data_10262_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10262
_Entry.PDB_ID 2DKM
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 6 6 SER HA H 6 4.528 5.113 -0.585 1
1 3 . 1 1 1 A 6 6 SER CA C 6 58.373 57.876 0.497 1
1 4 . 1 1 1 A 6 6 SER CB C 6 63.978 63.286 0.692 1
1 5 . 1 1 1 A 7 7 GLY H H 7 8.228 8.336 -0.108 1
1 6 . 1 1 1 A 7 7 GLY HA2 H 7 4.134 4.026 0.108 1
1 7 . 1 1 1 A 7 7 GLY HA3 H 7 4.134 4.027 0.107 1
1 8 . 1 1 1 A 7 7 GLY CA C 7 44.607 46.099 -1.492 1
1 9 . 1 1 1 A 7 7 GLY N N 7 110.638 112.292 -1.654 1
1 10 . 1 1 1 A 8 8 PRO HA H 8 4.419 4.563 -0.144 1
1 17 . 1 1 1 A 8 8 PRO C C 8 176.908 175.377 1.531 1
1 18 . 1 1 1 A 8 8 PRO CA C 8 62.851 62.810 0.041 1
1 19 . 1 1 1 A 8 8 PRO CB C 8 32.243 33.098 -0.855 1
1 22 . 1 1 1 A 9 9 LEU H H 9 8.462 8.387 0.075 1
1 23 . 1 1 1 A 9 9 LEU HA H 9 4.494 4.929 -0.435 1
1 33 . 1 1 1 A 9 9 LEU C C 9 174.124 174.771 -0.647 1
1 34 . 1 1 1 A 9 9 LEU CA C 9 52.587 51.558 1.029 1
1 35 . 1 1 1 A 9 9 LEU CB C 9 43.150 43.472 -0.322 1
1 39 . 1 1 1 A 9 9 LEU N N 9 126.015 122.369 3.646 1
1 40 . 1 1 1 A 10 10 PRO HA H 10 4.820 4.572 0.248 1
1 47 . 1 1 1 A 10 10 PRO CA C 10 61.368 62.087 -0.719 1
1 48 . 1 1 1 A 10 10 PRO CB C 10 31.391 31.960 -0.569 1
1 51 . 1 1 1 A 11 11 PRO HA H 11 4.949 4.727 0.222 1
1 58 . 1 1 1 A 11 11 PRO CA C 11 61.183 61.844 -0.661 1
1 59 . 1 1 1 A 11 11 PRO CB C 11 30.656 31.951 -1.295 1
1 62 . 1 1 1 A 12 12 PRO HA H 12 4.341 4.656 -0.315 1
1 69 . 1 1 1 A 12 12 PRO C C 12 174.849 176.777 -1.928 1
1 70 . 1 1 1 A 12 12 PRO CA C 12 63.062 62.670 0.392 1
1 71 . 1 1 1 A 12 12 PRO CB C 12 31.831 31.791 0.040 1
1 74 . 1 1 1 A 13 13 ARG H H 13 7.828 8.825 -0.997 1
1 75 . 1 1 1 A 13 13 ARG HA H 13 4.536 4.506 0.030 1
1 82 . 1 1 1 A 13 13 ARG C C 13 174.608 176.889 -2.281 1
1 83 . 1 1 1 A 13 13 ARG CA C 13 54.774 56.704 -1.930 1
1 84 . 1 1 1 A 13 13 ARG CB C 13 33.250 32.645 0.605 1
1 87 . 1 1 1 A 13 13 ARG N N 13 120.532 123.295 -2.763 1
1 88 . 1 1 1 A 14 14 ALA H H 14 8.694 7.846 0.848 1
1 89 . 1 1 1 A 14 14 ALA HA H 14 3.986 4.367 -0.381 1
1 93 . 1 1 1 A 14 14 ALA C C 14 177.232 176.624 0.608 1
1 94 . 1 1 1 A 14 14 ALA CA C 14 52.461 51.900 0.561 1
1 95 . 1 1 1 A 14 14 ALA CB C 14 16.806 17.308 -0.502 1
1 96 . 1 1 1 A 14 14 ALA N N 14 121.921 120.476 1.445 1
1 97 . 1 1 1 A 15 15 LEU H H 15 8.097 8.400 -0.303 1
1 98 . 1 1 1 A 15 15 LEU HA H 15 4.670 4.799 -0.129 1
1 108 . 1 1 1 A 15 15 LEU C C 15 177.364 176.289 1.075 1
1 109 . 1 1 1 A 15 15 LEU CA C 15 57.543 54.503 3.040 1
1 110 . 1 1 1 A 15 15 LEU CB C 15 41.877 41.442 0.435 1
1 114 . 1 1 1 A 15 15 LEU N N 15 122.215 121.150 1.065 1
1 115 . 1 1 1 A 16 16 THR H H 16 9.520 8.897 0.623 1
1 116 . 1 1 1 A 16 16 THR HA H 16 4.369 4.805 -0.436 1
1 121 . 1 1 1 A 16 16 THR C C 16 172.453 172.806 -0.353 1
1 122 . 1 1 1 A 16 16 THR CA C 16 62.480 61.380 1.100 1
1 123 . 1 1 1 A 16 16 THR CB C 16 72.198 72.724 -0.526 1
1 125 . 1 1 1 A 16 16 THR N N 16 122.214 120.027 2.187 1
1 126 . 1 1 1 A 17 17 LEU H H 17 8.847 8.762 0.085 1
1 127 . 1 1 1 A 17 17 LEU HA H 17 4.573 4.521 0.052 1
1 137 . 1 1 1 A 17 17 LEU C C 17 174.695 176.173 -1.478 1
1 138 . 1 1 1 A 17 17 LEU CA C 17 53.840 54.598 -0.758 1
1 139 . 1 1 1 A 17 17 LEU CB C 17 40.290 42.050 -1.760 1
1 143 . 1 1 1 A 17 17 LEU N N 17 127.415 127.740 -0.325 1
1 144 . 1 1 1 A 18 18 ALA H H 18 8.647 8.615 0.032 1
1 145 . 1 1 1 A 18 18 ALA HA H 18 4.106 4.107 -0.001 1
1 149 . 1 1 1 A 18 18 ALA C C 18 178.236 177.487 0.749 1
1 150 . 1 1 1 A 18 18 ALA CA C 18 53.926 54.064 -0.138 1
1 151 . 1 1 1 A 18 18 ALA CB C 18 18.876 19.214 -0.338 1
1 152 . 1 1 1 A 18 18 ALA N N 18 133.362 130.338 3.024 1
1 153 . 1 1 1 A 19 19 ALA H H 19 7.772 7.529 0.243 1
1 154 . 1 1 1 A 19 19 ALA HA H 19 4.561 4.682 -0.121 1
1 158 . 1 1 1 A 19 19 ALA C C 19 176.032 174.458 1.574 1
1 159 . 1 1 1 A 19 19 ALA CA C 19 53.011 51.793 1.218 1
1 160 . 1 1 1 A 19 19 ALA CB C 19 21.869 22.916 -1.047 1
1 161 . 1 1 1 A 19 19 ALA N N 19 115.654 116.714 -1.060 1
1 162 . 1 1 1 A 20 20 VAL H H 20 8.697 8.866 -0.169 1
1 163 . 1 1 1 A 20 20 VAL HA H 20 4.951 4.843 0.108 1
1 171 . 1 1 1 A 20 20 VAL C C 20 174.314 174.151 0.163 1
1 172 . 1 1 1 A 20 20 VAL CA C 20 61.352 60.082 1.270 1
1 173 . 1 1 1 A 20 20 VAL CB C 20 35.394 33.581 1.813 1
1 176 . 1 1 1 A 20 20 VAL N N 20 120.848 118.773 2.075 1
1 177 . 1 1 1 A 21 21 THR H H 21 9.198 8.425 0.773 1
1 178 . 1 1 1 A 21 21 THR HA H 21 4.941 4.745 0.196 1
1 183 . 1 1 1 A 21 21 THR C C 21 174.416 174.646 -0.230 1
1 184 . 1 1 1 A 21 21 THR CA C 21 60.347 58.911 1.436 1
1 185 . 1 1 1 A 21 21 THR CB C 21 68.713 71.698 -2.985 1
1 187 . 1 1 1 A 21 21 THR N N 21 120.326 124.517 -4.191 1
