
9903 1 16 . 1 1 100 100 LYS H H 462 8.033 8.033 8.314 -0.281 18002
9904 1 16 . 1 1 101 101 GLN N N 463 121.938 121.938 118.179 3.759 18002
9905 1 16 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.112 0.288 18002
9906 1 16 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.071 0.324 18002
9907 1 16 . 1 1 101 101 GLN CB C 463 32.214 32.214 27.972 4.242 18002
9908 1 16 . 1 1 101 101 GLN H H 463 8.372 8.372 7.965 0.407 18002
9909 1 16 . 1 1 102 102 TYR N N 464 117.422 117.422 120.350 -2.928 18002
9910 1 16 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.050 0.566 18002
9911 1 16 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.882 0.795 18002
9912 1 16 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.022 0.837 18002
9913 1 16 . 1 1 102 102 TYR H H 464 8.221 8.221 7.417 0.804 18002
9914 1 16 . 1 1 103 103 ALA N N 465 120.655 120.655 118.840 1.815 18002
9915 1 16 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.956 -0.241 18002
9916 1 16 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.989 0.924 18002
9917 1 16 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.504 0.298 18002
9918 1 16 . 1 1 103 103 ALA H H 465 8.637 8.637 8.061 0.576 18002
9919 1 16 . 1 1 104 104 HIS N N 466 112.871 112.871 116.865 -3.994 18002
9920 1 16 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.459 -0.318 18002
9921 1 16 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.164 0.463 18002
9922 1 16 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.022 -1.164 18002
9923 1 16 . 1 1 104 104 HIS H H 466 7.852 7.852 8.094 -0.242 18002
9924 1 16 . 1 1 105 105 TRP N N 467 121.317 121.317 119.529 1.788 18002
9925 1 16 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.507 -0.812 18002
9926 1 16 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.757 1.585 18002
9927 1 16 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.416 -1.911 18002
9928 1 16 . 1 1 105 105 TRP H H 467 8.668 8.668 8.074 0.594 18002
9929 1 16 . 1 1 106 106 MET N N 468 122.346 122.346 119.762 2.584 18002
9930 1 16 . 1 1 106 106 MET HA H 468 4.086 4.086 3.906 0.180 18002
9931 1 16 . 1 1 106 106 MET CA C 468 58.743 58.743 59.016 -0.273 18002
9932 1 16 . 1 1 106 106 MET CB C 468 31.402 31.402 31.625 -0.223 18002
9933 1 16 . 1 1 106 106 MET H H 468 9.790 9.790 8.262 1.528 18002
9934 1 16 . 1 1 107 107 ALA N N 469 119.758 119.758 121.287 -1.529 18002
9935 1 16 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.924 -0.219 18002
9936 1 16 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.794 1.335 18002
9937 1 16 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.165 2.240 18002
9938 1 16 . 1 1 107 107 ALA H H 469 7.702 7.702 7.598 0.104 18002
9939 1 16 . 1 1 108 108 ALA N N 470 119.233 119.233 121.986 -2.753 18002
9940 1 16 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.717 -0.171 18002
9941 1 16 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.346 0.475 18002
9942 1 16 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.994 -1.262 18002
9943 1 16 . 1 1 108 108 ALA H H 470 7.156 7.156 7.535 -0.379 18002
9944 1 16 . 1 1 109 109 CYS N N 471 116.736 116.736 116.179 0.557 18002
9945 1 16 . 1 1 109 109 CYS HA H 471 4.057 4.057 3.966 0.091 18002
9946 1 16 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.431 2.140 18002
9947 1 16 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.491 -0.098 18002
9948 1 16 . 1 1 109 109 CYS H H 471 8.256 8.256 8.629 -0.373 18002
9949 1 16 . 1 1 110 110 ARG N N 472 118.644 118.644 120.219 -1.575 18002
9950 1 16 . 1 1 110 110 ARG HA H 472 3.734 3.734 3.997 -0.263 18002
9951 1 16 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.027 1.177 18002
9952 1 16 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.993 0.324 18002
9953 1 16 . 1 1 110 110 ARG H H 472 8.403 8.403 7.473 0.930 18002
9954 1 16 . 1 1 111 111 LEU N N 473 121.877 121.877 120.467 1.410 18002
9955 1 16 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.047 -0.247 18002
9956 1 16 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.315 2.540 18002
9957 1 16 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.304 -0.884 18002
9958 1 16 . 1 1 111 111 LEU H H 473 7.916 7.916 7.758 0.158 18002
9959 1 16 . 1 1 112 112 ALA N N 474 122.765 122.765 120.583 2.182 18002
9960 1 16 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.046 0.434 18002
9961 1 16 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.687 0.574 18002
9962 1 16 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.041 1.834 18002
9963 1 16 . 1 1 112 112 ALA H H 474 8.393 8.393 8.780 -0.387 18002
9964 1 16 . 1 1 113 113 SER N N 475 113.613 113.613 112.405 1.208 18002
9965 1 16 . 1 1 113 113 SER HA H 475 4.782 4.782 4.236 0.546 18002
9966 1 16 . 1 1 113 113 SER CA C 475 61.090 61.090 61.016 0.074 18002
9967 1 16 . 1 1 113 113 SER CB C 475 63.612 63.612 62.959 0.652 18002
9968 1 16 . 1 1 113 113 SER H H 475 8.150 8.150 7.639 0.511 18002
9969 1 16 . 1 1 114 114 LYS N N 476 118.734 118.734 118.892 -0.158 18002
9970 1 16 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.249 0.304 18002
9971 1 16 . 1 1 114 114 LYS CA C 476 55.144 55.144 57.254 -2.110 18002
9972 1 16 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.614 -0.022 18002
9973 1 16 . 1 1 114 114 LYS H H 476 7.239 7.239 7.851 -0.612 18002
9974 1 16 . 1 1 115 115 GLY N N 477 107.818 107.818 107.873 -0.055 18002
9975 1 16 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.545 0.440 18002
9976 1 16 . 1 1 115 115 GLY H H 477 8.401 8.401 7.883 0.518 18002
9977 1 16 . 1 1 116 116 LYS N N 478 120.938 120.938 121.915 -0.977 18002
9978 1 16 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.585 -0.012 18002
9979 1 16 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.921 -0.074 18002
9980 1 16 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.233 1.088 18002
9981 1 16 . 1 1 116 116 LYS H H 478 8.142 8.142 7.773 0.369 18002
9982 1 16 . 1 1 117 117 THR N N 479 108.076 108.076 115.557 -7.481 18002
9983 1 16 . 1 1 117 117 THR HA H 479 4.671 4.671 4.321 0.350 18002
9984 1 16 . 1 1 117 117 THR CA C 479 59.191 59.191 61.117 -1.926 18002
9985 1 16 . 1 1 117 117 THR CB C 479 72.228 72.228 70.997 1.231 18002
9986 1 16 . 1 1 117 117 THR H H 479 7.926 7.926 8.146 -0.221 18002
9987 1 16 . 1 1 118 118 MET N N 480 116.403 116.403 119.478 -3.075 18002
9988 1 16 . 1 1 118 118 MET HA H 480 3.352 3.352 3.585 -0.233 18002
9989 1 16 . 1 1 118 118 MET CA C 480 57.947 57.947 57.308 0.639 18002
9990 1 16 . 1 1 118 118 MET CB C 480 33.920 33.920 29.995 3.925 18002
9991 1 16 . 1 1 118 118 MET H H 480 8.899 8.899 8.714 0.185 18002
9992 1 16 . 1 1 119 119 ALA N N 481 117.786 117.786 120.415 -2.629 18002
9993 1 16 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.325 -0.241 18002
9994 1 16 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.763 0.832 18002
9995 1 16 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.364 -0.302 18002
9996 1 16 . 1 1 119 119 ALA H H 481 7.645 7.645 7.879 -0.234 18002
9997 1 16 . 1 1 120 120 ASP N N 482 120.348 120.348 119.266 1.082 18002
9998 1 16 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.729 2.887 18002
9999 1 16 . 1 1 120 120 ASP H H 482 7.887 7.887 7.725 0.162 18002
10000 1 16 . 1 1 121 121 SER HA H 483 4.223 4.223 4.349 -0.126 18002
10001 1 16 . 1 1 121 121 SER CA C 483 61.455 61.455 60.657 0.798 18002
10002 1 16 . 1 1 121 121 SER CB C 483 62.996 62.996 63.416 -0.420 18002
10003 1 16 . 1 1 122 122 SER N N 484 116.845 116.845 117.408 -0.563 18002
10004 1 16 . 1 1 122 122 SER HA H 484 4.321 4.321 4.371 -0.050 18002
10005 1 16 . 1 1 122 122 SER CA C 484 60.584 60.584 60.142 0.442 18002
10006 1 16 . 1 1 122 122 SER CB C 484 64.314 64.314 63.336 0.978 18002
10007 1 16 . 1 1 122 122 SER H H 484 8.875 8.875 8.279 0.596 18002
10008 1 16 . 1 1 123 123 TYR N N 485 124.153 124.153 123.018 1.135 18002
10009 1 16 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.252 -0.372 18002
10010 1 16 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.448 2.866 18002
10011 1 16 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.195 0.546 18002
10012 1 16 . 1 1 123 123 TYR H H 485 8.018 8.018 7.452 0.566 18002
10013 1 16 . 1 1 124 124 ASN N N 486 115.339 115.339 117.087 -1.748 18002
10014 1 16 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.463 0.478 18002
10015 1 16 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.806 0.900 18002
10016 1 16 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.585 0.471 18002
10017 1 16 . 1 1 124 124 ASN H H 486 8.665 8.665 7.754 0.911 18002
10018 1 16 . 1 1 125 125 LEU N N 487 119.454 119.454 120.914 -1.460 18002
10019 1 16 . 1 1 125 125 LEU HA H 487 3.938 3.938 3.930 0.008 18002
10020 1 16 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.904 -0.234 18002
10021 1 16 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.865 -0.297 18002
10022 1 16 . 1 1 125 125 LEU H H 487 7.105 7.105 7.184 -0.079 18002
10023 1 16 . 1 1 126 126 GLU N N 488 121.189 121.189 118.621 2.568 18002
10024 1 16 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.903 0.127 18002
10025 1 16 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.801 -0.766 18002
10026 1 16 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.728 -0.643 18002
10027 1 16 . 1 1 126 126 GLU H H 488 8.053 8.053 8.320 -0.267 18002
10028 1 16 . 1 1 127 127 VAL N N 489 119.073 119.073 116.550 2.523 18002
10029 1 16 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.768 -0.750 18002
10030 1 16 . 1 1 127 127 VAL CA C 489 67.322 67.322 66.058 1.264 18002
10031 1 16 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.734 -0.075 18002
10032 1 16 . 1 1 127 127 VAL H H 489 7.769 7.769 7.733 0.036 18002
10033 1 16 . 1 1 128 128 GLN N N 490 116.214 116.214 118.019 -1.805 18002
10034 1 16 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.027 -0.196 18002
10035 1 16 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.523 0.233 18002
10036 1 16 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.813 0.299 18002
10037 1 16 . 1 1 128 128 GLN H H 490 7.542 7.542 8.186 -0.644 18002
10038 1 16 . 1 1 129 129 ASN N N 491 120.003 120.003 118.494 1.509 18002
10039 1 16 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.621 -0.202 18002
10040 1 16 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.790 0.370 18002
10041 1 16 . 1 1 129 129 ASN CB C 491 38.060 38.060 39.028 -0.967 18002
10042 1 16 . 1 1 129 129 ASN H H 491 8.582 8.582 7.898 0.684 18002
10043 1 16 . 1 1 130 130 ILE N N 492 122.365 122.365 120.069 2.296 18002
10044 1 16 . 1 1 130 130 ILE CA C 492 65.753 65.753 64.929 0.824 18002
10045 1 16 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.747 0.399 18002
10046 1 16 . 1 1 130 130 ILE H H 492 8.186 8.186 7.429 0.757 18002
10047 1 16 . 1 1 131 131 LEU N N 493 119.597 119.597 120.478 -0.881 18002
10048 1 16 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.938 0.067 18002
10049 1 16 . 1 1 131 131 LEU CA C 493 58.859 58.859 57.726 1.133 18002
10050 1 16 . 1 1 131 131 LEU CB C 493 41.536 41.536 39.617 1.919 18002
10051 1 16 . 1 1 131 131 LEU H H 493 8.224 8.224 7.953 0.271 18002
10052 1 16 . 1 1 132 132 SER N N 494 114.884 114.884 113.644 1.240 18002
10053 1 16 . 1 1 132 132 SER HA H 494 4.430 4.430 4.136 0.294 18002
10054 1 16 . 1 1 132 132 SER CA C 494 62.072 62.072 61.348 0.724 18002
10055 1 16 . 1 1 132 132 SER CB C 494 62.703 62.703 62.970 -0.267 18002
10056 1 16 . 1 1 132 132 SER H H 494 8.464 8.464 7.807 0.657 18002
10057 1 16 . 1 1 133 133 PHE N N 495 123.047 123.047 120.777 2.270 18002
10058 1 16 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.394 -0.017 18002
10059 1 16 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.348 -0.435 18002
10060 1 16 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.438 -0.388 18002
10061 1 16 . 1 1 133 133 PHE H H 495 7.915 7.915 8.293 -0.378 18002
10062 1 16 . 1 1 134 134 LEU N N 496 119.311 119.311 120.871 -1.560 18002
10063 1 16 . 1 1 134 134 LEU HA H 496 3.905 3.905 3.895 0.010 18002
10064 1 16 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.915 -1.314 18002
10065 1 16 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.467 0.434 18002
10066 1 16 . 1 1 134 134 LEU H H 496 8.386 8.386 8.441 -0.055 18002
10067 1 16 . 1 1 135 135 LYS N N 497 117.550 117.550 118.247 -0.697 18002
10068 1 16 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.021 -0.081 18002
10069 1 16 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.998 -0.723 18002
10070 1 16 . 1 1 135 135 LYS CB C 497 32.494 32.494 31.910 0.584 18002
10071 1 16 . 1 1 135 135 LYS H H 497 7.670 7.670 7.926 -0.256 18002
10072 1 16 . 1 1 136 136 MET N N 498 116.106 116.106 117.942 -1.836 18002
10073 1 16 . 1 1 136 136 MET HA H 498 4.354 4.354 4.623 -0.269 18002
10074 1 16 . 1 1 136 136 MET CA C 498 55.994 55.994 55.300 0.694 18002
10075 1 16 . 1 1 136 136 MET CB C 498 32.772 32.772 32.753 0.019 18002
10076 1 16 . 1 1 136 136 MET H H 498 7.421 7.421 8.141 -0.720 18002
10077 1 16 . 1 1 137 137 GLN N N 499 118.651 118.651 120.506 -1.855 18002
10078 1 16 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.962 0.222 18002
10079 1 16 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.576 -2.268 18002
10080 1 16 . 1 1 137 137 GLN H H 499 7.617 7.617 8.452 -0.835 18002
10081 1 17 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.570 -0.445 18002
10082 1 17 . 1 1 3 3 HIS CA C 365 55.015 55.015 58.387 -3.372 18002
10083 1 17 . 1 1 3 3 HIS CB C 365 31.929 31.929 30.084 1.845 18002
10084 1 17 . 1 1 4 4 MET N N 366 120.431 120.431 115.386 5.045 18002
10085 1 17 . 1 1 4 4 MET HA H 366 4.345 4.345 4.508 -0.163 18002
10086 1 17 . 1 1 4 4 MET CA C 366 55.337 55.337 56.528 -1.191 18002
10087 1 17 . 1 1 4 4 MET CB C 366 32.668 32.668 33.984 -1.316 18002
10088 1 17 . 1 1 4 4 MET H H 366 8.373 8.373 8.154 0.219 18002
10089 1 17 . 1 1 5 5 GLY N N 367 109.318 109.318 106.735 2.583 18002
10090 1 17 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.225 0.232 18002
10091 1 17 . 1 1 5 5 GLY H H 367 8.224 8.224 7.873 0.351 18002
10092 1 17 . 1 1 6 6 ASP N N 368 120.307 120.307 119.294 1.013 18002
10093 1 17 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.339 0.261 18002
10094 1 17 . 1 1 6 6 ASP CA C 368 54.513 54.513 54.338 0.175 18002
10095 1 17 . 1 1 6 6 ASP CB C 368 41.326 41.326 40.641 0.685 18002
10096 1 17 . 1 1 6 6 ASP H H 368 8.199 8.199 8.245 -0.046 18002
10097 1 17 . 1 1 7 7 ILE N N 369 120.668 120.668 117.198 3.470 18002
10098 1 17 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.042 0.176 18002
10099 1 17 . 1 1 7 7 ILE CA C 369 61.584 61.584 61.847 -0.263 18002
10100 1 17 . 1 1 7 7 ILE CB C 369 38.768 38.768 36.408 2.360 18002
10101 1 17 . 1 1 7 7 ILE H H 369 8.138 8.138 7.961 0.177 18002
10102 1 17 . 1 1 8 8 THR N N 370 117.564 117.564 116.283 1.281 18002
10103 1 17 . 1 1 8 8 THR HA H 370 4.322 4.322 4.216 0.106 18002
10104 1 17 . 1 1 8 8 THR CA C 370 62.332 62.332 62.995 -0.662 18002
10105 1 17 . 1 1 8 8 THR CB C 370 69.946 69.946 68.108 1.838 18002
10106 1 17 . 1 1 8 8 THR H H 370 8.230 8.230 7.875 0.355 18002
10107 1 17 . 1 1 9 9 SER N N 371 118.467 118.467 116.902 1.565 18002
10108 1 17 . 1 1 9 9 SER HA H 371 4.445 4.445 4.662 -0.217 18002
10109 1 17 . 1 1 9 9 SER CA C 371 58.274 58.274 57.958 0.316 18002
10110 1 17 . 1 1 9 9 SER CB C 371 63.996 63.996 62.855 1.141 18002
10111 1 17 . 1 1 9 9 SER H H 371 8.158 8.158 7.520 0.638 18002
10112 1 17 . 1 1 10 10 ILE N N 372 123.959 123.959 124.728 -0.769 18002
10113 1 17 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.141 -4.425 18002
10114 1 17 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.510 2.409 18002
10115 1 17 . 1 1 10 10 ILE H H 372 8.112 8.112 8.050 0.062 18002
10116 1 17 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.403 -0.051 18002
10117 1 17 . 1 1 11 11 PRO CA C 373 63.181 63.181 62.590 0.591 18002
10118 1 17 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.039 1.668 18002
10119 1 17 . 1 1 12 12 GLU N N 374 119.349 119.349 122.739 -3.390 18002
10120 1 17 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.614 0.173 18002
10121 1 17 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.490 -0.173 18002
10122 1 17 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.775 2.816 18002
10123 1 17 . 1 1 12 12 GLU H H 374 8.017 8.017 8.073 -0.056 18002
10124 1 17 . 1 1 13 13 LEU N N 375 122.288 122.288 126.067 -3.779 18002
10125 1 17 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.688 -0.210 18002
10126 1 17 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.958 -1.028 18002
10127 1 17 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.347 1.309 18002
10128 1 17 . 1 1 13 13 LEU H H 375 8.036 8.036 8.365 -0.329 18002
10129 1 17 . 1 1 14 14 ALA N N 376 125.461 125.461 127.209 -1.748 18002
10130 1 17 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.500 0.746 18002
10131 1 17 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.890 -0.145 18002
10132 1 17 . 1 1 14 14 ALA CB C 376 21.586 21.586 21.765 -0.179 18002
10133 1 17 . 1 1 14 14 ALA H H 376 8.181 8.181 8.123 0.058 18002
10134 1 17 . 1 1 15 15 ASP N N 377 122.242 122.242 119.430 2.812 18002
10135 1 17 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.425 -0.106 18002
10136 1 17 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.331 0.421 18002
10137 1 17 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.869 1.770 18002
10138 1 17 . 1 1 15 15 ASP H H 377 8.326 8.326 8.969 -0.643 18002
10139 1 17 . 1 1 16 16 TYR N N 378 118.961 118.961 118.932 0.029 18002
10140 1 17 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.935 0.456 18002
10141 1 17 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.192 3.389 18002
10142 1 17 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.395 0.628 18002
10143 1 17 . 1 1 16 16 TYR H H 378 8.869 8.869 7.540 1.329 18002
10144 1 17 . 1 1 17 17 ILE N N 379 125.214 125.214 118.651 6.563 18002
10145 1 17 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.532 -0.202 18002
10146 1 17 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.987 -0.255 18002
10147 1 17 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.175 -0.199 18002
10148 1 17 . 1 1 17 17 ILE H H 379 8.608 8.608 7.614 0.994 18002
10149 1 17 . 1 1 18 18 LYS N N 380 122.917 122.917 119.984 2.933 18002
10150 1 17 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.681 0.431 18002
10151 1 17 . 1 1 18 18 LYS CA C 380 55.836 55.836 53.605 2.232 18002
10152 1 17 . 1 1 18 18 LYS CB C 380 35.025 35.025 33.721 1.304 18002
10153 1 17 . 1 1 18 18 LYS H H 380 7.424 7.424 8.216 -0.792 18002
10154 1 17 . 1 1 19 19 VAL N N 381 122.839 122.839 118.915 3.924 18002
10155 1 17 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.720 0.543 18002
10156 1 17 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.386 1.130 18002
10157 1 17 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.540 -0.392 18002
10158 1 17 . 1 1 19 19 VAL H H 381 9.223 9.223 7.846 1.377 18002
10159 1 17 . 1 1 20 20 PHE N N 382 129.509 129.509 125.545 3.964 18002
10160 1 17 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.982 -0.139 18002
10161 1 17 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.925 -1.421 18002
10162 1 17 . 1 1 20 20 PHE CB C 382 42.862 42.862 43.097 -0.235 18002
10163 1 17 . 1 1 20 20 PHE H H 382 9.451 9.451 8.288 1.163 18002
10164 1 17 . 1 1 21 21 LYS N N 383 126.417 126.417 120.456 5.961 18002
10165 1 17 . 1 1 21 21 LYS CA C 383 52.841 52.841 53.661 -0.820 18002
10166 1 17 . 1 1 21 21 LYS CB C 383 33.219 33.219 33.087 0.132 18002
10167 1 17 . 1 1 21 21 LYS H H 383 7.582 7.582 6.566 1.016 18002
10168 1 17 . 1 1 22 22 PRO CA C 384 63.697 63.697 64.124 -0.427 18002
10169 1 17 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.923 0.046 18002
10170 1 17 . 1 1 23 23 LYS N N 385 118.026 118.026 113.429 4.597 18002
10171 1 17 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.249 -0.034 18002
10172 1 17 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.263 0.082 18002
10173 1 17 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.782 0.251 18002
10174 1 17 . 1 1 23 23 LYS H H 385 8.138 8.138 7.826 0.312 18002
10175 1 17 . 1 1 24 24 LYS N N 386 120.816 120.816 123.260 -2.444 18002
10176 1 17 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.268 -0.082 18002
10177 1 17 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.360 -0.498 18002
10178 1 17 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.593 0.234 18002
10179 1 17 . 1 1 24 24 LYS H H 386 7.727 7.727 8.379 -0.652 18002
10180 1 17 . 1 1 25 25 LEU N N 387 121.214 121.214 119.713 1.501 18002
10181 1 17 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.258 -0.090 18002
10182 1 17 . 1 1 25 25 LEU CA C 387 56.508 56.508 57.151 -0.643 18002
10183 1 17 . 1 1 25 25 LEU CB C 387 41.642 41.642 41.983 -0.341 18002
10184 1 17 . 1 1 25 25 LEU H H 387 8.241 8.241 7.870 0.371 18002
10185 1 17 . 1 1 26 26 THR N N 388 112.798 112.798 108.009 4.789 18002
10186 1 17 . 1 1 26 26 THR HA H 388 4.313 4.313 4.262 0.051 18002
10187 1 17 . 1 1 26 26 THR CA C 388 61.795 61.795 62.575 -0.780 18002
10188 1 17 . 1 1 26 26 THR CB C 388 69.875 69.875 68.929 0.946 18002
10189 1 17 . 1 1 26 26 THR H H 388 7.700 7.700 7.688 0.012 18002
10190 1 17 . 1 1 27 27 LEU N N 389 124.091 124.091 115.641 8.450 18002
10191 1 17 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.666 -0.312 18002
10192 1 17 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.481 0.052 18002
10193 1 17 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.488 -0.190 18002
10194 1 17 . 1 1 27 27 LEU H H 389 8.260 8.260 7.478 0.782 18002
10195 1 17 . 1 1 28 28 LYS N N 390 121.153 121.153 121.178 -0.025 18002
10196 1 17 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.000 0.320 18002
10197 1 17 . 1 1 28 28 LYS CA C 390 56.211 56.211 58.483 -2.272 18002
10198 1 17 . 1 1 28 28 LYS CB C 390 33.675 33.675 31.351 2.325 18002
10199 1 17 . 1 1 28 28 LYS H H 390 8.202 8.202 8.115 0.087 18002
10200 1 17 . 1 1 29 29 GLY N N 391 107.270 107.270 107.444 -0.174 18002
10201 1 17 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.406 -0.531 18002
10202 1 17 . 1 1 29 29 GLY H H 391 7.876 7.876 8.150 -0.274 18002
10203 1 17 . 1 1 30 30 TYR N N 392 118.471 118.471 125.815 -7.344 18002
10204 1 17 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.362 0.084 18002
10205 1 17 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.817 -0.770 18002
10206 1 17 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.292 2.533 18002
10207 1 17 . 1 1 30 30 TYR H H 392 8.183 8.183 8.779 -0.596 18002
10208 1 17 . 1 1 31 31 LYS N N 393 122.833 122.833 122.478 0.355 18002
10209 1 17 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.741 -0.226 18002
10210 1 17 . 1 1 31 31 LYS CA C 393 55.174 55.174 53.962 1.212 18002
10211 1 17 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.082 0.638 18002
10212 1 17 . 1 1 31 31 LYS H H 393 8.731 8.731 7.451 1.280 18002
10213 1 17 . 1 1 32 32 GLN N N 394 124.759 124.759 118.539 6.220 18002
10214 1 17 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.381 0.297 18002
10215 1 17 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.944 1.663 18002
10216 1 17 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.268 0.780 18002
10217 1 17 . 1 1 32 32 GLN H H 394 8.776 8.776 8.552 0.224 18002
10218 1 17 . 1 1 33 33 TYR N N 395 125.112 125.112 126.771 -1.659 18002
10219 1 17 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.737 0.337 18002
10220 1 17 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.184 0.980 18002
10221 1 17 . 1 1 33 33 TYR CB C 395 42.672 42.672 41.352 1.321 18002
10222 1 17 . 1 1 33 33 TYR H H 395 8.774 8.774 7.736 1.038 18002
10223 1 17 . 1 1 34 34 TRP N N 396 122.638 122.638 126.701 -4.063 18002
10224 1 17 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.618 -0.936 18002
10225 1 17 . 1 1 34 34 TRP CA C 396 57.218 57.218 52.887 4.331 18002
10226 1 17 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.407 1.097 18002
10227 1 17 . 1 1 34 34 TRP H H 396 8.975 8.975 7.718 1.257 18002
10228 1 17 . 1 1 35 35 CYS N N 397 127.146 127.146 122.472 4.674 18002
10229 1 17 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.407 -0.040 18002
10230 1 17 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.711 0.995 18002
10231 1 17 . 1 1 35 35 CYS H H 397 8.804 8.804 9.113 -0.309 18002
10232 1 17 . 1 1 36 36 THR N N 398 110.578 110.578 110.991 -0.413 18002
10233 1 17 . 1 1 36 36 THR HA H 398 5.358 5.358 4.820 0.538 18002
10234 1 17 . 1 1 36 36 THR CA C 398 58.704 58.704 60.778 -2.074 18002
10235 1 17 . 1 1 36 36 THR CB C 398 71.833 71.833 71.303 0.530 18002
10236 1 17 . 1 1 36 36 THR H H 398 9.090 9.090 7.932 1.158 18002
10237 1 17 . 1 1 37 37 PHE N N 399 127.322 127.322 127.720 -0.398 18002
10238 1 17 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.766 0.187 18002
10239 1 17 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.306 -1.060 18002
10240 1 17 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.884 1.301 18002
10241 1 17 . 1 1 37 37 PHE H H 399 8.846 8.846 8.314 0.532 18002
10242 1 17 . 1 1 38 38 LYS N N 400 125.391 125.391 125.137 0.254 18002
10243 1 17 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.892 -0.365 18002
10244 1 17 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.265 1.712 18002
10245 1 17 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.211 0.704 18002
10246 1 17 . 1 1 38 38 LYS H H 400 8.252 8.252 8.146 0.106 18002
10247 1 17 . 1 1 39 39 ASP N N 401 125.083 125.083 119.443 5.640 18002
10248 1 17 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.251 -0.173 18002
10249 1 17 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.686 -0.203 18002
10250 1 17 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.095 -0.574 18002
10251 1 17 . 1 1 39 39 ASP H H 401 9.408 9.408 8.936 0.472 18002
10252 1 17 . 1 1 40 40 THR N N 402 112.024 112.024 111.697 0.327 18002
10253 1 17 . 1 1 40 40 THR HA H 402 4.767 4.767 4.639 0.128 18002
10254 1 17 . 1 1 40 40 THR CA C 402 60.811 60.811 62.514 -1.703 18002
10255 1 17 . 1 1 40 40 THR CB C 402 68.823 68.823 70.858 -2.034 18002
10256 1 17 . 1 1 40 40 THR H H 402 8.224 8.224 8.265 -0.041 18002
10257 1 17 . 1 1 41 41 SER N N 403 116.142 116.142 115.298 0.844 18002
10258 1 17 . 1 1 41 41 SER HA H 403 5.428 5.428 4.742 0.686 18002
10259 1 17 . 1 1 41 41 SER CA C 403 58.297 58.297 56.067 2.230 18002
10260 1 17 . 1 1 41 41 SER CB C 403 66.409 66.409 64.580 1.829 18002
10261 1 17 . 1 1 41 41 SER H H 403 8.197 8.197 7.631 0.566 18002
10262 1 17 . 1 1 42 42 ILE N N 404 122.292 122.292 119.795 2.497 18002
10263 1 17 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.633 0.296 18002
10264 1 17 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.209 1.595 18002
10265 1 17 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.653 0.767 18002
10266 1 17 . 1 1 42 42 ILE H H 404 8.411 8.411 8.210 0.201 18002
10267 1 17 . 1 1 43 43 SER N N 405 122.244 122.244 115.726 6.518 18002
10268 1 17 . 1 1 43 43 SER HA H 405 4.966 4.966 4.822 0.144 18002
10269 1 17 . 1 1 43 43 SER CA C 405 57.735 57.735 57.046 0.689 18002
10270 1 17 . 1 1 43 43 SER CB C 405 65.388 65.388 65.990 -0.602 18002
10271 1 17 . 1 1 43 43 SER H H 405 8.752 8.752 8.226 0.526 18002
10272 1 17 . 1 1 44 44 CYS N N 406 120.004 120.004 121.274 -1.270 18002
10273 1 17 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.598 0.369 18002
10274 1 17 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.953 -0.895 18002
10275 1 17 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.062 0.378 18002
10276 1 17 . 1 1 44 44 CYS H H 406 8.470 8.470 8.118 0.352 18002
10277 1 17 . 1 1 45 45 TYR N N 407 122.704 122.704 127.183 -4.479 18002
10278 1 17 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.795 0.228 18002
10279 1 17 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.462 -0.479 18002
10280 1 17 . 1 1 45 45 TYR CB C 407 41.574 41.574 41.473 0.101 18002
10281 1 17 . 1 1 45 45 TYR H H 407 10.013 10.013 8.471 1.542 18002
10282 1 17 . 1 1 46 46 LYS N N 408 121.897 121.897 121.861 0.036 18002
10283 1 17 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.871 -0.525 18002
10284 1 17 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.750 3.269 18002
10285 1 17 . 1 1 46 46 LYS CB C 408 32.712 32.712 34.196 -1.484 18002
10286 1 17 . 1 1 46 46 LYS H H 408 9.734 9.734 9.002 0.732 18002
10287 1 17 . 1 1 47 47 SER N N 409 106.720 106.720 111.233 -4.513 18002
10288 1 17 . 1 1 47 47 SER HA H 409 4.776 4.776 5.168 -0.392 18002
10289 1 17 . 1 1 47 47 SER CA C 409 57.180 57.180 57.017 0.163 18002
10290 1 17 . 1 1 47 47 SER CB C 409 65.870 65.870 65.924 -0.054 18002
10291 1 17 . 1 1 47 47 SER H H 409 7.518 7.518 7.809 -0.291 18002
10292 1 17 . 1 1 48 48 LYS N N 410 122.302 122.302 120.860 1.442 18002
10293 1 17 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.923 1.311 18002
10294 1 17 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.789 0.510 18002
10295 1 17 . 1 1 48 48 LYS H H 410 8.195 8.195 9.033 -0.838 18002
10296 1 17 . 1 1 49 49 GLU N N 411 118.983 118.983 118.492 0.491 18002
10297 1 17 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.164 0.618 18002
10298 1 17 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.568 0.967 18002
10299 1 17 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.439 -0.751 18002
10300 1 17 . 1 1 49 49 GLU H H 411 8.752 8.752 8.592 0.160 18002
10301 1 17 . 1 1 50 50 GLU N N 412 118.384 118.384 117.164 1.220 18002
10302 1 17 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.552 -0.059 18002
10303 1 17 . 1 1 50 50 GLU CA C 412 55.789 55.789 56.846 -1.057 18002
10304 1 17 . 1 1 50 50 GLU CB C 412 30.005 30.005 30.588 -0.583 18002
10305 1 17 . 1 1 50 50 GLU H H 412 7.234 7.234 7.616 -0.382 18002
10306 1 17 . 1 1 51 51 SER N N 413 114.767 114.767 115.927 -1.160 18002
10307 1 17 . 1 1 51 51 SER CA C 413 59.764 59.764 61.183 -1.419 18002
10308 1 17 . 1 1 51 51 SER CB C 413 62.965 62.965 62.743 0.222 18002
10309 1 17 . 1 1 51 51 SER H H 413 7.382 7.382 7.862 -0.480 18002
10310 1 17 . 1 1 52 52 SER N N 414 114.496 114.496 112.702 1.794 18002
10311 1 17 . 1 1 52 52 SER HA H 414 4.560 4.560 4.546 0.014 18002
10312 1 17 . 1 1 52 52 SER CA C 414 58.574 58.574 57.925 0.649 18002
10313 1 17 . 1 1 52 52 SER CB C 414 63.829 63.829 63.966 -0.137 18002
10314 1 17 . 1 1 52 52 SER H H 414 7.682 7.682 8.073 -0.391 18002
10315 1 17 . 1 1 53 53 GLY N N 415 111.107 111.107 109.295 1.812 18002
10316 1 17 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.510 -0.277 18002
10317 1 17 . 1 1 53 53 GLY H H 415 7.918 7.918 8.314 -0.396 18002
10318 1 17 . 1 1 54 54 THR N N 416 120.214 120.214 115.723 4.491 18002
10319 1 17 . 1 1 54 54 THR CB C 416 70.035 70.035 71.224 -1.189 18002
10320 1 17 . 1 1 54 54 THR H H 416 8.622 8.622 7.957 0.665 18002
10321 1 17 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.281 0.194 18002
10322 1 17 . 1 1 55 55 PRO CA C 417 63.045 63.045 61.986 1.059 18002
10323 1 17 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.218 -0.640 18002
10324 1 17 . 1 1 56 56 ALA N N 418 125.591 125.591 123.280 2.311 18002
10325 1 17 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.162 -0.206 18002
10326 1 17 . 1 1 56 56 ALA CA C 418 54.535 54.535 52.805 1.730 18002
10327 1 17 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.739 -0.832 18002
10328 1 17 . 1 1 56 56 ALA H H 418 8.288 8.288 8.281 0.007 18002
10329 1 17 . 1 1 57 57 HIS N N 419 108.119 108.119 117.999 -9.880 18002
10330 1 17 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.759 -0.137 18002
10331 1 17 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.556 -0.976 18002
10332 1 17 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.940 2.279 18002
10333 1 17 . 1 1 57 57 HIS H H 419 7.072 7.072 7.904 -0.832 18002
10334 1 17 . 1 1 58 58 GLN N N 420 123.083 123.083 121.355 1.728 18002
10335 1 17 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.953 0.202 18002
10336 1 17 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.754 0.750 18002
10337 1 17 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.360 2.130 18002
10338 1 17 . 1 1 58 58 GLN H H 420 8.669 8.669 8.448 0.221 18002
10339 1 17 . 1 1 59 59 MET N N 421 122.330 122.330 118.579 3.751 18002
10340 1 17 . 1 1 59 59 MET HA H 421 4.621 4.621 4.596 0.025 18002
10341 1 17 . 1 1 59 59 MET CA C 421 54.892 54.892 55.170 -0.279 18002
10342 1 17 . 1 1 59 59 MET CB C 421 35.650 35.650 35.193 0.457 18002
10343 1 17 . 1 1 59 59 MET H H 421 8.995 8.995 8.294 0.701 18002
10344 1 17 . 1 1 60 60 ASN N N 422 123.220 123.220 120.239 2.981 18002
10345 1 17 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.685 0.263 18002
10346 1 17 . 1 1 60 60 ASN CA C 422 52.631 52.631 53.091 -0.460 18002
10347 1 17 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.042 0.697 18002
10348 1 17 . 1 1 60 60 ASN H H 422 8.728 8.728 8.543 0.185 18002
10349 1 17 . 1 1 61 61 LEU N N 423 126.072 126.072 124.595 1.477 18002
10350 1 17 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.140 -0.024 18002
10351 1 17 . 1 1 61 61 LEU CA C 423 56.613 56.613 56.292 0.321 18002
10352 1 17 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.947 0.510 18002
10353 1 17 . 1 1 61 61 LEU H H 423 8.942 8.942 7.896 1.046 18002
10354 1 17 . 1 1 62 62 ARG N N 424 121.977 121.977 117.176 4.801 18002
10355 1 17 . 1 1 62 62 ARG HA H 424 4.372 4.372 3.934 0.438 18002
10356 1 17 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.070 1.964 18002
10357 1 17 . 1 1 62 62 ARG CB C 424 29.610 29.610 29.924 -0.313 18002
10358 1 17 . 1 1 62 62 ARG H H 424 8.000 8.000 7.902 0.098 18002
10359 1 17 . 1 1 63 63 GLY N N 425 114.852 114.852 109.355 5.497 18002
10360 1 17 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.116 0.694 18002
10361 1 17 . 1 1 63 63 GLY H H 425 9.033 9.033 8.765 0.268 18002
10362 1 17 . 1 1 64 64 CYS N N 426 117.102 117.102 119.188 -2.086 18002
10363 1 17 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.229 0.670 18002
10364 1 17 . 1 1 64 64 CYS CA C 426 57.760 57.760 57.436 0.324 18002
10365 1 17 . 1 1 64 64 CYS CB C 426 28.824 28.824 26.723 2.101 18002
10366 1 17 . 1 1 64 64 CYS H H 426 8.248 8.248 7.918 0.330 18002
10367 1 17 . 1 1 65 65 GLU N N 427 119.501 119.501 125.105 -5.604 18002
10368 1 17 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.427 0.350 18002
10369 1 17 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.276 0.115 18002
10370 1 17 . 1 1 65 65 GLU CB C 427 31.938 31.938 32.038 -0.100 18002
10371 1 17 . 1 1 65 65 GLU H H 427 8.449 8.449 8.263 0.186 18002
10372 1 17 . 1 1 66 66 VAL N N 428 125.286 125.286 120.451 4.835 18002
10373 1 17 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.511 0.379 18002
10374 1 17 . 1 1 66 66 VAL CA C 428 60.752 60.752 60.961 -0.209 18002
10375 1 17 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.285 -0.310 18002
10376 1 17 . 1 1 66 66 VAL H H 428 8.624 8.624 8.355 0.269 18002
10377 1 17 . 1 1 67 67 THR N N 429 124.132 124.132 123.169 0.963 18002
10378 1 17 . 1 1 67 67 THR CA C 429 59.338 59.338 60.361 -1.022 18002
10379 1 17 . 1 1 67 67 THR CB C 429 72.021 72.021 69.487 2.534 18002
10380 1 17 . 1 1 67 67 THR H H 429 9.247 9.247 8.264 0.983 18002
10381 1 17 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.773 -0.124 18002
10382 1 17 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.334 0.404 18002
10383 1 17 . 1 1 68 68 PRO CB C 430 33.568 33.568 33.304 0.264 18002
10384 1 17 . 1 1 69 69 ASP N N 431 122.066 122.066 120.869 1.197 18002
10385 1 17 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.729 -0.082 18002
10386 1 17 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.895 -0.226 18002
10387 1 17 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.797 -0.692 18002
10388 1 17 . 1 1 69 69 ASP H H 431 8.250 8.250 8.627 -0.377 18002
10389 1 17 . 1 1 70 70 VAL N N 432 121.874 121.874 124.079 -2.205 18002
10390 1 17 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.658 -0.159 18002
10391 1 17 . 1 1 70 70 VAL CA C 432 60.088 60.088 59.914 0.174 18002
10392 1 17 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.015 1.017 18002
10393 1 17 . 1 1 70 70 VAL H H 432 8.305 8.305 8.176 0.129 18002
10394 1 17 . 1 1 71 71 ASN N N 433 124.366 124.366 127.718 -3.352 18002
10395 1 17 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.918 -0.236 18002
10396 1 17 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.465 0.296 18002
10397 1 17 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.173 1.106 18002
10398 1 17 . 1 1 71 71 ASN H H 433 8.637 8.637 8.359 0.278 18002
10399 1 17 . 1 1 72 72 ILE N N 434 126.786 126.786 123.974 2.812 18002
10400 1 17 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.579 -0.208 18002
10401 1 17 . 1 1 72 72 ILE CA C 434 64.518 64.518 64.091 0.427 18002
10402 1 17 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.683 -0.508 18002
10403 1 17 . 1 1 72 72 ILE H H 434 8.943 8.943 8.641 0.302 18002
10404 1 17 . 1 1 73 73 SER N N 435 118.305 118.305 117.154 1.151 18002
10405 1 17 . 1 1 73 73 SER CA C 435 61.633 61.633 60.974 0.659 18002
10406 1 17 . 1 1 73 73 SER CB C 435 62.435 62.435 63.001 -0.566 18002
10407 1 17 . 1 1 73 73 SER H H 435 8.578 8.578 8.478 0.100 18002
10408 1 17 . 1 1 74 74 GLY N N 436 107.443 107.443 106.430 1.013 18002
10409 1 17 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.727 0.134 18002
10410 1 17 . 1 1 74 74 GLY H H 436 7.620 7.620 7.622 -0.002 18002
10411 1 17 . 1 1 75 75 GLN N N 437 116.895 116.895 117.985 -1.090 18002
10412 1 17 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.808 -0.518 18002
10413 1 17 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.883 -0.182 18002
10414 1 17 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.990 0.755 18002
10415 1 17 . 1 1 75 75 GLN H H 437 7.798 7.798 7.583 0.215 18002
10416 1 17 . 1 1 76 76 LYS N N 438 119.308 119.308 119.826 -0.518 18002
10417 1 17 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.540 -0.398 18002
10418 1 17 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.748 0.295 18002
10419 1 17 . 1 1 76 76 LYS CB C 438 33.945 33.945 31.719 2.226 18002
10420 1 17 . 1 1 76 76 LYS H H 438 7.522 7.522 7.339 0.183 18002
10421 1 17 . 1 1 77 77 PHE N N 439 125.905 125.905 122.707 3.198 18002
10422 1 17 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.075 0.136 18002
10423 1 17 . 1 1 77 77 PHE CA C 439 55.639 55.639 57.727 -2.088 18002
10424 1 17 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.077 0.852 18002
10425 1 17 . 1 1 77 77 PHE H H 439 8.461 8.461 8.158 0.303 18002
10426 1 17 . 1 1 78 78 ASN N N 440 120.787 120.787 122.699 -1.912 18002
10427 1 17 . 1 1 78 78 ASN CA C 440 51.913 51.913 51.807 0.105 18002
10428 1 17 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.469 0.334 18002
10429 1 17 . 1 1 78 78 ASN H H 440 7.638 7.638 8.135 -0.497 18002
10430 1 17 . 1 1 79 79 ILE N N 441 123.421 123.421 127.101 -3.680 18002
10431 1 17 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.213 -0.042 18002
10432 1 17 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.861 1.706 18002
10433 1 17 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.588 1.899 18002
10434 1 17 . 1 1 79 79 ILE H H 441 9.550 9.550 8.001 1.549 18002
10435 1 17 . 1 1 80 80 LYS N N 442 126.267 126.267 130.545 -4.278 18002
10436 1 17 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.234 0.228 18002
10437 1 17 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.979 1.404 18002
10438 1 17 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.683 0.304 18002
10439 1 17 . 1 1 80 80 LYS H H 442 8.703 8.703 7.961 0.742 18002
10440 1 17 . 1 1 81 81 LEU N N 443 125.194 125.194 128.037 -2.843 18002
10441 1 17 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.623 0.649 18002
10442 1 17 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.732 -0.383 18002
10443 1 17 . 1 1 81 81 LEU CB C 443 44.704 44.704 42.532 2.172 18002
10444 1 17 . 1 1 81 81 LEU H H 443 9.223 9.223 8.370 0.853 18002
10445 1 17 . 1 1 82 82 LEU N N 444 122.753 122.753 126.373 -3.620 18002
10446 1 17 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.067 -0.053 18002
10447 1 17 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.386 0.532 18002
10448 1 17 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.188 -2.564 18002
10449 1 17 . 1 1 82 82 LEU H H 444 8.420 8.420 8.286 0.134 18002
10450 1 17 . 1 1 83 83 ILE N N 445 125.584 125.584 123.310 2.274 18002
10451 1 17 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.045 0.240 18002
10452 1 17 . 1 1 83 83 ILE CB C 445 41.036 41.036 42.630 -1.593 18002
10453 1 17 . 1 1 83 83 ILE H H 445 9.010 9.010 7.935 1.075 18002
10454 1 17 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.851 0.068 18002
10455 1 17 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.325 1.708 18002
10456 1 17 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.140 0.807 18002
10457 1 17 . 1 1 85 85 VAL N N 447 119.780 119.780 117.442 2.338 18002
10458 1 17 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.545 -0.042 18002
10459 1 17 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.584 0.758 18002
10460 1 17 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.553 0.713 18002
10461 1 17 . 1 1 85 85 VAL H H 447 8.304 8.304 8.537 -0.233 18002
10462 1 17 . 1 1 86 86 ALA N N 448 125.178 125.178 122.600 2.578 18002
10463 1 17 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.108 -0.133 18002
10464 1 17 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.795 0.766 18002
10465 1 17 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.250 -0.262 18002
10466 1 17 . 1 1 86 86 ALA H H 448 8.526 8.526 8.526 0.000 18002
10467 1 17 . 1 1 87 87 GLU N N 449 114.625 114.625 117.771 -3.146 18002
10468 1 17 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.134 0.156 18002
10469 1 17 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.422 -0.691 18002
10470 1 17 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.870 -0.610 18002
10471 1 17 . 1 1 87 87 GLU H H 449 8.402 8.402 8.640 -0.238 18002
10472 1 17 . 1 1 88 88 GLY N N 450 109.432 109.432 106.008 3.424 18002
10473 1 17 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.778 1.059 18002
10474 1 17 . 1 1 88 88 GLY H H 450 7.711 7.711 7.418 0.293 18002
10475 1 17 . 1 1 89 89 MET N N 451 121.382 121.382 120.325 1.057 18002
10476 1 17 . 1 1 89 89 MET HA H 451 5.076 5.076 5.199 -0.123 18002
10477 1 17 . 1 1 89 89 MET CA C 451 53.860 53.860 54.313 -0.453 18002
10478 1 17 . 1 1 89 89 MET CB C 451 35.942 35.942 37.131 -1.189 18002
10479 1 17 . 1 1 89 89 MET H H 451 8.355 8.355 7.885 0.470 18002
10480 1 17 . 1 1 90 90 ASN N N 452 123.538 123.538 121.127 2.411 18002
10481 1 17 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.832 0.121 18002
10482 1 17 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.354 -0.606 18002
10483 1 17 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.757 1.885 18002
10484 1 17 . 1 1 90 90 ASN H H 452 9.338 9.338 8.643 0.695 18002
10485 1 17 . 1 1 91 91 GLU N N 453 125.978 125.978 123.378 2.600 18002
10486 1 17 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.305 1.039 18002
10487 1 17 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.006 -0.733 18002
10488 1 17 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.713 1.030 18002
10489 1 17 . 1 1 91 91 GLU H H 453 8.168 8.168 8.414 -0.246 18002
10490 1 17 . 1 1 92 92 ILE N N 454 126.776 126.776 123.848 2.928 18002
10491 1 17 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.315 0.251 18002
10492 1 17 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.026 1.022 18002
10493 1 17 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.531 1.732 18002
10494 1 17 . 1 1 92 92 ILE H H 454 9.000 9.000 8.246 0.754 18002
10495 1 17 . 1 1 93 93 TRP N N 455 125.987 125.987 126.282 -0.295 18002
10496 1 17 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.358 -0.766 18002
10497 1 17 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.514 -1.724 18002
10498 1 17 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.799 0.587 18002
10499 1 17 . 1 1 93 93 TRP H H 455 9.278 9.278 8.237 1.041 18002
10500 1 17 . 1 1 94 94 LEU N N 456 120.912 120.912 123.809 -2.897 18002
10501 1 17 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.029 0.333 18002
10502 1 17 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.568 -0.352 18002
10503 1 17 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.155 0.439 18002
10504 1 17 . 1 1 94 94 LEU H H 456 9.534 9.534 8.042 1.492 18002
10505 1 17 . 1 1 95 95 ARG N N 457 123.669 123.669 121.841 1.828 18002
10506 1 17 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.904 0.367 18002
10507 1 17 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.286 0.131 18002
10508 1 17 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.812 0.450 18002
10509 1 17 . 1 1 95 95 ARG H H 457 9.439 9.439 8.142 1.297 18002
10510 1 17 . 1 1 96 96 CYS N N 458 125.273 125.273 119.497 5.776 18002
10511 1 17 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.546 0.152 18002
10512 1 17 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.574 0.218 18002
10513 1 17 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.802 -1.399 18002
10514 1 17 . 1 1 96 96 CYS H H 458 8.652 8.652 8.367 0.285 18002
10515 1 17 . 1 1 97 97 ASP N N 459 119.661 119.661 118.531 1.130 18002
10516 1 17 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.636 0.104 18002
10517 1 17 . 1 1 97 97 ASP CA C 459 56.228 56.228 53.315 2.913 18002
10518 1 17 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.596 1.989 18002
10519 1 17 . 1 1 97 97 ASP H H 459 9.116 9.116 8.135 0.981 18002
10520 1 17 . 1 1 98 98 ASN N N 460 109.173 109.173 115.312 -6.139 18002
10521 1 17 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.637 -0.265 18002
10522 1 17 . 1 1 98 98 ASN CA C 460 52.014 52.014 51.815 0.199 18002
10523 1 17 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.841 0.970 18002
10524 1 17 . 1 1 98 98 ASN H H 460 7.054 7.054 6.505 0.549 18002
10525 1 17 . 1 1 99 99 GLU N N 461 119.220 119.220 120.118 -0.898 18002
10526 1 17 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.061 -0.017 18002
10527 1 17 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.825 -0.057 18002
10528 1 17 . 1 1 99 99 GLU H H 461 8.937 8.937 8.877 0.060 18002
10529 1 17 . 1 1 100 100 LYS N N 462 120.647 120.647 119.848 0.799 18002
10530 1 17 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.996 0.649 18002
10531 1 17 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.732 0.804 18002
10532 1 17 . 1 1 100 100 LYS CB C 462 32.228 32.228 32.131 0.097 18002
10533 1 17 . 1 1 100 100 LYS H H 462 8.033 8.033 8.321 -0.288 18002
10534 1 17 . 1 1 101 101 GLN N N 463 121.938 121.938 117.956 3.982 18002
10535 1 17 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.277 0.123 18002
10536 1 17 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.461 -0.066 18002
10537 1 17 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.178 4.036 18002
10538 1 17 . 1 1 101 101 GLN H H 463 8.372 8.372 8.155 0.217 18002
10539 1 17 . 1 1 102 102 TYR N N 464 117.422 117.422 120.966 -3.544 18002
10540 1 17 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.167 0.449 18002
10541 1 17 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.537 0.140 18002
10542 1 17 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.336 0.523 18002
10543 1 17 . 1 1 102 102 TYR H H 464 8.221 8.221 7.761 0.460 18002
10544 1 17 . 1 1 103 103 ALA N N 465 120.655 120.655 119.147 1.508 18002
10545 1 17 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.983 -0.268 18002
10546 1 17 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.569 1.344 18002
10547 1 17 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.232 0.570 18002
10548 1 17 . 1 1 103 103 ALA H H 465 8.637 8.637 8.244 0.393 18002
10549 1 17 . 1 1 104 104 HIS N N 466 112.871 112.871 116.139 -3.268 18002
10550 1 17 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.552 -0.411 18002
10551 1 17 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.448 1.179 18002
10552 1 17 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.083 -1.225 18002
10553 1 17 . 1 1 104 104 HIS H H 466 7.852 7.852 7.975 -0.123 18002
10554 1 17 . 1 1 105 105 TRP N N 467 121.317 121.317 119.461 1.856 18002
10555 1 17 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.358 -0.663 18002
10556 1 17 . 1 1 105 105 TRP CA C 467 62.342 62.342 62.138 0.204 18002
10557 1 17 . 1 1 105 105 TRP CB C 467 27.505 27.505 28.910 -1.405 18002
10558 1 17 . 1 1 105 105 TRP H H 467 8.668 8.668 8.014 0.654 18002
10559 1 17 . 1 1 106 106 MET N N 468 122.346 122.346 117.645 4.701 18002
10560 1 17 . 1 1 106 106 MET HA H 468 4.086 4.086 3.939 0.147 18002
10561 1 17 . 1 1 106 106 MET CA C 468 58.743 58.743 59.063 -0.320 18002
10562 1 17 . 1 1 106 106 MET CB C 468 31.402 31.402 31.915 -0.513 18002
10563 1 17 . 1 1 106 106 MET H H 468 9.790 9.790 8.092 1.698 18002
10564 1 17 . 1 1 107 107 ALA N N 469 119.758 119.758 121.670 -1.912 18002
10565 1 17 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.168 -0.463 18002
10566 1 17 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.150 1.979 18002
10567 1 17 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.485 1.919 18002
10568 1 17 . 1 1 107 107 ALA H H 469 7.702 7.702 7.648 0.054 18002
10569 1 17 . 1 1 108 108 ALA N N 470 119.233 119.233 122.944 -3.711 18002
10570 1 17 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.843 -0.297 18002
10571 1 17 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.392 0.429 18002
10572 1 17 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.879 -1.147 18002
10573 1 17 . 1 1 108 108 ALA H H 470 7.156 7.156 8.415 -1.259 18002
10574 1 17 . 1 1 109 109 CYS N N 471 116.736 116.736 115.793 0.943 18002
10575 1 17 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.004 0.053 18002
10576 1 17 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.184 3.387 18002
10577 1 17 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.796 0.597 18002
10578 1 17 . 1 1 109 109 CYS H H 471 8.256 8.256 8.276 -0.020 18002
10579 1 17 . 1 1 110 110 ARG N N 472 118.644 118.644 121.566 -2.922 18002
10580 1 17 . 1 1 110 110 ARG HA H 472 3.734 3.734 3.905 -0.171 18002
10581 1 17 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.294 0.910 18002
10582 1 17 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.969 0.348 18002
10583 1 17 . 1 1 110 110 ARG H H 472 8.403 8.403 7.351 1.052 18002
10584 1 17 . 1 1 111 111 LEU N N 473 121.877 121.877 119.887 1.990 18002
10585 1 17 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.974 -0.174 18002
10586 1 17 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.310 2.545 18002
10587 1 17 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.051 -0.631 18002
10588 1 17 . 1 1 111 111 LEU H H 473 7.916 7.916 8.433 -0.517 18002
10589 1 17 . 1 1 112 112 ALA N N 474 122.765 122.765 121.839 0.926 18002
10590 1 17 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.260 0.220 18002
10591 1 17 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.697 0.564 18002
10592 1 17 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.000 1.875 18002
10593 1 17 . 1 1 112 112 ALA H H 474 8.393 8.393 8.875 -0.482 18002
10594 1 17 . 1 1 113 113 SER N N 475 113.613 113.613 113.777 -0.164 18002
10595 1 17 . 1 1 113 113 SER HA H 475 4.782 4.782 4.083 0.699 18002
10596 1 17 . 1 1 113 113 SER CA C 475 61.090 61.090 61.294 -0.204 18002
10597 1 17 . 1 1 113 113 SER CB C 475 63.612 63.612 63.078 0.534 18002
10598 1 17 . 1 1 113 113 SER H H 475 8.150 8.150 8.036 0.114 18002
10599 1 17 . 1 1 114 114 LYS N N 476 118.734 118.734 116.019 2.715 18002
10600 1 17 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.227 0.326 18002
10601 1 17 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.492 -1.348 18002
10602 1 17 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.391 0.200 18002
10603 1 17 . 1 1 114 114 LYS H H 476 7.239 7.239 7.838 -0.599 18002
10604 1 17 . 1 1 115 115 GLY N N 477 107.818 107.818 109.009 -1.191 18002
10605 1 17 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.395 0.591 18002
10606 1 17 . 1 1 115 115 GLY H H 477 8.401 8.401 8.452 -0.051 18002
10607 1 17 . 1 1 116 116 LYS N N 478 120.938 120.938 122.619 -1.681 18002
10608 1 17 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.389 0.184 18002
10609 1 17 . 1 1 116 116 LYS CA C 478 54.847 54.847 55.671 -0.824 18002
10610 1 17 . 1 1 116 116 LYS CB C 478 35.321 35.321 33.560 1.761 18002
10611 1 17 . 1 1 116 116 LYS H H 478 8.142 8.142 8.021 0.121 18002
10612 1 17 . 1 1 117 117 THR N N 479 108.076 108.076 111.451 -3.375 18002
10613 1 17 . 1 1 117 117 THR HA H 479 4.671 4.671 4.262 0.409 18002
10614 1 17 . 1 1 117 117 THR CA C 479 59.191 59.191 60.808 -1.617 18002
10615 1 17 . 1 1 117 117 THR CB C 479 72.228 72.228 69.533 2.695 18002
10616 1 17 . 1 1 117 117 THR H H 479 7.926 7.926 7.985 -0.059 18002
10617 1 17 . 1 1 118 118 MET N N 480 116.403 116.403 119.992 -3.589 18002
10618 1 17 . 1 1 118 118 MET HA H 480 3.352 3.352 4.481 -1.129 18002
10619 1 17 . 1 1 118 118 MET CA C 480 57.947 57.947 55.513 2.434 18002
10620 1 17 . 1 1 118 118 MET CB C 480 33.920 33.920 30.358 3.562 18002
10621 1 17 . 1 1 118 118 MET H H 480 8.899 8.899 8.484 0.415 18002
10622 1 17 . 1 1 119 119 ALA N N 481 117.786 117.786 120.633 -2.847 18002
10623 1 17 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.360 -0.276 18002
10624 1 17 . 1 1 119 119 ALA CA C 481 52.595 52.595 52.205 0.390 18002
10625 1 17 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.298 -0.236 18002
10626 1 17 . 1 1 119 119 ALA H H 481 7.645 7.645 7.915 -0.270 18002
10627 1 17 . 1 1 120 120 ASP N N 482 120.348 120.348 119.651 0.697 18002
10628 1 17 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.437 3.179 18002
10629 1 17 . 1 1 120 120 ASP H H 482 7.887 7.887 7.512 0.375 18002
10630 1 17 . 1 1 121 121 SER HA H 483 4.223 4.223 4.020 0.203 18002
10631 1 17 . 1 1 121 121 SER CA C 483 61.455 61.455 61.258 0.197 18002
10632 1 17 . 1 1 121 121 SER CB C 483 62.996 62.996 63.053 -0.057 18002
10633 1 17 . 1 1 122 122 SER N N 484 116.845 116.845 116.886 -0.041 18002
10634 1 17 . 1 1 122 122 SER HA H 484 4.321 4.321 4.204 0.117 18002
10635 1 17 . 1 1 122 122 SER CA C 484 60.584 60.584 60.426 0.158 18002
10636 1 17 . 1 1 122 122 SER CB C 484 64.314 64.314 62.495 1.819 18002
10637 1 17 . 1 1 122 122 SER H H 484 8.875 8.875 7.963 0.912 18002
10638 1 17 . 1 1 123 123 TYR N N 485 124.153 124.153 121.496 2.657 18002
10639 1 17 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.337 -0.457 18002
10640 1 17 . 1 1 123 123 TYR CA C 485 63.314 63.314 59.526 3.788 18002
10641 1 17 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.493 0.248 18002
10642 1 17 . 1 1 123 123 TYR H H 485 8.018 8.018 6.976 1.042 18002
10643 1 17 . 1 1 124 124 ASN N N 486 115.339 115.339 117.647 -2.308 18002
10644 1 17 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.402 -0.461 18002
10645 1 17 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.995 0.711 18002
10646 1 17 . 1 1 124 124 ASN CB C 486 38.056 38.056 38.031 0.025 18002
10647 1 17 . 1 1 124 124 ASN H H 486 8.665 8.665 8.471 0.194 18002
10648 1 17 . 1 1 125 125 LEU N N 487 119.454 119.454 119.609 -0.155 18002
10649 1 17 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.148 -0.210 18002
10650 1 17 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.736 -0.066 18002
10651 1 17 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.945 -0.377 18002
10652 1 17 . 1 1 125 125 LEU H H 487 7.105 7.105 7.595 -0.490 18002
10653 1 17 . 1 1 126 126 GLU N N 488 121.189 121.189 118.660 2.529 18002
10654 1 17 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.996 0.034 18002
10655 1 17 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.395 -0.360 18002
10656 1 17 . 1 1 126 126 GLU CB C 488 29.085 29.085 28.526 0.559 18002
10657 1 17 . 1 1 126 126 GLU H H 488 8.053 8.053 7.960 0.093 18002
10658 1 17 . 1 1 127 127 VAL N N 489 119.073 119.073 116.284 2.789 18002
10659 1 17 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.847 -0.829 18002
10660 1 17 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.321 2.001 18002
10661 1 17 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.571 0.088 18002
10662 1 17 . 1 1 127 127 VAL H H 489 7.769 7.769 7.174 0.595 18002
10663 1 17 . 1 1 128 128 GLN N N 490 116.214 116.214 118.910 -2.696 18002
10664 1 17 . 1 1 128 128 GLN HA H 490 3.832 3.832 3.936 -0.104 18002
10665 1 17 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.716 0.040 18002
10666 1 17 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.529 0.583 18002
10667 1 17 . 1 1 128 128 GLN H H 490 7.542 7.542 7.834 -0.292 18002
10668 1 17 . 1 1 129 129 ASN N N 491 120.003 120.003 116.833 3.170 18002
10669 1 17 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.628 -0.209 18002
10670 1 17 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.788 0.372 18002
10671 1 17 . 1 1 129 129 ASN CB C 491 38.060 38.060 39.486 -1.426 18002
10672 1 17 . 1 1 129 129 ASN H H 491 8.582 8.582 7.688 0.894 18002
10673 1 17 . 1 1 130 130 ILE N N 492 122.365 122.365 119.671 2.694 18002
10674 1 17 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.842 1.911 18002
10675 1 17 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.179 0.967 18002
10676 1 17 . 1 1 130 130 ILE H H 492 8.186 8.186 8.218 -0.032 18002
10677 1 17 . 1 1 131 131 LEU N N 493 119.597 119.597 121.685 -2.088 18002
10678 1 17 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.140 -0.135 18002
10679 1 17 . 1 1 131 131 LEU CA C 493 58.859 58.859 57.794 1.065 18002
10680 1 17 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.619 -0.083 18002
10681 1 17 . 1 1 131 131 LEU H H 493 8.224 8.224 7.494 0.730 18002
10682 1 17 . 1 1 132 132 SER N N 494 114.884 114.884 113.490 1.394 18002
10683 1 17 . 1 1 132 132 SER HA H 494 4.430 4.430 4.194 0.236 18002
10684 1 17 . 1 1 132 132 SER CA C 494 62.072 62.072 61.439 0.633 18002
10685 1 17 . 1 1 132 132 SER CB C 494 62.703 62.703 62.583 0.120 18002
10686 1 17 . 1 1 132 132 SER H H 494 8.464 8.464 7.805 0.659 18002
10687 1 17 . 1 1 133 133 PHE N N 495 123.047 123.047 122.432 0.615 18002
10688 1 17 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.216 0.161 18002
10689 1 17 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.822 -0.909 18002
10690 1 17 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.294 -0.244 18002
10691 1 17 . 1 1 133 133 PHE H H 495 7.915 7.915 7.778 0.137 18002
10692 1 17 . 1 1 134 134 LEU N N 496 119.311 119.311 118.394 0.917 18002
10693 1 17 . 1 1 134 134 LEU HA H 496 3.905 3.905 3.908 -0.003 18002
10694 1 17 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.171 0.430 18002
10695 1 17 . 1 1 134 134 LEU CB C 496 41.901 41.901 40.020 1.881 18002
10696 1 17 . 1 1 134 134 LEU H H 496 8.386 8.386 7.966 0.420 18002
10697 1 17 . 1 1 135 135 LYS N N 497 117.550 117.550 119.758 -2.208 18002
10698 1 17 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.067 -0.127 18002
10699 1 17 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.802 -0.527 18002
10700 1 17 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.809 -0.315 18002
10701 1 17 . 1 1 135 135 LYS H H 497 7.670 7.670 7.495 0.175 18002
10702 1 17 . 1 1 136 136 MET N N 498 116.106 116.106 114.547 1.559 18002
10703 1 17 . 1 1 136 136 MET HA H 498 4.354 4.354 4.721 -0.367 18002
10704 1 17 . 1 1 136 136 MET CA C 498 55.994 55.994 54.635 1.359 18002
10705 1 17 . 1 1 136 136 MET CB C 498 32.772 32.772 32.252 0.520 18002
10706 1 17 . 1 1 136 136 MET H H 498 7.421 7.421 7.946 -0.525 18002
10707 1 17 . 1 1 137 137 GLN N N 499 118.651 118.651 120.834 -2.183 18002
10708 1 17 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.222 -0.038 18002
10709 1 17 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.120 -1.812 18002
10710 1 17 . 1 1 137 137 GLN H H 499 7.617 7.617 7.634 -0.017 18002
10711 1 18 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.541 -0.416 18002
10712 1 18 . 1 1 3 3 HIS CA C 365 55.015 55.015 55.126 -0.111 18002
10713 1 18 . 1 1 3 3 HIS CB C 365 31.929 31.929 28.624 3.305 18002
10714 1 18 . 1 1 4 4 MET N N 366 120.431 120.431 122.235 -1.804 18002
10715 1 18 . 1 1 4 4 MET HA H 366 4.345 4.345 4.396 -0.051 18002
10716 1 18 . 1 1 4 4 MET CA C 366 55.337 55.337 56.059 -0.722 18002
10717 1 18 . 1 1 4 4 MET CB C 366 32.668 32.668 32.796 -0.128 18002
10718 1 18 . 1 1 4 4 MET H H 366 8.373 8.373 7.927 0.446 18002
10719 1 18 . 1 1 5 5 GLY N N 367 109.318 109.318 111.372 -2.054 18002
10720 1 18 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.220 0.237 18002
10721 1 18 . 1 1 5 5 GLY H H 367 8.224 8.224 8.432 -0.208 18002
10722 1 18 . 1 1 6 6 ASP N N 368 120.307 120.307 119.036 1.271 18002
10723 1 18 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.784 -0.184 18002
10724 1 18 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.421 1.092 18002
10725 1 18 . 1 1 6 6 ASP CB C 368 41.326 41.326 40.938 0.388 18002
10726 1 18 . 1 1 6 6 ASP H H 368 8.199 8.199 8.300 -0.101 18002
10727 1 18 . 1 1 7 7 ILE N N 369 120.668 120.668 120.026 0.642 18002
10728 1 18 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.093 0.125 18002
10729 1 18 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.024 -0.440 18002
10730 1 18 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.084 0.684 18002
10731 1 18 . 1 1 7 7 ILE H H 369 8.138 8.138 7.831 0.307 18002
10732 1 18 . 1 1 8 8 THR N N 370 117.564 117.564 115.601 1.963 18002
10733 1 18 . 1 1 8 8 THR HA H 370 4.322 4.322 4.357 -0.035 18002
10734 1 18 . 1 1 8 8 THR CA C 370 62.332 62.332 61.122 1.210 18002