1 188 . 1 1 1 A 22 22 PRO HA H 22 4.634 4.557 0.077 1
1 194 . 1 1 1 A 22 22 PRO C C 22 173.606 176.853 -3.247 1
1 195 . 1 1 1 A 22 22 PRO CA C 22 66.519 64.360 2.159 1
1 196 . 1 1 1 A 22 22 PRO CB C 22 32.078 31.674 0.404 1
1 199 . 1 1 1 A 23 23 ARG H H 23 6.621 8.244 -1.623 1
1 200 . 1 1 1 A 23 23 ARG HA H 23 4.591 4.513 0.078 1
1 207 . 1 1 1 A 23 23 ARG C C 23 176.554 175.694 0.860 1
1 208 . 1 1 1 A 23 23 ARG CA C 23 53.892 56.310 -2.418 1
1 209 . 1 1 1 A 23 23 ARG CB C 23 33.498 32.861 0.637 1
1 212 . 1 1 1 A 23 23 ARG N N 23 102.938 116.920 -13.982 1
1 213 . 1 1 1 A 24 24 THR H H 24 7.352 7.906 -0.554 1
1 214 . 1 1 1 A 24 24 THR HA H 24 5.593 5.191 0.402 1
1 219 . 1 1 1 A 24 24 THR C C 24 172.345 172.156 0.189 1
1 220 . 1 1 1 A 24 24 THR CA C 24 59.311 60.798 -1.487 1
1 221 . 1 1 1 A 24 24 THR CB C 24 73.311 71.761 1.550 1
1 223 . 1 1 1 A 24 24 THR N N 24 108.792 110.864 -2.072 1
1 224 . 1 1 1 A 25 25 VAL H H 25 8.437 8.247 0.190 1
1 225 . 1 1 1 A 25 25 VAL HA H 25 4.512 4.962 -0.450 1
1 233 . 1 1 1 A 25 25 VAL C C 25 172.854 173.930 -1.076 1
1 234 . 1 1 1 A 25 25 VAL CA C 25 61.617 61.016 0.601 1
1 235 . 1 1 1 A 25 25 VAL CB C 25 36.742 34.511 2.231 1
1 238 . 1 1 1 A 25 25 VAL N N 25 117.023 121.257 -4.234 1
1 239 . 1 1 1 A 26 26 HIS H H 26 8.915 8.674 0.241 1
1 240 . 1 1 1 A 26 26 HIS HA H 26 5.765 5.412 0.353 1
1 245 . 1 1 1 A 26 26 HIS C C 26 173.976 173.466 0.510 1
1 246 . 1 1 1 A 26 26 HIS CA C 26 52.896 53.798 -0.902 1
1 247 . 1 1 1 A 26 26 HIS CB C 26 34.004 33.034 0.970 1
1 250 . 1 1 1 A 26 26 HIS N N 26 128.155 127.690 0.465 1
1 251 . 1 1 1 A 27 27 LEU H H 27 9.034 9.070 -0.036 1
1 252 . 1 1 1 A 27 27 LEU HA H 27 5.505 5.021 0.484 1
1 262 . 1 1 1 A 27 27 LEU C C 27 174.821 174.469 0.352 1
1 263 . 1 1 1 A 27 27 LEU CA C 27 53.376 53.558 -0.182 1
1 264 . 1 1 1 A 27 27 LEU CB C 27 46.306 46.936 -0.630 1
1 268 . 1 1 1 A 27 27 LEU N N 27 128.569 128.382 0.187 1
1 269 . 1 1 1 A 28 28 THR H H 28 8.844 8.496 0.348 1
1 270 . 1 1 1 A 28 28 THR HA H 28 4.485 4.685 -0.200 1
1 275 . 1 1 1 A 28 28 THR C C 28 172.773 173.540 -0.767 1
1 276 . 1 1 1 A 28 28 THR CA C 28 60.052 60.330 -0.278 1
1 277 . 1 1 1 A 28 28 THR CB C 28 71.704 71.438 0.266 1
1 279 . 1 1 1 A 28 28 THR N N 28 112.165 112.670 -0.505 1
1 280 . 1 1 1 A 29 29 TRP H H 29 7.395 7.773 -0.378 1
1 281 . 1 1 1 A 29 29 TRP HA H 29 4.915 5.779 -0.864 1
1 290 . 1 1 1 A 29 29 TRP C C 29 174.013 174.300 -0.287 1
1 291 . 1 1 1 A 29 29 TRP CA C 29 56.626 54.477 2.149 1
1 292 . 1 1 1 A 29 29 TRP CB C 29 29.487 31.796 -2.309 1
1 298 . 1 1 1 A 29 29 TRP N N 29 115.623 119.915 -4.292 1
1 300 . 1 1 1 A 30 30 GLN H H 30 8.759 8.556 0.203 1
1 301 . 1 1 1 A 30 30 GLN HA H 30 4.641 4.737 -0.096 1
1 308 . 1 1 1 A 30 30 GLN C C 30 175.072 174.111 0.961 1
1 309 . 1 1 1 A 30 30 GLN CA C 30 52.975 53.721 -0.746 1
1 310 . 1 1 1 A 30 30 GLN CB C 30 28.398 28.398 0.000 1
1 312 . 1 1 1 A 30 30 GLN N N 30 117.497 120.203 -2.706 1
1 314 . 1 1 1 A 31 31 PRO HA H 31 4.487 4.608 -0.121 1
1 320 . 1 1 1 A 31 31 PRO C C 31 177.034 176.039 0.995 1
1 321 . 1 1 1 A 31 31 PRO CA C 31 62.710 62.796 -0.086 1
1 322 . 1 1 1 A 31 31 PRO CB C 31 32.738 32.163 0.575 1
1 325 . 1 1 1 A 32 32 SER H H 32 8.259 8.787 -0.528 1
1 326 . 1 1 1 A 32 32 SER HA H 32 4.670 4.967 -0.297 1
1 329 . 1 1 1 A 32 32 SER C C 32 174.689 173.569 1.120 1
1 330 . 1 1 1 A 32 32 SER CA C 32 57.296 56.969 0.327 1
1 331 . 1 1 1 A 32 32 SER CB C 32 64.748 64.983 -0.235 1
1 332 . 1 1 1 A 32 32 SER N N 32 117.667 116.879 0.788 1
1 333 . 1 1 1 A 33 33 ALA H H 33 9.038 8.573 0.465 1
1 334 . 1 1 1 A 33 33 ALA HA H 33 4.126 4.727 -0.601 1
1 338 . 1 1 1 A 33 33 ALA C C 33 177.795 178.120 -0.325 1
1 339 . 1 1 1 A 33 33 ALA CA C 33 54.213 51.181 3.032 1
1 340 . 1 1 1 A 33 33 ALA CB C 33 17.948 19.880 -1.932 1
1 341 . 1 1 1 A 33 33 ALA N N 33 131.772 126.544 5.228 1
1 342 . 1 1 1 A 34 34 GLY H H 34 8.576 8.794 -0.218 1
1 343 . 1 1 1 A 34 34 GLY HA2 H 34 4.171 3.987 0.184 1
1 344 . 1 1 1 A 34 34 GLY HA3 H 34 3.592 3.989 -0.397 1
1 345 . 1 1 1 A 34 34 GLY C C 34 174.182 174.446 -0.264 1
1 346 . 1 1 1 A 34 34 GLY CA C 34 44.987 45.011 -0.024 1
1 347 . 1 1 1 A 34 34 GLY N N 34 111.339 111.674 -0.335 1
1 348 . 1 1 1 A 35 35 ALA H H 35 7.637 7.752 -0.115 1
1 349 . 1 1 1 A 35 35 ALA HA H 35 4.210 4.190 0.020 1
1 353 . 1 1 1 A 35 35 ALA C C 35 178.918 176.991 1.927 1
1 354 . 1 1 1 A 35 35 ALA CA C 35 52.671 52.306 0.365 1
1 355 . 1 1 1 A 35 35 ALA CB C 35 18.988 19.579 -0.591 1
1 356 . 1 1 1 A 35 35 ALA N N 35 121.531 123.233 -1.702 1
1 357 . 1 1 1 A 36 36 THR H H 36 9.428 8.371 1.057 1
1 358 . 1 1 1 A 36 36 THR HA H 36 4.402 4.355 0.047 1