10735 1 18 . 1 1 8 8 THR CB C 370 69.946 69.946 67.446 2.500 18002
10736 1 18 . 1 1 8 8 THR H H 370 8.230 8.230 7.888 0.342 18002
10737 1 18 . 1 1 9 9 SER N N 371 118.467 118.467 119.485 -1.018 18002
10738 1 18 . 1 1 9 9 SER HA H 371 4.445 4.445 4.390 0.055 18002
10739 1 18 . 1 1 9 9 SER CA C 371 58.274 58.274 58.144 0.130 18002
10740 1 18 . 1 1 9 9 SER CB C 371 63.996 63.996 63.196 0.800 18002
10741 1 18 . 1 1 9 9 SER H H 371 8.158 8.158 8.047 0.111 18002
10742 1 18 . 1 1 10 10 ILE N N 372 123.959 123.959 121.357 2.602 18002
10743 1 18 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.107 -4.391 18002
10744 1 18 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.644 2.275 18002
10745 1 18 . 1 1 10 10 ILE H H 372 8.112 8.112 7.992 0.120 18002
10746 1 18 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.706 -0.354 18002
10747 1 18 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.563 1.618 18002
10748 1 18 . 1 1 11 11 PRO CB C 373 31.707 31.707 31.169 0.538 18002
10749 1 18 . 1 1 12 12 GLU N N 374 119.349 119.349 122.401 -3.052 18002
10750 1 18 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.466 0.321 18002
10751 1 18 . 1 1 12 12 GLU CA C 374 55.317 55.317 56.292 -0.975 18002
10752 1 18 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.665 2.926 18002
10753 1 18 . 1 1 12 12 GLU H H 374 8.017 8.017 8.241 -0.224 18002
10754 1 18 . 1 1 13 13 LEU N N 375 122.288 122.288 125.449 -3.161 18002
10755 1 18 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.714 -0.236 18002
10756 1 18 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.987 -1.057 18002
10757 1 18 . 1 1 13 13 LEU CB C 375 44.656 44.656 42.832 1.824 18002
10758 1 18 . 1 1 13 13 LEU H H 375 8.036 8.036 8.432 -0.396 18002
10759 1 18 . 1 1 14 14 ALA N N 376 125.461 125.461 128.307 -2.846 18002
10760 1 18 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.625 0.621 18002
10761 1 18 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.756 -0.011 18002
10762 1 18 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.218 -0.632 18002
10763 1 18 . 1 1 14 14 ALA H H 376 8.181 8.181 8.225 -0.044 18002
10764 1 18 . 1 1 15 15 ASP N N 377 122.242 122.242 120.129 2.113 18002
10765 1 18 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.860 -0.541 18002
10766 1 18 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.403 0.349 18002
10767 1 18 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.349 2.291 18002
10768 1 18 . 1 1 15 15 ASP H H 377 8.326 8.326 8.937 -0.611 18002
10769 1 18 . 1 1 16 16 TYR N N 378 118.961 118.961 119.448 -0.487 18002
10770 1 18 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.911 0.480 18002
10771 1 18 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.480 3.101 18002
10772 1 18 . 1 1 16 16 TYR CB C 378 39.023 39.023 37.756 1.267 18002
10773 1 18 . 1 1 16 16 TYR H H 378 8.869 8.869 7.635 1.234 18002
10774 1 18 . 1 1 17 17 ILE N N 379 125.214 125.214 119.556 5.658 18002
10775 1 18 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.550 -0.220 18002
10776 1 18 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.638 0.094 18002
10777 1 18 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.635 -0.659 18002
10778 1 18 . 1 1 17 17 ILE H H 379 8.608 8.608 7.630 0.978 18002
10779 1 18 . 1 1 18 18 LYS N N 380 122.917 122.917 119.839 3.078 18002
10780 1 18 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.938 0.174 18002
10781 1 18 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.192 1.644 18002
10782 1 18 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.194 0.831 18002
10783 1 18 . 1 1 18 18 LYS H H 380 7.424 7.424 8.477 -1.053 18002
10784 1 18 . 1 1 19 19 VAL N N 381 122.839 122.839 120.459 2.380 18002
10785 1 18 . 1 1 19 19 VAL HA H 381 5.263 5.263 5.177 0.086 18002
10786 1 18 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.005 1.511 18002
10787 1 18 . 1 1 19 19 VAL CB C 381 35.148 35.148 36.133 -0.985 18002
10788 1 18 . 1 1 19 19 VAL H H 381 9.223 9.223 7.889 1.334 18002
10789 1 18 . 1 1 20 20 PHE N N 382 129.509 129.509 121.947 7.562 18002
10790 1 18 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.273 -0.430 18002
10791 1 18 . 1 1 20 20 PHE CA C 382 55.505 55.505 55.899 -0.394 18002
10792 1 18 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.544 2.318 18002
10793 1 18 . 1 1 20 20 PHE H H 382 9.451 9.451 7.877 1.574 18002
10794 1 18 . 1 1 21 21 LYS N N 383 126.417 126.417 124.451 1.966 18002
10795 1 18 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.257 0.584 18002
10796 1 18 . 1 1 21 21 LYS CB C 383 33.219 33.219 34.163 -0.944 18002
10797 1 18 . 1 1 21 21 LYS H H 383 7.582 7.582 8.001 -0.419 18002
10798 1 18 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.724 0.973 18002
10799 1 18 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.744 0.225 18002
10800 1 18 . 1 1 23 23 LYS N N 385 118.026 118.026 120.742 -2.716 18002
10801 1 18 . 1 1 23 23 LYS HA H 385 4.215 4.215 3.894 0.321 18002
10802 1 18 . 1 1 23 23 LYS CA C 385 56.345 56.345 58.925 -2.580 18002
10803 1 18 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.457 0.576 18002
10804 1 18 . 1 1 23 23 LYS H H 385 8.138 8.138 8.222 -0.084 18002
10805 1 18 . 1 1 24 24 LYS N N 386 120.816 120.816 117.799 3.017 18002
10806 1 18 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.359 -0.173 18002
10807 1 18 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.458 -0.596 18002
10808 1 18 . 1 1 24 24 LYS CB C 386 32.827 32.827 31.863 0.963 18002
10809 1 18 . 1 1 24 24 LYS H H 386 7.727 7.727 8.301 -0.574 18002
10810 1 18 . 1 1 25 25 LEU N N 387 121.214 121.214 119.191 2.023 18002
10811 1 18 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.490 -0.322 18002
10812 1 18 . 1 1 25 25 LEU CA C 387 56.508 56.508 55.643 0.865 18002
10813 1 18 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.200 -0.558 18002
10814 1 18 . 1 1 25 25 LEU H H 387 8.241 8.241 7.850 0.391 18002
10815 1 18 . 1 1 26 26 THR N N 388 112.798 112.798 113.180 -0.382 18002
10816 1 18 . 1 1 26 26 THR HA H 388 4.313 4.313 4.181 0.132 18002
10817 1 18 . 1 1 26 26 THR CA C 388 61.795 61.795 62.694 -0.899 18002
10818 1 18 . 1 1 26 26 THR CB C 388 69.875 69.875 68.702 1.173 18002
10819 1 18 . 1 1 26 26 THR H H 388 7.700 7.700 7.933 -0.233 18002
10820 1 18 . 1 1 27 27 LEU N N 389 124.091 124.091 118.347 5.744 18002
10821 1 18 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.369 -0.015 18002
10822 1 18 . 1 1 27 27 LEU CA C 389 55.533 55.533 56.604 -1.071 18002
10823 1 18 . 1 1 27 27 LEU CB C 389 42.298 42.298 41.902 0.396 18002
10824 1 18 . 1 1 27 27 LEU H H 389 8.260 8.260 8.058 0.202 18002
10825 1 18 . 1 1 28 28 LYS N N 390 121.153 121.153 119.952 1.201 18002
10826 1 18 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.425 -0.105 18002
10827 1 18 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.926 -0.716 18002
10828 1 18 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.763 0.912 18002
10829 1 18 . 1 1 28 28 LYS H H 390 8.202 8.202 7.972 0.230 18002
10830 1 18 . 1 1 29 29 GLY N N 391 107.270 107.270 107.409 -0.139 18002
10831 1 18 . 1 1 29 29 GLY CA C 391 44.875 44.875 46.453 -1.578 18002
10832 1 18 . 1 1 29 29 GLY H H 391 7.876 7.876 8.215 -0.339 18002
10833 1 18 . 1 1 30 30 TYR N N 392 118.471 118.471 126.335 -7.864 18002
10834 1 18 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.608 -0.162 18002
10835 1 18 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.175 -0.128 18002
10836 1 18 . 1 1 30 30 TYR CB C 392 39.825 39.825 36.669 3.156 18002
10837 1 18 . 1 1 30 30 TYR H H 392 8.183 8.183 8.343 -0.160 18002
10838 1 18 . 1 1 31 31 LYS N N 393 122.833 122.833 123.127 -0.294 18002
10839 1 18 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.835 -0.320 18002
10840 1 18 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.229 0.945 18002
10841 1 18 . 1 1 31 31 LYS CB C 393 35.720 35.720 34.686 1.034 18002
10842 1 18 . 1 1 31 31 LYS H H 393 8.731 8.731 8.069 0.662 18002
10843 1 18 . 1 1 32 32 GLN N N 394 124.759 124.759 118.494 6.265 18002
10844 1 18 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.724 -0.046 18002
10845 1 18 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.166 1.441 18002
10846 1 18 . 1 1 32 32 GLN CB C 394 31.048 31.048 30.066 0.982 18002
10847 1 18 . 1 1 32 32 GLN H H 394 8.776 8.776 8.524 0.252 18002
10848 1 18 . 1 1 33 33 TYR N N 395 125.112 125.112 125.814 -0.702 18002
10849 1 18 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.736 0.338 18002
10850 1 18 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.865 -0.701 18002
10851 1 18 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.150 2.522 18002
10852 1 18 . 1 1 33 33 TYR H H 395 8.774 8.774 8.306 0.468 18002
10853 1 18 . 1 1 34 34 TRP N N 396 122.638 122.638 126.437 -3.799 18002
10854 1 18 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.550 -0.868 18002
10855 1 18 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.241 2.977 18002
10856 1 18 . 1 1 34 34 TRP CB C 396 29.504 29.504 29.474 0.029 18002
10857 1 18 . 1 1 34 34 TRP H H 396 8.975 8.975 7.980 0.995 18002
10858 1 18 . 1 1 35 35 CYS N N 397 127.146 127.146 123.268 3.878 18002
10859 1 18 . 1 1 35 35 CYS CA C 397 57.367 57.367 56.805 0.562 18002
10860 1 18 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.956 0.750 18002
10861 1 18 . 1 1 35 35 CYS H H 397 8.804 8.804 9.099 -0.295 18002
10862 1 18 . 1 1 36 36 THR N N 398 110.578 110.578 113.819 -3.241 18002
10863 1 18 . 1 1 36 36 THR HA H 398 5.358 5.358 4.969 0.389 18002
10864 1 18 . 1 1 36 36 THR CA C 398 58.704 58.704 60.169 -1.464 18002
10865 1 18 . 1 1 36 36 THR CB C 398 71.833 71.833 71.526 0.307 18002
10866 1 18 . 1 1 36 36 THR H H 398 9.090 9.090 7.977 1.113 18002
10867 1 18 . 1 1 37 37 PHE N N 399 127.322 127.322 129.167 -1.845 18002
10868 1 18 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.866 0.087 18002
10869 1 18 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.046 -0.800 18002
10870 1 18 . 1 1 37 37 PHE CB C 399 42.185 42.185 39.920 2.265 18002
10871 1 18 . 1 1 37 37 PHE H H 399 8.846 8.846 8.095 0.751 18002
10872 1 18 . 1 1 38 38 LYS N N 400 125.391 125.391 126.475 -1.084 18002
10873 1 18 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.397 0.130 18002
10874 1 18 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.797 1.179 18002
10875 1 18 . 1 1 38 38 LYS CB C 400 35.915 35.915 33.600 2.315 18002
10876 1 18 . 1 1 38 38 LYS H H 400 8.252 8.252 7.900 0.352 18002
10877 1 18 . 1 1 39 39 ASP N N 401 125.083 125.083 117.708 7.375 18002
10878 1 18 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.230 -0.152 18002
10879 1 18 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.301 0.182 18002
10880 1 18 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.463 -0.942 18002
10881 1 18 . 1 1 39 39 ASP H H 401 9.408 9.408 8.700 0.708 18002
10882 1 18 . 1 1 40 40 THR N N 402 112.024 112.024 108.259 3.765 18002
10883 1 18 . 1 1 40 40 THR HA H 402 4.767 4.767 4.266 0.501 18002
10884 1 18 . 1 1 40 40 THR CA C 402 60.811 60.811 63.107 -2.296 18002
10885 1 18 . 1 1 40 40 THR CB C 402 68.823 68.823 69.671 -0.848 18002
10886 1 18 . 1 1 40 40 THR H H 402 8.224 8.224 7.718 0.506 18002
10887 1 18 . 1 1 41 41 SER N N 403 116.142 116.142 115.569 0.573 18002
10888 1 18 . 1 1 41 41 SER HA H 403 5.428 5.428 4.441 0.987 18002
10889 1 18 . 1 1 41 41 SER CA C 403 58.297 58.297 57.042 1.255 18002
10890 1 18 . 1 1 41 41 SER CB C 403 66.409 66.409 65.443 0.966 18002
10891 1 18 . 1 1 41 41 SER H H 403 8.197 8.197 7.342 0.855 18002
10892 1 18 . 1 1 42 42 ILE N N 404 122.292 122.292 119.301 2.991 18002
10893 1 18 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.846 0.083 18002
10894 1 18 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.687 1.117 18002
10895 1 18 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.428 0.991 18002
10896 1 18 . 1 1 42 42 ILE H H 404 8.411 8.411 7.615 0.796 18002
10897 1 18 . 1 1 43 43 SER N N 405 122.244 122.244 116.202 6.042 18002
10898 1 18 . 1 1 43 43 SER HA H 405 4.966 4.966 4.847 0.119 18002
10899 1 18 . 1 1 43 43 SER CA C 405 57.735 57.735 57.090 0.645 18002
10900 1 18 . 1 1 43 43 SER CB C 405 65.388 65.388 64.401 0.987 18002
10901 1 18 . 1 1 43 43 SER H H 405 8.752 8.752 8.196 0.556 18002
10902 1 18 . 1 1 44 44 CYS N N 406 120.004 120.004 124.522 -4.518 18002
10903 1 18 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.604 0.363 18002
10904 1 18 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.726 -0.668 18002
10905 1 18 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.157 1.283 18002
10906 1 18 . 1 1 44 44 CYS H H 406 8.470 8.470 8.719 -0.249 18002
10907 1 18 . 1 1 45 45 TYR N N 407 122.704 122.704 128.199 -5.495 18002
10908 1 18 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.472 0.551 18002
10909 1 18 . 1 1 45 45 TYR CA C 407 56.983 56.983 56.998 -0.015 18002
10910 1 18 . 1 1 45 45 TYR CB C 407 41.574 41.574 42.064 -0.490 18002
10911 1 18 . 1 1 45 45 TYR H H 407 10.013 10.013 8.174 1.839 18002
10912 1 18 . 1 1 46 46 LYS N N 408 121.897 121.897 124.105 -2.208 18002
10913 1 18 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.782 -0.436 18002
10914 1 18 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.727 3.292 18002
10915 1 18 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.828 -1.116 18002
10916 1 18 . 1 1 46 46 LYS H H 408 9.734 9.734 8.631 1.103 18002
10917 1 18 . 1 1 47 47 SER N N 409 106.720 106.720 115.691 -8.971 18002
10918 1 18 . 1 1 47 47 SER HA H 409 4.776 4.776 4.837 -0.061 18002
10919 1 18 . 1 1 47 47 SER CA C 409 57.180 57.180 56.956 0.224 18002
10920 1 18 . 1 1 47 47 SER CB C 409 65.870 65.870 64.606 1.264 18002
10921 1 18 . 1 1 47 47 SER H H 409 7.518 7.518 8.131 -0.613 18002
10922 1 18 . 1 1 48 48 LYS N N 410 122.302 122.302 124.985 -2.683 18002
10923 1 18 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.953 1.281 18002
10924 1 18 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.694 0.605 18002
10925 1 18 . 1 1 48 48 LYS H H 410 8.195 8.195 8.933 -0.738 18002
10926 1 18 . 1 1 49 49 GLU N N 411 118.983 118.983 120.113 -1.130 18002
10927 1 18 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.178 0.604 18002
10928 1 18 . 1 1 49 49 GLU CA C 411 59.535 59.535 57.526 2.009 18002
10929 1 18 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.460 -0.772 18002
10930 1 18 . 1 1 49 49 GLU H H 411 8.752 8.752 8.427 0.325 18002
10931 1 18 . 1 1 50 50 GLU N N 412 118.384 118.384 119.556 -1.172 18002
10932 1 18 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.425 0.068 18002
10933 1 18 . 1 1 50 50 GLU CA C 412 55.789 55.789 55.568 0.221 18002
10934 1 18 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.567 1.438 18002
10935 1 18 . 1 1 50 50 GLU H H 412 7.234 7.234 7.602 -0.368 18002
10936 1 18 . 1 1 51 51 SER N N 413 114.767 114.767 117.269 -2.502 18002
10937 1 18 . 1 1 51 51 SER CA C 413 59.764 59.764 61.041 -1.277 18002
10938 1 18 . 1 1 51 51 SER CB C 413 62.965 62.965 63.182 -0.217 18002
10939 1 18 . 1 1 51 51 SER H H 413 7.382 7.382 7.985 -0.603 18002
10940 1 18 . 1 1 52 52 SER N N 414 114.496 114.496 115.006 -0.510 18002
10941 1 18 . 1 1 52 52 SER HA H 414 4.560 4.560 4.568 -0.008 18002
10942 1 18 . 1 1 52 52 SER CA C 414 58.574 58.574 58.022 0.552 18002
10943 1 18 . 1 1 52 52 SER CB C 414 63.829 63.829 63.212 0.617 18002
10944 1 18 . 1 1 52 52 SER H H 414 7.682 7.682 8.289 -0.607 18002
10945 1 18 . 1 1 53 53 GLY N N 415 111.107 111.107 110.378 0.729 18002
10946 1 18 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.823 -0.590 18002
10947 1 18 . 1 1 53 53 GLY H H 415 7.918 7.918 8.035 -0.117 18002
10948 1 18 . 1 1 54 54 THR N N 416 120.214 120.214 115.374 4.840 18002
10949 1 18 . 1 1 54 54 THR CB C 416 70.035 70.035 70.729 -0.694 18002
10950 1 18 . 1 1 54 54 THR H H 416 8.622 8.622 8.131 0.491 18002
10951 1 18 . 1 1 55 55 PRO HA H 417 4.475 4.475 2.988 1.487 18002
10952 1 18 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.359 0.686 18002
10953 1 18 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.119 -0.541 18002
10954 1 18 . 1 1 56 56 ALA N N 418 125.591 125.591 122.227 3.364 18002
10955 1 18 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.103 -0.147 18002
10956 1 18 . 1 1 56 56 ALA CA C 418 54.535 54.535 52.797 1.738 18002
10957 1 18 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.658 -0.751 18002
10958 1 18 . 1 1 56 56 ALA H H 418 8.288 8.288 7.928 0.360 18002
10959 1 18 . 1 1 57 57 HIS N N 419 108.119 108.119 114.717 -6.598 18002
10960 1 18 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.686 -0.064 18002
10961 1 18 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.927 -1.347 18002
10962 1 18 . 1 1 57 57 HIS CB C 419 34.219 34.219 31.641 2.578 18002
10963 1 18 . 1 1 57 57 HIS H H 419 7.072 7.072 7.851 -0.779 18002
10964 1 18 . 1 1 58 58 GLN N N 420 123.083 123.083 118.689 4.394 18002
10965 1 18 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.420 0.735 18002
10966 1 18 . 1 1 58 58 GLN CA C 420 55.504 55.504 53.555 1.949 18002
10967 1 18 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.684 1.806 18002
10968 1 18 . 1 1 58 58 GLN H H 420 8.669 8.669 7.360 1.309 18002
10969 1 18 . 1 1 59 59 MET N N 421 122.330 122.330 120.875 1.455 18002
10970 1 18 . 1 1 59 59 MET HA H 421 4.621 4.621 4.752 -0.131 18002
10971 1 18 . 1 1 59 59 MET CA C 421 54.892 54.892 54.662 0.230 18002
10972 1 18 . 1 1 59 59 MET CB C 421 35.650 35.650 35.651 -0.001 18002
10973 1 18 . 1 1 59 59 MET H H 421 8.995 8.995 7.977 1.018 18002
10974 1 18 . 1 1 60 60 ASN N N 422 123.220 123.220 118.157 5.063 18002
10975 1 18 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.554 0.394 18002
10976 1 18 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.778 -0.147 18002
10977 1 18 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.434 0.305 18002
10978 1 18 . 1 1 60 60 ASN H H 422 8.728 8.728 8.357 0.371 18002
10979 1 18 . 1 1 61 61 LEU N N 423 126.072 126.072 113.130 12.942 18002
10980 1 18 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.343 -0.227 18002
10981 1 18 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.685 0.928 18002
10982 1 18 . 1 1 61 61 LEU CB C 423 42.457 42.457 39.976 2.481 18002
10983 1 18 . 1 1 61 61 LEU H H 423 8.942 8.942 8.587 0.355 18002
10984 1 18 . 1 1 62 62 ARG N N 424 121.977 121.977 118.555 3.422 18002
10985 1 18 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.460 -0.088 18002
10986 1 18 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.457 2.577 18002
10987 1 18 . 1 1 62 62 ARG CB C 424 29.610 29.610 32.058 -2.448 18002
10988 1 18 . 1 1 62 62 ARG H H 424 8.000 8.000 7.516 0.484 18002
10989 1 18 . 1 1 63 63 GLY N N 425 114.852 114.852 112.824 2.028 18002
10990 1 18 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.112 0.698 18002
10991 1 18 . 1 1 63 63 GLY H H 425 9.033 9.033 8.724 0.309 18002
10992 1 18 . 1 1 64 64 CYS N N 426 117.102 117.102 119.852 -2.750 18002
10993 1 18 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.656 0.243 18002
10994 1 18 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.905 0.855 18002
10995 1 18 . 1 1 64 64 CYS CB C 426 28.824 28.824 26.888 1.936 18002
10996 1 18 . 1 1 64 64 CYS H H 426 8.248 8.248 7.705 0.543 18002
10997 1 18 . 1 1 65 65 GLU N N 427 119.501 119.501 124.931 -5.430 18002
10998 1 18 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.412 0.365 18002
10999 1 18 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.489 -0.098 18002
11000 1 18 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.251 0.687 18002
11001 1 18 . 1 1 65 65 GLU H H 427 8.449 8.449 8.689 -0.240 18002
11002 1 18 . 1 1 66 66 VAL N N 428 125.286 125.286 126.756 -1.470 18002
11003 1 18 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.222 0.668 18002
11004 1 18 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.975 -1.223 18002
11005 1 18 . 1 1 66 66 VAL CB C 428 33.975 33.975 33.793 0.182 18002
11006 1 18 . 1 1 66 66 VAL H H 428 8.624 8.624 8.446 0.178 18002
11007 1 18 . 1 1 67 67 THR N N 429 124.132 124.132 123.896 0.236 18002
11008 1 18 . 1 1 67 67 THR CA C 429 59.338 59.338 60.590 -1.252 18002
11009 1 18 . 1 1 67 67 THR CB C 429 72.021 72.021 70.549 1.472 18002
11010 1 18 . 1 1 67 67 THR H H 429 9.247 9.247 8.168 1.079 18002
11011 1 18 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.654 -0.005 18002
11012 1 18 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.716 0.022 18002
11013 1 18 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.782 0.786 18002
11014 1 18 . 1 1 69 69 ASP N N 431 122.066 122.066 122.808 -0.742 18002
11015 1 18 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.916 -0.269 18002
11016 1 18 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.447 0.222 18002
11017 1 18 . 1 1 69 69 ASP CB C 431 42.105 42.105 43.449 -1.344 18002
11018 1 18 . 1 1 69 69 ASP H H 431 8.250 8.250 9.280 -1.030 18002
11019 1 18 . 1 1 70 70 VAL N N 432 121.874 121.874 121.905 -0.031 18002
11020 1 18 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.358 0.141 18002
11021 1 18 . 1 1 70 70 VAL CA C 432 60.088 60.088 61.113 -1.025 18002
11022 1 18 . 1 1 70 70 VAL CB C 432 35.032 35.032 33.221 1.812 18002
11023 1 18 . 1 1 70 70 VAL H H 432 8.305 8.305 8.216 0.089 18002
11024 1 18 . 1 1 71 71 ASN N N 433 124.366 124.366 128.300 -3.934 18002
11025 1 18 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.925 -0.243 18002
11026 1 18 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.713 0.048 18002
11027 1 18 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.089 1.190 18002
11028 1 18 . 1 1 71 71 ASN H H 433 8.637 8.637 8.216 0.421 18002
11029 1 18 . 1 1 72 72 ILE N N 434 126.786 126.786 123.548 3.238 18002
11030 1 18 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.674 -0.303 18002
11031 1 18 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.497 1.021 18002
11032 1 18 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.891 -0.716 18002
11033 1 18 . 1 1 72 72 ILE H H 434 8.943 8.943 8.317 0.626 18002
11034 1 18 . 1 1 73 73 SER N N 435 118.305 118.305 116.473 1.832 18002
11035 1 18 . 1 1 73 73 SER CA C 435 61.633 61.633 60.945 0.688 18002
11036 1 18 . 1 1 73 73 SER CB C 435 62.435 62.435 62.931 -0.496 18002
11037 1 18 . 1 1 73 73 SER H H 435 8.578 8.578 8.327 0.251 18002
11038 1 18 . 1 1 74 74 GLY N N 436 107.443 107.443 106.406 1.037 18002
11039 1 18 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.706 0.155 18002
11040 1 18 . 1 1 74 74 GLY H H 436 7.620 7.620 7.817 -0.197 18002
11041 1 18 . 1 1 75 75 GLN N N 437 116.895 116.895 117.541 -0.646 18002
11042 1 18 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.822 -0.532 18002
11043 1 18 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.716 -0.015 18002
11044 1 18 . 1 1 75 75 GLN CB C 437 26.745 26.745 26.364 0.381 18002
11045 1 18 . 1 1 75 75 GLN H H 437 7.798 7.798 8.075 -0.277 18002
11046 1 18 . 1 1 76 76 LYS N N 438 119.308 119.308 115.229 4.079 18002
11047 1 18 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.434 -0.292 18002
11048 1 18 . 1 1 76 76 LYS CA C 438 55.043 55.043 53.767 1.276 18002
11049 1 18 . 1 1 76 76 LYS CB C 438 33.945 33.945 35.571 -1.626 18002
11050 1 18 . 1 1 76 76 LYS H H 438 7.522 7.522 7.705 -0.183 18002
11051 1 18 . 1 1 77 77 PHE N N 439 125.905 125.905 117.367 8.538 18002
11052 1 18 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.633 -0.422 18002
11053 1 18 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.058 -0.419 18002
11054 1 18 . 1 1 77 77 PHE CB C 439 38.929 38.929 40.908 -1.979 18002
11055 1 18 . 1 1 77 77 PHE H H 439 8.461 8.461 8.640 -0.179 18002
11056 1 18 . 1 1 78 78 ASN N N 440 120.787 120.787 121.396 -0.609 18002
11057 1 18 . 1 1 78 78 ASN CA C 440 51.913 51.913 51.717 0.196 18002
11058 1 18 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.968 -0.165 18002
11059 1 18 . 1 1 78 78 ASN H H 440 7.638 7.638 8.409 -0.771 18002
11060 1 18 . 1 1 79 79 ILE N N 441 123.421 123.421 126.531 -3.110 18002
11061 1 18 . 1 1 79 79 ILE HA H 441 4.171 4.171 3.980 0.191 18002
11062 1 18 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.172 1.395 18002
11063 1 18 . 1 1 79 79 ILE CB C 441 41.487 41.487 36.048 5.439 18002
11064 1 18 . 1 1 79 79 ILE H H 441 9.550 9.550 8.703 0.847 18002
11065 1 18 . 1 1 80 80 LYS N N 442 126.267 126.267 129.230 -2.963 18002
11066 1 18 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.199 0.263 18002
11067 1 18 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.392 1.991 18002
11068 1 18 . 1 1 80 80 LYS CB C 442 32.987 32.987 31.993 0.994 18002
11069 1 18 . 1 1 80 80 LYS H H 442 8.703 8.703 7.935 0.768 18002
11070 1 18 . 1 1 81 81 LEU N N 443 125.194 125.194 125.998 -0.804 18002
11071 1 18 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.675 0.597 18002
11072 1 18 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.345 0.004 18002
11073 1 18 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.355 1.349 18002
11074 1 18 . 1 1 81 81 LEU H H 443 9.223 9.223 7.648 1.575 18002
11075 1 18 . 1 1 82 82 LEU N N 444 122.753 122.753 125.758 -3.005 18002
11076 1 18 . 1 1 82 82 LEU HA H 444 5.014 5.014 4.766 0.248 18002
11077 1 18 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.346 0.571 18002
11078 1 18 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.523 -2.899 18002
11079 1 18 . 1 1 82 82 LEU H H 444 8.420 8.420 7.918 0.502 18002
11080 1 18 . 1 1 83 83 ILE N N 445 125.584 125.584 122.012 3.572 18002
11081 1 18 . 1 1 83 83 ILE CA C 445 58.285 58.285 57.931 0.354 18002
11082 1 18 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.966 -0.930 18002
11083 1 18 . 1 1 83 83 ILE H H 445 9.010 9.010 7.820 1.190 18002
11084 1 18 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.820 0.099 18002
11085 1 18 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.257 1.776 18002
11086 1 18 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.697 0.250 18002
11087 1 18 . 1 1 85 85 VAL N N 447 119.780 119.780 116.307 3.473 18002
11088 1 18 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.526 -0.023 18002
11089 1 18 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.837 0.505 18002
11090 1 18 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.445 0.821 18002
11091 1 18 . 1 1 85 85 VAL H H 447 8.304 8.304 8.551 -0.247 18002
11092 1 18 . 1 1 86 86 ALA N N 448 125.178 125.178 122.341 2.837 18002
11093 1 18 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.134 -0.159 18002
11094 1 18 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.725 0.836 18002
11095 1 18 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.360 -0.372 18002
11096 1 18 . 1 1 86 86 ALA H H 448 8.526 8.526 8.503 0.023 18002
11097 1 18 . 1 1 87 87 GLU N N 449 114.625 114.625 117.584 -2.959 18002
11098 1 18 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.130 0.160 18002
11099 1 18 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.438 -0.707 18002
11100 1 18 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.843 -0.583 18002
11101 1 18 . 1 1 87 87 GLU H H 449 8.402 8.402 8.649 -0.247 18002
11102 1 18 . 1 1 88 88 GLY N N 450 109.432 109.432 106.190 3.242 18002
11103 1 18 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.788 1.049 18002
11104 1 18 . 1 1 88 88 GLY H H 450 7.711 7.711 7.380 0.331 18002
11105 1 18 . 1 1 89 89 MET N N 451 121.382 121.382 120.525 0.857 18002
11106 1 18 . 1 1 89 89 MET HA H 451 5.076 5.076 5.026 0.050 18002
11107 1 18 . 1 1 89 89 MET CA C 451 53.860 53.860 54.602 -0.742 18002
11108 1 18 . 1 1 89 89 MET CB C 451 35.942 35.942 37.312 -1.370 18002
11109 1 18 . 1 1 89 89 MET H H 451 8.355 8.355 8.011 0.344 18002
11110 1 18 . 1 1 90 90 ASN N N 452 123.538 123.538 122.970 0.568 18002
11111 1 18 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.887 0.066 18002
11112 1 18 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.459 -0.710 18002
11113 1 18 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.965 1.677 18002
11114 1 18 . 1 1 90 90 ASN H H 452 9.338 9.338 8.946 0.392 18002
11115 1 18 . 1 1 91 91 GLU N N 453 125.978 125.978 123.653 2.325 18002
11116 1 18 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.136 1.208 18002
11117 1 18 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.319 -1.046 18002
11118 1 18 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.048 1.695 18002
11119 1 18 . 1 1 91 91 GLU H H 453 8.168 8.168 8.105 0.063 18002
11120 1 18 . 1 1 92 92 ILE N N 454 126.776 126.776 123.735 3.041 18002
11121 1 18 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.162 0.404 18002
11122 1 18 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.134 0.914 18002
11123 1 18 . 1 1 92 92 ILE CB C 454 42.262 42.262 40.301 1.961 18002
11124 1 18 . 1 1 92 92 ILE H H 454 9.000 9.000 7.744 1.256 18002
11125 1 18 . 1 1 93 93 TRP N N 455 125.987 125.987 123.867 2.120 18002
11126 1 18 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.747 -0.155 18002
11127 1 18 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.627 -1.837 18002
11128 1 18 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.351 1.035 18002
11129 1 18 . 1 1 93 93 TRP H H 455 9.278 9.278 8.034 1.244 18002
11130 1 18 . 1 1 94 94 LEU N N 456 120.912 120.912 123.570 -2.658 18002
11131 1 18 . 1 1 94 94 LEU HA H 456 5.362 5.362 5.144 0.218 18002
11132 1 18 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.740 -0.524 18002
11133 1 18 . 1 1 94 94 LEU CB C 456 43.594 43.594 42.799 0.795 18002
11134 1 18 . 1 1 94 94 LEU H H 456 9.534 9.534 7.861 1.673 18002
11135 1 18 . 1 1 95 95 ARG N N 457 123.669 123.669 121.781 1.888 18002
11136 1 18 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.511 0.760 18002
11137 1 18 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.922 -0.505 18002
11138 1 18 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.117 1.145 18002
11139 1 18 . 1 1 95 95 ARG H H 457 9.439 9.439 8.373 1.066 18002
11140 1 18 . 1 1 96 96 CYS N N 458 125.273 125.273 123.460 1.813 18002
11141 1 18 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.919 -0.221 18002
11142 1 18 . 1 1 96 96 CYS CA C 458 58.792 58.792 60.080 -1.288 18002
11143 1 18 . 1 1 96 96 CYS CB C 458 30.403 30.403 28.288 2.115 18002
11144 1 18 . 1 1 96 96 CYS H H 458 8.652 8.652 8.639 0.013 18002
11145 1 18 . 1 1 97 97 ASP N N 459 119.661 119.661 123.360 -3.699 18002
11146 1 18 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.797 -0.057 18002
11147 1 18 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.819 1.409 18002
11148 1 18 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.281 1.304 18002
11149 1 18 . 1 1 97 97 ASP H H 459 9.116 9.116 9.111 0.005 18002
11150 1 18 . 1 1 98 98 ASN N N 460 109.173 109.173 114.308 -5.135 18002
11151 1 18 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.570 -0.198 18002
11152 1 18 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.499 -0.485 18002
11153 1 18 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.210 1.601 18002
11154 1 18 . 1 1 98 98 ASN H H 460 7.054 7.054 7.487 -0.433 18002
11155 1 18 . 1 1 99 99 GLU N N 461 119.220 119.220 118.733 0.487 18002
11156 1 18 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.249 0.795 18002
11157 1 18 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.149 0.619 18002
11158 1 18 . 1 1 99 99 GLU H H 461 8.937 8.937 8.539 0.398 18002
11159 1 18 . 1 1 100 100 LYS N N 462 120.647 120.647 119.748 0.899 18002
11160 1 18 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.989 0.656 18002
11161 1 18 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.416 1.120 18002
11162 1 18 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.944 0.284 18002
11163 1 18 . 1 1 100 100 LYS H H 462 8.033 8.033 8.295 -0.262 18002
11164 1 18 . 1 1 101 101 GLN N N 463 121.938 121.938 119.186 2.752 18002
11165 1 18 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.160 0.240 18002
11166 1 18 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.309 0.087 18002
11167 1 18 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.077 4.137 18002
11168 1 18 . 1 1 101 101 GLN H H 463 8.372 8.372 8.105 0.267 18002
11169 1 18 . 1 1 102 102 TYR N N 464 117.422 117.422 120.784 -3.362 18002
11170 1 18 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.032 0.584 18002
11171 1 18 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.331 0.346 18002
11172 1 18 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.179 0.680 18002
11173 1 18 . 1 1 102 102 TYR H H 464 8.221 8.221 7.589 0.632 18002
11174 1 18 . 1 1 103 103 ALA N N 465 120.655 120.655 117.568 3.087 18002
11175 1 18 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.897 -0.182 18002
11176 1 18 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.462 1.451 18002
11177 1 18 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.345 0.457 18002
11178 1 18 . 1 1 103 103 ALA H H 465 8.637 8.637 7.788 0.849 18002
11179 1 18 . 1 1 104 104 HIS N N 466 112.871 112.871 117.952 -5.081 18002
11180 1 18 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.354 -0.213 18002
11181 1 18 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.887 -0.260 18002
11182 1 18 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.138 -1.280 18002
11183 1 18 . 1 1 104 104 HIS H H 466 7.852 7.852 7.697 0.155 18002
11184 1 18 . 1 1 105 105 TRP N N 467 121.317 121.317 118.595 2.722 18002
11185 1 18 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.463 -0.768 18002
11186 1 18 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.774 1.568 18002
11187 1 18 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.006 -1.501 18002
11188 1 18 . 1 1 105 105 TRP H H 467 8.668 8.668 7.783 0.885 18002
11189 1 18 . 1 1 106 106 MET N N 468 122.346 122.346 119.336 3.010 18002
11190 1 18 . 1 1 106 106 MET HA H 468 4.086 4.086 3.973 0.113 18002
11191 1 18 . 1 1 106 106 MET CA C 468 58.743 58.743 58.328 0.416 18002
11192 1 18 . 1 1 106 106 MET CB C 468 31.402 31.402 31.185 0.217 18002
11193 1 18 . 1 1 106 106 MET H H 468 9.790 9.790 7.970 1.820 18002
11194 1 18 . 1 1 107 107 ALA N N 469 119.758 119.758 121.012 -1.254 18002
11195 1 18 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.923 -0.218 18002
11196 1 18 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.548 1.581 18002
11197 1 18 . 1 1 107 107 ALA CB C 469 20.405 20.405 17.990 2.415 18002
11198 1 18 . 1 1 107 107 ALA H H 469 7.702 7.702 7.667 0.035 18002
11199 1 18 . 1 1 108 108 ALA N N 470 119.233 119.233 122.732 -3.499 18002
11200 1 18 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.604 -0.058 18002
11201 1 18 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.150 0.671 18002
11202 1 18 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.832 -1.100 18002
11203 1 18 . 1 1 108 108 ALA H H 470 7.156 7.156 7.508 -0.352 18002
11204 1 18 . 1 1 109 109 CYS N N 471 116.736 116.736 114.558 2.178 18002
11205 1 18 . 1 1 109 109 CYS HA H 471 4.057 4.057 3.992 0.065 18002
11206 1 18 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.127 2.444 18002
11207 1 18 . 1 1 109 109 CYS CB C 471 27.393 27.393 26.919 0.474 18002
11208 1 18 . 1 1 109 109 CYS H H 471 8.256 8.256 8.339 -0.083 18002
11209 1 18 . 1 1 110 110 ARG N N 472 118.644 118.644 118.834 -0.190 18002
11210 1 18 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.136 -0.402 18002
11211 1 18 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.042 2.162 18002
11212 1 18 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.424 -0.107 18002
11213 1 18 . 1 1 110 110 ARG H H 472 8.403 8.403 7.815 0.588 18002
11214 1 18 . 1 1 111 111 LEU N N 473 121.877 121.877 118.125 3.752 18002
11215 1 18 . 1 1 111 111 LEU HA H 473 3.800 3.800 3.938 -0.138 18002
11216 1 18 . 1 1 111 111 LEU CA C 473 59.855 59.855 56.755 3.100 18002
11217 1 18 . 1 1 111 111 LEU CB C 473 40.420 40.420 38.656 1.764 18002
11218 1 18 . 1 1 111 111 LEU H H 473 7.916 7.916 7.200 0.716 18002
11219 1 18 . 1 1 112 112 ALA N N 474 122.765 122.765 122.647 0.118 18002
11220 1 18 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.722 0.758 18002
11221 1 18 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.406 0.855 18002
11222 1 18 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.953 1.922 18002
11223 1 18 . 1 1 112 112 ALA H H 474 8.393 8.393 8.619 -0.226 18002
11224 1 18 . 1 1 113 113 SER N N 475 113.613 113.613 113.108 0.505 18002
11225 1 18 . 1 1 113 113 SER HA H 475 4.782 4.782 4.093 0.689 18002
11226 1 18 . 1 1 113 113 SER CA C 475 61.090 61.090 61.102 -0.012 18002
11227 1 18 . 1 1 113 113 SER CB C 475 63.612 63.612 63.235 0.377 18002
11228 1 18 . 1 1 113 113 SER H H 475 8.150 8.150 7.957 0.193 18002
11229 1 18 . 1 1 114 114 LYS N N 476 118.734 118.734 117.925 0.809 18002
11230 1 18 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.199 0.354 18002
11231 1 18 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.065 -0.921 18002
11232 1 18 . 1 1 114 114 LYS CB C 476 32.591 32.591 31.551 1.040 18002
11233 1 18 . 1 1 114 114 LYS H H 476 7.239 7.239 7.493 -0.254 18002
11234 1 18 . 1 1 115 115 GLY N N 477 107.818 107.818 108.304 -0.486 18002
11235 1 18 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.882 0.104 18002
11236 1 18 . 1 1 115 115 GLY H H 477 8.401 8.401 8.070 0.331 18002
11237 1 18 . 1 1 116 116 LYS N N 478 120.938 120.938 118.957 1.981 18002
11238 1 18 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.857 -0.284 18002
11239 1 18 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.362 0.485 18002
11240 1 18 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.748 -0.427 18002
11241 1 18 . 1 1 116 116 LYS H H 478 8.142 8.142 7.154 0.988 18002
11242 1 18 . 1 1 117 117 THR N N 479 108.076 108.076 115.699 -7.623 18002
11243 1 18 . 1 1 117 117 THR HA H 479 4.671 4.671 4.373 0.298 18002
11244 1 18 . 1 1 117 117 THR CA C 479 59.191 59.191 60.508 -1.317 18002
11245 1 18 . 1 1 117 117 THR CB C 479 72.228 72.228 70.553 1.675 18002
11246 1 18 . 1 1 117 117 THR H H 479 7.926 7.926 8.256 -0.330 18002
11247 1 18 . 1 1 118 118 MET N N 480 116.403 116.403 117.538 -1.135 18002
11248 1 18 . 1 1 118 118 MET HA H 480 3.352 3.352 4.154 -0.802 18002
11249 1 18 . 1 1 118 118 MET CA C 480 57.947 57.947 56.866 1.081 18002
11250 1 18 . 1 1 118 118 MET CB C 480 33.920 33.920 30.832 3.087 18002
11251 1 18 . 1 1 118 118 MET H H 480 8.899 8.899 8.371 0.528 18002
11252 1 18 . 1 1 119 119 ALA N N 481 117.786 117.786 120.876 -3.090 18002
11253 1 18 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.096 -0.012 18002
11254 1 18 . 1 1 119 119 ALA CA C 481 52.595 52.595 54.018 -1.423 18002
11255 1 18 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.838 0.224 18002
11256 1 18 . 1 1 119 119 ALA H H 481 7.645 7.645 7.918 -0.273 18002
11257 1 18 . 1 1 120 120 ASP N N 482 120.348 120.348 115.957 4.391 18002
11258 1 18 . 1 1 120 120 ASP CB C 482 44.616 44.616 39.241 5.375 18002
11259 1 18 . 1 1 120 120 ASP H H 482 7.887 7.887 8.451 -0.564 18002
11260 1 18 . 1 1 121 121 SER HA H 483 4.223 4.223 3.999 0.224 18002
11261 1 18 . 1 1 121 121 SER CA C 483 61.455 61.455 61.615 -0.160 18002
11262 1 18 . 1 1 121 121 SER CB C 483 62.996 62.996 62.931 0.065 18002
11263 1 18 . 1 1 122 122 SER N N 484 116.845 116.845 114.413 2.432 18002
11264 1 18 . 1 1 122 122 SER HA H 484 4.321 4.321 4.393 -0.072 18002
11265 1 18 . 1 1 122 122 SER CA C 484 60.584 60.584 59.542 1.042 18002
11266 1 18 . 1 1 122 122 SER CB C 484 64.314 64.314 63.049 1.265 18002
11267 1 18 . 1 1 122 122 SER H H 484 8.875 8.875 7.732 1.143 18002
11268 1 18 . 1 1 123 123 TYR N N 485 124.153 124.153 120.610 3.543 18002
11269 1 18 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.454 -0.574 18002
11270 1 18 . 1 1 123 123 TYR CA C 485 63.314 63.314 57.622 5.692 18002
11271 1 18 . 1 1 123 123 TYR CB C 485 37.741 37.741 36.781 0.961 18002
11272 1 18 . 1 1 123 123 TYR H H 485 8.018 8.018 7.280 0.738 18002
11273 1 18 . 1 1 124 124 ASN N N 486 115.339 115.339 119.396 -4.057 18002
11274 1 18 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.453 -0.512 18002
11275 1 18 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.440 0.266 18002
11276 1 18 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.788 0.268 18002
11277 1 18 . 1 1 124 124 ASN H H 486 8.665 8.665 8.806 -0.141 18002
11278 1 18 . 1 1 125 125 LEU N N 487 119.454 119.454 119.344 0.110 18002
11279 1 18 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.208 -0.270 18002
11280 1 18 . 1 1 125 125 LEU CA C 487 57.670 57.670 56.799 0.871 18002
11281 1 18 . 1 1 125 125 LEU CB C 487 41.568 41.568 42.145 -0.577 18002
11282 1 18 . 1 1 125 125 LEU H H 487 7.105 7.105 7.628 -0.523 18002
11283 1 18 . 1 1 126 126 GLU N N 488 121.189 121.189 119.621 1.568 18002
11284 1 18 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.986 0.044 18002
11285 1 18 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.544 -0.509 18002
11286 1 18 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.663 -0.578 18002
11287 1 18 . 1 1 126 126 GLU H H 488 8.053 8.053 8.228 -0.175 18002
11288 1 18 . 1 1 127 127 VAL N N 489 119.073 119.073 115.392 3.681 18002
11289 1 18 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.783 -0.765 18002
11290 1 18 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.879 1.443 18002
11291 1 18 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.743 -0.084 18002
11292 1 18 . 1 1 127 127 VAL H H 489 7.769 7.769 8.302 -0.533 18002
11293 1 18 . 1 1 128 128 GLN N N 490 116.214 116.214 117.710 -1.496 18002
11294 1 18 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.148 -0.316 18002
11295 1 18 . 1 1 128 128 GLN CA C 490 58.756 58.756 57.868 0.888 18002
11296 1 18 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.206 -0.094 18002
11297 1 18 . 1 1 128 128 GLN H H 490 7.542 7.542 7.811 -0.269 18002
11298 1 18 . 1 1 129 129 ASN N N 491 120.003 120.003 118.920 1.083 18002
11299 1 18 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.616 -0.197 18002
11300 1 18 . 1 1 129 129 ASN CA C 491 56.160 56.160 56.341 -0.181 18002
11301 1 18 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.764 -0.704 18002
11302 1 18 . 1 1 129 129 ASN H H 491 8.582 8.582 7.662 0.920 18002
11303 1 18 . 1 1 130 130 ILE N N 492 122.365 122.365 119.239 3.126 18002
11304 1 18 . 1 1 130 130 ILE CA C 492 65.753 65.753 64.419 1.334 18002
11305 1 18 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.034 1.112 18002
11306 1 18 . 1 1 130 130 ILE H H 492 8.186 8.186 7.442 0.744 18002
11307 1 18 . 1 1 131 131 LEU N N 493 119.597 119.597 121.385 -1.788 18002
11308 1 18 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.976 0.029 18002
11309 1 18 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.644 0.215 18002
11310 1 18 . 1 1 131 131 LEU CB C 493 41.536 41.536 40.200 1.336 18002
11311 1 18 . 1 1 131 131 LEU H H 493 8.224 8.224 7.746 0.478 18002
11312 1 18 . 1 1 132 132 SER N N 494 114.884 114.884 114.888 -0.004 18002
11313 1 18 . 1 1 132 132 SER HA H 494 4.430 4.430 4.247 0.183 18002
11314 1 18 . 1 1 132 132 SER CA C 494 62.072 62.072 61.707 0.365 18002
11315 1 18 . 1 1 132 132 SER CB C 494 62.703 62.703 62.980 -0.278 18002
11316 1 18 . 1 1 132 132 SER H H 494 8.464 8.464 7.758 0.706 18002
11317 1 18 . 1 1 133 133 PHE N N 495 123.047 123.047 121.263 1.784 18002
11318 1 18 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.185 0.192 18002
11319 1 18 . 1 1 133 133 PHE CA C 495 60.913 60.913 60.809 0.104 18002
11320 1 18 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.765 0.285 18002
11321 1 18 . 1 1 133 133 PHE H H 495 7.915 7.915 7.847 0.068 18002
11322 1 18 . 1 1 134 134 LEU N N 496 119.311 119.311 117.439 1.872 18002
11323 1 18 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.154 -0.249 18002
11324 1 18 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.265 -0.664 18002
11325 1 18 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.680 0.221 18002
11326 1 18 . 1 1 134 134 LEU H H 496 8.386 8.386 8.218 0.168 18002
11327 1 18 . 1 1 135 135 LYS N N 497 117.550 117.550 119.645 -2.095 18002
11328 1 18 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.172 -0.232 18002
11329 1 18 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.703 -0.428 18002
11330 1 18 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.775 -0.281 18002
11331 1 18 . 1 1 135 135 LYS H H 497 7.670 7.670 7.845 -0.175 18002
11332 1 18 . 1 1 136 136 MET N N 498 116.106 116.106 117.025 -0.919 18002
11333 1 18 . 1 1 136 136 MET HA H 498 4.354 4.354 4.629 -0.275 18002
11334 1 18 . 1 1 136 136 MET CA C 498 55.994 55.994 54.794 1.200 18002
11335 1 18 . 1 1 136 136 MET CB C 498 32.772 32.772 32.830 -0.058 18002
11336 1 18 . 1 1 136 136 MET H H 498 7.421 7.421 8.075 -0.654 18002
11337 1 18 . 1 1 137 137 GLN N N 499 118.651 118.651 119.764 -1.113 18002
11338 1 18 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.979 0.205 18002
11339 1 18 . 1 1 137 137 GLN CA C 499 55.308 55.308 58.421 -3.113 18002
11340 1 18 . 1 1 137 137 GLN H H 499 7.617 7.617 7.236 0.381 18002
11341 1 19 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.272 -0.147 18002
11342 1 19 . 1 1 3 3 HIS CA C 365 55.015 55.015 57.040 -2.025 18002
11343 1 19 . 1 1 3 3 HIS CB C 365 31.929 31.929 28.824 3.105 18002
11344 1 19 . 1 1 4 4 MET N N 366 120.431 120.431 120.774 -0.343 18002
11345 1 19 . 1 1 4 4 MET HA H 366 4.345 4.345 4.497 -0.152 18002
11346 1 19 . 1 1 4 4 MET CA C 366 55.337 55.337 55.649 -0.312 18002
11347 1 19 . 1 1 4 4 MET CB C 366 32.668 32.668 32.759 -0.091 18002
11348 1 19 . 1 1 4 4 MET H H 366 8.373 8.373 8.633 -0.260 18002
11349 1 19 . 1 1 5 5 GLY N N 367 109.318 109.318 110.401 -1.083 18002
11350 1 19 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.117 0.340 18002
11351 1 19 . 1 1 5 5 GLY H H 367 8.224 8.224 8.191 0.033 18002
11352 1 19 . 1 1 6 6 ASP N N 368 120.307 120.307 121.971 -1.664 18002
11353 1 19 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.718 -0.118 18002
11354 1 19 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.167 1.346 18002
11355 1 19 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.422 -0.096 18002
11356 1 19 . 1 1 6 6 ASP H H 368 8.199 8.199 8.259 -0.060 18002
11357 1 19 . 1 1 7 7 ILE N N 369 120.668 120.668 119.041 1.627 18002
11358 1 19 . 1 1 7 7 ILE HA H 369 4.218 4.218 3.969 0.249 18002
11359 1 19 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.405 -0.821 18002
11360 1 19 . 1 1 7 7 ILE CB C 369 38.768 38.768 38.221 0.547 18002
11361 1 19 . 1 1 7 7 ILE H H 369 8.138 8.138 8.209 -0.071 18002
11362 1 19 . 1 1 8 8 THR N N 370 117.564 117.564 114.798 2.766 18002
11363 1 19 . 1 1 8 8 THR HA H 370 4.322 4.322 4.093 0.229 18002
11364 1 19 . 1 1 8 8 THR CA C 370 62.332 62.332 63.002 -0.669 18002
11365 1 19 . 1 1 8 8 THR CB C 370 69.946 69.946 69.027 0.919 18002
11366 1 19 . 1 1 8 8 THR H H 370 8.230 8.230 7.878 0.352 18002
11367 1 19 . 1 1 9 9 SER N N 371 118.467 118.467 118.397 0.070 18002
11368 1 19 . 1 1 9 9 SER HA H 371 4.445 4.445 4.684 -0.239 18002
11369 1 19 . 1 1 9 9 SER CA C 371 58.274 58.274 57.739 0.535 18002
11370 1 19 . 1 1 9 9 SER CB C 371 63.996 63.996 65.219 -1.223 18002
11371 1 19 . 1 1 9 9 SER H H 371 8.158 8.158 8.190 -0.032 18002
11372 1 19 . 1 1 10 10 ILE N N 372 123.959 123.959 120.835 3.124 18002
11373 1 19 . 1 1 10 10 ILE CA C 372 58.716 58.716 58.264 0.452 18002
11374 1 19 . 1 1 10 10 ILE CB C 372 38.919 38.919 38.150 0.769 18002
11375 1 19 . 1 1 10 10 ILE H H 372 8.112 8.112 8.443 -0.331 18002
11376 1 19 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.478 -0.126 18002
11377 1 19 . 1 1 11 11 PRO CA C 373 63.181 63.181 62.333 0.848 18002
11378 1 19 . 1 1 11 11 PRO CB C 373 31.707 31.707 31.766 -0.059 18002
11379 1 19 . 1 1 12 12 GLU N N 374 119.349 119.349 123.550 -4.201 18002
11380 1 19 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.638 0.149 18002
11381 1 19 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.800 -0.483 18002
11382 1 19 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.395 3.196 18002
11383 1 19 . 1 1 12 12 GLU H H 374 8.017 8.017 8.485 -0.468 18002
11384 1 19 . 1 1 13 13 LEU N N 375 122.288 122.288 124.493 -2.205 18002
11385 1 19 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.649 -0.171 18002
11386 1 19 . 1 1 13 13 LEU CA C 375 53.930 53.930 54.641 -0.711 18002
11387 1 19 . 1 1 13 13 LEU CB C 375 44.656 44.656 42.656 2.000 18002
11388 1 19 . 1 1 13 13 LEU H H 375 8.036 8.036 8.639 -0.603 18002
11389 1 19 . 1 1 14 14 ALA N N 376 125.461 125.461 128.271 -2.810 18002
11390 1 19 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.806 0.440 18002
11391 1 19 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.745 0.000 18002
11392 1 19 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.209 -0.623 18002
11393 1 19 . 1 1 14 14 ALA H H 376 8.181 8.181 8.214 -0.033 18002
11394 1 19 . 1 1 15 15 ASP N N 377 122.242 122.242 118.801 3.441 18002
11395 1 19 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.414 -0.095 18002
11396 1 19 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.156 0.597 18002
11397 1 19 . 1 1 15 15 ASP CB C 377 46.639 46.639 42.659 3.980 18002
11398 1 19 . 1 1 15 15 ASP H H 377 8.326 8.326 8.782 -0.456 18002
11399 1 19 . 1 1 16 16 TYR N N 378 118.961 118.961 118.153 0.808 18002
11400 1 19 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.528 0.863 18002
11401 1 19 . 1 1 16 16 TYR CA C 378 59.581 59.581 58.261 1.319 18002
11402 1 19 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.137 0.886 18002
11403 1 19 . 1 1 16 16 TYR H H 378 8.869 8.869 6.798 2.071 18002
11404 1 19 . 1 1 17 17 ILE N N 379 125.214 125.214 122.288 2.926 18002
11405 1 19 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.289 0.041 18002
11406 1 19 . 1 1 17 17 ILE CA C 379 58.732 58.732 60.117 -1.385 18002
11407 1 19 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.225 -1.249 18002
11408 1 19 . 1 1 17 17 ILE H H 379 8.608 8.608 8.019 0.589 18002
11409 1 19 . 1 1 18 18 LYS N N 380 122.917 122.917 125.559 -2.642 18002
11410 1 19 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.440 -0.328 18002
11411 1 19 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.295 1.541 18002
11412 1 19 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.046 -0.021 18002
11413 1 19 . 1 1 18 18 LYS H H 380 7.424 7.424 8.377 -0.953 18002
11414 1 19 . 1 1 19 19 VAL N N 381 122.839 122.839 122.878 -0.039 18002
11415 1 19 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.574 0.689 18002
11416 1 19 . 1 1 19 19 VAL CA C 381 61.516 61.516 61.190 0.326 18002
11417 1 19 . 1 1 19 19 VAL CB C 381 35.148 35.148 36.223 -1.075 18002
11418 1 19 . 1 1 19 19 VAL H H 381 9.223 9.223 8.103 1.120 18002
11419 1 19 . 1 1 20 20 PHE N N 382 129.509 129.509 125.660 3.849 18002
11420 1 19 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.976 -0.133 18002
11421 1 19 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.688 -1.183 18002
11422 1 19 . 1 1 20 20 PHE CB C 382 42.862 42.862 41.008 1.854 18002
11423 1 19 . 1 1 20 20 PHE H H 382 9.451 9.451 8.665 0.786 18002
11424 1 19 . 1 1 21 21 LYS N N 383 126.417 126.417 121.781 4.636 18002
11425 1 19 . 1 1 21 21 LYS CA C 383 52.841 52.841 56.640 -3.799 18002
11426 1 19 . 1 1 21 21 LYS CB C 383 33.219 33.219 30.502 2.717 18002
11427 1 19 . 1 1 21 21 LYS H H 383 7.582 7.582 8.267 -0.685 18002
11428 1 19 . 1 1 22 22 PRO CA C 384 63.697 63.697 62.812 0.885 18002
11429 1 19 . 1 1 22 22 PRO CB C 384 31.969 31.969 32.340 -0.371 18002
11430 1 19 . 1 1 23 23 LYS N N 385 118.026 118.026 118.183 -0.157 18002
11431 1 19 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.085 0.130 18002
11432 1 19 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.751 -0.406 18002
11433 1 19 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.301 0.732 18002
11434 1 19 . 1 1 23 23 LYS H H 385 8.138 8.138 8.153 -0.015 18002
11435 1 19 . 1 1 24 24 LYS N N 386 120.816 120.816 121.935 -1.119 18002
11436 1 19 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.111 0.075 18002
11437 1 19 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.770 -0.908 18002
11438 1 19 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.500 0.327 18002
11439 1 19 . 1 1 24 24 LYS H H 386 7.727 7.727 8.195 -0.468 18002
11440 1 19 . 1 1 25 25 LEU N N 387 121.214 121.214 119.603 1.611 18002
11441 1 19 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.405 -0.237 18002
11442 1 19 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.522 -0.014 18002
11443 1 19 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.361 -0.719 18002
11444 1 19 . 1 1 25 25 LEU H H 387 8.241 8.241 7.786 0.455 18002
11445 1 19 . 1 1 26 26 THR N N 388 112.798 112.798 111.635 1.163 18002
11446 1 19 . 1 1 26 26 THR HA H 388 4.313 4.313 4.138 0.175 18002
11447 1 19 . 1 1 26 26 THR CA C 388 61.795 61.795 62.961 -1.166 18002
11448 1 19 . 1 1 26 26 THR CB C 388 69.875 69.875 68.331 1.544 18002
11449 1 19 . 1 1 26 26 THR H H 388 7.700 7.700 7.806 -0.106 18002
11450 1 19 . 1 1 27 27 LEU N N 389 124.091 124.091 120.720 3.371 18002
11451 1 19 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.663 -0.309 18002
11452 1 19 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.150 0.383 18002
11453 1 19 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.608 -0.310 18002
11454 1 19 . 1 1 27 27 LEU H H 389 8.260 8.260 8.266 -0.006 18002
11455 1 19 . 1 1 28 28 LYS N N 390 121.153 121.153 119.259 1.894 18002
11456 1 19 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.836 -0.516 18002
11457 1 19 . 1 1 28 28 LYS CA C 390 56.211 56.211 55.278 0.933 18002
11458 1 19 . 1 1 28 28 LYS CB C 390 33.675 33.675 33.617 0.058 18002
11459 1 19 . 1 1 28 28 LYS H H 390 8.202 8.202 8.010 0.192 18002
11460 1 19 . 1 1 29 29 GLY N N 391 107.270 107.270 106.767 0.503 18002
11461 1 19 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.102 -0.227 18002
11462 1 19 . 1 1 29 29 GLY H H 391 7.876 7.876 8.392 -0.516 18002
11463 1 19 . 1 1 30 30 TYR N N 392 118.471 118.471 126.176 -7.705 18002
11464 1 19 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.366 0.080 18002
11465 1 19 . 1 1 30 30 TYR CA C 392 59.047 59.047 58.910 0.137 18002
11466 1 19 . 1 1 30 30 TYR CB C 392 39.825 39.825 38.331 1.494 18002
11467 1 19 . 1 1 30 30 TYR H H 392 8.183 8.183 8.290 -0.107 18002
11468 1 19 . 1 1 31 31 LYS N N 393 122.833 122.833 126.672 -3.839 18002
11469 1 19 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.608 -0.093 18002
11470 1 19 . 1 1 31 31 LYS CA C 393 55.174 55.174 55.388 -0.214 18002
11471 1 19 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.741 -0.021 18002
11472 1 19 . 1 1 31 31 LYS H H 393 8.731 8.731 7.894 0.837 18002
11473 1 19 . 1 1 32 32 GLN N N 394 124.759 124.759 125.738 -0.979 18002
11474 1 19 . 1 1 32 32 GLN HA H 394 4.678 4.678 5.298 -0.620 18002
11475 1 19 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.478 1.129 18002
11476 1 19 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.857 1.191 18002
11477 1 19 . 1 1 32 32 GLN H H 394 8.776 8.776 8.798 -0.022 18002
11478 1 19 . 1 1 33 33 TYR N N 395 125.112 125.112 122.772 2.340 18002
11479 1 19 . 1 1 33 33 TYR HA H 395 5.074 5.074 5.463 -0.389 18002
11480 1 19 . 1 1 33 33 TYR CA C 395 57.164 57.164 55.437 1.728 18002
11481 1 19 . 1 1 33 33 TYR CB C 395 42.672 42.672 42.183 0.489 18002
11482 1 19 . 1 1 33 33 TYR H H 395 8.774 8.774 9.277 -0.503 18002
11483 1 19 . 1 1 34 34 TRP N N 396 122.638 122.638 124.656 -2.018 18002
11484 1 19 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.293 -0.611 18002
11485 1 19 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.158 3.060 18002
11486 1 19 . 1 1 34 34 TRP CB C 396 29.504 29.504 29.680 -0.176 18002
11487 1 19 . 1 1 34 34 TRP H H 396 8.975 8.975 8.276 0.699 18002
11488 1 19 . 1 1 35 35 CYS N N 397 127.146 127.146 124.889 2.257 18002
11489 1 19 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.141 0.226 18002
11490 1 19 . 1 1 35 35 CYS CB C 397 31.706 31.706 29.574 2.132 18002
11491 1 19 . 1 1 35 35 CYS H H 397 8.804 8.804 8.837 -0.033 18002
11492 1 19 . 1 1 36 36 THR N N 398 110.578 110.578 116.750 -6.172 18002
11493 1 19 . 1 1 36 36 THR HA H 398 5.358 5.358 5.087 0.271 18002
11494 1 19 . 1 1 36 36 THR CA C 398 58.704 58.704 60.503 -1.799 18002
11495 1 19 . 1 1 36 36 THR CB C 398 71.833 71.833 71.378 0.455 18002
11496 1 19 . 1 1 36 36 THR H H 398 9.090 9.090 7.691 1.399 18002
11497 1 19 . 1 1 37 37 PHE N N 399 127.322 127.322 126.096 1.226 18002
11498 1 19 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.466 0.487 18002
11499 1 19 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.381 -1.135 18002
11500 1 19 . 1 1 37 37 PHE CB C 399 42.185 42.185 38.628 3.557 18002
11501 1 19 . 1 1 37 37 PHE H H 399 8.846 8.846 9.162 -0.316 18002
11502 1 19 . 1 1 38 38 LYS N N 400 125.391 125.391 124.818 0.573 18002
11503 1 19 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.917 -0.390 18002
11504 1 19 . 1 1 38 38 LYS CA C 400 55.977 55.977 54.580 1.397 18002
11505 1 19 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.221 0.694 18002
11506 1 19 . 1 1 38 38 LYS H H 400 8.252 8.252 7.592 0.660 18002
11507 1 19 . 1 1 39 39 ASP N N 401 125.083 125.083 123.681 1.402 18002
11508 1 19 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.333 -0.255 18002
11509 1 19 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.105 0.378 18002
11510 1 19 . 1 1 39 39 ASP CB C 401 39.521 39.521 39.785 -0.264 18002
11511 1 19 . 1 1 39 39 ASP H H 401 9.408 9.408 8.948 0.460 18002
11512 1 19 . 1 1 40 40 THR N N 402 112.024 112.024 116.173 -4.149 18002
11513 1 19 . 1 1 40 40 THR HA H 402 4.767 4.767 4.479 0.288 18002
11514 1 19 . 1 1 40 40 THR CA C 402 60.811 60.811 61.571 -0.759 18002
11515 1 19 . 1 1 40 40 THR CB C 402 68.823 68.823 68.989 -0.166 18002
11516 1 19 . 1 1 40 40 THR H H 402 8.224 8.224 8.333 -0.109 18002
11517 1 19 . 1 1 41 41 SER N N 403 116.142 116.142 117.201 -1.059 18002
11518 1 19 . 1 1 41 41 SER HA H 403 5.428 5.428 4.634 0.794 18002
11519 1 19 . 1 1 41 41 SER CA C 403 58.297 58.297 57.863 0.434 18002
11520 1 19 . 1 1 41 41 SER CB C 403 66.409 66.409 66.282 0.127 18002
11521 1 19 . 1 1 41 41 SER H H 403 8.197 8.197 7.968 0.229 18002
11522 1 19 . 1 1 42 42 ILE N N 404 122.292 122.292 125.697 -3.405 18002
11523 1 19 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.408 0.521 18002
11524 1 19 . 1 1 42 42 ILE CA C 404 59.804 59.804 59.107 0.697 18002
11525 1 19 . 1 1 42 42 ILE CB C 404 41.420 41.420 38.364 3.056 18002
11526 1 19 . 1 1 42 42 ILE H H 404 8.411 8.411 7.794 0.617 18002
11527 1 19 . 1 1 43 43 SER N N 405 122.244 122.244 120.463 1.781 18002
11528 1 19 . 1 1 43 43 SER HA H 405 4.966 4.966 4.549 0.417 18002
11529 1 19 . 1 1 43 43 SER CA C 405 57.735 57.735 57.045 0.690 18002
11530 1 19 . 1 1 43 43 SER CB C 405 65.388 65.388 64.520 0.868 18002
11531 1 19 . 1 1 43 43 SER H H 405 8.752 8.752 8.010 0.742 18002
11532 1 19 . 1 1 44 44 CYS N N 406 120.004 120.004 122.899 -2.895 18002
11533 1 19 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.591 0.376 18002
11534 1 19 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.589 -0.531 18002
11535 1 19 . 1 1 44 44 CYS CB C 406 29.440 29.440 27.914 1.526 18002
11536 1 19 . 1 1 44 44 CYS H H 406 8.470 8.470 8.244 0.226 18002
11537 1 19 . 1 1 45 45 TYR N N 407 122.704 122.704 127.401 -4.697 18002
11538 1 19 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.542 0.481 18002
11539 1 19 . 1 1 45 45 TYR CA C 407 56.983 56.983 57.475 -0.492 18002
11540 1 19 . 1 1 45 45 TYR CB C 407 41.574 41.574 39.927 1.647 18002
11541 1 19 . 1 1 45 45 TYR H H 407 10.013 10.013 8.407 1.606 18002
11542 1 19 . 1 1 46 46 LYS N N 408 121.897 121.897 123.524 -1.627 18002
11543 1 19 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.755 -0.409 18002
11544 1 19 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.260 2.759 18002
11545 1 19 . 1 1 46 46 LYS CB C 408 32.712 32.712 34.139 -1.427 18002
11546 1 19 . 1 1 46 46 LYS H H 408 9.734 9.734 8.783 0.951 18002
11547 1 19 . 1 1 47 47 SER N N 409 106.720 106.720 113.321 -6.601 18002
11548 1 19 . 1 1 47 47 SER HA H 409 4.776 4.776 4.869 -0.093 18002
11549 1 19 . 1 1 47 47 SER CA C 409 57.180 57.180 57.741 -0.561 18002
11550 1 19 . 1 1 47 47 SER CB C 409 65.870 65.870 65.871 -0.001 18002
11551 1 19 . 1 1 47 47 SER H H 409 7.518 7.518 8.213 -0.695 18002
11552 1 19 . 1 1 48 48 LYS N N 410 122.302 122.302 127.152 -4.850 18002
11553 1 19 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.242 0.992 18002
11554 1 19 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.806 0.492 18002
11555 1 19 . 1 1 48 48 LYS H H 410 8.195 8.195 8.993 -0.798 18002
11556 1 19 . 1 1 49 49 GLU N N 411 118.983 118.983 120.265 -1.282 18002
11557 1 19 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.120 0.662 18002
11558 1 19 . 1 1 49 49 GLU CA C 411 59.535 59.535 59.032 0.503 18002
11559 1 19 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.333 -0.645 18002
11560 1 19 . 1 1 49 49 GLU H H 411 8.752 8.752 8.630 0.122 18002
11561 1 19 . 1 1 50 50 GLU N N 412 118.384 118.384 117.252 1.132 18002
11562 1 19 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.315 0.178 18002
11563 1 19 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.084 -1.295 18002
11564 1 19 . 1 1 50 50 GLU CB C 412 30.005 30.005 30.041 -0.036 18002
11565 1 19 . 1 1 50 50 GLU H H 412 7.234 7.234 7.821 -0.587 18002
11566 1 19 . 1 1 51 51 SER N N 413 114.767 114.767 114.812 -0.045 18002
11567 1 19 . 1 1 51 51 SER CA C 413 59.764 59.764 60.611 -0.848 18002
11568 1 19 . 1 1 51 51 SER CB C 413 62.965 62.965 61.884 1.081 18002
11569 1 19 . 1 1 51 51 SER H H 413 7.382 7.382 8.307 -0.925 18002
11570 1 19 . 1 1 52 52 SER N N 414 114.496 114.496 118.863 -4.367 18002
11571 1 19 . 1 1 52 52 SER HA H 414 4.560 4.560 4.539 0.021 18002
11572 1 19 . 1 1 52 52 SER CA C 414 58.574 58.574 59.310 -0.736 18002
11573 1 19 . 1 1 52 52 SER CB C 414 63.829 63.829 63.622 0.207 18002