1 363 . 1 1 1 A 36 36 THR C C 36 174.739 174.248 0.491 1
1 364 . 1 1 1 A 36 36 THR CA C 36 62.692 63.338 -0.646 1
1 365 . 1 1 1 A 36 36 THR CB C 36 69.482 70.380 -0.898 1
1 367 . 1 1 1 A 36 36 THR N N 36 113.103 115.236 -2.133 1
1 368 . 1 1 1 A 37 37 HIS H H 37 7.857 7.260 0.597 1
1 369 . 1 1 1 A 37 37 HIS HA H 37 4.878 4.887 -0.009 1
1 374 . 1 1 1 A 37 37 HIS C C 37 171.103 171.901 -0.798 1
1 375 . 1 1 1 A 37 37 HIS CA C 37 55.867 54.146 1.721 1
1 376 . 1 1 1 A 37 37 HIS CB C 37 32.655 32.486 0.169 1
1 379 . 1 1 1 A 37 37 HIS N N 37 118.486 115.032 3.454 1
1 380 . 1 1 1 A 38 38 TYR H H 38 9.217 8.618 0.599 1
1 381 . 1 1 1 A 38 38 TYR HA H 38 5.303 5.434 -0.131 1
1 388 . 1 1 1 A 38 38 TYR C C 38 173.922 174.533 -0.611 1
1 389 . 1 1 1 A 38 38 TYR CA C 38 56.504 56.333 0.171 1
1 390 . 1 1 1 A 38 38 TYR CB C 38 41.823 42.106 -0.283 1
1 395 . 1 1 1 A 38 38 TYR N N 38 114.077 117.714 -3.637 1
1 396 . 1 1 1 A 39 39 LEU H H 39 9.052 8.687 0.365 1
1 397 . 1 1 1 A 39 39 LEU HA H 39 5.061 4.887 0.174 1
1 407 . 1 1 1 A 39 39 LEU C C 39 175.455 174.530 0.925 1
1 408 . 1 1 1 A 39 39 LEU CA C 39 53.855 54.059 -0.204 1
1 409 . 1 1 1 A 39 39 LEU CB C 39 45.254 43.464 1.790 1
1 413 . 1 1 1 A 39 39 LEU N N 39 123.997 125.877 -1.880 1
1 414 . 1 1 1 A 40 40 VAL H H 40 9.520 9.631 -0.111 1
1 415 . 1 1 1 A 40 40 VAL HA H 40 4.988 4.490 0.498 1
1 423 . 1 1 1 A 40 40 VAL C C 40 174.578 174.124 0.454 1
1 424 . 1 1 1 A 40 40 VAL CA C 40 60.575 61.678 -1.103 1
1 425 . 1 1 1 A 40 40 VAL CB C 40 33.284 32.910 0.374 1
1 428 . 1 1 1 A 40 40 VAL N N 40 129.678 129.430 0.248 1
1 429 . 1 1 1 A 41 41 ARG H H 41 9.096 8.807 0.289 1
1 430 . 1 1 1 A 41 41 ARG HA H 41 5.384 5.294 0.090 1
1 437 . 1 1 1 A 41 41 ARG C C 41 175.100 174.479 0.621 1
1 438 . 1 1 1 A 41 41 ARG CA C 41 54.297 54.765 -0.468 1
1 439 . 1 1 1 A 41 41 ARG CB C 41 33.003 32.302 0.701 1
1 442 . 1 1 1 A 41 41 ARG N N 41 126.332 129.280 -2.948 1
1 443 . 1 1 1 A 42 42 CYS H H 42 9.004 9.157 -0.153 1
1 444 . 1 1 1 A 42 42 CYS HA H 42 5.309 5.057 0.252 1
1 447 . 1 1 1 A 42 42 CYS C C 42 173.417 174.115 -0.698 1
1 448 . 1 1 1 A 42 42 CYS CA C 42 57.508 57.554 -0.046 1
1 449 . 1 1 1 A 42 42 CYS CB C 42 28.859 28.807 0.052 1
1 450 . 1 1 1 A 42 42 CYS N N 42 123.359 127.807 -4.448 1
1 451 . 1 1 1 A 43 43 SER H H 43 9.102 9.186 -0.084 1
1 452 . 1 1 1 A 43 43 SER HA H 43 5.324 5.313 0.011 1
1 455 . 1 1 1 A 43 43 SER C C 43 171.429 171.862 -0.433 1
1 456 . 1 1 1 A 43 43 SER CA C 43 55.621 55.291 0.330 1
1 457 . 1 1 1 A 43 43 SER CB C 43 64.856 64.960 -0.104 1
1 458 . 1 1 1 A 43 43 SER N N 43 125.444 120.887 4.557 1
1 459 . 1 1 1 A 44 44 PRO HA H 44 4.389 4.767 -0.378 1
1 466 . 1 1 1 A 44 44 PRO C C 44 176.559 177.481 -0.922 1
1 467 . 1 1 1 A 44 44 PRO CA C 44 63.027 62.712 0.315 1
1 468 . 1 1 1 A 44 44 PRO CB C 44 31.935 32.067 -0.132 1
1 471 . 1 1 1 A 45 45 ALA H H 45 8.261 8.136 0.125 1
1 472 . 1 1 1 A 45 45 ALA HA H 45 4.157 4.127 0.030 1
1 476 . 1 1 1 A 45 45 ALA C C 45 177.706 177.118 0.588 1
1 477 . 1 1 1 A 45 45 ALA CA C 45 53.284 53.799 -0.515 1
1 478 . 1 1 1 A 45 45 ALA CB C 45 18.978 18.971 0.007 1
1 479 . 1 1 1 A 45 45 ALA N N 45 126.162 124.693 1.469 1
1 480 . 1 1 1 A 46 46 SER H H 46 8.275 7.771 0.504 1
1 481 . 1 1 1 A 46 46 SER HA H 46 4.779 4.791 -0.012 1
1 484 . 1 1 1 A 46 46 SER C C 46 172.182 174.250 -2.068 1
1 485 . 1 1 1 A 46 46 SER CA C 46 55.091 55.434 -0.343 1
1 486 . 1 1 1 A 46 46 SER CB C 46 63.130 64.417 -1.287 1
1 487 . 1 1 1 A 46 46 SER N N 46 113.009 113.734 -0.725 1
1 488 . 1 1 1 A 47 47 PRO HA H 47 4.336 4.558 -0.222 1
1 493 . 1 1 1 A 47 47 PRO C C 47 177.165 175.733 1.432 1
1 494 . 1 1 1 A 47 47 PRO CA C 47 63.268 63.701 -0.433 1
1 495 . 1 1 1 A 47 47 PRO CB C 47 32.528 31.610 0.918 1
1 498 . 1 1 1 A 48 48 LYS H H 48 9.089 7.809 1.280 1
1 499 . 1 1 1 A 48 48 LYS HA H 48 4.408 4.565 -0.157 1
1 508 . 1 1 1 A 48 48 LYS C C 48 176.917 175.960 0.957 1
1 509 . 1 1 1 A 48 48 LYS CA C 48 55.893 55.754 0.139 1
1 510 . 1 1 1 A 48 48 LYS CB C 48 32.997 33.334 -0.337 1
1 514 . 1 1 1 A 48 48 LYS N N 48 122.579 115.235 7.344 1
1 515 . 1 1 1 A 49 49 GLY HA2 H 49 4.021 4.234 -0.213 1
1 516 . 1 1 1 A 49 49 GLY HA3 H 49 3.881 4.235 -0.354 1
1 517 . 1 1 1 A 49 49 GLY C C 49 174.552 174.395 0.157 1
1 518 . 1 1 1 A 49 49 GLY CA C 49 46.011 45.182 0.829 1
1 519 . 1 1 1 A 50 50 GLU H H 50 8.608 8.881 -0.273 1
1 520 . 1 1 1 A 50 50 GLU HA H 50 4.335 4.402 -0.067 1
1 525 . 1 1 1 A 50 50 GLU C C 50 176.672 177.003 -0.331 1
1 526 . 1 1 1 A 50 50 GLU CA C 50 56.978 58.132 -1.154 1
1 527 . 1 1 1 A 50 50 GLU CB C 50 29.458 30.745 -1.287 1
1 529 . 1 1 1 A 50 50 GLU N N 50 121.378 120.194 1.184 1