11574 1 19 . 1 1 52 52 SER H H 414 7.682 7.682 8.011 -0.329 18002
11575 1 19 . 1 1 53 53 GLY N N 415 111.107 111.107 109.473 1.634 18002
11576 1 19 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.609 -0.376 18002
11577 1 19 . 1 1 53 53 GLY H H 415 7.918 7.918 7.540 0.378 18002
11578 1 19 . 1 1 54 54 THR N N 416 120.214 120.214 119.429 0.785 18002
11579 1 19 . 1 1 54 54 THR CB C 416 70.035 70.035 69.923 0.112 18002
11580 1 19 . 1 1 54 54 THR H H 416 8.622 8.622 8.271 0.351 18002
11581 1 19 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.146 0.329 18002
11582 1 19 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.739 0.305 18002
11583 1 19 . 1 1 55 55 PRO CB C 417 31.578 31.578 31.886 -0.308 18002
11584 1 19 . 1 1 56 56 ALA N N 418 125.591 125.591 125.789 -0.198 18002
11585 1 19 . 1 1 56 56 ALA HA H 418 3.956 3.956 3.999 -0.043 18002
11586 1 19 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.004 0.531 18002
11587 1 19 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.380 -0.473 18002
11588 1 19 . 1 1 56 56 ALA H H 418 8.288 8.288 8.448 -0.160 18002
11589 1 19 . 1 1 57 57 HIS N N 419 108.119 108.119 115.194 -7.075 18002
11590 1 19 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.623 -0.001 18002
11591 1 19 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.980 -1.400 18002
11592 1 19 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.101 2.118 18002
11593 1 19 . 1 1 57 57 HIS H H 419 7.072 7.072 7.817 -0.745 18002
11594 1 19 . 1 1 58 58 GLN N N 420 123.083 123.083 126.225 -3.142 18002
11595 1 19 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.626 0.529 18002
11596 1 19 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.883 0.621 18002
11597 1 19 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.146 2.344 18002
11598 1 19 . 1 1 58 58 GLN H H 420 8.669 8.669 8.131 0.538 18002
11599 1 19 . 1 1 59 59 MET N N 421 122.330 122.330 122.596 -0.266 18002
11600 1 19 . 1 1 59 59 MET HA H 421 4.621 4.621 4.855 -0.234 18002
11601 1 19 . 1 1 59 59 MET CA C 421 54.892 54.892 53.660 1.232 18002
11602 1 19 . 1 1 59 59 MET CB C 421 35.650 35.650 36.478 -0.828 18002
11603 1 19 . 1 1 59 59 MET H H 421 8.995 8.995 8.003 0.992 18002
11604 1 19 . 1 1 60 60 ASN N N 422 123.220 123.220 119.960 3.260 18002
11605 1 19 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.648 0.300 18002
11606 1 19 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.729 -0.098 18002
11607 1 19 . 1 1 60 60 ASN CB C 422 38.739 38.739 37.520 1.218 18002
11608 1 19 . 1 1 60 60 ASN H H 422 8.728 8.728 8.525 0.203 18002
11609 1 19 . 1 1 61 61 LEU N N 423 126.072 126.072 121.885 4.187 18002
11610 1 19 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.257 -0.141 18002
11611 1 19 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.913 1.700 18002
11612 1 19 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.269 1.188 18002
11613 1 19 . 1 1 61 61 LEU H H 423 8.942 8.942 8.094 0.848 18002
11614 1 19 . 1 1 62 62 ARG N N 424 121.977 121.977 117.542 4.435 18002
11615 1 19 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.078 0.294 18002
11616 1 19 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.440 2.594 18002
11617 1 19 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.061 -0.450 18002
11618 1 19 . 1 1 62 62 ARG H H 424 8.000 8.000 7.311 0.689 18002
11619 1 19 . 1 1 63 63 GLY N N 425 114.852 114.852 106.720 8.132 18002
11620 1 19 . 1 1 63 63 GLY CA C 425 45.810 45.810 46.033 -0.223 18002
11621 1 19 . 1 1 63 63 GLY H H 425 9.033 9.033 8.437 0.596 18002
11622 1 19 . 1 1 64 64 CYS N N 426 117.102 117.102 116.653 0.449 18002
11623 1 19 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.629 0.270 18002
11624 1 19 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.631 1.129 18002
11625 1 19 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.565 -0.741 18002
11626 1 19 . 1 1 64 64 CYS H H 426 8.248 8.248 7.348 0.900 18002
11627 1 19 . 1 1 65 65 GLU N N 427 119.501 119.501 120.938 -1.437 18002
11628 1 19 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.433 0.344 18002
11629 1 19 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.849 -0.458 18002
11630 1 19 . 1 1 65 65 GLU CB C 427 31.938 31.938 32.230 -0.292 18002
11631 1 19 . 1 1 65 65 GLU H H 427 8.449 8.449 9.030 -0.581 18002
11632 1 19 . 1 1 66 66 VAL N N 428 125.286 125.286 120.766 4.520 18002
11633 1 19 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.565 0.325 18002
11634 1 19 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.624 -0.872 18002
11635 1 19 . 1 1 66 66 VAL CB C 428 33.975 33.975 35.799 -1.824 18002
11636 1 19 . 1 1 66 66 VAL H H 428 8.624 8.624 8.418 0.206 18002
11637 1 19 . 1 1 67 67 THR N N 429 124.132 124.132 124.204 -0.072 18002
11638 1 19 . 1 1 67 67 THR CA C 429 59.338 59.338 59.915 -0.577 18002
11639 1 19 . 1 1 67 67 THR CB C 429 72.021 72.021 68.955 3.066 18002
11640 1 19 . 1 1 67 67 THR H H 429 9.247 9.247 8.177 1.070 18002
11641 1 19 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.666 -0.017 18002
11642 1 19 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.575 0.163 18002
11643 1 19 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.003 1.565 18002
11644 1 19 . 1 1 69 69 ASP N N 431 122.066 122.066 124.053 -1.987 18002
11645 1 19 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.735 -0.088 18002
11646 1 19 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.987 -0.318 18002
11647 1 19 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.363 -0.258 18002
11648 1 19 . 1 1 69 69 ASP H H 431 8.250 8.250 8.444 -0.194 18002
11649 1 19 . 1 1 70 70 VAL N N 432 121.874 121.874 123.530 -1.656 18002
11650 1 19 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.413 0.086 18002
11651 1 19 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.001 0.087 18002
11652 1 19 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.526 0.506 18002
11653 1 19 . 1 1 70 70 VAL H H 432 8.305 8.305 8.122 0.183 18002
11654 1 19 . 1 1 71 71 ASN N N 433 124.366 124.366 127.110 -2.744 18002
11655 1 19 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.953 -0.271 18002
11656 1 19 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.335 0.426 18002
11657 1 19 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.962 1.317 18002
11658 1 19 . 1 1 71 71 ASN H H 433 8.637 8.637 8.160 0.477 18002
11659 1 19 . 1 1 72 72 ILE N N 434 126.786 126.786 123.019 3.767 18002
11660 1 19 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.631 -0.260 18002
11661 1 19 . 1 1 72 72 ILE CA C 434 64.518 64.518 62.935 1.583 18002
11662 1 19 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.771 -0.596 18002
11663 1 19 . 1 1 72 72 ILE H H 434 8.943 8.943 8.280 0.663 18002
11664 1 19 . 1 1 73 73 SER N N 435 118.305 118.305 116.587 1.718 18002
11665 1 19 . 1 1 73 73 SER CA C 435 61.633 61.633 60.807 0.826 18002
11666 1 19 . 1 1 73 73 SER CB C 435 62.435 62.435 62.905 -0.470 18002
11667 1 19 . 1 1 73 73 SER H H 435 8.578 8.578 8.091 0.487 18002
11668 1 19 . 1 1 74 74 GLY N N 436 107.443 107.443 106.439 1.004 18002
11669 1 19 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.564 0.297 18002
11670 1 19 . 1 1 74 74 GLY H H 436 7.620 7.620 7.441 0.179 18002
11671 1 19 . 1 1 75 75 GLN N N 437 116.895 116.895 117.917 -1.022 18002
11672 1 19 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.617 -0.327 18002
11673 1 19 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.845 -0.144 18002
11674 1 19 . 1 1 75 75 GLN CB C 437 26.745 26.745 26.254 0.491 18002
11675 1 19 . 1 1 75 75 GLN H H 437 7.798 7.798 8.009 -0.211 18002
11676 1 19 . 1 1 76 76 LYS N N 438 119.308 119.308 117.464 1.844 18002
11677 1 19 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.389 -0.247 18002
11678 1 19 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.335 0.708 18002
11679 1 19 . 1 1 76 76 LYS CB C 438 33.945 33.945 34.072 -0.127 18002
11680 1 19 . 1 1 76 76 LYS H H 438 7.522 7.522 7.373 0.149 18002
11681 1 19 . 1 1 77 77 PHE N N 439 125.905 125.905 121.703 4.202 18002
11682 1 19 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.260 -0.049 18002
11683 1 19 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.878 -1.239 18002
11684 1 19 . 1 1 77 77 PHE CB C 439 38.929 38.929 39.748 -0.819 18002
11685 1 19 . 1 1 77 77 PHE H H 439 8.461 8.461 8.429 0.032 18002
11686 1 19 . 1 1 78 78 ASN N N 440 120.787 120.787 121.889 -1.102 18002
11687 1 19 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.892 -0.979 18002
11688 1 19 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.123 -0.320 18002
11689 1 19 . 1 1 78 78 ASN H H 440 7.638 7.638 8.428 -0.790 18002
11690 1 19 . 1 1 79 79 ILE N N 441 123.421 123.421 126.362 -2.941 18002
11691 1 19 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.405 -0.234 18002
11692 1 19 . 1 1 79 79 ILE CA C 441 61.567 61.567 59.730 1.837 18002
11693 1 19 . 1 1 79 79 ILE CB C 441 41.487 41.487 40.385 1.102 18002
11694 1 19 . 1 1 79 79 ILE H H 441 9.550 9.550 8.664 0.886 18002
11695 1 19 . 1 1 80 80 LYS N N 442 126.267 126.267 129.136 -2.869 18002
11696 1 19 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.889 -0.427 18002
11697 1 19 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.463 0.920 18002
11698 1 19 . 1 1 80 80 LYS CB C 442 32.987 32.987 34.259 -1.272 18002
11699 1 19 . 1 1 80 80 LYS H H 442 8.703 8.703 8.037 0.666 18002
11700 1 19 . 1 1 81 81 LEU N N 443 125.194 125.194 125.717 -0.523 18002
11701 1 19 . 1 1 81 81 LEU HA H 443 5.272 5.272 5.010 0.262 18002
11702 1 19 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.569 -0.220 18002
11703 1 19 . 1 1 81 81 LEU CB C 443 44.704 44.704 44.121 0.583 18002
11704 1 19 . 1 1 81 81 LEU H H 443 9.223 9.223 9.414 -0.191 18002
11705 1 19 . 1 1 82 82 LEU N N 444 122.753 122.753 126.046 -3.293 18002
11706 1 19 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.213 -0.199 18002
11707 1 19 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.228 0.690 18002
11708 1 19 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.802 -3.178 18002
11709 1 19 . 1 1 82 82 LEU H H 444 8.420 8.420 7.990 0.430 18002
11710 1 19 . 1 1 83 83 ILE N N 445 125.584 125.584 123.061 2.523 18002
11711 1 19 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.484 -0.200 18002
11712 1 19 . 1 1 83 83 ILE CB C 445 41.036 41.036 40.459 0.577 18002
11713 1 19 . 1 1 83 83 ILE H H 445 9.010 9.010 8.024 0.986 18002
11714 1 19 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.665 0.254 18002
11715 1 19 . 1 1 84 84 PRO CA C 446 64.033 64.033 63.146 0.887 18002
11716 1 19 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.071 0.876 18002
11717 1 19 . 1 1 85 85 VAL N N 447 119.780 119.780 117.278 2.502 18002
11718 1 19 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.509 -0.006 18002
11719 1 19 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.339 1.003 18002
11720 1 19 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.392 0.874 18002
11721 1 19 . 1 1 85 85 VAL H H 447 8.304 8.304 8.509 -0.205 18002
11722 1 19 . 1 1 86 86 ALA N N 448 125.178 125.178 121.861 3.317 18002
11723 1 19 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.169 -0.194 18002
11724 1 19 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.700 0.861 18002
11725 1 19 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.311 -0.323 18002
11726 1 19 . 1 1 86 86 ALA H H 448 8.526 8.526 8.481 0.045 18002
11727 1 19 . 1 1 87 87 GLU N N 449 114.625 114.625 118.752 -4.127 18002
11728 1 19 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.088 0.202 18002
11729 1 19 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.659 -0.928 18002
11730 1 19 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.738 -0.478 18002
11731 1 19 . 1 1 87 87 GLU H H 449 8.402 8.402 8.503 -0.101 18002
11732 1 19 . 1 1 88 88 GLY N N 450 109.432 109.432 105.340 4.092 18002
11733 1 19 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.790 1.047 18002
11734 1 19 . 1 1 88 88 GLY H H 450 7.711 7.711 7.644 0.067 18002
11735 1 19 . 1 1 89 89 MET N N 451 121.382 121.382 119.806 1.576 18002
11736 1 19 . 1 1 89 89 MET HA H 451 5.076 5.076 4.979 0.097 18002
11737 1 19 . 1 1 89 89 MET CA C 451 53.860 53.860 54.768 -0.908 18002
11738 1 19 . 1 1 89 89 MET CB C 451 35.942 35.942 36.827 -0.885 18002
11739 1 19 . 1 1 89 89 MET H H 451 8.355 8.355 8.072 0.283 18002
11740 1 19 . 1 1 90 90 ASN N N 452 123.538 123.538 121.820 1.718 18002
11741 1 19 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.853 0.100 18002
11742 1 19 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.693 -0.945 18002
11743 1 19 . 1 1 90 90 ASN CB C 452 40.642 40.642 40.261 0.381 18002
11744 1 19 . 1 1 90 90 ASN H H 452 9.338 9.338 8.368 0.970 18002
11745 1 19 . 1 1 91 91 GLU N N 453 125.978 125.978 124.683 1.295 18002
11746 1 19 . 1 1 91 91 GLU HA H 453 5.344 5.344 3.769 1.575 18002
11747 1 19 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.212 -0.939 18002
11748 1 19 . 1 1 91 91 GLU CB C 453 31.743 31.743 29.611 2.131 18002
11749 1 19 . 1 1 91 91 GLU H H 453 8.168 8.168 8.556 -0.388 18002
11750 1 19 . 1 1 92 92 ILE N N 454 126.776 126.776 126.203 0.573 18002
11751 1 19 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.965 0.601 18002
11752 1 19 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.072 -0.024 18002
11753 1 19 . 1 1 92 92 ILE CB C 454 42.262 42.262 39.931 2.331 18002
11754 1 19 . 1 1 92 92 ILE H H 454 9.000 9.000 7.308 1.692 18002
11755 1 19 . 1 1 93 93 TRP N N 455 125.987 125.987 127.189 -1.202 18002
11756 1 19 . 1 1 93 93 TRP HA H 455 4.592 4.592 4.990 -0.398 18002
11757 1 19 . 1 1 93 93 TRP CA C 455 53.790 53.790 54.963 -1.173 18002
11758 1 19 . 1 1 93 93 TRP CB C 455 31.386 31.386 30.084 1.302 18002
11759 1 19 . 1 1 93 93 TRP H H 455 9.278 9.278 8.068 1.210 18002
11760 1 19 . 1 1 94 94 LEU N N 456 120.912 120.912 120.851 0.061 18002
11761 1 19 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.869 0.493 18002
11762 1 19 . 1 1 94 94 LEU CA C 456 53.216 53.216 54.118 -0.902 18002
11763 1 19 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.087 0.508 18002
11764 1 19 . 1 1 94 94 LEU H H 456 9.534 9.534 8.168 1.366 18002
11765 1 19 . 1 1 95 95 ARG N N 457 123.669 123.669 121.789 1.880 18002
11766 1 19 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.720 0.551 18002
11767 1 19 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.698 -0.281 18002
11768 1 19 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.740 0.522 18002
11769 1 19 . 1 1 95 95 ARG H H 457 9.439 9.439 7.930 1.509 18002
11770 1 19 . 1 1 96 96 CYS N N 458 125.273 125.273 122.837 2.436 18002
11771 1 19 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.726 -0.029 18002
11772 1 19 . 1 1 96 96 CYS CA C 458 58.792 58.792 57.517 1.275 18002
11773 1 19 . 1 1 96 96 CYS CB C 458 30.403 30.403 31.336 -0.933 18002
11774 1 19 . 1 1 96 96 CYS H H 458 8.652 8.652 8.878 -0.226 18002
11775 1 19 . 1 1 97 97 ASP N N 459 119.661 119.661 117.763 1.898 18002
11776 1 19 . 1 1 97 97 ASP HA H 459 4.740 4.740 5.096 -0.356 18002
11777 1 19 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.119 2.109 18002
11778 1 19 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.799 1.786 18002
11779 1 19 . 1 1 97 97 ASP H H 459 9.116 9.116 8.585 0.531 18002
11780 1 19 . 1 1 98 98 ASN N N 460 109.173 109.173 116.463 -7.290 18002
11781 1 19 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.783 -0.411 18002
11782 1 19 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.016 -0.002 18002
11783 1 19 . 1 1 98 98 ASN CB C 460 40.811 40.811 41.667 -0.856 18002
11784 1 19 . 1 1 98 98 ASN H H 460 7.054 7.054 6.635 0.419 18002
11785 1 19 . 1 1 99 99 GLU N N 461 119.220 119.220 123.393 -4.173 18002
11786 1 19 . 1 1 99 99 GLU CA C 461 60.044 60.044 60.184 -0.140 18002
11787 1 19 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.591 0.177 18002
11788 1 19 . 1 1 99 99 GLU H H 461 8.937 8.937 9.014 -0.077 18002
11789 1 19 . 1 1 100 100 LYS N N 462 120.647 120.647 119.769 0.878 18002
11790 1 19 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.085 0.560 18002
11791 1 19 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.368 1.168 18002
11792 1 19 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.827 0.401 18002
11793 1 19 . 1 1 100 100 LYS H H 462 8.033 8.033 8.372 -0.339 18002
11794 1 19 . 1 1 101 101 GLN N N 463 121.938 121.938 118.492 3.446 18002
11795 1 19 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.093 0.307 18002
11796 1 19 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.723 0.672 18002
11797 1 19 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.049 4.165 18002
11798 1 19 . 1 1 101 101 GLN H H 463 8.372 8.372 7.956 0.416 18002
11799 1 19 . 1 1 102 102 TYR N N 464 117.422 117.422 121.288 -3.866 18002
11800 1 19 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.115 0.501 18002
11801 1 19 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.541 0.136 18002
11802 1 19 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.202 0.658 18002
11803 1 19 . 1 1 102 102 TYR H H 464 8.221 8.221 8.194 0.027 18002
11804 1 19 . 1 1 103 103 ALA N N 465 120.655 120.655 118.411 2.244 18002
11805 1 19 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.044 -0.329 18002
11806 1 19 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.694 1.219 18002
11807 1 19 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.266 0.536 18002
11808 1 19 . 1 1 103 103 ALA H H 465 8.637 8.637 7.935 0.702 18002
11809 1 19 . 1 1 104 104 HIS N N 466 112.871 112.871 117.877 -5.006 18002
11810 1 19 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.514 -0.373 18002
11811 1 19 . 1 1 104 104 HIS CA C 466 60.627 60.627 60.213 0.414 18002
11812 1 19 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.380 -1.522 18002
11813 1 19 . 1 1 104 104 HIS H H 466 7.852 7.852 8.039 -0.187 18002
11814 1 19 . 1 1 105 105 TRP N N 467 121.317 121.317 119.661 1.656 18002
11815 1 19 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.286 -0.591 18002
11816 1 19 . 1 1 105 105 TRP CA C 467 62.342 62.342 62.038 0.304 18002
11817 1 19 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.203 -1.698 18002
11818 1 19 . 1 1 105 105 TRP H H 467 8.668 8.668 8.060 0.608 18002
11819 1 19 . 1 1 106 106 MET N N 468 122.346 122.346 117.693 4.653 18002
11820 1 19 . 1 1 106 106 MET HA H 468 4.086 4.086 3.834 0.252 18002
11821 1 19 . 1 1 106 106 MET CA C 468 58.743 58.743 59.165 -0.422 18002
11822 1 19 . 1 1 106 106 MET CB C 468 31.402 31.402 31.584 -0.182 18002
11823 1 19 . 1 1 106 106 MET H H 468 9.790 9.790 8.277 1.513 18002
11824 1 19 . 1 1 107 107 ALA N N 469 119.758 119.758 121.746 -1.988 18002
11825 1 19 . 1 1 107 107 ALA HA H 469 3.705 3.705 3.915 -0.210 18002
11826 1 19 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.623 1.506 18002
11827 1 19 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.249 2.156 18002
11828 1 19 . 1 1 107 107 ALA H H 469 7.702 7.702 7.602 0.100 18002
11829 1 19 . 1 1 108 108 ALA N N 470 119.233 119.233 120.654 -1.421 18002
11830 1 19 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.775 -0.229 18002
11831 1 19 . 1 1 108 108 ALA CA C 470 55.821 55.821 54.584 1.237 18002
11832 1 19 . 1 1 108 108 ALA CB C 470 16.732 16.732 17.593 -0.861 18002
11833 1 19 . 1 1 108 108 ALA H H 470 7.156 7.156 7.686 -0.530 18002
11834 1 19 . 1 1 109 109 CYS N N 471 116.736 116.736 113.853 2.883 18002
11835 1 19 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.213 -0.156 18002
11836 1 19 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.843 2.728 18002
11837 1 19 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.757 -0.364 18002
11838 1 19 . 1 1 109 109 CYS H H 471 8.256 8.256 8.184 0.072 18002
11839 1 19 . 1 1 110 110 ARG N N 472 118.644 118.644 120.067 -1.423 18002
11840 1 19 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.116 -0.382 18002
11841 1 19 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.129 1.075 18002
11842 1 19 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.184 0.133 18002
11843 1 19 . 1 1 110 110 ARG H H 472 8.403 8.403 7.635 0.768 18002
11844 1 19 . 1 1 111 111 LEU N N 473 121.877 121.877 116.718 5.159 18002
11845 1 19 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.342 -0.542 18002
11846 1 19 . 1 1 111 111 LEU CA C 473 59.855 59.855 56.837 3.018 18002
11847 1 19 . 1 1 111 111 LEU CB C 473 40.420 40.420 39.798 0.622 18002
11848 1 19 . 1 1 111 111 LEU H H 473 7.916 7.916 7.637 0.279 18002
11849 1 19 . 1 1 112 112 ALA N N 474 122.765 122.765 122.743 0.022 18002
11850 1 19 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.141 0.339 18002
11851 1 19 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.610 0.651 18002
11852 1 19 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.077 1.798 18002
11853 1 19 . 1 1 112 112 ALA H H 474 8.393 8.393 7.757 0.636 18002
11854 1 19 . 1 1 113 113 SER N N 475 113.613 113.613 112.408 1.205 18002
11855 1 19 . 1 1 113 113 SER HA H 475 4.782 4.782 4.302 0.480 18002
11856 1 19 . 1 1 113 113 SER CA C 475 61.090 61.090 61.413 -0.323 18002
11857 1 19 . 1 1 113 113 SER CB C 475 63.612 63.612 63.187 0.425 18002
11858 1 19 . 1 1 113 113 SER H H 475 8.150 8.150 7.799 0.351 18002
11859 1 19 . 1 1 114 114 LYS N N 476 118.734 118.734 117.652 1.082 18002
11860 1 19 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.174 0.379 18002
11861 1 19 . 1 1 114 114 LYS CA C 476 55.144 55.144 57.142 -1.998 18002
11862 1 19 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.165 0.426 18002
11863 1 19 . 1 1 114 114 LYS H H 476 7.239 7.239 7.790 -0.551 18002
11864 1 19 . 1 1 115 115 GLY N N 477 107.818 107.818 108.805 -0.987 18002
11865 1 19 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.336 0.650 18002
11866 1 19 . 1 1 115 115 GLY H H 477 8.401 8.401 7.691 0.710 18002
11867 1 19 . 1 1 116 116 LYS N N 478 120.938 120.938 122.425 -1.487 18002
11868 1 19 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.544 0.029 18002
11869 1 19 . 1 1 116 116 LYS CA C 478 54.847 54.847 55.014 -0.167 18002
11870 1 19 . 1 1 116 116 LYS CB C 478 35.321 35.321 33.912 1.409 18002
11871 1 19 . 1 1 116 116 LYS H H 478 8.142 8.142 8.004 0.138 18002
11872 1 19 . 1 1 117 117 THR N N 479 108.076 108.076 111.074 -2.998 18002
11873 1 19 . 1 1 117 117 THR HA H 479 4.671 4.671 4.312 0.359 18002
11874 1 19 . 1 1 117 117 THR CA C 479 59.191 59.191 61.025 -1.834 18002
11875 1 19 . 1 1 117 117 THR CB C 479 72.228 72.228 69.940 2.288 18002
11876 1 19 . 1 1 117 117 THR H H 479 7.926 7.926 8.011 -0.085 18002
11877 1 19 . 1 1 118 118 MET N N 480 116.403 116.403 119.025 -2.622 18002
11878 1 19 . 1 1 118 118 MET HA H 480 3.352 3.352 4.198 -0.846 18002
11879 1 19 . 1 1 118 118 MET CA C 480 57.947 57.947 56.865 1.082 18002
11880 1 19 . 1 1 118 118 MET CB C 480 33.920 33.920 31.872 2.048 18002
11881 1 19 . 1 1 118 118 MET H H 480 8.899 8.899 8.431 0.468 18002
11882 1 19 . 1 1 119 119 ALA N N 481 117.786 117.786 119.937 -2.151 18002
11883 1 19 . 1 1 119 119 ALA HA H 481 4.084 4.084 3.906 0.178 18002
11884 1 19 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.389 1.206 18002
11885 1 19 . 1 1 119 119 ALA CB C 481 19.062 19.062 18.437 0.625 18002
11886 1 19 . 1 1 119 119 ALA H H 481 7.645 7.645 7.521 0.124 18002
11887 1 19 . 1 1 120 120 ASP N N 482 120.348 120.348 119.793 0.555 18002
11888 1 19 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.650 2.966 18002
11889 1 19 . 1 1 120 120 ASP H H 482 7.887 7.887 7.563 0.324 18002
11890 1 19 . 1 1 121 121 SER HA H 483 4.223 4.223 4.509 -0.286 18002
11891 1 19 . 1 1 121 121 SER CA C 483 61.455 61.455 60.578 0.877 18002
11892 1 19 . 1 1 121 121 SER CB C 483 62.996 62.996 63.711 -0.715 18002
11893 1 19 . 1 1 122 122 SER N N 484 116.845 116.845 116.509 0.336 18002
11894 1 19 . 1 1 122 122 SER HA H 484 4.321 4.321 4.508 -0.187 18002
11895 1 19 . 1 1 122 122 SER CA C 484 60.584 60.584 60.371 0.213 18002
11896 1 19 . 1 1 122 122 SER CB C 484 64.314 64.314 63.509 0.805 18002
11897 1 19 . 1 1 122 122 SER H H 484 8.875 8.875 7.897 0.978 18002
11898 1 19 . 1 1 123 123 TYR N N 485 124.153 124.153 121.513 2.640 18002
11899 1 19 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.021 -0.141 18002
11900 1 19 . 1 1 123 123 TYR CA C 485 63.314 63.314 58.842 4.472 18002
11901 1 19 . 1 1 123 123 TYR CB C 485 37.741 37.741 36.489 1.252 18002
11902 1 19 . 1 1 123 123 TYR H H 485 8.018 8.018 8.564 -0.546 18002
11903 1 19 . 1 1 124 124 ASN N N 486 115.339 115.339 118.523 -3.184 18002
11904 1 19 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.544 0.397 18002
11905 1 19 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.584 1.122 18002
11906 1 19 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.709 0.347 18002
11907 1 19 . 1 1 124 124 ASN H H 486 8.665 8.665 7.557 1.108 18002
11908 1 19 . 1 1 125 125 LEU N N 487 119.454 119.454 119.939 -0.485 18002
11909 1 19 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.077 -0.139 18002
11910 1 19 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.532 0.138 18002
11911 1 19 . 1 1 125 125 LEU CB C 487 41.568 41.568 42.118 -0.550 18002
11912 1 19 . 1 1 125 125 LEU H H 487 7.105 7.105 7.995 -0.890 18002
11913 1 19 . 1 1 126 126 GLU N N 488 121.189 121.189 119.123 2.066 18002
11914 1 19 . 1 1 126 126 GLU HA H 488 4.030 4.030 3.937 0.093 18002
11915 1 19 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.594 -0.560 18002
11916 1 19 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.711 -0.626 18002
11917 1 19 . 1 1 126 126 GLU H H 488 8.053 8.053 7.494 0.559 18002
11918 1 19 . 1 1 127 127 VAL N N 489 119.073 119.073 116.061 3.012 18002
11919 1 19 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.743 -0.725 18002
11920 1 19 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.904 1.418 18002
11921 1 19 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.878 -0.219 18002
11922 1 19 . 1 1 127 127 VAL H H 489 7.769 7.769 8.245 -0.476 18002
11923 1 19 . 1 1 128 128 GLN N N 490 116.214 116.214 117.987 -1.773 18002
11924 1 19 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.030 -0.198 18002
11925 1 19 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.294 0.462 18002
11926 1 19 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.847 0.265 18002
11927 1 19 . 1 1 128 128 GLN H H 490 7.542 7.542 7.836 -0.294 18002
11928 1 19 . 1 1 129 129 ASN N N 491 120.003 120.003 116.548 3.455 18002
11929 1 19 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.784 -0.365 18002
11930 1 19 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.217 0.943 18002
11931 1 19 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.897 -0.837 18002
11932 1 19 . 1 1 129 129 ASN H H 491 8.582 8.582 7.842 0.740 18002
11933 1 19 . 1 1 130 130 ILE N N 492 122.365 122.365 117.821 4.544 18002
11934 1 19 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.212 2.541 18002
11935 1 19 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.544 0.602 18002
11936 1 19 . 1 1 130 130 ILE H H 492 8.186 8.186 7.490 0.696 18002
11937 1 19 . 1 1 131 131 LEU N N 493 119.597 119.597 120.665 -1.068 18002
11938 1 19 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.113 -0.108 18002
11939 1 19 . 1 1 131 131 LEU CA C 493 58.859 58.859 57.268 1.591 18002
11940 1 19 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.721 -0.185 18002
11941 1 19 . 1 1 131 131 LEU H H 493 8.224 8.224 7.585 0.639 18002
11942 1 19 . 1 1 132 132 SER N N 494 114.884 114.884 114.833 0.051 18002
11943 1 19 . 1 1 132 132 SER HA H 494 4.430 4.430 4.242 0.188 18002
11944 1 19 . 1 1 132 132 SER CA C 494 62.072 62.072 61.364 0.708 18002
11945 1 19 . 1 1 132 132 SER CB C 494 62.703 62.703 62.832 -0.129 18002
11946 1 19 . 1 1 132 132 SER H H 494 8.464 8.464 8.058 0.406 18002
11947 1 19 . 1 1 133 133 PHE N N 495 123.047 123.047 120.105 2.942 18002
11948 1 19 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.317 0.060 18002
11949 1 19 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.244 -0.331 18002
11950 1 19 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.131 -0.081 18002
11951 1 19 . 1 1 133 133 PHE H H 495 7.915 7.915 7.843 0.072 18002
11952 1 19 . 1 1 134 134 LEU N N 496 119.311 119.311 117.235 2.076 18002
11953 1 19 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.200 -0.295 18002
11954 1 19 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.319 -0.717 18002
11955 1 19 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.042 0.859 18002
11956 1 19 . 1 1 134 134 LEU H H 496 8.386 8.386 7.980 0.406 18002
11957 1 19 . 1 1 135 135 LYS N N 497 117.550 117.550 120.982 -3.432 18002
11958 1 19 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.175 -0.235 18002
11959 1 19 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.700 -0.425 18002
11960 1 19 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.653 -0.159 18002
11961 1 19 . 1 1 135 135 LYS H H 497 7.670 7.670 7.838 -0.168 18002
11962 1 19 . 1 1 136 136 MET N N 498 116.106 116.106 116.772 -0.666 18002
11963 1 19 . 1 1 136 136 MET HA H 498 4.354 4.354 4.666 -0.312 18002
11964 1 19 . 1 1 136 136 MET CA C 498 55.994 55.994 54.040 1.954 18002
11965 1 19 . 1 1 136 136 MET CB C 498 32.772 32.772 32.264 0.508 18002
11966 1 19 . 1 1 136 136 MET H H 498 7.421 7.421 7.660 -0.239 18002
11967 1 19 . 1 1 137 137 GLN N N 499 118.651 118.651 118.630 0.021 18002
11968 1 19 . 1 1 137 137 GLN HA H 499 4.184 4.184 3.941 0.243 18002
11969 1 19 . 1 1 137 137 GLN CA C 499 55.308 55.308 56.796 -1.488 18002
11970 1 19 . 1 1 137 137 GLN H H 499 7.617 7.617 7.658 -0.041 18002
11971 1 20 . 1 1 3 3 HIS HA H 365 4.125 4.125 4.805 -0.680 18002
11972 1 20 . 1 1 3 3 HIS CA C 365 55.015 55.015 55.851 -0.836 18002
11973 1 20 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.852 2.077 18002
11974 1 20 . 1 1 4 4 MET N N 366 120.431 120.431 121.029 -0.598 18002
11975 1 20 . 1 1 4 4 MET HA H 366 4.345 4.345 4.700 -0.355 18002
11976 1 20 . 1 1 4 4 MET CA C 366 55.337 55.337 54.302 1.035 18002
11977 1 20 . 1 1 4 4 MET CB C 366 32.668 32.668 32.495 0.173 18002
11978 1 20 . 1 1 4 4 MET H H 366 8.373 8.373 8.620 -0.247 18002
11979 1 20 . 1 1 5 5 GLY N N 367 109.318 109.318 108.560 0.758 18002
11980 1 20 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.662 -0.205 18002
11981 1 20 . 1 1 5 5 GLY H H 367 8.224 8.224 8.351 -0.127 18002
11982 1 20 . 1 1 6 6 ASP N N 368 120.307 120.307 119.890 0.417 18002
11983 1 20 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.519 0.081 18002
11984 1 20 . 1 1 6 6 ASP CA C 368 54.513 54.513 55.437 -0.924 18002
11985 1 20 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.382 -0.056 18002
11986 1 20 . 1 1 6 6 ASP H H 368 8.199 8.199 7.841 0.358 18002
11987 1 20 . 1 1 7 7 ILE N N 369 120.668 120.668 114.468 6.200 18002
11988 1 20 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.268 -0.050 18002
11989 1 20 . 1 1 7 7 ILE CA C 369 61.584 61.584 59.657 1.927 18002