1 530 . 1 1 1 A 51 51 GLU H H 51 8.287 7.862 0.425 1
1 531 . 1 1 1 A 51 51 GLU HA H 51 4.381 4.327 0.054 1
1 536 . 1 1 1 A 51 51 GLU C C 51 176.218 176.865 -0.647 1
1 537 . 1 1 1 A 51 51 GLU CA C 51 56.996 56.725 0.271 1
1 538 . 1 1 1 A 51 51 GLU CB C 51 31.066 30.150 0.916 1
1 540 . 1 1 1 A 51 51 GLU N N 51 120.863 119.236 1.627 1
1 541 . 1 1 1 A 52 52 GLU H H 52 8.445 8.486 -0.041 1
1 542 . 1 1 1 A 52 52 GLU HA H 52 4.464 4.394 0.070 1
1 547 . 1 1 1 A 52 52 GLU C C 52 176.128 176.234 -0.106 1
1 548 . 1 1 1 A 52 52 GLU CA C 52 55.955 55.333 0.622 1
1 549 . 1 1 1 A 52 52 GLU CB C 52 31.691 30.193 1.498 1
1 551 . 1 1 1 A 52 52 GLU N N 52 121.103 123.653 -2.550 1
1 552 . 1 1 1 A 53 53 GLU H H 53 8.441 8.494 -0.053 1
1 553 . 1 1 1 A 53 53 GLU HA H 53 4.609 4.288 0.321 1
1 558 . 1 1 1 A 53 53 GLU C C 53 175.816 175.594 0.222 1
1 559 . 1 1 1 A 53 53 GLU CA C 53 56.697 56.516 0.181 1
1 560 . 1 1 1 A 53 53 GLU CB C 53 31.022 30.026 0.996 1
1 562 . 1 1 1 A 53 53 GLU N N 53 121.949 119.095 2.854 1
1 563 . 1 1 1 A 54 54 ARG H H 54 8.569 9.003 -0.434 1
1 564 . 1 1 1 A 54 54 ARG HA H 54 4.768 4.940 -0.172 1
1 571 . 1 1 1 A 54 54 ARG C C 54 174.881 174.667 0.214 1
1 572 . 1 1 1 A 54 54 ARG CA C 54 54.950 55.180 -0.230 1
1 573 . 1 1 1 A 54 54 ARG CB C 54 33.374 31.905 1.469 1
1 576 . 1 1 1 A 54 54 ARG N N 54 123.714 124.369 -0.655 1
1 577 . 1 1 1 A 55 55 GLU H H 55 8.650 8.735 -0.085 1
1 578 . 1 1 1 A 55 55 GLU HA H 55 5.493 5.237 0.256 1
1 583 . 1 1 1 A 55 55 GLU C C 55 175.566 175.063 0.503 1
1 584 . 1 1 1 A 55 55 GLU CA C 55 54.915 55.031 -0.116 1
1 585 . 1 1 1 A 55 55 GLU CB C 55 33.250 31.796 1.454 1
1 587 . 1 1 1 A 55 55 GLU N N 55 123.537 124.878 -1.341 1
1 588 . 1 1 1 A 56 56 VAL H H 56 9.419 9.022 0.397 1
1 589 . 1 1 1 A 56 56 VAL HA H 56 4.524 5.024 -0.500 1
1 597 . 1 1 1 A 56 56 VAL C C 56 173.502 174.097 -0.595 1
1 598 . 1 1 1 A 56 56 VAL CA C 56 60.981 58.759 2.222 1
1 599 . 1 1 1 A 56 56 VAL CB C 56 36.117 35.626 0.491 1
1 602 . 1 1 1 A 56 56 VAL N N 56 123.343 117.746 5.597 1
1 603 . 1 1 1 A 57 57 GLN H H 57 8.767 8.829 -0.062 1
1 604 . 1 1 1 A 57 57 GLN HA H 57 5.671 5.274 0.397 1
1 611 . 1 1 1 A 57 57 GLN C C 57 176.357 175.289 1.068 1
1 612 . 1 1 1 A 57 57 GLN CA C 57 54.735 54.163 0.572 1
1 613 . 1 1 1 A 57 57 GLN CB C 57 30.781 31.366 -0.585 1
1 615 . 1 1 1 A 57 57 GLN N N 57 125.639 121.193 4.446 1
1 617 . 1 1 1 A 58 58 VAL H H 58 9.217 8.941 0.276 1
1 618 . 1 1 1 A 58 58 VAL HA H 58 5.129 4.848 0.281 1
1 626 . 1 1 1 A 58 58 VAL C C 58 175.925 176.685 -0.760 1
1 627 . 1 1 1 A 58 58 VAL CA C 58 59.652 59.612 0.040 1
1 628 . 1 1 1 A 58 58 VAL CB C 58 36.540 35.054 1.486 1
1 631 . 1 1 1 A 58 58 VAL N N 58 117.022 118.331 -1.309 1
1 632 . 1 1 1 A 59 59 GLY H H 59 9.008 8.702 0.306 1
1 633 . 1 1 1 A 59 59 GLY HA2 H 59 4.670 3.995 0.675 1
1 634 . 1 1 1 A 59 59 GLY HA3 H 59 3.914 4.044 -0.130 1
1 635 . 1 1 1 A 59 59 GLY C C 59 173.386 174.420 -1.034 1
1 636 . 1 1 1 A 59 59 GLY CA C 59 45.093 46.126 -1.033 1
1 637 . 1 1 1 A 59 59 GLY N N 59 109.174 111.151 -1.977 1
1 638 . 1 1 1 A 60 60 ARG H H 60 7.695 7.713 -0.018 1
1 639 . 1 1 1 A 60 60 ARG HA H 60 4.866 4.848 0.018 1
1 645 . 1 1 1 A 60 60 ARG C C 60 173.760 175.629 -1.869 1
1 646 . 1 1 1 A 60 60 ARG CA C 60 52.764 53.728 -0.964 1
1 647 . 1 1 1 A 60 60 ARG CB C 60 31.785 31.611 0.174 1
1 650 . 1 1 1 A 60 60 ARG N N 60 118.520 118.607 -0.087 1
1 651 . 1 1 1 A 61 61 PRO HA H 61 3.539 3.753 -0.214 1
1 658 . 1 1 1 A 61 61 PRO C C 61 173.175 173.676 -0.501 1
1 659 . 1 1 1 A 61 61 PRO CA C 61 62.265 62.837 -0.572 1
1 660 . 1 1 1 A 61 61 PRO CB C 61 27.546 30.761 -3.215 1
1 663 . 1 1 1 A 62 62 GLU H H 62 7.879 7.665 0.214 1
1 664 . 1 1 1 A 62 62 GLU HA H 62 4.071 4.522 -0.451 1
1 669 . 1 1 1 A 62 62 GLU C C 62 174.107 174.833 -0.726 1
1 670 . 1 1 1 A 62 62 GLU CA C 62 55.229 54.778 0.451 1
1 671 . 1 1 1 A 62 62 GLU CB C 62 32.838 31.993 0.845 1
1 673 . 1 1 1 A 62 62 GLU N N 62 118.173 113.926 4.247 1
1 674 . 1 1 1 A 63 63 VAL H H 63 8.930 8.340 0.590 1
1 675 . 1 1 1 A 63 63 VAL HA H 63 4.548 4.992 -0.444 1
1 683 . 1 1 1 A 63 63 VAL C C 63 170.325 173.199 -2.874 1
1 684 . 1 1 1 A 63 63 VAL CA C 63 60.770 59.622 1.148 1
1 685 . 1 1 1 A 63 63 VAL CB C 63 35.394 35.962 -0.568 1
1 688 . 1 1 1 A 63 63 VAL N N 63 117.161 121.961 -4.800 1
1 689 . 1 1 1 A 64 64 LEU H H 64 8.332 9.044 -0.712 1
1 690 . 1 1 1 A 64 64 LEU HA H 64 5.122 5.418 -0.296 1
1 700 . 1 1 1 A 64 64 LEU C C 64 176.243 174.496 1.747 1
1 701 . 1 1 1 A 64 64 LEU CA C 64 53.346 53.670 -0.324 1
1 702 . 1 1 1 A 64 64 LEU CB C 64 42.649 45.575 -2.926 1
1 706 . 1 1 1 A 64 64 LEU N N 64 130.510 128.670 1.840 1