11990 1 20 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.236 1.532 18002
11991 1 20 . 1 1 7 7 ILE H H 369 8.138 8.138 8.091 0.047 18002
11992 1 20 . 1 1 8 8 THR N N 370 117.564 117.564 115.766 1.798 18002
11993 1 20 . 1 1 8 8 THR HA H 370 4.322 4.322 4.209 0.113 18002
11994 1 20 . 1 1 8 8 THR CA C 370 62.332 62.332 63.020 -0.688 18002
11995 1 20 . 1 1 8 8 THR CB C 370 69.946 69.946 69.403 0.543 18002
11996 1 20 . 1 1 8 8 THR H H 370 8.230 8.230 7.497 0.733 18002
11997 1 20 . 1 1 9 9 SER N N 371 118.467 118.467 119.583 -1.116 18002
11998 1 20 . 1 1 9 9 SER HA H 371 4.445 4.445 4.590 -0.145 18002
11999 1 20 . 1 1 9 9 SER CA C 371 58.274 58.274 57.855 0.419 18002
12000 1 20 . 1 1 9 9 SER CB C 371 63.996 63.996 64.293 -0.297 18002
12001 1 20 . 1 1 9 9 SER H H 371 8.158 8.158 8.414 -0.256 18002
12002 1 20 . 1 1 10 10 ILE N N 372 123.959 123.959 119.751 4.208 18002
12003 1 20 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.946 -5.230 18002
12004 1 20 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.552 2.367 18002
12005 1 20 . 1 1 10 10 ILE H H 372 8.112 8.112 8.591 -0.479 18002
12006 1 20 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.614 -0.262 18002
12007 1 20 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.504 1.677 18002
12008 1 20 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.015 1.692 18002
12009 1 20 . 1 1 12 12 GLU N N 374 119.349 119.349 121.429 -2.080 18002
12010 1 20 . 1 1 12 12 GLU HA H 374 4.787 4.787 5.007 -0.220 18002
12011 1 20 . 1 1 12 12 GLU CA C 374 55.317 55.317 54.590 0.727 18002
12012 1 20 . 1 1 12 12 GLU CB C 374 33.591 33.591 31.465 2.126 18002
12013 1 20 . 1 1 12 12 GLU H H 374 8.017 8.017 7.945 0.072 18002
12014 1 20 . 1 1 13 13 LEU N N 375 122.288 122.288 126.287 -3.999 18002
12015 1 20 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.622 -0.144 18002
12016 1 20 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.146 -1.216 18002
12017 1 20 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.481 1.175 18002
12018 1 20 . 1 1 13 13 LEU H H 375 8.036 8.036 8.253 -0.217 18002
12019 1 20 . 1 1 14 14 ALA N N 376 125.461 125.461 127.538 -2.077 18002
12020 1 20 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.762 0.484 18002
12021 1 20 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.483 0.262 18002
12022 1 20 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.158 -0.572 18002
12023 1 20 . 1 1 14 14 ALA H H 376 8.181 8.181 8.232 -0.051 18002
12024 1 20 . 1 1 15 15 ASP N N 377 122.242 122.242 121.397 0.845 18002
12025 1 20 . 1 1 15 15 ASP HA H 377 4.319 4.319 5.070 -0.751 18002
12026 1 20 . 1 1 15 15 ASP CA C 377 53.752 53.752 54.033 -0.282 18002
12027 1 20 . 1 1 15 15 ASP CB C 377 46.639 46.639 45.456 1.183 18002
12028 1 20 . 1 1 15 15 ASP H H 377 8.326 8.326 9.136 -0.810 18002
12029 1 20 . 1 1 16 16 TYR N N 378 118.961 118.961 116.520 2.441 18002
12030 1 20 . 1 1 16 16 TYR HA H 378 5.391 5.391 5.052 0.339 18002
12031 1 20 . 1 1 16 16 TYR CA C 378 59.581 59.581 56.452 3.130 18002
12032 1 20 . 1 1 16 16 TYR CB C 378 39.023 39.023 39.166 -0.143 18002
12033 1 20 . 1 1 16 16 TYR H H 378 8.869 8.869 7.912 0.957 18002
12034 1 20 . 1 1 17 17 ILE N N 379 125.214 125.214 119.502 5.712 18002
12035 1 20 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.613 -0.283 18002
12036 1 20 . 1 1 17 17 ILE CA C 379 58.732 58.732 58.782 -0.050 18002
12037 1 20 . 1 1 17 17 ILE CB C 379 40.976 40.976 42.158 -1.182 18002
12038 1 20 . 1 1 17 17 ILE H H 379 8.608 8.608 8.009 0.599 18002
12039 1 20 . 1 1 18 18 LYS N N 380 122.917 122.917 121.183 1.734 18002
12040 1 20 . 1 1 18 18 LYS HA H 380 5.112 5.112 4.924 0.188 18002
12041 1 20 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.825 1.011 18002
12042 1 20 . 1 1 18 18 LYS CB C 380 35.025 35.025 35.363 -0.338 18002
12043 1 20 . 1 1 18 18 LYS H H 380 7.424 7.424 8.283 -0.859 18002
12044 1 20 . 1 1 19 19 VAL N N 381 122.839 122.839 122.184 0.655 18002
12045 1 20 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.770 0.493 18002
12046 1 20 . 1 1 19 19 VAL CA C 381 61.516 61.516 59.795 1.721 18002
12047 1 20 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.284 -0.136 18002
12048 1 20 . 1 1 19 19 VAL H H 381 9.223 9.223 7.985 1.238 18002
12049 1 20 . 1 1 20 20 PHE N N 382 129.509 129.509 125.256 4.253 18002
12050 1 20 . 1 1 20 20 PHE HA H 382 4.843 4.843 4.846 -0.003 18002
12051 1 20 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.172 -0.667 18002
12052 1 20 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.250 2.612 18002
12053 1 20 . 1 1 20 20 PHE H H 382 9.451 9.451 8.032 1.419 18002
12054 1 20 . 1 1 21 21 LYS N N 383 126.417 126.417 127.257 -0.840 18002
12055 1 20 . 1 1 21 21 LYS CA C 383 52.841 52.841 52.026 0.815 18002
12056 1 20 . 1 1 21 21 LYS CB C 383 33.219 33.219 31.968 1.251 18002
12057 1 20 . 1 1 21 21 LYS H H 383 7.582 7.582 7.361 0.221 18002
12058 1 20 . 1 1 22 22 PRO CA C 384 63.697 63.697 64.117 -0.420 18002
12059 1 20 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.972 -0.003 18002
12060 1 20 . 1 1 23 23 LYS N N 385 118.026 118.026 115.281 2.745 18002
12061 1 20 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.307 -0.092 18002
12062 1 20 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.151 0.194 18002
12063 1 20 . 1 1 23 23 LYS CB C 385 33.033 33.033 33.087 -0.054 18002
12064 1 20 . 1 1 23 23 LYS H H 385 8.138 8.138 8.019 0.119 18002
12065 1 20 . 1 1 24 24 LYS N N 386 120.816 120.816 123.618 -2.802 18002
12066 1 20 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.367 -0.181 18002
12067 1 20 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.429 -0.567 18002
12068 1 20 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.734 0.093 18002
12069 1 20 . 1 1 24 24 LYS H H 386 7.727 7.727 8.636 -0.909 18002
12070 1 20 . 1 1 25 25 LEU N N 387 121.214 121.214 120.098 1.116 18002
12071 1 20 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.225 -0.057 18002
12072 1 20 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.342 0.166 18002
12073 1 20 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.808 -1.166 18002
12074 1 20 . 1 1 25 25 LEU H H 387 8.241 8.241 8.200 0.041 18002
12075 1 20 . 1 1 26 26 THR N N 388 112.798 112.798 108.804 3.994 18002
12076 1 20 . 1 1 26 26 THR HA H 388 4.313 4.313 4.275 0.038 18002
12077 1 20 . 1 1 26 26 THR CA C 388 61.795 61.795 61.898 -0.103 18002
12078 1 20 . 1 1 26 26 THR CB C 388 69.875 69.875 69.572 0.303 18002
12079 1 20 . 1 1 26 26 THR H H 388 7.700 7.700 8.094 -0.394 18002
12080 1 20 . 1 1 27 27 LEU N N 389 124.091 124.091 121.126 2.965 18002
12081 1 20 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.621 -0.267 18002
12082 1 20 . 1 1 27 27 LEU CA C 389 55.533 55.533 53.950 1.583 18002
12083 1 20 . 1 1 27 27 LEU CB C 389 42.298 42.298 43.698 -1.400 18002
12084 1 20 . 1 1 27 27 LEU H H 389 8.260 8.260 7.554 0.706 18002
12085 1 20 . 1 1 28 28 LYS N N 390 121.153 121.153 117.351 3.802 18002
12086 1 20 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.094 0.226 18002
12087 1 20 . 1 1 28 28 LYS CA C 390 56.211 56.211 57.147 -0.936 18002
12088 1 20 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.470 1.205 18002
12089 1 20 . 1 1 28 28 LYS H H 390 8.202 8.202 8.420 -0.218 18002
12090 1 20 . 1 1 29 29 GLY N N 391 107.270 107.270 108.833 -1.563 18002
12091 1 20 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.359 -0.484 18002
12092 1 20 . 1 1 29 29 GLY H H 391 7.876 7.876 8.163 -0.287 18002
12093 1 20 . 1 1 30 30 TYR N N 392 118.471 118.471 125.268 -6.797 18002
12094 1 20 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.476 -0.030 18002
12095 1 20 . 1 1 30 30 TYR CA C 392 59.047 59.047 60.109 -1.062 18002
12096 1 20 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.875 1.950 18002
12097 1 20 . 1 1 30 30 TYR H H 392 8.183 8.183 8.772 -0.589 18002
12098 1 20 . 1 1 31 31 LYS N N 393 122.833 122.833 124.990 -2.157 18002
12099 1 20 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.538 -0.023 18002
12100 1 20 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.595 0.579 18002
12101 1 20 . 1 1 31 31 LYS CB C 393 35.720 35.720 36.087 -0.367 18002
12102 1 20 . 1 1 31 31 LYS H H 393 8.731 8.731 8.033 0.698 18002
12103 1 20 . 1 1 32 32 GLN N N 394 124.759 124.759 121.303 3.456 18002
12104 1 20 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.565 0.113 18002
12105 1 20 . 1 1 32 32 GLN CA C 394 56.607 56.607 54.493 2.114 18002
12106 1 20 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.086 1.962 18002
12107 1 20 . 1 1 32 32 GLN H H 394 8.776 8.776 8.283 0.493 18002
12108 1 20 . 1 1 33 33 TYR N N 395 125.112 125.112 123.568 1.544 18002
12109 1 20 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.014 1.060 18002
12110 1 20 . 1 1 33 33 TYR CA C 395 57.164 57.164 57.075 0.090 18002
12111 1 20 . 1 1 33 33 TYR CB C 395 42.672 42.672 39.364 3.308 18002
12112 1 20 . 1 1 33 33 TYR H H 395 8.774 8.774 7.911 0.863 18002
12113 1 20 . 1 1 34 34 TRP N N 396 122.638 122.638 123.639 -1.001 18002
12114 1 20 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.557 -0.875 18002
12115 1 20 . 1 1 34 34 TRP CA C 396 57.218 57.218 54.594 2.624 18002
12116 1 20 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.993 0.511 18002
12117 1 20 . 1 1 34 34 TRP H H 396 8.975 8.975 7.344 1.631 18002
12118 1 20 . 1 1 35 35 CYS N N 397 127.146 127.146 124.323 2.823 18002
12119 1 20 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.386 -0.019 18002
12120 1 20 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.256 1.450 18002
12121 1 20 . 1 1 35 35 CYS H H 397 8.804 8.804 8.981 -0.177 18002
12122 1 20 . 1 1 36 36 THR N N 398 110.578 110.578 115.368 -4.790 18002
12123 1 20 . 1 1 36 36 THR HA H 398 5.358 5.358 4.858 0.500 18002
12124 1 20 . 1 1 36 36 THR CA C 398 58.704 58.704 61.241 -2.537 18002
12125 1 20 . 1 1 36 36 THR CB C 398 71.833 71.833 70.826 1.006 18002
12126 1 20 . 1 1 36 36 THR H H 398 9.090 9.090 8.024 1.066 18002
12127 1 20 . 1 1 37 37 PHE N N 399 127.322 127.322 127.528 -0.206 18002
12128 1 20 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.677 0.276 18002
12129 1 20 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.297 -1.052 18002
12130 1 20 . 1 1 37 37 PHE CB C 399 42.185 42.185 41.514 0.671 18002
12131 1 20 . 1 1 37 37 PHE H H 399 8.846 8.846 8.217 0.629 18002
12132 1 20 . 1 1 38 38 LYS N N 400 125.391 125.391 123.742 1.649 18002
12133 1 20 . 1 1 38 38 LYS HA H 400 4.527 4.527 5.079 -0.552 18002
12134 1 20 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.219 0.758 18002
12135 1 20 . 1 1 38 38 LYS CB C 400 35.915 35.915 35.592 0.323 18002
12136 1 20 . 1 1 38 38 LYS H H 400 8.252 8.252 7.868 0.384 18002
12137 1 20 . 1 1 39 39 ASP N N 401 125.083 125.083 120.782 4.301 18002
12138 1 20 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.277 -0.199 18002
12139 1 20 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.442 0.041 18002
12140 1 20 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.202 -0.680 18002
12141 1 20 . 1 1 39 39 ASP H H 401 9.408 9.408 8.841 0.567 18002
12142 1 20 . 1 1 40 40 THR N N 402 112.024 112.024 113.675 -1.651 18002
12143 1 20 . 1 1 40 40 THR HA H 402 4.767 4.767 4.621 0.146 18002
12144 1 20 . 1 1 40 40 THR CA C 402 60.811 60.811 61.591 -0.780 18002
12145 1 20 . 1 1 40 40 THR CB C 402 68.823 68.823 69.812 -0.989 18002
12146 1 20 . 1 1 40 40 THR H H 402 8.224 8.224 8.274 -0.050 18002
12147 1 20 . 1 1 41 41 SER N N 403 116.142 116.142 115.106 1.036 18002
12148 1 20 . 1 1 41 41 SER HA H 403 5.428 5.428 4.901 0.527 18002
12149 1 20 . 1 1 41 41 SER CA C 403 58.297 58.297 56.823 1.474 18002
12150 1 20 . 1 1 41 41 SER CB C 403 66.409 66.409 66.805 -0.396 18002
12151 1 20 . 1 1 41 41 SER H H 403 8.197 8.197 7.826 0.371 18002
12152 1 20 . 1 1 42 42 ILE N N 404 122.292 122.292 120.158 2.134 18002
12153 1 20 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.317 0.612 18002
12154 1 20 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.042 1.762 18002
12155 1 20 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.370 1.050 18002
12156 1 20 . 1 1 42 42 ILE H H 404 8.411 8.411 8.224 0.187 18002
12157 1 20 . 1 1 43 43 SER N N 405 122.244 122.244 115.331 6.913 18002
12158 1 20 . 1 1 43 43 SER HA H 405 4.966 4.966 4.918 0.048 18002
12159 1 20 . 1 1 43 43 SER CA C 405 57.735 57.735 57.385 0.350 18002
12160 1 20 . 1 1 43 43 SER CB C 405 65.388 65.388 65.360 0.028 18002
12161 1 20 . 1 1 43 43 SER H H 405 8.752 8.752 8.325 0.427 18002
12162 1 20 . 1 1 44 44 CYS N N 406 120.004 120.004 124.357 -4.353 18002
12163 1 20 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.840 0.127 18002
12164 1 20 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.555 -0.497 18002
12165 1 20 . 1 1 44 44 CYS CB C 406 29.440 29.440 29.069 0.371 18002
12166 1 20 . 1 1 44 44 CYS H H 406 8.470 8.470 8.428 0.042 18002
12167 1 20 . 1 1 45 45 TYR N N 407 122.704 122.704 124.249 -1.545 18002
12168 1 20 . 1 1 45 45 TYR HA H 407 5.023 5.023 5.047 -0.024 18002
12169 1 20 . 1 1 45 45 TYR CA C 407 56.983 56.983 56.128 0.855 18002
12170 1 20 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.081 1.493 18002
12171 1 20 . 1 1 45 45 TYR H H 407 10.013 10.013 8.058 1.955 18002
12172 1 20 . 1 1 46 46 LYS N N 408 121.897 121.897 123.177 -1.280 18002
12173 1 20 . 1 1 46 46 LYS HA H 408 4.346 4.346 3.925 0.421 18002
12174 1 20 . 1 1 46 46 LYS CA C 408 60.019 60.019 56.790 3.229 18002
12175 1 20 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.357 -0.645 18002
12176 1 20 . 1 1 46 46 LYS H H 408 9.734 9.734 8.708 1.026 18002
12177 1 20 . 1 1 47 47 SER N N 409 106.720 106.720 113.547 -6.827 18002
12178 1 20 . 1 1 47 47 SER HA H 409 4.776 4.776 4.901 -0.125 18002
12179 1 20 . 1 1 47 47 SER CA C 409 57.180 57.180 57.118 0.062 18002
12180 1 20 . 1 1 47 47 SER CB C 409 65.870 65.870 65.562 0.308 18002
12181 1 20 . 1 1 47 47 SER H H 409 7.518 7.518 8.142 -0.624 18002
12182 1 20 . 1 1 48 48 LYS N N 410 122.302 122.302 124.053 -1.751 18002
12183 1 20 . 1 1 48 48 LYS CA C 410 59.234 59.234 58.594 0.640 18002
12184 1 20 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.571 0.728 18002
12185 1 20 . 1 1 48 48 LYS H H 410 8.195 8.195 9.161 -0.966 18002
12186 1 20 . 1 1 49 49 GLU N N 411 118.983 118.983 119.427 -0.444 18002
12187 1 20 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.085 0.697 18002
12188 1 20 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.719 0.816 18002
12189 1 20 . 1 1 49 49 GLU CB C 411 28.688 28.688 28.456 0.232 18002
12190 1 20 . 1 1 49 49 GLU H H 411 8.752 8.752 8.882 -0.130 18002
12191 1 20 . 1 1 50 50 GLU N N 412 118.384 118.384 119.999 -1.615 18002
12192 1 20 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.038 0.455 18002
12193 1 20 . 1 1 50 50 GLU CA C 412 55.789 55.789 58.809 -3.020 18002
12194 1 20 . 1 1 50 50 GLU CB C 412 30.005 30.005 28.656 1.349 18002
12195 1 20 . 1 1 50 50 GLU H H 412 7.234 7.234 7.736 -0.502 18002
12196 1 20 . 1 1 51 51 SER N N 413 114.767 114.767 115.487 -0.720 18002
12197 1 20 . 1 1 51 51 SER CA C 413 59.764 59.764 60.972 -1.208 18002
12198 1 20 . 1 1 51 51 SER CB C 413 62.965 62.965 63.102 -0.137 18002
12199 1 20 . 1 1 51 51 SER H H 413 7.382 7.382 7.873 -0.491 18002
12200 1 20 . 1 1 52 52 SER N N 414 114.496 114.496 113.031 1.465 18002
12201 1 20 . 1 1 52 52 SER HA H 414 4.560 4.560 4.696 -0.136 18002
12202 1 20 . 1 1 52 52 SER CA C 414 58.574 58.574 58.275 0.299 18002
12203 1 20 . 1 1 52 52 SER CB C 414 63.829 63.829 64.471 -0.642 18002
12204 1 20 . 1 1 52 52 SER H H 414 7.682 7.682 7.798 -0.116 18002
12205 1 20 . 1 1 53 53 GLY N N 415 111.107 111.107 108.941 2.166 18002
12206 1 20 . 1 1 53 53 GLY CA C 415 44.233 44.233 45.502 -1.269 18002
12207 1 20 . 1 1 53 53 GLY H H 415 7.918 7.918 7.998 -0.080 18002
12208 1 20 . 1 1 54 54 THR N N 416 120.214 120.214 114.699 5.515 18002
12209 1 20 . 1 1 54 54 THR CB C 416 70.035 70.035 71.036 -1.001 18002
12210 1 20 . 1 1 54 54 THR H H 416 8.622 8.622 8.094 0.528 18002
12211 1 20 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.451 0.024 18002
12212 1 20 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.892 0.153 18002
12213 1 20 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.671 -1.093 18002
12214 1 20 . 1 1 56 56 ALA N N 418 125.591 125.591 124.336 1.255 18002
12215 1 20 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.066 -0.110 18002
12216 1 20 . 1 1 56 56 ALA CA C 418 54.535 54.535 54.158 0.377 18002
12217 1 20 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.536 -0.629 18002
12218 1 20 . 1 1 56 56 ALA H H 418 8.288 8.288 8.678 -0.390 18002
12219 1 20 . 1 1 57 57 HIS N N 419 108.119 108.119 111.574 -3.455 18002
12220 1 20 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.705 -0.083 18002
12221 1 20 . 1 1 57 57 HIS CA C 419 54.580 54.580 56.182 -1.602 18002
12222 1 20 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.514 1.705 18002
12223 1 20 . 1 1 57 57 HIS H H 419 7.072 7.072 7.949 -0.877 18002
12224 1 20 . 1 1 58 58 GLN N N 420 123.083 123.083 119.951 3.132 18002
12225 1 20 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.873 0.282 18002
12226 1 20 . 1 1 58 58 GLN CA C 420 55.504 55.504 55.030 0.474 18002
12227 1 20 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.561 1.929 18002
12228 1 20 . 1 1 58 58 GLN H H 420 8.669 8.669 8.755 -0.086 18002
12229 1 20 . 1 1 59 59 MET N N 421 122.330 122.330 119.185 3.145 18002
12230 1 20 . 1 1 59 59 MET HA H 421 4.621 4.621 4.720 -0.099 18002
12231 1 20 . 1 1 59 59 MET CA C 421 54.892 54.892 53.833 1.059 18002
12232 1 20 . 1 1 59 59 MET CB C 421 35.650 35.650 35.612 0.038 18002
12233 1 20 . 1 1 59 59 MET H H 421 8.995 8.995 7.934 1.061 18002
12234 1 20 . 1 1 60 60 ASN N N 422 123.220 123.220 120.455 2.765 18002
12235 1 20 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.742 0.206 18002
12236 1 20 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.992 -0.361 18002
12237 1 20 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.574 0.165 18002
12238 1 20 . 1 1 60 60 ASN H H 422 8.728 8.728 8.568 0.160 18002
12239 1 20 . 1 1 61 61 LEU N N 423 126.072 126.072 122.149 3.923 18002
12240 1 20 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.360 -0.244 18002
12241 1 20 . 1 1 61 61 LEU CA C 423 56.613 56.613 54.256 2.357 18002
12242 1 20 . 1 1 61 61 LEU CB C 423 42.457 42.457 40.870 1.587 18002
12243 1 20 . 1 1 61 61 LEU H H 423 8.942 8.942 7.879 1.063 18002
12244 1 20 . 1 1 62 62 ARG N N 424 121.977 121.977 120.190 1.787 18002
12245 1 20 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.028 0.344 18002
12246 1 20 . 1 1 62 62 ARG CA C 424 59.034 59.034 57.546 1.488 18002
12247 1 20 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.436 -0.826 18002
12248 1 20 . 1 1 62 62 ARG H H 424 8.000 8.000 7.604 0.396 18002
12249 1 20 . 1 1 63 63 GLY N N 425 114.852 114.852 113.603 1.249 18002
12250 1 20 . 1 1 63 63 GLY CA C 425 45.810 45.810 44.630 1.180 18002
12251 1 20 . 1 1 63 63 GLY H H 425 9.033 9.033 9.012 0.021 18002
12252 1 20 . 1 1 64 64 CYS N N 426 117.102 117.102 117.446 -0.344 18002
12253 1 20 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.702 0.197 18002
12254 1 20 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.334 1.426 18002
12255 1 20 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.565 -0.741 18002
12256 1 20 . 1 1 64 64 CYS H H 426 8.248 8.248 7.740 0.508 18002
12257 1 20 . 1 1 65 65 GLU N N 427 119.501 119.501 120.391 -0.890 18002
12258 1 20 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.512 0.265 18002
12259 1 20 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.846 -0.455 18002
12260 1 20 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.567 0.371 18002
12261 1 20 . 1 1 65 65 GLU H H 427 8.449 8.449 8.677 -0.228 18002
12262 1 20 . 1 1 66 66 VAL N N 428 125.286 125.286 120.684 4.602 18002
12263 1 20 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.442 0.448 18002
12264 1 20 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.901 -1.149 18002
12265 1 20 . 1 1 66 66 VAL CB C 428 33.975 33.975 35.026 -1.052 18002
12266 1 20 . 1 1 66 66 VAL H H 428 8.624 8.624 8.504 0.120 18002
12267 1 20 . 1 1 67 67 THR N N 429 124.132 124.132 124.861 -0.729 18002
12268 1 20 . 1 1 67 67 THR CA C 429 59.338 59.338 60.708 -1.370 18002
12269 1 20 . 1 1 67 67 THR CB C 429 72.021 72.021 70.054 1.967 18002
12270 1 20 . 1 1 67 67 THR H H 429 9.247 9.247 8.473 0.774 18002
12271 1 20 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.729 -0.080 18002
12272 1 20 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.604 0.134 18002
12273 1 20 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.237 1.331 18002
12274 1 20 . 1 1 69 69 ASP N N 431 122.066 122.066 124.325 -2.259 18002
12275 1 20 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.981 -0.334 18002
12276 1 20 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.044 0.625 18002
12277 1 20 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.105 0.000 18002
12278 1 20 . 1 1 69 69 ASP H H 431 8.250 8.250 8.598 -0.348 18002
12279 1 20 . 1 1 70 70 VAL N N 432 121.874 121.874 122.004 -0.130 18002
12280 1 20 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.165 0.334 18002
12281 1 20 . 1 1 70 70 VAL CA C 432 60.088 60.088 61.025 -0.937 18002
12282 1 20 . 1 1 70 70 VAL CB C 432 35.032 35.032 32.926 2.106 18002
12283 1 20 . 1 1 70 70 VAL H H 432 8.305 8.305 8.107 0.198 18002
12284 1 20 . 1 1 71 71 ASN N N 433 124.366 124.366 128.617 -4.251 18002
12285 1 20 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.843 -0.161 18002
12286 1 20 . 1 1 71 71 ASN CA C 433 52.761 52.761 51.851 0.910 18002
12287 1 20 . 1 1 71 71 ASN CB C 433 40.279 40.279 38.097 2.182 18002
12288 1 20 . 1 1 71 71 ASN H H 433 8.637 8.637 8.065 0.572 18002
12289 1 20 . 1 1 72 72 ILE N N 434 126.786 126.786 121.394 5.392 18002
12290 1 20 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.656 -0.285 18002
12291 1 20 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.113 1.405 18002
12292 1 20 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.401 -0.226 18002
12293 1 20 . 1 1 72 72 ILE H H 434 8.943 8.943 7.807 1.136 18002
12294 1 20 . 1 1 73 73 SER N N 435 118.305 118.305 115.928 2.377 18002
12295 1 20 . 1 1 73 73 SER CA C 435 61.633 61.633 59.877 1.756 18002
12296 1 20 . 1 1 73 73 SER CB C 435 62.435 62.435 62.606 -0.171 18002
12297 1 20 . 1 1 73 73 SER H H 435 8.578 8.578 8.314 0.264 18002
12298 1 20 . 1 1 74 74 GLY N N 436 107.443 107.443 108.833 -1.390 18002
12299 1 20 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.111 0.750 18002
12300 1 20 . 1 1 74 74 GLY H H 436 7.620 7.620 7.289 0.331 18002
12301 1 20 . 1 1 75 75 GLN N N 437 116.895 116.895 117.121 -0.226 18002
12302 1 20 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.678 -0.388 18002
12303 1 20 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.829 -0.128 18002
12304 1 20 . 1 1 75 75 GLN CB C 437 26.745 26.745 25.672 1.073 18002
12305 1 20 . 1 1 75 75 GLN H H 437 7.798 7.798 8.340 -0.542 18002
12306 1 20 . 1 1 76 76 LYS N N 438 119.308 119.308 116.798 2.510 18002
12307 1 20 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.098 0.044 18002
12308 1 20 . 1 1 76 76 LYS CA C 438 55.043 55.043 53.976 1.067 18002
12309 1 20 . 1 1 76 76 LYS CB C 438 33.945 33.945 34.871 -0.926 18002
12310 1 20 . 1 1 76 76 LYS H H 438 7.522 7.522 7.332 0.190 18002
12311 1 20 . 1 1 77 77 PHE N N 439 125.905 125.905 119.990 5.915 18002
12312 1 20 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.243 -0.032 18002
12313 1 20 . 1 1 77 77 PHE CA C 439 55.639 55.639 55.850 -0.211 18002
12314 1 20 . 1 1 77 77 PHE CB C 439 38.929 38.929 39.404 -0.475 18002
12315 1 20 . 1 1 77 77 PHE H H 439 8.461 8.461 8.081 0.380 18002
12316 1 20 . 1 1 78 78 ASN N N 440 120.787 120.787 120.872 -0.085 18002
12317 1 20 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.381 -0.468 18002
12318 1 20 . 1 1 78 78 ASN CB C 440 40.803 40.803 40.920 -0.117 18002
12319 1 20 . 1 1 78 78 ASN H H 440 7.638 7.638 8.437 -0.799 18002
12320 1 20 . 1 1 79 79 ILE N N 441 123.421 123.421 125.144 -1.723 18002
12321 1 20 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.280 -0.109 18002
12322 1 20 . 1 1 79 79 ILE CA C 441 61.567 61.567 61.014 0.553 18002
12323 1 20 . 1 1 79 79 ILE CB C 441 41.487 41.487 39.477 2.010 18002
12324 1 20 . 1 1 79 79 ILE H H 441 9.550 9.550 8.834 0.716 18002
12325 1 20 . 1 1 80 80 LYS N N 442 126.267 126.267 129.637 -3.370 18002
12326 1 20 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.587 -0.125 18002
12327 1 20 . 1 1 80 80 LYS CA C 442 56.383 56.383 55.219 1.163 18002
12328 1 20 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.416 0.571 18002
12329 1 20 . 1 1 80 80 LYS H H 442 8.703 8.703 8.176 0.527 18002
12330 1 20 . 1 1 81 81 LEU N N 443 125.194 125.194 126.846 -1.652 18002
12331 1 20 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.463 0.809 18002
12332 1 20 . 1 1 81 81 LEU CA C 443 53.349 53.349 54.014 -0.665 18002
12333 1 20 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.071 1.633 18002
12334 1 20 . 1 1 81 81 LEU H H 443 9.223 9.223 8.423 0.800 18002
12335 1 20 . 1 1 82 82 LEU N N 444 122.753 122.753 126.148 -3.395 18002
12336 1 20 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.182 -0.168 18002
12337 1 20 . 1 1 82 82 LEU CA C 444 53.918 53.918 54.045 -0.127 18002
12338 1 20 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.818 -3.194 18002
12339 1 20 . 1 1 82 82 LEU H H 444 8.420 8.420 7.997 0.423 18002
12340 1 20 . 1 1 83 83 ILE N N 445 125.584 125.584 122.769 2.815 18002
12341 1 20 . 1 1 83 83 ILE CA C 445 58.285 58.285 57.455 0.830 18002
12342 1 20 . 1 1 83 83 ILE CB C 445 41.036 41.036 40.995 0.041 18002
12343 1 20 . 1 1 83 83 ILE H H 445 9.010 9.010 8.198 0.812 18002
12344 1 20 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.934 -0.015 18002
12345 1 20 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.114 1.919 18002
12346 1 20 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.873 0.074 18002
12347 1 20 . 1 1 85 85 VAL N N 447 119.780 119.780 119.326 0.454 18002
12348 1 20 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.552 -0.049 18002
12349 1 20 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.658 0.684 18002
12350 1 20 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.806 0.460 18002
12351 1 20 . 1 1 85 85 VAL H H 447 8.304 8.304 8.422 -0.118 18002
12352 1 20 . 1 1 86 86 ALA N N 448 125.178 125.178 122.031 3.147 18002
12353 1 20 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.159 -0.184 18002
12354 1 20 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.680 0.881 18002
12355 1 20 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.358 -0.370 18002
12356 1 20 . 1 1 86 86 ALA H H 448 8.526 8.526 8.507 0.019 18002
12357 1 20 . 1 1 87 87 GLU N N 449 114.625 114.625 117.458 -2.833 18002
12358 1 20 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.133 0.157 18002
12359 1 20 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.269 -0.538 18002
12360 1 20 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.800 -0.540 18002
12361 1 20 . 1 1 87 87 GLU H H 449 8.402 8.402 8.601 -0.199 18002
12362 1 20 . 1 1 88 88 GLY N N 450 109.432 109.432 106.534 2.898 18002
12363 1 20 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.749 1.088 18002
12364 1 20 . 1 1 88 88 GLY H H 450 7.711 7.711 7.416 0.295 18002
12365 1 20 . 1 1 89 89 MET N N 451 121.382 121.382 120.932 0.450 18002
12366 1 20 . 1 1 89 89 MET HA H 451 5.076 5.076 5.134 -0.058 18002
12367 1 20 . 1 1 89 89 MET CA C 451 53.860 53.860 54.501 -0.641 18002
12368 1 20 . 1 1 89 89 MET CB C 451 35.942 35.942 37.133 -1.191 18002
12369 1 20 . 1 1 89 89 MET H H 451 8.355 8.355 8.131 0.224 18002
12370 1 20 . 1 1 90 90 ASN N N 452 123.538 123.538 123.639 -0.101 18002
12371 1 20 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.861 0.092 18002
12372 1 20 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.355 -0.607 18002
12373 1 20 . 1 1 90 90 ASN CB C 452 40.642 40.642 39.096 1.546 18002
12374 1 20 . 1 1 90 90 ASN H H 452 9.338 9.338 8.988 0.350 18002
12375 1 20 . 1 1 91 91 GLU N N 453 125.978 125.978 124.258 1.720 18002
12376 1 20 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.473 0.871 18002
12377 1 20 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.404 -1.131 18002
12378 1 20 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.306 1.437 18002
12379 1 20 . 1 1 91 91 GLU H H 453 8.168 8.168 8.526 -0.358 18002
12380 1 20 . 1 1 92 92 ILE N N 454 126.776 126.776 126.602 0.174 18002
12381 1 20 . 1 1 92 92 ILE HA H 454 4.566 4.566 3.783 0.783 18002
12382 1 20 . 1 1 92 92 ILE CA C 454 60.048 60.048 60.447 -0.399 18002
12383 1 20 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.415 0.847 18002
12384 1 20 . 1 1 92 92 ILE H H 454 9.000 9.000 8.572 0.428 18002
12385 1 20 . 1 1 93 93 TRP N N 455 125.987 125.987 123.371 2.616 18002
12386 1 20 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.044 -0.452 18002
12387 1 20 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.277 -1.487 18002
12388 1 20 . 1 1 93 93 TRP CB C 455 31.386 31.386 31.724 -0.338 18002
12389 1 20 . 1 1 93 93 TRP H H 455 9.278 9.278 7.409 1.869 18002
12390 1 20 . 1 1 94 94 LEU N N 456 120.912 120.912 120.454 0.458 18002
12391 1 20 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.694 0.668 18002
12392 1 20 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.785 -0.570 18002
12393 1 20 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.197 0.398 18002
12394 1 20 . 1 1 94 94 LEU H H 456 9.534 9.534 8.302 1.232 18002
12395 1 20 . 1 1 95 95 ARG N N 457 123.669 123.669 121.325 2.344 18002
12396 1 20 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.510 0.761 18002
12397 1 20 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.778 -0.360 18002
12398 1 20 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.619 0.643 18002
12399 1 20 . 1 1 95 95 ARG H H 457 9.439 9.439 8.958 0.481 18002
12400 1 20 . 1 1 96 96 CYS N N 458 125.273 125.273 120.120 5.153 18002
12401 1 20 . 1 1 96 96 CYS HA H 458 4.698 4.698 5.062 -0.364 18002
12402 1 20 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.786 0.006 18002
12403 1 20 . 1 1 96 96 CYS CB C 458 30.403 30.403 29.079 1.324 18002
12404 1 20 . 1 1 96 96 CYS H H 458 8.652 8.652 8.650 0.002 18002
12405 1 20 . 1 1 97 97 ASP N N 459 119.661 119.661 122.361 -2.700 18002
12406 1 20 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.767 -0.027 18002
12407 1 20 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.487 1.741 18002
12408 1 20 . 1 1 97 97 ASP CB C 459 43.585 43.585 41.849 1.736 18002
12409 1 20 . 1 1 97 97 ASP H H 459 9.116 9.116 9.207 -0.091 18002
12410 1 20 . 1 1 98 98 ASN N N 460 109.173 109.173 113.935 -4.762 18002
12411 1 20 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.732 -0.360 18002
12412 1 20 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.450 -0.436 18002
12413 1 20 . 1 1 98 98 ASN CB C 460 40.811 40.811 39.276 1.535 18002
12414 1 20 . 1 1 98 98 ASN H H 460 7.054 7.054 7.458 -0.404 18002
12415 1 20 . 1 1 99 99 GLU N N 461 119.220 119.220 119.672 -0.452 18002
12416 1 20 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.532 0.512 18002
12417 1 20 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.244 0.524 18002
12418 1 20 . 1 1 99 99 GLU H H 461 8.937 8.937 8.581 0.356 18002
12419 1 20 . 1 1 100 100 LYS N N 462 120.647 120.647 118.089 2.558 18002
12420 1 20 . 1 1 100 100 LYS HA H 462 4.645 4.645 3.844 0.801 18002
12421 1 20 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.214 1.322 18002
12422 1 20 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.831 0.397 18002
12423 1 20 . 1 1 100 100 LYS H H 462 8.033 8.033 8.143 -0.110 18002
12424 1 20 . 1 1 101 101 GLN N N 463 121.938 121.938 118.726 3.212 18002
12425 1 20 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.092 0.308 18002
12426 1 20 . 1 1 101 101 GLN CA C 463 59.395 59.395 58.497 0.898 18002
12427 1 20 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.268 3.946 18002
12428 1 20 . 1 1 101 101 GLN H H 463 8.372 8.372 7.516 0.856 18002
12429 1 20 . 1 1 102 102 TYR N N 464 117.422 117.422 119.325 -1.903 18002
12430 1 20 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.245 0.371 18002
12431 1 20 . 1 1 102 102 TYR CA C 464 61.677 61.677 60.639 1.038 18002
12432 1 20 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.090 0.769 18002
12433 1 20 . 1 1 102 102 TYR H H 464 8.221 8.221 8.044 0.177 18002
12434 1 20 . 1 1 103 103 ALA N N 465 120.655 120.655 119.735 0.920 18002
12435 1 20 . 1 1 103 103 ALA HA H 465 3.715 3.715 4.092 -0.377 18002
12436 1 20 . 1 1 103 103 ALA CA C 465 55.913 55.913 53.728 2.185 18002
12437 1 20 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.684 0.118 18002
12438 1 20 . 1 1 103 103 ALA H H 465 8.637 8.637 7.201 1.436 18002
12439 1 20 . 1 1 104 104 HIS N N 466 112.871 112.871 118.619 -5.748 18002
12440 1 20 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.537 -0.396 18002
12441 1 20 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.253 1.374 18002
12442 1 20 . 1 1 104 104 HIS CB C 466 28.858 28.858 29.896 -1.038 18002
12443 1 20 . 1 1 104 104 HIS H H 466 7.852 7.852 7.988 -0.136 18002
12444 1 20 . 1 1 105 105 TRP N N 467 121.317 121.317 118.857 2.460 18002
12445 1 20 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.526 -0.831 18002
12446 1 20 . 1 1 105 105 TRP CA C 467 62.342 62.342 60.902 1.440 18002
12447 1 20 . 1 1 105 105 TRP CB C 467 27.505 27.505 28.802 -1.297 18002
12448 1 20 . 1 1 105 105 TRP H H 467 8.668 8.668 8.080 0.588 18002
12449 1 20 . 1 1 106 106 MET N N 468 122.346 122.346 118.427 3.919 18002
12450 1 20 . 1 1 106 106 MET HA H 468 4.086 4.086 4.349 -0.263 18002
12451 1 20 . 1 1 106 106 MET CA C 468 58.743 58.743 57.184 1.559 18002
12452 1 20 . 1 1 106 106 MET CB C 468 31.402 31.402 31.617 -0.215 18002
12453 1 20 . 1 1 106 106 MET H H 468 9.790 9.790 7.791 1.999 18002
12454 1 20 . 1 1 107 107 ALA N N 469 119.758 119.758 120.998 -1.240 18002
12455 1 20 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.191 -0.486 18002
12456 1 20 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.391 1.738 18002
12457 1 20 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.115 2.290 18002
12458 1 20 . 1 1 107 107 ALA H H 469 7.702 7.702 7.717 -0.015 18002
12459 1 20 . 1 1 108 108 ALA N N 470 119.233 119.233 121.494 -2.261 18002
12460 1 20 . 1 1 108 108 ALA HA H 470 3.546 3.546 4.016 -0.470 18002
12461 1 20 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.053 0.768 18002
12462 1 20 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.468 -1.736 18002
12463 1 20 . 1 1 108 108 ALA H H 470 7.156 7.156 7.590 -0.434 18002
12464 1 20 . 1 1 109 109 CYS N N 471 116.736 116.736 117.088 -0.352 18002
12465 1 20 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.090 -0.033 18002
12466 1 20 . 1 1 109 109 CYS CA C 471 64.571 64.571 61.605 2.966 18002
12467 1 20 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.900 -0.507 18002
12468 1 20 . 1 1 109 109 CYS H H 471 8.256 8.256 8.124 0.132 18002
12469 1 20 . 1 1 110 110 ARG N N 472 118.644 118.644 119.446 -0.802 18002
12470 1 20 . 1 1 110 110 ARG HA H 472 3.734 3.734 3.978 -0.244 18002
12471 1 20 . 1 1 110 110 ARG CA C 472 60.204 60.204 59.053 1.151 18002
12472 1 20 . 1 1 110 110 ARG CB C 472 30.317 30.317 29.842 0.475 18002
12473 1 20 . 1 1 110 110 ARG H H 472 8.403 8.403 7.568 0.835 18002
12474 1 20 . 1 1 111 111 LEU N N 473 121.877 121.877 120.627 1.250 18002
12475 1 20 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.132 -0.332 18002
12476 1 20 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.348 2.507 18002
12477 1 20 . 1 1 111 111 LEU CB C 473 40.420 40.420 41.549 -1.129 18002
12478 1 20 . 1 1 111 111 LEU H H 473 7.916 7.916 7.355 0.561 18002
12479 1 20 . 1 1 112 112 ALA N N 474 122.765 122.765 120.657 2.108 18002
12480 1 20 . 1 1 112 112 ALA HA H 474 4.480 4.480 4.074 0.406 18002
12481 1 20 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.548 0.713 18002
12482 1 20 . 1 1 112 112 ALA CB C 474 19.875 19.875 18.264 1.611 18002
12483 1 20 . 1 1 112 112 ALA H H 474 8.393 8.393 8.788 -0.395 18002
12484 1 20 . 1 1 113 113 SER N N 475 113.613 113.613 114.065 -0.452 18002
12485 1 20 . 1 1 113 113 SER HA H 475 4.782 4.782 4.202 0.580 18002
12486 1 20 . 1 1 113 113 SER CA C 475 61.090 61.090 61.048 0.042 18002
12487 1 20 . 1 1 113 113 SER CB C 475 63.612 63.612 63.241 0.371 18002
12488 1 20 . 1 1 113 113 SER H H 475 8.150 8.150 7.708 0.442 18002
12489 1 20 . 1 1 114 114 LYS N N 476 118.734 118.734 118.662 0.072 18002
12490 1 20 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.293 0.260 18002
12491 1 20 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.252 -1.108 18002
12492 1 20 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.240 0.351 18002
12493 1 20 . 1 1 114 114 LYS H H 476 7.239 7.239 7.763 -0.524 18002
12494 1 20 . 1 1 115 115 GLY N N 477 107.818 107.818 108.061 -0.243 18002
12495 1 20 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.301 0.685 18002
12496 1 20 . 1 1 115 115 GLY H H 477 8.401 8.401 7.910 0.491 18002
12497 1 20 . 1 1 116 116 LYS N N 478 120.938 120.938 120.030 0.908 18002
12498 1 20 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.493 0.080 18002
12499 1 20 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.638 0.209 18002
12500 1 20 . 1 1 116 116 LYS CB C 478 35.321 35.321 35.215 0.106 18002
12501 1 20 . 1 1 116 116 LYS H H 478 8.142 8.142 7.391 0.751 18002
12502 1 20 . 1 1 117 117 THR N N 479 108.076 108.076 115.651 -7.575 18002
12503 1 20 . 1 1 117 117 THR HA H 479 4.671 4.671 4.551 0.120 18002
12504 1 20 . 1 1 117 117 THR CA C 479 59.191 59.191 61.141 -1.950 18002
12505 1 20 . 1 1 117 117 THR CB C 479 72.228 72.228 70.468 1.760 18002
12506 1 20 . 1 1 117 117 THR H H 479 7.926 7.926 8.095 -0.169 18002
12507 1 20 . 1 1 118 118 MET N N 480 116.403 116.403 119.506 -3.103 18002
12508 1 20 . 1 1 118 118 MET HA H 480 3.352 3.352 3.632 -0.280 18002
12509 1 20 . 1 1 118 118 MET CA C 480 57.947 57.947 57.135 0.812 18002
12510 1 20 . 1 1 118 118 MET CB C 480 33.920 33.920 29.970 3.950 18002
12511 1 20 . 1 1 118 118 MET H H 480 8.899 8.899 8.714 0.185 18002
12512 1 20 . 1 1 119 119 ALA N N 481 117.786 117.786 120.686 -2.900 18002
12513 1 20 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.454 -0.370 18002
12514 1 20 . 1 1 119 119 ALA CA C 481 52.595 52.595 51.830 0.765 18002
12515 1 20 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.296 -0.234 18002
12516 1 20 . 1 1 119 119 ALA H H 481 7.645 7.645 7.929 -0.284 18002
12517 1 20 . 1 1 120 120 ASP N N 482 120.348 120.348 119.259 1.089 18002
12518 1 20 . 1 1 120 120 ASP CB C 482 44.616 44.616 41.832 2.784 18002
12519 1 20 . 1 1 120 120 ASP H H 482 7.887 7.887 7.738 0.149 18002
12520 1 20 . 1 1 121 121 SER HA H 483 4.223 4.223 4.307 -0.084 18002
12521 1 20 . 1 1 121 121 SER CA C 483 61.455 61.455 60.589 0.866 18002
12522 1 20 . 1 1 121 121 SER CB C 483 62.996 62.996 63.199 -0.203 18002
12523 1 20 . 1 1 122 122 SER N N 484 116.845 116.845 117.384 -0.539 18002
12524 1 20 . 1 1 122 122 SER HA H 484 4.321 4.321 4.263 0.058 18002
12525 1 20 . 1 1 122 122 SER CA C 484 60.584 60.584 60.157 0.427 18002
12526 1 20 . 1 1 122 122 SER CB C 484 64.314 64.314 63.194 1.120 18002
12527 1 20 . 1 1 122 122 SER H H 484 8.875 8.875 7.854 1.021 18002
12528 1 20 . 1 1 123 123 TYR N N 485 124.153 124.153 122.389 1.764 18002
12529 1 20 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.456 -0.576 18002
12530 1 20 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.137 3.177 18002
12531 1 20 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.517 0.224 18002
12532 1 20 . 1 1 123 123 TYR H H 485 8.018 8.018 7.695 0.323 18002
12533 1 20 . 1 1 124 124 ASN N N 486 115.339 115.339 117.677 -2.338 18002
12534 1 20 . 1 1 124 124 ASN HA H 486 3.941 3.941 3.630 0.311 18002
12535 1 20 . 1 1 124 124 ASN CA C 486 56.706 56.706 55.698 1.008 18002
12536 1 20 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.470 0.586 18002
12537 1 20 . 1 1 124 124 ASN H H 486 8.665 8.665 7.090 1.575 18002
12538 1 20 . 1 1 125 125 LEU N N 487 119.454 119.454 119.551 -0.097 18002
12539 1 20 . 1 1 125 125 LEU HA H 487 3.938 3.938 3.923 0.015 18002
12540 1 20 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.766 -0.096 18002
12541 1 20 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.812 -0.244 18002
12542 1 20 . 1 1 125 125 LEU H H 487 7.105 7.105 8.236 -1.131 18002
12543 1 20 . 1 1 126 126 GLU N N 488 121.189 121.189 117.586 3.603 18002
12544 1 20 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.049 -0.019 18002
12545 1 20 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.162 -0.127 18002
12546 1 20 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.642 -0.557 18002
12547 1 20 . 1 1 126 126 GLU H H 488 8.053 8.053 7.409 0.644 18002
12548 1 20 . 1 1 127 127 VAL N N 489 119.073 119.073 117.157 1.916 18002
12549 1 20 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.651 -0.633 18002
12550 1 20 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.935 1.387 18002
12551 1 20 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.644 0.015 18002
12552 1 20 . 1 1 127 127 VAL H H 489 7.769 7.769 7.937 -0.168 18002
12553 1 20 . 1 1 128 128 GLN N N 490 116.214 116.214 117.774 -1.560 18002
12554 1 20 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.001 -0.169 18002
12555 1 20 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.692 0.064 18002
12556 1 20 . 1 1 128 128 GLN CB C 490 28.112 28.112 28.227 -0.115 18002
12557 1 20 . 1 1 128 128 GLN H H 490 7.542 7.542 7.950 -0.408 18002
12558 1 20 . 1 1 129 129 ASN N N 491 120.003 120.003 118.596 1.407 18002
12559 1 20 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.673 -0.254 18002
12560 1 20 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.757 0.403 18002
12561 1 20 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.276 -0.216 18002
12562 1 20 . 1 1 129 129 ASN H H 491 8.582 8.582 7.442 1.140 18002
12563 1 20 . 1 1 130 130 ILE N N 492 122.365 122.365 119.478 2.887 18002
12564 1 20 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.486 2.267 18002
12565 1 20 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.244 0.902 18002
12566 1 20 . 1 1 130 130 ILE H H 492 8.186 8.186 7.403 0.783 18002
12567 1 20 . 1 1 131 131 LEU N N 493 119.597 119.597 121.702 -2.105 18002
12568 1 20 . 1 1 131 131 LEU HA H 493 4.005 4.005 4.038 -0.033 18002
12569 1 20 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.059 0.800 18002
12570 1 20 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.941 -0.405 18002
12571 1 20 . 1 1 131 131 LEU H H 493 8.224 8.224 7.732 0.492 18002
12572 1 20 . 1 1 132 132 SER N N 494 114.884 114.884 114.823 0.061 18002
12573 1 20 . 1 1 132 132 SER HA H 494 4.430 4.430 4.082 0.348 18002
12574 1 20 . 1 1 132 132 SER CA C 494 62.072 62.072 61.470 0.602 18002
12575 1 20 . 1 1 132 132 SER CB C 494 62.703 62.703 62.850 -0.147 18002
12576 1 20 . 1 1 132 132 SER H H 494 8.464 8.464 7.705 0.759 18002
12577 1 20 . 1 1 133 133 PHE N N 495 123.047 123.047 122.295 0.752 18002
12578 1 20 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.265 0.112 18002
12579 1 20 . 1 1 133 133 PHE CA C 495 60.913 60.913 60.522 0.391 18002
12580 1 20 . 1 1 133 133 PHE CB C 495 39.050 39.050 38.970 0.080 18002
12581 1 20 . 1 1 133 133 PHE H H 495 7.915 7.915 7.505 0.410 18002
12582 1 20 . 1 1 134 134 LEU N N 496 119.311 119.311 117.069 2.242 18002
12583 1 20 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.102 -0.197 18002
12584 1 20 . 1 1 134 134 LEU CA C 496 57.601 57.601 58.275 -0.674 18002
12585 1 20 . 1 1 134 134 LEU CB C 496 41.901 41.901 40.616 1.285 18002
12586 1 20 . 1 1 134 134 LEU H H 496 8.386 8.386 8.176 0.210 18002
12587 1 20 . 1 1 135 135 LYS N N 497 117.550 117.550 115.925 1.625 18002
12588 1 20 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.124 -0.184 18002
12589 1 20 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.334 -0.059 18002
12590 1 20 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.394 0.100 18002
12591 1 20 . 1 1 135 135 LYS H H 497 7.670 7.670 7.611 0.059 18002
12592 1 20 . 1 1 136 136 MET N N 498 116.106 116.106 118.227 -2.121 18002
12593 1 20 . 1 1 136 136 MET HA H 498 4.354 4.354 4.226 0.128 18002
12594 1 20 . 1 1 136 136 MET CA C 498 55.994 55.994 57.914 -1.920 18002
12595 1 20 . 1 1 136 136 MET CB C 498 32.772 32.772 32.703 0.069 18002
12596 1 20 . 1 1 136 136 MET H H 498 7.421 7.421 8.443 -1.022 18002
12597 1 20 . 1 1 137 137 GLN N N 499 118.651 118.651 117.949 0.702 18002
12598 1 20 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.406 -0.222 18002
12599 1 20 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.087 -1.780 18002
12600 1 20 . 1 1 137 137 GLN H H 499 7.617 7.617 8.158 -0.540 18002
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 128 3.162 -0.765 3.080 18002
2 1 1 "Average Difference" HA 128 0.364 -0.009 0.366 18002
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18002
4 1 1 "Average Difference" CA 133 1.214 -0.250 1.193 18002
5 1 1 "Average Difference" CB 127 1.240 -0.453 1.159 18002
6 1 1 "Average Difference" HN 128 0.683 -0.197 0.656 18002
7 1 2 "Average Difference" N 128 2.981 -0.451 2.959 18002
8 1 2 "Average Difference" HA 128 0.340 -0.040 0.339 18002
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18002
10 1 2 "Average Difference" CA 133 1.340 -0.330 1.303 18002
11 1 2 "Average Difference" CB 127 1.432 -0.524 1.338 18002
12 1 2 "Average Difference" HN 128 0.671 -0.244 0.627 18002
13 1 3 "Average Difference" N 128 3.032 -0.383 3.020 18002
14 1 3 "Average Difference" HA 128 0.355 -0.022 0.355 18002
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18002
16 1 3 "Average Difference" CA 133 1.276 -0.273 1.251 18002
17 1 3 "Average Difference" CB 127 1.338 -0.559 1.220 18002
18 1 3 "Average Difference" HN 128 0.633 -0.219 0.596 18002
19 1 4 "Average Difference" N 128 2.981 -0.146 2.989 18002
20 1 4 "Average Difference" HA 128 0.364 -0.026 0.365 18002
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18002
22 1 4 "Average Difference" CA 133 1.275 -0.282 1.248 18002
23 1 4 "Average Difference" CB 127 1.367 -0.549 1.257 18002
24 1 4 "Average Difference" HN 128 0.661 -0.222 0.625 18002
25 1 5 "Average Difference" N 128 3.022 -0.516 2.990 18002
26 1 5 "Average Difference" HA 128 0.361 -0.029 0.361 18002
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18002
28 1 5 "Average Difference" CA 133 1.189 -0.293 1.157 18002
29 1 5 "Average Difference" CB 127 1.422 -0.501 1.336 18002
30 1 5 "Average Difference" HN 128 0.657 -0.221 0.621 18002
31 1 6 "Average Difference" N 128 3.085 -0.348 3.078 18002
32 1 6 "Average Difference" HA 128 0.370 -0.034 0.370 18002
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18002
34 1 6 "Average Difference" CA 133 1.309 -0.217 1.296 18002
35 1 6 "Average Difference" CB 127 1.399 -0.516 1.305 18002
36 1 6 "Average Difference" HN 128 0.674 -0.244 0.631 18002
37 1 7 "Average Difference" N 128 3.137 -0.282 3.137 18002
38 1 7 "Average Difference" HA 128 0.382 -0.042 0.382 18002
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18002
40 1 7 "Average Difference" CA 133 1.256 -0.247 1.236 18002
41 1 7 "Average Difference" CB 127 1.354 -0.506 1.260 18002
42 1 7 "Average Difference" HN 128 0.589 -0.174 0.565 18002
43 1 8 "Average Difference" N 128 3.117 -0.202 3.123 18002
44 1 8 "Average Difference" HA 128 0.381 -0.038 0.380 18002
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18002
46 1 8 "Average Difference" CA 133 1.266 -0.300 1.234 18002
47 1 8 "Average Difference" CB 127 1.403 -0.553 1.294 18002
48 1 8 "Average Difference" HN 128 0.675 -0.233 0.636 18002
49 1 9 "Average Difference" N 128 3.083 -0.474 3.059 18002
50 1 9 "Average Difference" HA 128 0.369 0.006 0.370 18002
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18002
52 1 9 "Average Difference" CA 133 1.349 -0.265 1.328 18002
53 1 9 "Average Difference" CB 127 1.311 -0.338 1.272 18002
54 1 9 "Average Difference" HN 128 0.610 -0.189 0.583 18002
55 1 10 "Average Difference" N 128 3.022 -0.374 3.011 18002
56 1 10 "Average Difference" HA 128 0.344 -0.040 0.343 18002
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18002
58 1 10 "Average Difference" CA 133 1.291 -0.218 1.277 18002
59 1 10 "Average Difference" CB 127 1.406 -0.549 1.299 18002
60 1 10 "Average Difference" HN 128 0.675 -0.250 0.629 18002
61 1 11 "Average Difference" N 128 2.912 -0.438 2.890 18002
62 1 11 "Average Difference" HA 128 0.357 -0.028 0.357 18002
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18002
64 1 11 "Average Difference" CA 133 1.378 -0.308 1.348 18002
65 1 11 "Average Difference" CB 127 1.358 -0.487 1.273 18002
66 1 11 "Average Difference" HN 128 0.637 -0.255 0.586 18002
67 1 12 "Average Difference" N 128 3.312 -0.580 3.274 18002
68 1 12 "Average Difference" HA 128 0.354 -0.025 0.354 18002
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18002
70 1 12 "Average Difference" CA 133 1.329 -0.225 1.315 18002
71 1 12 "Average Difference" CB 127 1.333 -0.535 1.226 18002
72 1 12 "Average Difference" HN 128 0.662 -0.175 0.641 18002
73 1 13 "Average Difference" N 128 2.914 -0.111 2.923 18002
74 1 13 "Average Difference" HA 128 0.357 -0.042 0.356 18002
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18002
76 1 13 "Average Difference" CA 133 1.304 -0.222 1.290 18002
77 1 13 "Average Difference" CB 127 1.442 -0.578 1.327 18002
78 1 13 "Average Difference" HN 128 0.619 -0.190 0.591 18002
79 1 14 "Average Difference" N 128 2.926 -0.217 2.930 18002
80 1 14 "Average Difference" HA 128 0.411 -0.040 0.411 18002
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18002
82 1 14 "Average Difference" CA 133 1.250 -0.252 1.229 18002
83 1 14 "Average Difference" CB 127 1.381 -0.537 1.278 18002
84 1 14 "Average Difference" HN 128 0.637 -0.199 0.607 18002
85 1 15 "Average Difference" N 128 3.270 -0.484 3.246 18002
86 1 15 "Average Difference" HA 128 0.386 -0.061 0.383 18002
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18002
88 1 15 "Average Difference" CA 133 1.322 -0.236 1.305 18002
89 1 15 "Average Difference" CB 127 1.420 -0.552 1.314 18002
90 1 15 "Average Difference" HN 128 0.606 -0.270 0.545 18002
91 1 16 "Average Difference" N 128 3.105 -0.375 3.094 18002
92 1 16 "Average Difference" HA 128 0.349 -0.043 0.348 18002
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18002
94 1 16 "Average Difference" CA 133 1.302 -0.195 1.292 18002
95 1 16 "Average Difference" CB 127 1.367 -0.535 1.263 18002
96 1 16 "Average Difference" HN 128 0.610 -0.236 0.565 18002
97 1 17 "Average Difference" N 128 3.210 -0.560 3.174 18002
98 1 17 "Average Difference" HA 128 0.367 -0.014 0.369 18002
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18002
100 1 17 "Average Difference" CA 133 1.331 -0.254 1.311 18002
101 1 17 "Average Difference" CB 127 1.307 -0.542 1.194 18002
102 1 17 "Average Difference" HN 128 0.640 -0.278 0.578 18002
103 1 18 "Average Difference" N 128 3.459 -0.403 3.449 18002
104 1 18 "Average Difference" HA 128 0.393 -0.028 0.394 18002
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18002
106 1 18 "Average Difference" CA 133 1.336 -0.310 1.304 18002
107 1 18 "Average Difference" CB 127 1.522 -0.657 1.378 18002
108 1 18 "Average Difference" HN 128 0.673 -0.266 0.621 18002
109 1 19 "Average Difference" N 128 2.937 0.019 2.949 18002
110 1 19 "Average Difference" HA 128 0.374 -0.026 0.374 18002
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18002
112 1 19 "Average Difference" CA 133 1.201 -0.270 1.175 18002
113 1 19 "Average Difference" CB 127 1.342 -0.487 1.256 18002
114 1 19 "Average Difference" HN 128 0.644 -0.229 0.605 18002
115 1 20 "Average Difference" N 128 2.846 -0.407 2.828 18002
116 1 20 "Average Difference" HA 128 0.373 -0.019 0.374 18002
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18002
118 1 20 "Average Difference" CA 133 1.302 -0.324 1.266 18002
119 1 20 "Average Difference" CB 127 1.243 -0.453 1.163 18002
120 1 20 "Average Difference" HN 128 0.676 -0.240 0.634 18002
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 18002
_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 3 3 HIS HA H 365 4.125 4.125 4.536 -0.411 18002
2 1 . 1 1 3 3 HIS CA C 365 55.015 55.015 56.602 -1.587 18002
3 1 . 1 1 3 3 HIS CB C 365 31.929 31.929 29.666 2.263 18002
4 1 . 1 1 4 4 MET N N 366 120.431 120.431 120.211 0.220 18002
5 1 . 1 1 4 4 MET HA H 366 4.345 4.345 4.498 -0.153 18002
6 1 . 1 1 4 4 MET CA C 366 55.337 55.337 55.795 -0.458 18002
7 1 . 1 1 4 4 MET CB C 366 32.668 32.668 33.256 -0.588 18002
8 1 . 1 1 4 4 MET H H 366 8.373 8.373 8.264 0.109 18002
9 1 . 1 1 5 5 GLY N N 367 109.318 109.318 109.485 -0.167 18002
10 1 . 1 1 5 5 GLY CA C 367 45.457 45.457 45.079 0.378 18002
11 1 . 1 1 5 5 GLY H H 367 8.224 8.224 8.284 -0.060 18002
12 1 . 1 1 6 6 ASP N N 368 120.307 120.307 120.220 0.087 18002
13 1 . 1 1 6 6 ASP HA H 368 4.600 4.600 4.649 -0.049 18002
14 1 . 1 1 6 6 ASP CA C 368 54.513 54.513 53.911 0.602 18002
15 1 . 1 1 6 6 ASP CB C 368 41.326 41.326 41.379 -0.053 18002
16 1 . 1 1 6 6 ASP H H 368 8.199 8.199 8.187 0.012 18002
17 1 . 1 1 7 7 ILE N N 369 120.668 120.668 117.628 3.040 18002
18 1 . 1 1 7 7 ILE HA H 369 4.218 4.218 4.100 0.118 18002
19 1 . 1 1 7 7 ILE CA C 369 61.584 61.584 62.052 -0.468 18002
20 1 . 1 1 7 7 ILE CB C 369 38.768 38.768 37.744 1.024 18002
21 1 . 1 1 7 7 ILE H H 369 8.138 8.138 8.153 -0.015 18002
22 1 . 1 1 8 8 THR N N 370 117.564 117.564 114.264 3.300 18002
23 1 . 1 1 8 8 THR HA H 370 4.322 4.322 4.259 0.063 18002
24 1 . 1 1 8 8 THR CA C 370 62.332 62.332 62.039 0.293 18002
25 1 . 1 1 8 8 THR CB C 370 69.946 69.946 68.759 1.187 18002
26 1 . 1 1 8 8 THR H H 370 8.230 8.230 7.831 0.399 18002
27 1 . 1 1 9 9 SER N N 371 118.467 118.467 117.657 0.810 18002
28 1 . 1 1 9 9 SER HA H 371 4.445 4.445 4.464 -0.019 18002
29 1 . 1 1 9 9 SER CA C 371 58.274 58.274 58.252 0.022 18002
30 1 . 1 1 9 9 SER CB C 371 63.996 63.996 63.353 0.643 18002
31 1 . 1 1 9 9 SER H H 371 8.158 8.158 8.190 -0.032 18002
32 1 . 1 1 10 10 ILE N N 372 123.959 123.959 120.720 3.239 18002
33 1 . 1 1 10 10 ILE CA C 372 58.716 58.716 63.068 -4.352 18002
34 1 . 1 1 10 10 ILE CB C 372 38.919 38.919 36.302 2.617 18002
35 1 . 1 1 10 10 ILE H H 372 8.112 8.112 8.220 -0.108 18002
36 1 . 1 1 11 11 PRO HA H 373 4.352 4.352 4.563 -0.211 18002
37 1 . 1 1 11 11 PRO CA C 373 63.181 63.181 61.720 1.461 18002
38 1 . 1 1 11 11 PRO CB C 373 31.707 31.707 30.443 1.264 18002
39 1 . 1 1 12 12 GLU N N 374 119.349 119.349 121.869 -2.520 18002
40 1 . 1 1 12 12 GLU HA H 374 4.787 4.787 4.542 0.245 18002
41 1 . 1 1 12 12 GLU CA C 374 55.317 55.317 55.508 -0.191 18002
42 1 . 1 1 12 12 GLU CB C 374 33.591 33.591 30.851 2.740 18002
43 1 . 1 1 12 12 GLU H H 374 8.017 8.017 8.044 -0.027 18002
44 1 . 1 1 13 13 LEU N N 375 122.288 122.288 125.705 -3.417 18002
45 1 . 1 1 13 13 LEU HA H 375 4.478 4.478 4.616 -0.138 18002
46 1 . 1 1 13 13 LEU CA C 375 53.930 53.930 55.042 -1.112 18002
47 1 . 1 1 13 13 LEU CB C 375 44.656 44.656 43.477 1.178 18002
48 1 . 1 1 13 13 LEU H H 375 8.036 8.036 8.426 -0.389 18002
49 1 . 1 1 14 14 ALA N N 376 125.461 125.461 127.742 -2.281 18002
50 1 . 1 1 14 14 ALA HA H 376 5.246 5.246 4.844 0.402 18002
51 1 . 1 1 14 14 ALA CA C 376 51.745 51.745 51.619 0.126 18002
52 1 . 1 1 14 14 ALA CB C 376 21.586 21.586 22.108 -0.522 18002
53 1 . 1 1 14 14 ALA H H 376 8.181 8.181 8.195 -0.014 18002
54 1 . 1 1 15 15 ASP N N 377 122.242 122.242 119.453 2.789 18002
55 1 . 1 1 15 15 ASP HA H 377 4.319 4.319 4.696 -0.377 18002
56 1 . 1 1 15 15 ASP CA C 377 53.752 53.752 53.649 0.103 18002
57 1 . 1 1 15 15 ASP CB C 377 46.639 46.639 44.180 2.459 18002
58 1 . 1 1 15 15 ASP H H 377 8.326 8.326 8.762 -0.436 18002
59 1 . 1 1 16 16 TYR N N 378 118.961 118.961 118.648 0.313 18002
60 1 . 1 1 16 16 TYR HA H 378 5.391 5.391 4.943 0.448 18002
61 1 . 1 1 16 16 TYR CA C 378 59.581 59.581 57.047 2.534 18002
62 1 . 1 1 16 16 TYR CB C 378 39.023 39.023 38.938 0.085 18002
63 1 . 1 1 16 16 TYR H H 378 8.869 8.869 7.741 1.128 18002
64 1 . 1 1 17 17 ILE N N 379 125.214 125.214 120.287 4.927 18002
65 1 . 1 1 17 17 ILE HA H 379 4.330 4.330 4.481 -0.151 18002
66 1 . 1 1 17 17 ILE CA C 379 58.732 58.732 59.298 -0.566 18002
67 1 . 1 1 17 17 ILE CB C 379 40.976 40.976 41.871 -0.895 18002
68 1 . 1 1 17 17 ILE H H 379 8.608 8.608 7.996 0.612 18002
69 1 . 1 1 18 18 LYS N N 380 122.917 122.917 122.650 0.267 18002
70 1 . 1 1 18 18 LYS HA H 380 5.112 5.112 5.036 0.076 18002
71 1 . 1 1 18 18 LYS CA C 380 55.836 55.836 54.441 1.395 18002
72 1 . 1 1 18 18 LYS CB C 380 35.025 35.025 34.483 0.542 18002
73 1 . 1 1 18 18 LYS H H 380 7.424 7.424 8.377 -0.953 18002
74 1 . 1 1 19 19 VAL N N 381 122.839 122.839 121.344 1.495 18002
75 1 . 1 1 19 19 VAL HA H 381 5.263 5.263 4.758 0.505 18002
76 1 . 1 1 19 19 VAL CA C 381 61.516 61.516 60.029 1.487 18002
77 1 . 1 1 19 19 VAL CB C 381 35.148 35.148 35.581 -0.433 18002
78 1 . 1 1 19 19 VAL H H 381 9.223 9.223 7.925 1.298 18002
79 1 . 1 1 20 20 PHE N N 382 129.509 129.509 124.758 4.751 18002
80 1 . 1 1 20 20 PHE HA H 382 4.843 4.843 5.003 -0.160 18002
81 1 . 1 1 20 20 PHE CA C 382 55.505 55.505 56.008 -0.503 18002
82 1 . 1 1 20 20 PHE CB C 382 42.862 42.862 40.906 1.956 18002
83 1 . 1 1 20 20 PHE H H 382 9.451 9.451 8.126 1.325 18002
84 1 . 1 1 21 21 LYS N N 383 126.417 126.417 124.095 2.322 18002
85 1 . 1 1 21 21 LYS CA C 383 52.841 52.841 53.180 -0.339 18002
86 1 . 1 1 21 21 LYS CB C 383 33.219 33.219 32.551 0.668 18002
87 1 . 1 1 21 21 LYS H H 383 7.582 7.582 7.996 -0.414 18002
88 1 . 1 1 22 22 PRO CA C 384 63.697 63.697 63.379 0.318 18002
89 1 . 1 1 22 22 PRO CB C 384 31.969 31.969 31.999 -0.030 18002
90 1 . 1 1 23 23 LYS N N 385 118.026 118.026 116.683 1.343 18002
91 1 . 1 1 23 23 LYS HA H 385 4.215 4.215 4.108 0.107 18002
92 1 . 1 1 23 23 LYS CA C 385 56.345 56.345 56.939 -0.594 18002
93 1 . 1 1 23 23 LYS CB C 385 33.033 33.033 32.339 0.694 18002
94 1 . 1 1 23 23 LYS H H 385 8.138 8.138 7.992 0.146 18002
95 1 . 1 1 24 24 LYS N N 386 120.816 120.816 121.866 -1.050 18002
96 1 . 1 1 24 24 LYS HA H 386 4.186 4.186 4.218 -0.032 18002
97 1 . 1 1 24 24 LYS CA C 386 56.862 56.862 57.527 -0.665 18002
98 1 . 1 1 24 24 LYS CB C 386 32.827 32.827 32.433 0.394 18002
99 1 . 1 1 24 24 LYS H H 386 7.727 7.727 8.350 -0.623 18002
100 1 . 1 1 25 25 LEU N N 387 121.214 121.214 120.026 1.188 18002
101 1 . 1 1 25 25 LEU HA H 387 4.168 4.168 4.361 -0.193 18002
102 1 . 1 1 25 25 LEU CA C 387 56.508 56.508 56.358 0.149 18002
103 1 . 1 1 25 25 LEU CB C 387 41.642 41.642 42.202 -0.560 18002
104 1 . 1 1 25 25 LEU H H 387 8.241 8.241 8.003 0.238 18002
105 1 . 1 1 26 26 THR N N 388 112.798 112.798 111.232 1.566 18002
106 1 . 1 1 26 26 THR HA H 388 4.313 4.313 4.286 0.027 18002
107 1 . 1 1 26 26 THR CA C 388 61.795 61.795 62.351 -0.556 18002
108 1 . 1 1 26 26 THR CB C 388 69.875 69.875 68.985 0.890 18002
109 1 . 1 1 26 26 THR H H 388 7.700 7.700 7.845 -0.145 18002
110 1 . 1 1 27 27 LEU N N 389 124.091 124.091 120.766 3.325 18002
111 1 . 1 1 27 27 LEU HA H 389 4.354 4.354 4.608 -0.254 18002
112 1 . 1 1 27 27 LEU CA C 389 55.533 55.533 55.151 0.382 18002
113 1 . 1 1 27 27 LEU CB C 389 42.298 42.298 42.446 -0.148 18002
114 1 . 1 1 27 27 LEU H H 389 8.260 8.260 7.921 0.339 18002
115 1 . 1 1 28 28 LYS N N 390 121.153 121.153 119.377 1.776 18002
116 1 . 1 1 28 28 LYS HA H 390 4.320 4.320 4.264 0.056 18002
117 1 . 1 1 28 28 LYS CA C 390 56.211 56.211 56.966 -0.755 18002
118 1 . 1 1 28 28 LYS CB C 390 33.675 33.675 32.469 1.206 18002
119 1 . 1 1 28 28 LYS H H 390 8.202 8.202 8.242 -0.040 18002
120 1 . 1 1 29 29 GLY N N 391 107.270 107.270 108.435 -1.165 18002
121 1 . 1 1 29 29 GLY CA C 391 44.875 44.875 45.569 -0.694 18002
122 1 . 1 1 29 29 GLY H H 391 7.876 7.876 8.117 -0.241 18002
123 1 . 1 1 30 30 TYR N N 392 118.471 118.471 123.448 -4.977 18002
124 1 . 1 1 30 30 TYR HA H 392 4.446 4.446 4.350 0.096 18002
125 1 . 1 1 30 30 TYR CA C 392 59.047 59.047 59.722 -0.675 18002
126 1 . 1 1 30 30 TYR CB C 392 39.825 39.825 37.281 2.544 18002
127 1 . 1 1 30 30 TYR H H 392 8.183 8.183 8.456 -0.273 18002
128 1 . 1 1 31 31 LYS N N 393 122.833 122.833 123.317 -0.484 18002
129 1 . 1 1 31 31 LYS HA H 393 4.515 4.515 4.661 -0.146 18002
130 1 . 1 1 31 31 LYS CA C 393 55.174 55.174 54.693 0.480 18002
131 1 . 1 1 31 31 LYS CB C 393 35.720 35.720 35.254 0.466 18002
132 1 . 1 1 31 31 LYS H H 393 8.731 8.731 7.843 0.888 18002
133 1 . 1 1 32 32 GLN N N 394 124.759 124.759 121.011 3.748 18002
134 1 . 1 1 32 32 GLN HA H 394 4.678 4.678 4.769 -0.091 18002
135 1 . 1 1 32 32 GLN CA C 394 56.607 56.607 55.037 1.570 18002
136 1 . 1 1 32 32 GLN CB C 394 31.048 31.048 29.892 1.156 18002
137 1 . 1 1 32 32 GLN H H 394 8.776 8.776 8.485 0.291 18002
138 1 . 1 1 33 33 TYR N N 395 125.112 125.112 124.232 0.880 18002
139 1 . 1 1 33 33 TYR HA H 395 5.074 5.074 4.698 0.376 18002
140 1 . 1 1 33 33 TYR CA C 395 57.164 57.164 56.311 0.853 18002
141 1 . 1 1 33 33 TYR CB C 395 42.672 42.672 40.758 1.914 18002
142 1 . 1 1 33 33 TYR H H 395 8.774 8.774 8.255 0.519 18002
143 1 . 1 1 34 34 TRP N N 396 122.638 122.638 124.595 -1.957 18002
144 1 . 1 1 34 34 TRP HA H 396 4.682 4.682 5.392 -0.710 18002
145 1 . 1 1 34 34 TRP CA C 396 57.218 57.218 53.890 3.328 18002
146 1 . 1 1 34 34 TRP CB C 396 29.504 29.504 28.946 0.558 18002
147 1 . 1 1 34 34 TRP H H 396 8.975 8.975 7.919 1.056 18002
148 1 . 1 1 35 35 CYS N N 397 127.146 127.146 123.497 3.649 18002
149 1 . 1 1 35 35 CYS CA C 397 57.367 57.367 57.400 -0.033 18002
150 1 . 1 1 35 35 CYS CB C 397 31.706 31.706 30.401 1.305 18002
151 1 . 1 1 35 35 CYS H H 397 8.804 8.804 8.843 -0.039 18002
152 1 . 1 1 36 36 THR N N 398 110.578 110.578 114.875 -4.297 18002