1 707 . 1 1 1 A 65 65 LEU H H 65 9.261 9.151 0.110 1
1 708 . 1 1 1 A 65 65 LEU HA H 65 4.443 4.894 -0.451 1
1 718 . 1 1 1 A 65 65 LEU C C 65 174.016 176.175 -2.159 1
1 719 . 1 1 1 A 65 65 LEU CA C 65 53.920 53.906 0.014 1
1 720 . 1 1 1 A 65 65 LEU CB C 65 42.976 41.974 1.002 1
1 724 . 1 1 1 A 65 65 LEU N N 65 128.611 128.594 0.017 1
1 725 . 1 1 1 A 66 66 ASP H H 66 8.105 8.730 -0.625 1
1 726 . 1 1 1 A 66 66 ASP HA H 66 5.207 4.604 0.603 1
1 729 . 1 1 1 A 66 66 ASP C C 66 176.161 176.579 -0.418 1
1 730 . 1 1 1 A 66 66 ASP CA C 66 51.001 54.781 -3.780 1
1 731 . 1 1 1 A 66 66 ASP CB C 66 42.836 41.128 1.708 1
1 732 . 1 1 1 A 66 66 ASP N N 66 121.799 125.804 -4.005 1
1 733 . 1 1 1 A 67 67 GLY H H 67 8.688 8.343 0.345 1
1 734 . 1 1 1 A 67 67 GLY HA2 H 67 3.923 3.950 -0.027 1
1 735 . 1 1 1 A 67 67 GLY HA3 H 67 3.808 3.956 -0.148 1
1 736 . 1 1 1 A 67 67 GLY C C 67 175.500 174.241 1.259 1
1 737 . 1 1 1 A 67 67 GLY CA C 67 46.591 46.795 -0.204 1
1 738 . 1 1 1 A 67 67 GLY N N 67 106.518 110.948 -4.430 1
1 739 . 1 1 1 A 68 68 LEU H H 68 8.125 7.574 0.551 1
1 740 . 1 1 1 A 68 68 LEU HA H 68 4.252 4.966 -0.714 1
1 750 . 1 1 1 A 68 68 LEU C C 68 174.914 175.254 -0.340 1
1 751 . 1 1 1 A 68 68 LEU CA C 68 53.469 53.200 0.269 1
1 752 . 1 1 1 A 68 68 LEU CB C 68 40.422 45.467 -5.045 1
1 756 . 1 1 1 A 68 68 LEU N N 68 119.345 119.825 -0.480 1
1 757 . 1 1 1 A 69 69 GLU H H 69 8.207 8.930 -0.723 1
1 758 . 1 1 1 A 69 69 GLU HA H 69 4.908 4.813 0.095 1
1 763 . 1 1 1 A 69 69 GLU C C 69 174.464 174.086 0.378 1
1 764 . 1 1 1 A 69 69 GLU CA C 69 53.081 52.882 0.199 1
1 765 . 1 1 1 A 69 69 GLU CB C 69 31.538 31.300 0.238 1
1 767 . 1 1 1 A 69 69 GLU N N 69 119.486 119.701 -0.215 1
1 768 . 1 1 1 A 70 70 PRO HA H 70 4.866 4.342 0.524 1
1 775 . 1 1 1 A 70 70 PRO C C 70 178.285 177.810 0.475 1
1 776 . 1 1 1 A 70 70 PRO CA C 70 63.203 63.629 -0.426 1
1 777 . 1 1 1 A 70 70 PRO CB C 70 33.726 31.359 2.367 1
1 780 . 1 1 1 A 71 71 GLY H H 71 7.362 8.748 -1.386 1
1 781 . 1 1 1 A 71 71 GLY HA2 H 71 3.807 3.957 -0.150 1
1 782 . 1 1 1 A 71 71 GLY HA3 H 71 3.756 3.962 -0.206 1
1 783 . 1 1 1 A 71 71 GLY C C 71 174.664 173.932 0.732 1
1 784 . 1 1 1 A 71 71 GLY CA C 71 46.926 46.287 0.639 1
1 785 . 1 1 1 A 71 71 GLY N N 71 113.776 112.079 1.697 1
1 786 . 1 1 1 A 72 72 ARG H H 72 8.036 7.302 0.734 1
1 787 . 1 1 1 A 72 72 ARG HA H 72 4.597 4.744 -0.147 1
1 793 . 1 1 1 A 72 72 ARG C C 72 173.293 174.269 -0.976 1
1 794 . 1 1 1 A 72 72 ARG CA C 72 54.633 54.400 0.233 1
1 795 . 1 1 1 A 72 72 ARG CB C 72 33.704 33.191 0.513 1
1 798 . 1 1 1 A 72 72 ARG N N 72 119.611 119.839 -0.228 1
1 799 . 1 1 1 A 73 73 ASP H H 73 7.785 8.513 -0.728 1
1 800 . 1 1 1 A 73 73 ASP HA H 73 5.276 5.219 0.057 1
1 803 . 1 1 1 A 73 73 ASP C C 73 175.904 175.067 0.837 1
1 804 . 1 1 1 A 73 73 ASP CA C 73 53.568 53.075 0.493 1
1 805 . 1 1 1 A 73 73 ASP CB C 73 42.970 42.659 0.311 1
1 806 . 1 1 1 A 73 73 ASP N N 73 118.900 125.951 -7.051 1
1 807 . 1 1 1 A 74 74 TYR H H 74 9.516 9.124 0.392 1
1 808 . 1 1 1 A 74 74 TYR HA H 74 4.800 5.165 -0.365 1
1 815 . 1 1 1 A 74 74 TYR C C 74 174.631 174.999 -0.368 1
1 816 . 1 1 1 A 74 74 TYR CA C 74 58.548 56.726 1.822 1
1 817 . 1 1 1 A 74 74 TYR CB C 74 42.029 43.439 -1.410 1
1 822 . 1 1 1 A 74 74 TYR N N 74 121.903 120.823 1.080 1
1 823 . 1 1 1 A 75 75 GLU H H 75 9.248 9.305 -0.057 1
1 824 . 1 1 1 A 75 75 GLU HA H 75 4.756 5.095 -0.339 1
1 829 . 1 1 1 A 75 75 GLU C C 75 175.524 175.609 -0.085 1
1 830 . 1 1 1 A 75 75 GLU CA C 75 55.621 55.390 0.231 1
1 831 . 1 1 1 A 75 75 GLU CB C 75 30.778 31.553 -0.775 1
1 833 . 1 1 1 A 75 75 GLU N N 75 122.425 120.808 1.617 1
1 834 . 1 1 1 A 76 76 VAL H H 76 8.884 9.198 -0.314 1
1 835 . 1 1 1 A 76 76 VAL HA H 76 5.246 5.143 0.103 1
1 843 . 1 1 1 A 76 76 VAL C C 76 174.800 174.760 0.040 1
1 844 . 1 1 1 A 76 76 VAL CA C 76 60.199 61.179 -0.980 1
1 845 . 1 1 1 A 76 76 VAL CB C 76 33.449 33.336 0.113 1
1 848 . 1 1 1 A 76 76 VAL N N 76 126.853 126.501 0.352 1
1 849 . 1 1 1 A 77 77 SER H H 77 9.234 8.664 0.570 1
1 850 . 1 1 1 A 77 77 SER HA H 77 5.398 5.349 0.049 1
1 853 . 1 1 1 A 77 77 SER C C 77 173.138 173.391 -0.253 1
1 854 . 1 1 1 A 77 77 SER CA C 77 56.032 56.557 -0.525 1
1 855 . 1 1 1 A 77 77 SER CB C 77 66.374 64.526 1.848 1
1 856 . 1 1 1 A 77 77 SER N N 77 120.852 122.040 -1.188 1
1 857 . 1 1 1 A 78 78 VAL H H 78 9.092 8.864 0.228 1
1 858 . 1 1 1 A 78 78 VAL HA H 78 4.756 4.574 0.182 1
1 866 . 1 1 1 A 78 78 VAL C C 78 173.641 174.460 -0.819 1
1 867 . 1 1 1 A 78 78 VAL CA C 78 61.246 60.910 0.336 1
1 868 . 1 1 1 A 78 78 VAL CB C 78 34.467 32.538 1.929 1
1 871 . 1 1 1 A 78 78 VAL N N 78 122.453 126.232 -3.779 1