153 1 . 1 1 36 36 THR HA H 398 5.358 5.358 4.981 0.377 18002
154 1 . 1 1 36 36 THR CA C 398 58.704 58.704 60.876 -2.172 18002
155 1 . 1 1 36 36 THR CB C 398 71.833 71.833 71.124 0.709 18002
156 1 . 1 1 36 36 THR H H 398 9.090 9.090 8.049 1.041 18002
157 1 . 1 1 37 37 PHE N N 399 127.322 127.322 126.790 0.532 18002
158 1 . 1 1 37 37 PHE HA H 399 4.953 4.953 4.629 0.324 18002
159 1 . 1 1 37 37 PHE CA C 399 56.246 56.246 57.493 -1.247 18002
160 1 . 1 1 37 37 PHE CB C 399 42.185 42.185 40.140 2.045 18002
161 1 . 1 1 37 37 PHE H H 399 8.846 8.846 8.299 0.547 18002
162 1 . 1 1 38 38 LYS N N 400 125.391 125.391 125.202 0.189 18002
163 1 . 1 1 38 38 LYS HA H 400 4.527 4.527 4.663 -0.136 18002
164 1 . 1 1 38 38 LYS CA C 400 55.977 55.977 55.098 0.879 18002
165 1 . 1 1 38 38 LYS CB C 400 35.915 35.915 34.758 1.157 18002
166 1 . 1 1 38 38 LYS H H 400 8.252 8.252 8.026 0.227 18002
167 1 . 1 1 39 39 ASP N N 401 125.083 125.083 120.657 4.426 18002
168 1 . 1 1 39 39 ASP HA H 401 4.078 4.078 4.293 -0.215 18002
169 1 . 1 1 39 39 ASP CA C 401 57.483 57.483 57.507 -0.024 18002
170 1 . 1 1 39 39 ASP CB C 401 39.521 39.521 40.273 -0.752 18002
171 1 . 1 1 39 39 ASP H H 401 9.408 9.408 8.891 0.517 18002
172 1 . 1 1 40 40 THR N N 402 112.024 112.024 111.572 0.452 18002
173 1 . 1 1 40 40 THR HA H 402 4.767 4.767 4.512 0.255 18002
174 1 . 1 1 40 40 THR CA C 402 60.811 60.811 61.946 -1.136 18002
175 1 . 1 1 40 40 THR CB C 402 68.823 68.823 69.676 -0.853 18002
176 1 . 1 1 40 40 THR H H 402 8.224 8.224 8.103 0.121 18002
177 1 . 1 1 41 41 SER N N 403 116.142 116.142 115.727 0.415 18002
178 1 . 1 1 41 41 SER HA H 403 5.428 5.428 4.758 0.670 18002
179 1 . 1 1 41 41 SER CA C 403 58.297 58.297 57.033 1.264 18002
180 1 . 1 1 41 41 SER CB C 403 66.409 66.409 65.939 0.470 18002
181 1 . 1 1 41 41 SER H H 403 8.197 8.197 7.881 0.316 18002
182 1 . 1 1 42 42 ILE N N 404 122.292 122.292 120.903 1.389 18002
183 1 . 1 1 42 42 ILE HA H 404 4.929 4.929 4.508 0.421 18002
184 1 . 1 1 42 42 ILE CA C 404 59.804 59.804 58.615 1.189 18002
185 1 . 1 1 42 42 ILE CB C 404 41.420 41.420 40.177 1.243 18002
186 1 . 1 1 42 42 ILE H H 404 8.411 8.411 7.988 0.423 18002
187 1 . 1 1 43 43 SER N N 405 122.244 122.244 116.808 5.436 18002
188 1 . 1 1 43 43 SER HA H 405 4.966 4.966 4.769 0.197 18002
189 1 . 1 1 43 43 SER CA C 405 57.735 57.735 57.179 0.556 18002
190 1 . 1 1 43 43 SER CB C 405 65.388 65.388 65.400 -0.012 18002
191 1 . 1 1 43 43 SER H H 405 8.752 8.752 8.233 0.519 18002
192 1 . 1 1 44 44 CYS N N 406 120.004 120.004 123.153 -3.149 18002
193 1 . 1 1 44 44 CYS HA H 406 4.967 4.967 4.686 0.281 18002
194 1 . 1 1 44 44 CYS CA C 406 57.058 57.058 57.849 -0.791 18002
195 1 . 1 1 44 44 CYS CB C 406 29.440 29.440 28.617 0.823 18002
196 1 . 1 1 44 44 CYS H H 406 8.470 8.470 8.324 0.146 18002
197 1 . 1 1 45 45 TYR N N 407 122.704 122.704 126.555 -3.851 18002
198 1 . 1 1 45 45 TYR HA H 407 5.023 5.023 4.834 0.189 18002
199 1 . 1 1 45 45 TYR CA C 407 56.983 56.983 56.933 0.050 18002
200 1 . 1 1 45 45 TYR CB C 407 41.574 41.574 40.906 0.668 18002
201 1 . 1 1 45 45 TYR H H 407 10.013 10.013 8.237 1.776 18002
202 1 . 1 1 46 46 LYS N N 408 121.897 121.897 122.970 -1.073 18002
203 1 . 1 1 46 46 LYS HA H 408 4.346 4.346 4.496 -0.150 18002
204 1 . 1 1 46 46 LYS CA C 408 60.019 60.019 57.096 2.923 18002
205 1 . 1 1 46 46 LYS CB C 408 32.712 32.712 33.636 -0.924 18002
206 1 . 1 1 46 46 LYS H H 408 9.734 9.734 8.905 0.829 18002
207 1 . 1 1 47 47 SER N N 409 106.720 106.720 112.347 -5.627 18002
208 1 . 1 1 47 47 SER HA H 409 4.776 4.776 4.886 -0.110 18002
209 1 . 1 1 47 47 SER CA C 409 57.180 57.180 57.623 -0.443 18002
210 1 . 1 1 47 47 SER CB C 409 65.870 65.870 65.188 0.682 18002
211 1 . 1 1 47 47 SER H H 409 7.518 7.518 7.932 -0.414 18002
212 1 . 1 1 48 48 LYS N N 410 122.302 122.302 121.950 0.352 18002
213 1 . 1 1 48 48 LYS CA C 410 59.234 59.234 57.937 1.297 18002
214 1 . 1 1 48 48 LYS CB C 410 32.299 32.299 31.909 0.390 18002
215 1 . 1 1 48 48 LYS H H 410 8.195 8.195 8.821 -0.626 18002
216 1 . 1 1 49 49 GLU N N 411 118.983 118.983 119.768 -0.785 18002
217 1 . 1 1 49 49 GLU HA H 411 4.782 4.782 4.119 0.663 18002
218 1 . 1 1 49 49 GLU CA C 411 59.535 59.535 58.690 0.845 18002
219 1 . 1 1 49 49 GLU CB C 411 28.688 28.688 29.431 -0.743 18002
220 1 . 1 1 49 49 GLU H H 411 8.752 8.752 8.341 0.411 18002
221 1 . 1 1 50 50 GLU N N 412 118.384 118.384 118.045 0.339 18002
222 1 . 1 1 50 50 GLU HA H 412 4.493 4.493 4.240 0.253 18002
223 1 . 1 1 50 50 GLU CA C 412 55.789 55.789 57.311 -1.522 18002
224 1 . 1 1 50 50 GLU CB C 412 30.005 30.005 29.241 0.764 18002
225 1 . 1 1 50 50 GLU H H 412 7.234 7.234 8.032 -0.798 18002
226 1 . 1 1 51 51 SER N N 413 114.767 114.767 114.894 -0.127 18002
227 1 . 1 1 51 51 SER CA C 413 59.764 59.764 60.875 -1.111 18002
228 1 . 1 1 51 51 SER CB C 413 62.965 62.965 62.881 0.084 18002
229 1 . 1 1 51 51 SER H H 413 7.382 7.382 8.176 -0.794 18002
230 1 . 1 1 52 52 SER N N 414 114.496 114.496 114.965 -0.469 18002
231 1 . 1 1 52 52 SER HA H 414 4.560 4.560 4.597 -0.037 18002
232 1 . 1 1 52 52 SER CA C 414 58.574 58.574 58.300 0.274 18002
233 1 . 1 1 52 52 SER CB C 414 63.829 63.829 64.096 -0.267 18002
234 1 . 1 1 52 52 SER H H 414 7.682 7.682 8.013 -0.331 18002
235 1 . 1 1 53 53 GLY N N 415 111.107 111.107 110.125 0.982 18002
236 1 . 1 1 53 53 GLY CA C 415 44.233 44.233 44.900 -0.667 18002
237 1 . 1 1 53 53 GLY H H 415 7.918 7.918 7.876 0.042 18002
238 1 . 1 1 54 54 THR N N 416 120.214 120.214 116.529 3.684 18002
239 1 . 1 1 54 54 THR CB C 416 70.035 70.035 70.387 -0.351 18002
240 1 . 1 1 54 54 THR H H 416 8.622 8.622 8.100 0.522 18002
241 1 . 1 1 55 55 PRO HA H 417 4.475 4.475 4.123 0.352 18002
242 1 . 1 1 55 55 PRO CA C 417 63.045 63.045 62.844 0.201 18002
243 1 . 1 1 55 55 PRO CB C 417 31.578 31.578 32.092 -0.514 18002
244 1 . 1 1 56 56 ALA N N 418 125.591 125.591 124.728 0.863 18002
245 1 . 1 1 56 56 ALA HA H 418 3.956 3.956 4.048 -0.092 18002
246 1 . 1 1 56 56 ALA CA C 418 54.535 54.535 53.747 0.788 18002
247 1 . 1 1 56 56 ALA CB C 418 18.907 18.907 19.516 -0.609 18002
248 1 . 1 1 56 56 ALA H H 418 8.288 8.288 8.252 0.036 18002
249 1 . 1 1 57 57 HIS N N 419 108.119 108.119 115.330 -7.211 18002
250 1 . 1 1 57 57 HIS HA H 419 4.622 4.622 4.679 -0.057 18002
251 1 . 1 1 57 57 HIS CA C 419 54.580 54.580 55.896 -1.316 18002
252 1 . 1 1 57 57 HIS CB C 419 34.219 34.219 32.296 1.923 18002
253 1 . 1 1 57 57 HIS H H 419 7.072 7.072 7.782 -0.710 18002
254 1 . 1 1 58 58 GLN N N 420 123.083 123.083 122.798 0.285 18002
255 1 . 1 1 58 58 GLN HA H 420 5.155 5.155 4.719 0.436 18002
256 1 . 1 1 58 58 GLN CA C 420 55.504 55.504 54.799 0.705 18002
257 1 . 1 1 58 58 GLN CB C 420 32.490 32.490 30.216 2.274 18002
258 1 . 1 1 58 58 GLN H H 420 8.669 8.669 8.360 0.309 18002
259 1 . 1 1 59 59 MET N N 421 122.330 122.330 120.176 2.154 18002
260 1 . 1 1 59 59 MET HA H 421 4.621 4.621 4.709 -0.088 18002
261 1 . 1 1 59 59 MET CA C 421 54.892 54.892 54.172 0.720 18002
262 1 . 1 1 59 59 MET CB C 421 35.650 35.650 36.010 -0.360 18002
263 1 . 1 1 59 59 MET H H 421 8.995 8.995 8.070 0.925 18002
264 1 . 1 1 60 60 ASN N N 422 123.220 123.220 119.654 3.566 18002
265 1 . 1 1 60 60 ASN HA H 422 4.948 4.948 4.742 0.206 18002
266 1 . 1 1 60 60 ASN CA C 422 52.631 52.631 52.721 -0.090 18002
267 1 . 1 1 60 60 ASN CB C 422 38.739 38.739 38.058 0.681 18002
268 1 . 1 1 60 60 ASN H H 422 8.728 8.728 8.550 0.178 18002
269 1 . 1 1 61 61 LEU N N 423 126.072 126.072 122.699 3.373 18002
270 1 . 1 1 61 61 LEU HA H 423 4.116 4.116 4.253 -0.137 18002
271 1 . 1 1 61 61 LEU CA C 423 56.613 56.613 55.233 1.380 18002
272 1 . 1 1 61 61 LEU CB C 423 42.457 42.457 41.498 0.959 18002
273 1 . 1 1 61 61 LEU H H 423 8.942 8.942 8.228 0.714 18002
274 1 . 1 1 62 62 ARG N N 424 121.977 121.977 117.877 4.100 18002
275 1 . 1 1 62 62 ARG HA H 424 4.372 4.372 4.025 0.347 18002
276 1 . 1 1 62 62 ARG CA C 424 59.034 59.034 56.861 2.173 18002
277 1 . 1 1 62 62 ARG CB C 424 29.610 29.610 30.196 -0.586 18002
278 1 . 1 1 62 62 ARG H H 424 8.000 8.000 7.778 0.222 18002
279 1 . 1 1 63 63 GLY N N 425 114.852 114.852 110.168 4.684 18002
280 1 . 1 1 63 63 GLY CA C 425 45.810 45.810 45.307 0.503 18002
281 1 . 1 1 63 63 GLY H H 425 9.033 9.033 8.703 0.330 18002
282 1 . 1 1 64 64 CYS N N 426 117.102 117.102 117.530 -0.428 18002
283 1 . 1 1 64 64 CYS HA H 426 4.899 4.899 4.564 0.335 18002
284 1 . 1 1 64 64 CYS CA C 426 57.760 57.760 56.913 0.847 18002
285 1 . 1 1 64 64 CYS CB C 426 28.824 28.824 29.025 -0.201 18002
286 1 . 1 1 64 64 CYS H H 426 8.248 8.248 7.708 0.540 18002
287 1 . 1 1 65 65 GLU N N 427 119.501 119.501 122.006 -2.505 18002
288 1 . 1 1 65 65 GLU HA H 427 4.777 4.777 4.464 0.313 18002
289 1 . 1 1 65 65 GLU CA C 427 55.391 55.391 55.573 -0.182 18002
290 1 . 1 1 65 65 GLU CB C 427 31.938 31.938 31.645 0.292 18002
291 1 . 1 1 65 65 GLU H H 427 8.449 8.449 8.783 -0.334 18002
292 1 . 1 1 66 66 VAL N N 428 125.286 125.286 122.920 2.366 18002
293 1 . 1 1 66 66 VAL HA H 428 4.890 4.890 4.481 0.409 18002
294 1 . 1 1 66 66 VAL CA C 428 60.752 60.752 61.099 -0.347 18002
295 1 . 1 1 66 66 VAL CB C 428 33.975 33.975 34.275 -0.300 18002
296 1 . 1 1 66 66 VAL H H 428 8.624 8.624 8.439 0.185 18002
297 1 . 1 1 67 67 THR N N 429 124.132 124.132 123.732 0.400 18002
298 1 . 1 1 67 67 THR CA C 429 59.338 59.338 60.245 -0.907 18002
299 1 . 1 1 67 67 THR CB C 429 72.021 72.021 69.951 2.070 18002
300 1 . 1 1 67 67 THR H H 429 9.247 9.247 8.259 0.988 18002
301 1 . 1 1 68 68 PRO HA H 430 4.649 4.649 4.642 0.007 18002
302 1 . 1 1 68 68 PRO CA C 430 62.738 62.738 62.569 0.169 18002
303 1 . 1 1 68 68 PRO CB C 430 33.568 33.568 32.490 1.078 18002
304 1 . 1 1 69 69 ASP N N 431 122.066 122.066 122.846 -0.780 18002
305 1 . 1 1 69 69 ASP HA H 431 4.647 4.647 4.876 -0.229 18002
306 1 . 1 1 69 69 ASP CA C 431 54.669 54.669 54.508 0.161 18002
307 1 . 1 1 69 69 ASP CB C 431 42.105 42.105 42.936 -0.831 18002
308 1 . 1 1 69 69 ASP H H 431 8.250 8.250 8.606 -0.355 18002
309 1 . 1 1 70 70 VAL N N 432 121.874 121.874 122.661 -0.787 18002
310 1 . 1 1 70 70 VAL HA H 432 4.499 4.499 4.599 -0.100 18002
311 1 . 1 1 70 70 VAL CA C 432 60.088 60.088 60.051 0.037 18002
312 1 . 1 1 70 70 VAL CB C 432 35.032 35.032 34.335 0.697 18002
313 1 . 1 1 70 70 VAL H H 432 8.305 8.305 8.108 0.197 18002
314 1 . 1 1 71 71 ASN N N 433 124.366 124.366 127.247 -2.881 18002
315 1 . 1 1 71 71 ASN HA H 433 4.682 4.682 4.943 -0.261 18002
316 1 . 1 1 71 71 ASN CA C 433 52.761 52.761 52.158 0.603 18002
317 1 . 1 1 71 71 ASN CB C 433 40.279 40.279 39.440 0.839 18002
318 1 . 1 1 71 71 ASN H H 433 8.637 8.637 8.208 0.429 18002
319 1 . 1 1 72 72 ILE N N 434 126.786 126.786 123.187 3.599 18002
320 1 . 1 1 72 72 ILE HA H 434 3.371 3.371 3.757 -0.386 18002
321 1 . 1 1 72 72 ILE CA C 434 64.518 64.518 63.157 1.361 18002
322 1 . 1 1 72 72 ILE CB C 434 37.175 37.175 37.624 -0.449 18002
323 1 . 1 1 72 72 ILE H H 434 8.943 8.943 8.573 0.370 18002
324 1 . 1 1 73 73 SER N N 435 118.305 118.305 116.602 1.703 18002
325 1 . 1 1 73 73 SER CA C 435 61.633 61.633 60.724 0.909 18002
326 1 . 1 1 73 73 SER CB C 435 62.435 62.435 62.951 -0.516 18002
327 1 . 1 1 73 73 SER H H 435 8.578 8.578 8.323 0.255 18002
328 1 . 1 1 74 74 GLY N N 436 107.443 107.443 106.095 1.348 18002
329 1 . 1 1 74 74 GLY CA C 436 44.861 44.861 44.702 0.159 18002
330 1 . 1 1 74 74 GLY H H 436 7.620 7.620 7.737 -0.117 18002
331 1 . 1 1 75 75 GLN N N 437 116.895 116.895 116.919 -0.024 18002
332 1 . 1 1 75 75 GLN HA H 437 3.290 3.290 3.633 -0.343 18002
333 1 . 1 1 75 75 GLN CA C 437 56.701 56.701 56.500 0.201 18002
334 1 . 1 1 75 75 GLN CB C 437 26.745 26.745 26.105 0.640 18002
335 1 . 1 1 75 75 GLN H H 437 7.798 7.798 7.775 0.023 18002
336 1 . 1 1 76 76 LYS N N 438 119.308 119.308 119.124 0.184 18002
337 1 . 1 1 76 76 LYS HA H 438 4.142 4.142 4.299 -0.157 18002
338 1 . 1 1 76 76 LYS CA C 438 55.043 55.043 54.980 0.063 18002
339 1 . 1 1 76 76 LYS CB C 438 33.945 33.945 32.890 1.055 18002
340 1 . 1 1 76 76 LYS H H 438 7.522 7.522 7.551 -0.029 18002
341 1 . 1 1 77 77 PHE N N 439 125.905 125.905 122.393 3.512 18002
342 1 . 1 1 77 77 PHE HA H 439 4.211 4.211 4.261 -0.050 18002
343 1 . 1 1 77 77 PHE CA C 439 55.639 55.639 56.697 -1.058 18002
344 1 . 1 1 77 77 PHE CB C 439 38.929 38.929 38.451 0.479 18002
345 1 . 1 1 77 77 PHE H H 439 8.461 8.461 8.038 0.423 18002
346 1 . 1 1 78 78 ASN N N 440 120.787 120.787 122.173 -1.386 18002
347 1 . 1 1 78 78 ASN CA C 440 51.913 51.913 52.248 -0.335 18002
348 1 . 1 1 78 78 ASN CB C 440 40.803 40.803 41.100 -0.297 18002
349 1 . 1 1 78 78 ASN H H 440 7.638 7.638 8.292 -0.654 18002
350 1 . 1 1 79 79 ILE N N 441 123.421 123.421 124.984 -1.563 18002
351 1 . 1 1 79 79 ILE HA H 441 4.171 4.171 4.279 -0.108 18002
352 1 . 1 1 79 79 ILE CA C 441 61.567 61.567 60.026 1.541 18002
353 1 . 1 1 79 79 ILE CB C 441 41.487 41.487 38.953 2.534 18002
354 1 . 1 1 79 79 ILE H H 441 9.550 9.550 8.594 0.956 18002
355 1 . 1 1 80 80 LYS N N 442 126.267 126.267 129.169 -2.902 18002
356 1 . 1 1 80 80 LYS HA H 442 4.462 4.462 4.370 0.092 18002
357 1 . 1 1 80 80 LYS CA C 442 56.383 56.383 54.899 1.484 18002
358 1 . 1 1 80 80 LYS CB C 442 32.987 32.987 32.635 0.352 18002
359 1 . 1 1 80 80 LYS H H 442 8.703 8.703 8.229 0.474 18002
360 1 . 1 1 81 81 LEU N N 443 125.194 125.194 127.086 -1.892 18002
361 1 . 1 1 81 81 LEU HA H 443 5.272 5.272 4.742 0.530 18002
362 1 . 1 1 81 81 LEU CA C 443 53.349 53.349 53.373 -0.024 18002
363 1 . 1 1 81 81 LEU CB C 443 44.704 44.704 43.184 1.520 18002
364 1 . 1 1 81 81 LEU H H 443 9.223 9.223 8.166 1.057 18002
365 1 . 1 1 82 82 LEU N N 444 122.753 122.753 126.811 -4.058 18002
366 1 . 1 1 82 82 LEU HA H 444 5.014 5.014 5.156 -0.142 18002
367 1 . 1 1 82 82 LEU CA C 444 53.918 53.918 53.301 0.617 18002
368 1 . 1 1 82 82 LEU CB C 444 43.624 43.624 46.580 -2.956 18002
369 1 . 1 1 82 82 LEU H H 444 8.420 8.420 8.041 0.379 18002
370 1 . 1 1 83 83 ILE N N 445 125.584 125.584 122.027 3.557 18002
371 1 . 1 1 83 83 ILE CA C 445 58.285 58.285 58.214 0.071 18002
372 1 . 1 1 83 83 ILE CB C 445 41.036 41.036 41.862 -0.826 18002
373 1 . 1 1 83 83 ILE H H 445 9.010 9.010 8.017 0.993 18002
374 1 . 1 1 84 84 PRO HA H 446 4.919 4.919 4.814 0.105 18002
375 1 . 1 1 84 84 PRO CA C 446 64.033 64.033 62.385 1.648 18002
376 1 . 1 1 84 84 PRO CB C 446 31.947 31.947 31.600 0.347 18002
377 1 . 1 1 85 85 VAL N N 447 119.780 119.780 118.304 1.476 18002
378 1 . 1 1 85 85 VAL HA H 447 4.503 4.503 4.510 -0.007 18002
379 1 . 1 1 85 85 VAL CA C 447 60.342 60.342 59.685 0.657 18002
380 1 . 1 1 85 85 VAL CB C 447 35.266 35.266 34.453 0.813 18002
381 1 . 1 1 85 85 VAL H H 447 8.304 8.304 8.250 0.054 18002
382 1 . 1 1 86 86 ALA N N 448 125.178 125.178 122.268 2.910 18002
383 1 . 1 1 86 86 ALA HA H 448 3.975 3.975 4.146 -0.171 18002
384 1 . 1 1 86 86 ALA CA C 448 55.561 55.561 54.638 0.923 18002
385 1 . 1 1 86 86 ALA CB C 448 17.988 17.988 18.384 -0.396 18002
386 1 . 1 1 86 86 ALA H H 448 8.526 8.526 8.480 0.046 18002
387 1 . 1 1 87 87 GLU N N 449 114.625 114.625 117.954 -3.329 18002
388 1 . 1 1 87 87 GLU HA H 449 4.290 4.290 4.126 0.164 18002
389 1 . 1 1 87 87 GLU CA C 449 56.731 56.731 57.385 -0.654 18002
390 1 . 1 1 87 87 GLU CB C 449 29.260 29.260 29.817 -0.557 18002
391 1 . 1 1 87 87 GLU H H 449 8.402 8.402 8.629 -0.227 18002
392 1 . 1 1 88 88 GLY N N 450 109.432 109.432 106.251 3.181 18002
393 1 . 1 1 88 88 GLY CA C 450 45.837 45.837 44.827 1.011 18002
394 1 . 1 1 88 88 GLY H H 450 7.711 7.711 7.672 0.039 18002
395 1 . 1 1 89 89 MET N N 451 121.382 121.382 120.188 1.194 18002
396 1 . 1 1 89 89 MET HA H 451 5.076 5.076 5.004 0.072 18002
397 1 . 1 1 89 89 MET CA C 451 53.860 53.860 54.761 -0.901 18002
398 1 . 1 1 89 89 MET CB C 451 35.942 35.942 37.095 -1.153 18002
399 1 . 1 1 89 89 MET H H 451 8.355 8.355 7.956 0.399 18002
400 1 . 1 1 90 90 ASN N N 452 123.538 123.538 122.852 0.686 18002
401 1 . 1 1 90 90 ASN HA H 452 4.953 4.953 4.866 0.087 18002
402 1 . 1 1 90 90 ASN CA C 452 51.748 51.748 52.502 -0.754 18002
403 1 . 1 1 90 90 ASN CB C 452 40.642 40.642 38.992 1.650 18002
404 1 . 1 1 90 90 ASN H H 452 9.338 9.338 8.855 0.483 18002
405 1 . 1 1 91 91 GLU N N 453 125.978 125.978 124.202 1.776 18002
406 1 . 1 1 91 91 GLU HA H 453 5.344 5.344 4.200 1.144 18002
407 1 . 1 1 91 91 GLU CA C 453 55.273 55.273 56.421 -1.148 18002
408 1 . 1 1 91 91 GLU CB C 453 31.743 31.743 30.129 1.614 18002
409 1 . 1 1 91 91 GLU H H 453 8.168 8.168 8.247 -0.079 18002
410 1 . 1 1 92 92 ILE N N 454 126.776 126.776 124.838 1.938 18002
411 1 . 1 1 92 92 ILE HA H 454 4.566 4.566 4.051 0.515 18002
412 1 . 1 1 92 92 ILE CA C 454 60.048 60.048 59.715 0.333 18002
413 1 . 1 1 92 92 ILE CB C 454 42.262 42.262 41.198 1.064 18002
414 1 . 1 1 92 92 ILE H H 454 9.000 9.000 7.932 1.068 18002
415 1 . 1 1 93 93 TRP N N 455 125.987 125.987 124.344 1.643 18002
416 1 . 1 1 93 93 TRP HA H 455 4.592 4.592 5.003 -0.411 18002
417 1 . 1 1 93 93 TRP CA C 455 53.790 53.790 55.484 -1.694 18002
418 1 . 1 1 93 93 TRP CB C 455 31.386 31.386 31.049 0.337 18002
419 1 . 1 1 93 93 TRP H H 455 9.278 9.278 8.058 1.220 18002
420 1 . 1 1 94 94 LEU N N 456 120.912 120.912 121.810 -0.898 18002
421 1 . 1 1 94 94 LEU HA H 456 5.362 5.362 4.907 0.455 18002
422 1 . 1 1 94 94 LEU CA C 456 53.216 53.216 53.578 -0.362 18002
423 1 . 1 1 94 94 LEU CB C 456 43.594 43.594 43.317 0.277 18002
424 1 . 1 1 94 94 LEU H H 456 9.534 9.534 8.069 1.465 18002
425 1 . 1 1 95 95 ARG N N 457 123.669 123.669 121.674 1.995 18002
426 1 . 1 1 95 95 ARG HA H 457 5.271 5.271 4.709 0.562 18002
427 1 . 1 1 95 95 ARG CA C 457 55.417 55.417 55.690 -0.273 18002
428 1 . 1 1 95 95 ARG CB C 457 33.262 33.262 32.464 0.798 18002
429 1 . 1 1 95 95 ARG H H 457 9.439 9.439 8.461 0.978 18002
430 1 . 1 1 96 96 CYS N N 458 125.273 125.273 120.895 4.378 18002
431 1 . 1 1 96 96 CYS HA H 458 4.698 4.698 4.868 -0.170 18002
432 1 . 1 1 96 96 CYS CA C 458 58.792 58.792 58.406 0.386 18002
433 1 . 1 1 96 96 CYS CB C 458 30.403 30.403 30.092 0.311 18002
434 1 . 1 1 96 96 CYS H H 458 8.652 8.652 8.558 0.093 18002
435 1 . 1 1 97 97 ASP N N 459 119.661 119.661 121.143 -1.482 18002
436 1 . 1 1 97 97 ASP HA H 459 4.740 4.740 4.713 0.027 18002
437 1 . 1 1 97 97 ASP CA C 459 56.228 56.228 54.185 2.043 18002
438 1 . 1 1 97 97 ASP CB C 459 43.585 43.585 42.128 1.457 18002
439 1 . 1 1 97 97 ASP H H 459 9.116 9.116 8.729 0.387 18002
440 1 . 1 1 98 98 ASN N N 460 109.173 109.173 115.529 -6.356 18002
441 1 . 1 1 98 98 ASN HA H 460 4.372 4.372 4.715 -0.343 18002
442 1 . 1 1 98 98 ASN CA C 460 52.014 52.014 52.352 -0.338 18002
443 1 . 1 1 98 98 ASN CB C 460 40.811 40.811 40.140 0.671 18002
444 1 . 1 1 98 98 ASN H H 460 7.054 7.054 7.261 -0.207 18002
445 1 . 1 1 99 99 GLU N N 461 119.220 119.220 120.482 -1.262 18002
446 1 . 1 1 99 99 GLU CA C 461 60.044 60.044 59.615 0.429 18002
447 1 . 1 1 99 99 GLU CB C 461 29.768 29.768 29.415 0.353 18002
448 1 . 1 1 99 99 GLU H H 461 8.937 8.937 8.819 0.118 18002
449 1 . 1 1 100 100 LYS N N 462 120.647 120.647 119.298 1.349 18002
450 1 . 1 1 100 100 LYS HA H 462 4.645 4.645 4.013 0.632 18002
451 1 . 1 1 100 100 LYS CA C 462 60.536 60.536 59.385 1.151 18002
452 1 . 1 1 100 100 LYS CB C 462 32.228 32.228 31.850 0.378 18002
453 1 . 1 1 100 100 LYS H H 462 8.033 8.033 8.247 -0.214 18002
454 1 . 1 1 101 101 GLN N N 463 121.938 121.938 118.843 3.095 18002
455 1 . 1 1 101 101 GLN HA H 463 4.400 4.400 4.068 0.332 18002
456 1 . 1 1 101 101 GLN CA C 463 59.395 59.395 59.026 0.369 18002
457 1 . 1 1 101 101 GLN CB C 463 32.214 32.214 28.243 3.971 18002
458 1 . 1 1 101 101 GLN H H 463 8.372 8.372 8.021 0.351 18002
459 1 . 1 1 102 102 TYR N N 464 117.422 117.422 120.400 -2.978 18002
460 1 . 1 1 102 102 TYR HA H 464 4.616 4.616 4.127 0.489 18002
461 1 . 1 1 102 102 TYR CA C 464 61.677 61.677 61.086 0.591 18002
462 1 . 1 1 102 102 TYR CB C 464 38.859 38.859 38.068 0.791 18002
463 1 . 1 1 102 102 TYR H H 464 8.221 8.221 7.752 0.469 18002
464 1 . 1 1 103 103 ALA N N 465 120.655 120.655 119.120 1.535 18002
465 1 . 1 1 103 103 ALA HA H 465 3.715 3.715 3.950 -0.235 18002
466 1 . 1 1 103 103 ALA CA C 465 55.913 55.913 54.708 1.205 18002
467 1 . 1 1 103 103 ALA CB C 465 18.802 18.802 18.403 0.399 18002
468 1 . 1 1 103 103 ALA H H 465 8.637 8.637 7.887 0.750 18002
469 1 . 1 1 104 104 HIS N N 466 112.871 112.871 117.375 -4.504 18002
470 1 . 1 1 104 104 HIS HA H 466 4.141 4.141 4.503 -0.362 18002
471 1 . 1 1 104 104 HIS CA C 466 60.627 60.627 59.532 1.095 18002
472 1 . 1 1 104 104 HIS CB C 466 28.858 28.858 30.059 -1.201 18002
473 1 . 1 1 104 104 HIS H H 466 7.852 7.852 7.985 -0.133 18002
474 1 . 1 1 105 105 TRP N N 467 121.317 121.317 119.344 1.973 18002
475 1 . 1 1 105 105 TRP HA H 467 3.695 3.695 4.454 -0.759 18002
476 1 . 1 1 105 105 TRP CA C 467 62.342 62.342 61.086 1.256 18002
477 1 . 1 1 105 105 TRP CB C 467 27.505 27.505 29.239 -1.734 18002
478 1 . 1 1 105 105 TRP H H 467 8.668 8.668 7.944 0.724 18002
479 1 . 1 1 106 106 MET N N 468 122.346 122.346 118.784 3.562 18002
480 1 . 1 1 106 106 MET HA H 468 4.086 4.086 3.976 0.110 18002
481 1 . 1 1 106 106 MET CA C 468 58.743 58.743 58.559 0.184 18002
482 1 . 1 1 106 106 MET CB C 468 31.402 31.402 31.411 -0.009 18002
483 1 . 1 1 106 106 MET H H 468 9.790 9.790 8.194 1.596 18002
484 1 . 1 1 107 107 ALA N N 469 119.758 119.758 120.870 -1.111 18002
485 1 . 1 1 107 107 ALA HA H 469 3.705 3.705 4.092 -0.387 18002
486 1 . 1 1 107 107 ALA CA C 469 56.129 56.129 54.502 1.627 18002
487 1 . 1 1 107 107 ALA CB C 469 20.405 20.405 18.141 2.264 18002
488 1 . 1 1 107 107 ALA H H 469 7.702 7.702 7.748 -0.046 18002
489 1 . 1 1 108 108 ALA N N 470 119.233 119.233 121.935 -2.702 18002
490 1 . 1 1 108 108 ALA HA H 470 3.546 3.546 3.845 -0.299 18002
491 1 . 1 1 108 108 ALA CA C 470 55.821 55.821 55.035 0.786 18002
492 1 . 1 1 108 108 ALA CB C 470 16.732 16.732 18.039 -1.307 18002
493 1 . 1 1 108 108 ALA H H 470 7.156 7.156 7.780 -0.624 18002
494 1 . 1 1 109 109 CYS N N 471 116.736 116.736 116.088 0.648 18002
495 1 . 1 1 109 109 CYS HA H 471 4.057 4.057 4.162 -0.105 18002
496 1 . 1 1 109 109 CYS CA C 471 64.571 64.571 62.074 2.497 18002
497 1 . 1 1 109 109 CYS CB C 471 27.393 27.393 27.048 0.345 18002
498 1 . 1 1 109 109 CYS H H 471 8.256 8.256 8.481 -0.225 18002
499 1 . 1 1 110 110 ARG N N 472 118.644 118.644 120.091 -1.447 18002
500 1 . 1 1 110 110 ARG HA H 472 3.734 3.734 4.050 -0.316 18002
501 1 . 1 1 110 110 ARG CA C 472 60.204 60.204 58.869 1.335 18002
502 1 . 1 1 110 110 ARG CB C 472 30.317 30.317 30.110 0.207 18002
503 1 . 1 1 110 110 ARG H H 472 8.403 8.403 7.612 0.791 18002
504 1 . 1 1 111 111 LEU N N 473 121.877 121.877 119.970 1.907 18002
505 1 . 1 1 111 111 LEU HA H 473 3.800 3.800 4.059 -0.259 18002
506 1 . 1 1 111 111 LEU CA C 473 59.855 59.855 57.595 2.260 18002
507 1 . 1 1 111 111 LEU CB C 473 40.420 40.420 40.897 -0.477 18002
508 1 . 1 1 111 111 LEU H H 473 7.916 7.916 7.978 -0.062 18002
509 1 . 1 1 112 112 ALA N N 474 122.765 122.765 121.099 1.666 18002
510 1 . 1 1 112 112 ALA HA H 474 4.480 4.480 3.993 0.487 18002
511 1 . 1 1 112 112 ALA CA C 474 55.261 55.261 54.671 0.590 18002
512 1 . 1 1 112 112 ALA CB C 474 19.875 19.875 17.974 1.901 18002
513 1 . 1 1 112 112 ALA H H 474 8.393 8.393 8.475 -0.082 18002
514 1 . 1 1 113 113 SER N N 475 113.613 113.613 113.074 0.539 18002
515 1 . 1 1 113 113 SER HA H 475 4.782 4.782 4.237 0.545 18002
516 1 . 1 1 113 113 SER CA C 475 61.090 61.090 60.882 0.208 18002
517 1 . 1 1 113 113 SER CB C 475 63.612 63.612 63.202 0.410 18002
518 1 . 1 1 113 113 SER H H 475 8.150 8.150 7.955 0.195 18002
519 1 . 1 1 114 114 LYS N N 476 118.734 118.734 118.088 0.646 18002
520 1 . 1 1 114 114 LYS HA H 476 4.553 4.553 4.233 0.320 18002
521 1 . 1 1 114 114 LYS CA C 476 55.144 55.144 56.685 -1.541 18002
522 1 . 1 1 114 114 LYS CB C 476 32.591 32.591 32.335 0.256 18002
523 1 . 1 1 114 114 LYS H H 476 7.239 7.239 7.822 -0.583 18002
524 1 . 1 1 115 115 GLY N N 477 107.818 107.818 107.727 0.091 18002
525 1 . 1 1 115 115 GLY CA C 477 45.986 45.986 45.477 0.509 18002
526 1 . 1 1 115 115 GLY H H 477 8.401 8.401 8.000 0.401 18002
527 1 . 1 1 116 116 LYS N N 478 120.938 120.938 120.968 -0.030 18002
528 1 . 1 1 116 116 LYS HA H 478 4.573 4.573 4.542 0.031 18002
529 1 . 1 1 116 116 LYS CA C 478 54.847 54.847 54.709 0.138 18002
530 1 . 1 1 116 116 LYS CB C 478 35.321 35.321 34.684 0.637 18002
531 1 . 1 1 116 116 LYS H H 478 8.142 8.142 7.672 0.470 18002
532 1 . 1 1 117 117 THR N N 479 108.076 108.076 114.827 -6.751 18002
533 1 . 1 1 117 117 THR HA H 479 4.671 4.671 4.288 0.383 18002
534 1 . 1 1 117 117 THR CA C 479 59.191 59.191 60.829 -1.638 18002
535 1 . 1 1 117 117 THR CB C 479 72.228 72.228 69.986 2.242 18002
536 1 . 1 1 117 117 THR H H 479 7.926 7.926 8.071 -0.145 18002
537 1 . 1 1 118 118 MET N N 480 116.403 116.403 118.996 -2.593 18002
538 1 . 1 1 118 118 MET HA H 480 3.352 3.352 3.967 -0.614 18002
539 1 . 1 1 118 118 MET CA C 480 57.947 57.947 56.034 1.913 18002
540 1 . 1 1 118 118 MET CB C 480 33.920 33.920 31.187 2.733 18002
541 1 . 1 1 118 118 MET H H 480 8.899 8.899 8.465 0.434 18002
542 1 . 1 1 119 119 ALA N N 481 117.786 117.786 120.743 -2.957 18002
543 1 . 1 1 119 119 ALA HA H 481 4.084 4.084 4.081 0.003 18002
544 1 . 1 1 119 119 ALA CA C 481 52.595 52.595 53.115 -0.520 18002
545 1 . 1 1 119 119 ALA CB C 481 19.062 19.062 19.059 0.003 18002
546 1 . 1 1 119 119 ALA H H 481 7.645 7.645 7.988 -0.343 18002
547 1 . 1 1 120 120 ASP N N 482 120.348 120.348 117.217 3.131 18002
548 1 . 1 1 120 120 ASP CB C 482 44.616 44.616 40.545 4.071 18002
549 1 . 1 1 120 120 ASP H H 482 7.887 7.887 7.953 -0.066 18002
550 1 . 1 1 121 121 SER HA H 483 4.223 4.223 4.207 0.016 18002
551 1 . 1 1 121 121 SER CA C 483 61.455 61.455 61.261 0.194 18002
552 1 . 1 1 121 121 SER CB C 483 62.996 62.996 63.160 -0.164 18002
553 1 . 1 1 122 122 SER N N 484 116.845 116.845 116.234 0.611 18002
554 1 . 1 1 122 122 SER HA H 484 4.321 4.321 4.357 -0.036 18002
555 1 . 1 1 122 122 SER CA C 484 60.584 60.584 60.156 0.428 18002
556 1 . 1 1 122 122 SER CB C 484 64.314 64.314 63.024 1.290 18002
557 1 . 1 1 122 122 SER H H 484 8.875 8.875 8.150 0.725 18002
558 1 . 1 1 123 123 TYR N N 485 124.153 124.153 122.165 1.988 18002
559 1 . 1 1 123 123 TYR HA H 485 3.880 3.880 4.210 -0.330 18002
560 1 . 1 1 123 123 TYR CA C 485 63.314 63.314 60.599 2.715 18002
561 1 . 1 1 123 123 TYR CB C 485 37.741 37.741 37.713 0.028 18002
562 1 . 1 1 123 123 TYR H H 485 8.018 8.018 8.064 -0.046 18002
563 1 . 1 1 124 124 ASN N N 486 115.339 115.339 117.544 -2.205 18002
564 1 . 1 1 124 124 ASN HA H 486 3.941 3.941 4.068 -0.127 18002
565 1 . 1 1 124 124 ASN CA C 486 56.706 56.706 56.000 0.706 18002
566 1 . 1 1 124 124 ASN CB C 486 38.056 38.056 37.966 0.090 18002
567 1 . 1 1 124 124 ASN H H 486 8.665 8.665 7.914 0.751 18002
568 1 . 1 1 125 125 LEU N N 487 119.454 119.454 119.573 -0.119 18002
569 1 . 1 1 125 125 LEU HA H 487 3.938 3.938 4.077 -0.139 18002
570 1 . 1 1 125 125 LEU CA C 487 57.670 57.670 57.435 0.234 18002
571 1 . 1 1 125 125 LEU CB C 487 41.568 41.568 41.865 -0.297 18002
572 1 . 1 1 125 125 LEU H H 487 7.105 7.105 7.857 -0.752 18002
573 1 . 1 1 126 126 GLU N N 488 121.189 121.189 118.615 2.574 18002
574 1 . 1 1 126 126 GLU HA H 488 4.030 4.030 4.003 0.027 18002
575 1 . 1 1 126 126 GLU CA C 488 59.035 59.035 59.214 -0.179 18002
576 1 . 1 1 126 126 GLU CB C 488 29.085 29.085 29.562 -0.478 18002
577 1 . 1 1 126 126 GLU H H 488 8.053 8.053 7.844 0.209 18002
578 1 . 1 1 127 127 VAL N N 489 119.073 119.073 117.034 2.039 18002
579 1 . 1 1 127 127 VAL HA H 489 3.018 3.018 3.702 -0.684 18002
580 1 . 1 1 127 127 VAL CA C 489 67.322 67.322 65.729 1.593 18002
581 1 . 1 1 127 127 VAL CB C 489 31.659 31.659 31.575 0.084 18002
582 1 . 1 1 127 127 VAL H H 489 7.769 7.769 7.536 0.233 18002
583 1 . 1 1 128 128 GLN N N 490 116.214 116.214 117.756 -1.542 18002
584 1 . 1 1 128 128 GLN HA H 490 3.832 3.832 4.025 -0.193 18002
585 1 . 1 1 128 128 GLN CA C 490 58.756 58.756 58.403 0.353 18002
586 1 . 1 1 128 128 GLN CB C 490 28.112 28.112 27.893 0.218 18002
587 1 . 1 1 128 128 GLN H H 490 7.542 7.542 7.949 -0.407 18002
588 1 . 1 1 129 129 ASN N N 491 120.003 120.003 118.022 1.981 18002
589 1 . 1 1 129 129 ASN HA H 491 4.419 4.419 4.644 -0.225 18002
590 1 . 1 1 129 129 ASN CA C 491 56.160 56.160 55.728 0.432 18002
591 1 . 1 1 129 129 ASN CB C 491 38.060 38.060 38.563 -0.502 18002
592 1 . 1 1 129 129 ASN H H 491 8.582 8.582 7.640 0.942 18002
593 1 . 1 1 130 130 ILE N N 492 122.365 122.365 120.102 2.263 18002
594 1 . 1 1 130 130 ILE CA C 492 65.753 65.753 63.389 2.364 18002
595 1 . 1 1 130 130 ILE CB C 492 38.146 38.146 37.065 1.081 18002
596 1 . 1 1 130 130 ILE H H 492 8.186 8.186 7.484 0.702 18002
597 1 . 1 1 131 131 LEU N N 493 119.597 119.597 120.436 -0.839 18002
598 1 . 1 1 131 131 LEU HA H 493 4.005 4.005 3.991 0.014 18002
599 1 . 1 1 131 131 LEU CA C 493 58.859 58.859 58.342 0.517 18002
600 1 . 1 1 131 131 LEU CB C 493 41.536 41.536 41.158 0.378 18002
601 1 . 1 1 131 131 LEU H H 493 8.224 8.224 7.879 0.345 18002
602 1 . 1 1 132 132 SER N N 494 114.884 114.884 114.374 0.510 18002
603 1 . 1 1 132 132 SER HA H 494 4.430 4.430 4.218 0.212 18002
604 1 . 1 1 132 132 SER CA C 494 62.072 62.072 61.362 0.710 18002
605 1 . 1 1 132 132 SER CB C 494 62.703 62.703 62.847 -0.144 18002
606 1 . 1 1 132 132 SER H H 494 8.464 8.464 7.794 0.670 18002
607 1 . 1 1 133 133 PHE N N 495 123.047 123.047 121.065 1.982 18002
608 1 . 1 1 133 133 PHE HA H 495 4.377 4.377 4.294 0.083 18002
609 1 . 1 1 133 133 PHE CA C 495 60.913 60.913 61.225 -0.312 18002
610 1 . 1 1 133 133 PHE CB C 495 39.050 39.050 39.114 -0.064 18002
611 1 . 1 1 133 133 PHE H H 495 7.915 7.915 8.152 -0.237 18002
612 1 . 1 1 134 134 LEU N N 496 119.311 119.311 118.391 0.920 18002
613 1 . 1 1 134 134 LEU HA H 496 3.905 3.905 4.160 -0.255 18002
614 1 . 1 1 134 134 LEU CA C 496 57.601 57.601 57.952 -0.351 18002
615 1 . 1 1 134 134 LEU CB C 496 41.901 41.901 41.257 0.644 18002
616 1 . 1 1 134 134 LEU H H 496 8.386 8.386 8.060 0.326 18002
617 1 . 1 1 135 135 LYS N N 497 117.550 117.550 118.920 -1.370 18002
618 1 . 1 1 135 135 LYS HA H 497 3.940 3.940 4.079 -0.140 18002
619 1 . 1 1 135 135 LYS CA C 497 58.275 58.275 58.650 -0.375 18002
620 1 . 1 1 135 135 LYS CB C 497 32.494 32.494 32.483 0.011 18002
621 1 . 1 1 135 135 LYS H H 497 7.670 7.670 7.815 -0.145 18002
622 1 . 1 1 136 136 MET N N 498 116.106 116.106 115.311 0.795 18002
623 1 . 1 1 136 136 MET HA H 498 4.354 4.354 4.534 -0.180 18002
624 1 . 1 1 136 136 MET CA C 498 55.994 55.994 55.855 0.139 18002
625 1 . 1 1 136 136 MET CB C 498 32.772 32.772 32.902 -0.130 18002
626 1 . 1 1 136 136 MET H H 498 7.421 7.421 7.696 -0.275 18002
627 1 . 1 1 137 137 GLN N N 499 118.651 118.651 118.294 0.357 18002
628 1 . 1 1 137 137 GLN HA H 499 4.184 4.184 4.130 0.054 18002
629 1 . 1 1 137 137 GLN CA C 499 55.308 55.308 57.285 -1.977 18002
630 1 . 1 1 137 137 GLN H H 499 7.617 7.617 7.952 -0.335 18002
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