1 872 . 1 1 1 A 79 79 GLN H H 79 8.587 8.331 0.256 1
1 873 . 1 1 1 A 79 79 GLN HA H 79 4.438 4.900 -0.462 1
1 880 . 1 1 1 A 79 79 GLN C C 79 174.999 174.177 0.822 1
1 881 . 1 1 1 A 79 79 GLN CA C 79 54.227 54.311 -0.084 1
1 882 . 1 1 1 A 79 79 GLN CB C 79 33.587 32.466 1.121 1
1 884 . 1 1 1 A 79 79 GLN N N 79 125.619 127.447 -1.828 1
1 886 . 1 1 1 A 80 80 SER H H 80 8.623 8.986 -0.363 1
1 887 . 1 1 1 A 80 80 SER HA H 80 4.756 4.872 -0.116 1
1 890 . 1 1 1 A 80 80 SER C C 80 172.264 173.892 -1.628 1
1 891 . 1 1 1 A 80 80 SER CA C 80 58.177 58.403 -0.226 1
1 892 . 1 1 1 A 80 80 SER CB C 80 63.920 63.166 0.754 1
1 893 . 1 1 1 A 80 80 SER N N 80 122.844 124.295 -1.451 1
1 894 . 1 1 1 A 81 81 LEU H H 81 8.348 8.890 -0.542 1
1 895 . 1 1 1 A 81 81 LEU HA H 81 5.124 4.364 0.760 1
1 905 . 1 1 1 A 81 81 LEU C C 81 175.775 176.231 -0.456 1
1 906 . 1 1 1 A 81 81 LEU CA C 81 54.033 53.904 0.129 1
1 907 . 1 1 1 A 81 81 LEU CB C 81 44.690 41.897 2.793 1
1 911 . 1 1 1 A 81 81 LEU N N 81 123.191 127.469 -4.278 1
1 912 . 1 1 1 A 82 82 ARG H H 82 8.374 8.972 -0.598 1
1 913 . 1 1 1 A 82 82 ARG HA H 82 4.616 4.265 0.351 1
1 919 . 1 1 1 A 82 82 ARG C C 82 176.864 175.758 1.106 1
1 920 . 1 1 1 A 82 82 ARG CA C 82 55.868 56.417 -0.549 1
1 921 . 1 1 1 A 82 82 ARG CB C 82 32.322 32.395 -0.073 1
1 924 . 1 1 1 A 82 82 ARG N N 82 121.029 125.899 -4.870 1
1 925 . 1 1 1 A 83 83 GLY H H 83 8.309 7.324 0.985 1
1 926 . 1 1 1 A 83 83 GLY HA2 H 83 4.031 4.093 -0.062 1
1 927 . 1 1 1 A 83 83 GLY HA3 H 83 3.888 4.143 -0.255 1
1 928 . 1 1 1 A 83 83 GLY C C 83 174.562 174.163 0.399 1
1 929 . 1 1 1 A 83 83 GLY CA C 83 45.963 45.972 -0.009 1
1 930 . 1 1 1 A 83 83 GLY N N 83 109.937 106.980 2.957 1
1 931 . 1 1 1 A 84 84 PRO HA H 84 4.573 4.351 0.222 1
1 938 . 1 1 1 A 84 84 PRO C C 84 176.533 176.088 0.445 1
1 939 . 1 1 1 A 84 84 PRO CA C 84 63.485 64.800 -1.315 1
1 940 . 1 1 1 A 84 84 PRO CB C 84 32.409 32.063 0.346 1
1 943 . 1 1 1 A 85 85 GLU H H 85 7.799 7.577 0.222 1
1 944 . 1 1 1 A 85 85 GLU HA H 85 4.369 4.875 -0.506 1
1 949 . 1 1 1 A 85 85 GLU C C 85 174.722 175.444 -0.722 1
1 950 . 1 1 1 A 85 85 GLU CA C 85 55.899 54.860 1.039 1
1 951 . 1 1 1 A 85 85 GLU CB C 85 31.911 33.067 -1.156 1
1 953 . 1 1 1 A 85 85 GLU N N 85 122.093 112.241 9.852 1
1 954 . 1 1 1 A 86 86 GLY H H 86 8.329 8.767 -0.438 1
1 955 . 1 1 1 A 86 86 GLY HA2 H 86 5.298 4.215 1.083 1
1 956 . 1 1 1 A 86 86 GLY HA3 H 86 3.559 4.230 -0.671 1
1 957 . 1 1 1 A 86 86 GLY C C 86 174.355 173.097 1.258 1
1 958 . 1 1 1 A 86 86 GLY CA C 86 44.034 44.026 0.008 1
1 959 . 1 1 1 A 86 86 GLY N N 86 109.387 108.880 0.507 1
1 960 . 1 1 1 A 87 87 SER H H 87 8.807 8.149 0.658 1
1 961 . 1 1 1 A 87 87 SER HA H 87 4.670 4.634 0.036 1
1 964 . 1 1 1 A 87 87 SER C C 87 175.195 174.609 0.586 1
1 965 . 1 1 1 A 87 87 SER CA C 87 57.737 57.680 0.057 1
1 966 . 1 1 1 A 87 87 SER CB C 87 67.829 65.957 1.872 1
1 967 . 1 1 1 A 87 87 SER N N 87 117.698 113.147 4.551 1
1 968 . 1 1 1 A 88 88 GLU H H 88 8.754 8.664 0.090 1
1 969 . 1 1 1 A 88 88 GLU HA H 88 4.357 4.308 0.049 1
1 974 . 1 1 1 A 88 88 GLU C C 88 177.474 176.769 0.705 1
1 975 . 1 1 1 A 88 88 GLU CA C 88 57.525 56.755 0.770 1
1 976 . 1 1 1 A 88 88 GLU CB C 88 31.162 30.303 0.859 1
1 978 . 1 1 1 A 88 88 GLU N N 88 118.709 120.304 -1.595 1
1 979 . 1 1 1 A 89 89 ALA H H 89 8.855 8.318 0.537 1
1 980 . 1 1 1 A 89 89 ALA HA H 89 4.792 4.560 0.232 1
1 984 . 1 1 1 A 89 89 ALA C C 89 178.379 176.754 1.625 1
1 985 . 1 1 1 A 89 89 ALA CA C 89 51.264 51.796 -0.532 1
1 986 . 1 1 1 A 89 89 ALA CB C 89 20.040 19.727 0.313 1
1 987 . 1 1 1 A 89 89 ALA N N 89 127.301 124.356 2.945 1
1 988 . 1 1 1 A 90 90 ARG H H 90 8.549 8.507 0.042 1
1 989 . 1 1 1 A 90 90 ARG HA H 90 4.658 5.000 -0.342 1
1 996 . 1 1 1 A 90 90 ARG C C 90 174.720 175.230 -0.510 1
1 997 . 1 1 1 A 90 90 ARG CA C 90 53.575 54.319 -0.744 1
1 998 . 1 1 1 A 90 90 ARG CB C 90 33.456 32.142 1.314 1
1 1001 . 1 1 1 A 90 90 ARG N N 90 121.289 123.403 -2.114 1
1 1002 . 1 1 1 A 91 91 GLY H H 91 8.396 8.889 -0.493 1
1 1003 . 1 1 1 A 91 91 GLY HA2 H 91 5.306 4.209 1.097 1
1 1004 . 1 1 1 A 91 91 GLY HA3 H 91 3.700 4.248 -0.548 1
1 1005 . 1 1 1 A 91 91 GLY C C 91 173.191 172.190 1.001 1
1 1006 . 1 1 1 A 91 91 GLY CA C 91 44.493 43.907 0.586 1
1 1007 . 1 1 1 A 91 91 GLY N N 91 108.579 111.952 -3.373 1
1 1008 . 1 1 1 A 92 92 ILE H H 92 8.891 8.248 0.643 1
1 1009 . 1 1 1 A 92 92 ILE HA H 92 4.499 5.009 -0.510 1
1 1019 . 1 1 1 A 92 92 ILE C C 92 171.877 173.916 -2.039 1
1 1020 . 1 1 1 A 92 92 ILE CA C 92 60.682 59.153 1.529 1
1 1021 . 1 1 1 A 92 92 ILE CB C 92 42.425 41.881 0.544 1
1 1025 . 1 1 1 A 92 92 ILE N N 92 118.313 121.698 -3.385 1
1 1026 . 1 1 1 A 93 93 ARG H H 93 7.980 8.578 -0.598 1
1 1027 . 1 1 1 A 93 93 ARG HA H 93 5.224 4.642 0.582 1
1 1034 . 1 1 1 A 93 93 ARG C C 93 175.072 175.860 -0.788 1
1 1035 . 1 1 1 A 93 93 ARG CA C 93 54.499 55.383 -0.884 1
1 1036 . 1 1 1 A 93 93 ARG CB C 93 31.767 30.576 1.191 1
1 1039 . 1 1 1 A 93 93 ARG N N 93 124.879 128.480 -3.601 1
1 1040 . 1 1 1 A 94 94 ALA H H 94 9.064 8.300 0.764 1
1 1041 . 1 1 1 A 94 94 ALA HA H 94 4.731 4.355 0.376 1
1 1045 . 1 1 1 A 94 94 ALA C C 94 174.494 177.101 -2.607 1
1 1046 . 1 1 1 A 94 94 ALA CA C 94 50.577 52.919 -2.342 1
1 1047 . 1 1 1 A 94 94 ALA CB C 94 23.082 19.385 3.697 1
1 1048 . 1 1 1 A 94 94 ALA N N 94 126.095 129.405 -3.310 1
1 1049 . 1 1 1 A 95 95 ARG H H 95 8.263 8.628 -0.365 1
1 1050 . 1 1 1 A 95 95 ARG HA H 95 5.548 4.810 0.738 1
1 1058 . 1 1 1 A 95 95 ARG C C 95 176.901 174.319 2.582 1
1 1059 . 1 1 1 A 95 95 ARG CA C 95 53.787 55.787 -2.000 1
1 1060 . 1 1 1 A 95 95 ARG CB C 95 32.426 34.018 -1.592 1
1 1063 . 1 1 1 A 95 95 ARG N N 95 123.374 120.010 3.364 1
1 1065 . 1 1 1 A 96 96 THR H H 96 9.208 8.768 0.440 1
1 1066 . 1 1 1 A 96 96 THR HA H 96 4.461 5.076 -0.615 1
1 1071 . 1 1 1 A 96 96 THR CA C 96 58.248 58.436 -0.188 1
1 1072 . 1 1 1 A 96 96 THR CB C 96 68.466 70.910 -2.444 1
1 1074 . 1 1 1 A 96 96 THR N N 96 119.492 115.460 4.032 1
1 1075 . 1 1 1 A 97 97 PRO HA H 97 4.636 4.609 0.027 1
1 1082 . 1 1 1 A 97 97 PRO C C 97 175.725 175.727 -0.002 1
1 1083 . 1 1 1 A 97 97 PRO CA C 97 61.907 62.328 -0.421 1
1 1084 . 1 1 1 A 97 97 PRO CB C 97 32.590 33.423 -0.833 1
1 1087 . 1 1 1 A 98 98 THR H H 98 7.943 8.375 -0.432 1
1 1088 . 1 1 1 A 98 98 THR HA H 98 4.208 5.099 -0.891 1
1 1093 . 1 1 1 A 98 98 THR C C 98 175.058 172.929 2.129 1
1 1094 . 1 1 1 A 98 98 THR CA C 98 62.069 60.409 1.660 1
1 1095 . 1 1 1 A 98 98 THR CB C 98 69.719 71.097 -1.378 1
1 1097 . 1 1 1 A 98 98 THR N N 98 107.148 110.865 -3.717 1
1 1098 . 1 1 1 A 99 99 SER H H 99 8.163 8.785 -0.622 1
1 1099 . 1 1 1 A 99 99 SER HA H 99 4.524 4.644 -0.120 1
1 1102 . 1 1 1 A 99 99 SER C C 99 174.319 174.531 -0.212 1
1 1103 . 1 1 1 A 99 99 SER CA C 99 58.107 57.244 0.863 1
1 1104 . 1 1 1 A 99 99 SER CB C 99 64.492 64.890 -0.398 1
1 1105 . 1 1 1 A 99 99 SER N N 99 115.114 122.661 -7.547 1
1 1106 . 1 1 1 A 100 100 GLY H H 100 8.336 8.478 -0.142 1
1 1107 . 1 1 1 A 100 100 GLY HA2 H 100 4.222 4.094 0.128 1
1 1108 . 1 1 1 A 100 100 GLY HA3 H 100 4.222 4.095 0.127 1
1 1109 . 1 1 1 A 100 100 GLY C C 100 171.696 173.456 -1.760 1
1 1110 . 1 1 1 A 100 100 GLY CA C 100 44.617 44.427 0.190 1
1 1111 . 1 1 1 A 100 100 GLY N N 100 110.678 112.050 -1.372 1
1 1112 . 1 1 1 A 101 101 PRO HA H 101 4.506 4.656 -0.150 1
1 1118 . 1 1 1 A 101 101 PRO CA C 101 63.358 62.702 0.656 1
1 1119 . 1 1 1 A 101 101 PRO CB C 101 32.313 32.342 -0.029 1
1 1 . 2 1 1 A 6 6 SER HA H 6 4.528 4.889 -0.361 1
1 3 . 2 1 1 A 6 6 SER CA C 6 58.373 58.469 -0.096 1
1 4 . 2 1 1 A 6 6 SER CB C 6 63.978 63.824 0.154 1
1 5 . 2 1 1 A 7 7 GLY H H 7 8.228 8.677 -0.449 1
1 6 . 2 1 1 A 7 7 GLY HA2 H 7 4.134 4.330 -0.196 1
1 7 . 2 1 1 A 7 7 GLY HA3 H 7 4.134 4.330 -0.196 1
1 8 . 2 1 1 A 7 7 GLY CA C 7 44.607 44.535 0.072 1
1 9 . 2 1 1 A 7 7 GLY N N 7 110.638 112.495 -1.857 1
1 10 . 2 1 1 A 8 8 PRO HA H 8 4.419 4.623 -0.204 1
1 17 . 2 1 1 A 8 8 PRO C C 8 176.908 175.354 1.554 1
1 18 . 2 1 1 A 8 8 PRO CA C 8 62.851 62.913 -0.062 1
1 19 . 2 1 1 A 8 8 PRO CB C 8 32.243 32.578 -0.335 1
1 22 . 2 1 1 A 9 9 LEU H H 9 8.462 8.422 0.040 1
1 23 . 2 1 1 A 9 9 LEU HA H 9 4.494 4.923 -0.429 1
1 33 . 2 1 1 A 9 9 LEU C C 9 174.124 174.766 -0.642 1
1 34 . 2 1 1 A 9 9 LEU CA C 9 52.587 51.546 1.041 1
1 35 . 2 1 1 A 9 9 LEU CB C 9 43.150 43.398 -0.248 1
1 39 . 2 1 1 A 9 9 LEU N N 9 126.015 122.572 3.443 1
1 40 . 2 1 1 A 10 10 PRO HA H 10 4.820 4.596 0.224 1
1 47 . 2 1 1 A 10 10 PRO CA C 10 61.368 62.140 -0.772 1
1 48 . 2 1 1 A 10 10 PRO CB C 10 31.391 32.423 -1.032 1
1 51 . 2 1 1 A 11 11 PRO HA H 11 4.949 4.625 0.324 1
1 58 . 2 1 1 A 11 11 PRO CA C 11 61.183 61.857 -0.674 1
1 59 . 2 1 1 A 11 11 PRO CB C 11 30.656 31.961 -1.305 1
1 62 . 2 1 1 A 12 12 PRO HA H 12 4.341 4.701 -0.360 1
1 69 . 2 1 1 A 12 12 PRO C C 12 174.849 176.796 -1.947 1
1 70 . 2 1 1 A 12 12 PRO CA C 12 63.062 62.715 0.347 1
1 71 . 2 1 1 A 12 12 PRO CB C 12 31.831 31.871 -0.040 1
1 74 . 2 1 1 A 13 13 ARG H H 13 7.828 8.354 -0.526 1
1 75 . 2 1 1 A 13 13 ARG HA H 13 4.536 4.533 0.003 1
1 82 . 2 1 1 A 13 13 ARG C C 13 174.608 176.472 -1.864 1
1 83 . 2 1 1 A 13 13 ARG CA C 13 54.774 56.545 -1.771 1
1 84 . 2 1 1 A 13 13 ARG CB C 13 33.250 31.978 1.272 1
1 87 . 2 1 1 A 13 13 ARG N N 13 120.532 119.068 1.464 1
1 88 . 2 1 1 A 14 14 ALA H H 14 8.694 7.684 1.010 1
1 89 . 2 1 1 A 14 14 ALA HA H 14 3.986 4.404 -0.418 1
1 93 . 2 1 1 A 14 14 ALA C C 14 177.232 176.568 0.664 1
1 94 . 2 1 1 A 14 14 ALA CA C 14 52.461 51.703 0.758 1
1 95 . 2 1 1 A 14 14 ALA CB C 14 16.806 17.283 -0.477 1
1 96 . 2 1 1 A 14 14 ALA N N 14 121.921 121.080 0.841 1
1 97 . 2 1 1 A 15 15 LEU H H 15 8.097 8.331 -0.234 1
1 98 . 2 1 1 A 15 15 LEU HA H 15 4.670 4.747 -0.077 1
1 108 . 2 1 1 A 15 15 LEU C C 15 177.364 176.128 1.236 1
1 109 . 2 1 1 A 15 15 LEU CA C 15 57.543 54.469 3.074 1
1 110 . 2 1 1 A 15 15 LEU CB C 15 41.877 41.132 0.745 1
1 114 . 2 1 1 A 15 15 LEU N N 15 122.215 121.846 0.369 1
1 115 . 2 1 1 A 16 16 THR H H 16 9.520 8.915 0.605 1
1 116 . 2 1 1 A 16 16 THR HA H 16 4.369 4.789 -0.420 1
1 121 . 2 1 1 A 16 16 THR C C 16 172.453 172.972 -0.519 1
1 122 . 2 1 1 A 16 16 THR CA C 16 62.480 61.517 0.963 1
1 123 . 2 1 1 A 16 16 THR CB C 16 72.198 72.629 -0.431 1
1 125 . 2 1 1 A 16 16 THR N N 16 122.214 120.022 2.192 1
1 126 . 2 1 1 A 17 17 LEU H H 17 8.847 8.671 0.176 1
1 127 . 2 1 1 A 17 17 LEU HA H 17 4.573 4.425 0.148 1
1 137 . 2 1 1 A 17 17 LEU C C 17 174.695 176.591 -1.896 1
1 138 . 2 1 1 A 17 17 LEU CA C 17 53.840 54.433 -0.593 1
1 139 . 2 1 1 A 17 17 LEU CB C 17 40.290 42.027 -1.737 1
1 143 . 2 1 1 A 17 17 LEU N N 17 127.415 127.429 -0.014 1
1 144 . 2 1 1 A 18 18 ALA H H 18 8.647 8.581 0.066 1
1 145 . 2 1 1 A 18 18 ALA HA H 18 4.106 4.032 0.074 1
1 149 . 2 1 1 A 18 18 ALA C C 18 178.236 177.303 0.933 1
1 150 . 2 1 1 A 18 18 ALA CA C 18 53.926 54.835 -0.909 1
1 151 . 2 1 1 A 18 18 ALA CB C 18 18.876 19.068 -0.192 1
1 152 . 2 1 1 A 18 18 ALA N N 18 133.362 129.787 3.575 1
1 153 . 2 1 1 A 19 19 ALA H H 19 7.772 7.149 0.623 1
1 154 . 2 1 1 A 19 19 ALA HA H 19 4.561 4.796 -0.235 1
1 158 . 2 1 1 A 19 19 ALA C C 19 176.032 174.688 1.344 1
1 159 . 2 1 1 A 19 19 ALA CA C 19 53.011 51.144 1.867 1
1 160 . 2 1 1 A 19 19 ALA CB C 19 21.869 23.049 -1.180 1
1 161 . 2 1 1 A 19 19 ALA N N 19 115.654 117.270 -1.616 1
1 162 . 2 1 1 A 20 20 VAL H H 20 8.697 8.791 -0.094 1
1 163 . 2 1 1 A 20 20 VAL HA H 20 4.951 4.776 0.175 1
1 171 . 2 1 1 A 20 20 VAL C C 20 174.314 174.201 0.113 1
1 172 . 2 1 1 A 20 20 VAL CA C 20 61.352 60.204 1.148 1
1 173 . 2 1 1 A 20 20 VAL CB C 20 35.394 33.670 1.724 1
1 176 . 2 1 1 A 20 20 VAL N N 20 120.848 118.560 2.288 1
1 177 . 2 1 1 A 21 21 THR H H 21 9.198 8.378 0.820 1
1 178 . 2 1 1 A 21 21 THR HA H 21 4.941 4.739 0.202 1
1 183 . 2 1 1 A 21 21 THR C C 21 174.416 174.544 -0.128 1
1 184 . 2 1 1 A 21 21 THR CA C 21 60.347 58.863 1.484 1
1 185 . 2 1 1 A 21 21 THR CB C 21 68.713 71.586 -2.873 1
1 187 . 2 1 1 A 21 21 THR N N 21 120.326 124.517 -4.191 1
1 188 . 2 1 1 A 22 22 PRO HA H 22 4.634 4.556 0.078 1
1 194 . 2 1 1 A 22 22 PRO C C 22 173.606 176.689 -3.083 1
1 195 . 2 1 1 A 22 22 PRO CA C 22 66.519 64.246 2.273 1
1 196 . 2 1 1 A 22 22 PRO CB C 22 32.078 31.618 0.460 1
1 199 . 2 1 1 A 23 23 ARG H H 23 6.621 8.099 -1.478 1
1 200 . 2 1 1 A 23 23 ARG HA H 23 4.591 4.487 0.104 1
1 207 . 2 1 1 A 23 23 ARG C C 23 176.554 175.680 0.874 1
1 208 . 2 1 1 A 23 23 ARG CA C 23 53.892 56.284 -2.392 1
1 209 . 2 1 1 A 23 23 ARG CB C 23 33.498 33.005 0.493 1
1 212 . 2 1 1 A 23 23 ARG N N 23 102.938 116.911 -13.973 1
1 213 . 2 1 1 A 24 24 THR H H 24 7.352 7.936 -0.584 1
1 214 . 2 1 1 A 24 24 THR HA H 24 5.593 5.319 0.274 1
1 219 . 2 1 1 A 24 24 THR C C 24 172.345 172.236 0.109 1
1 220 . 2 1 1 A 24 24 THR CA C 24 59.311 60.629 -1.318 1
1 221 . 2 1 1 A 24 24 THR CB C 24 73.311 72.059 1.252 1
1 223 . 2 1 1 A 24 24 THR N N 24 108.792 110.775 -1.983 1
1 224 . 2 1 1 A 25 25 VAL H H 25 8.437 8.461 -0.024 1
1 225 . 2 1 1 A 25 25 VAL HA H 25 4.512 4.932 -0.420 1
1 233 . 2 1 1 A 25 25 VAL C C 25 172.854 174.166 -1.312 1
1 234 . 2 1 1 A 25 25 VAL CA C 25 61.617 60.999 0.618 1
1 235 . 2 1 1 A 25 25 VAL CB C 25 36.742 34.310 2.432 1
1 238 . 2 1 1 A 25 25 VAL N N 25 117.023 121.119 -4.096 1
1 239 . 2 1 1 A 26 26 HIS H H 26 8.915 8.562 0.353 1
1 240 . 2 1 1 A 26 26 HIS HA H 26 5.765 5.660 0.105 1
1 245 . 2 1 1 A 26 26 HIS C C 26 173.976 172.996 0.980 1
1 246 . 2 1 1 A 26 26 HIS CA C 26 52.896 53.687 -0.791 1
1 247 . 2 1 1 A 26 26 HIS CB C 26 34.004 32.787 1.217 1
1 250 . 2 1 1 A 26 26 HIS N N 26 128.155 127.632 0.523 1
1 251 . 2 1 1 A 27 27 LEU H H 27 9.034 9.164 -0.130 1
1 252 . 2 1 1 A 27 27 LEU HA H 27 5.505 5.160 0.345 1
1 262 . 2 1 1 A 27 27 LEU C C 27 174.821 174.919 -0.098 1
1 263 . 2 1 1 A 27 27 LEU CA C 27 53.376 53.306 0.070 1
1 264 . 2 1 1 A 27 27 LEU CB C 27 46.306 46.687 -0.381 1
1 268 . 2 1 1 A 27 27 LEU N N 27 128.569 130.314 -1.745 1
1 269 . 2 1 1 A 28 28 THR H H 28 8.844 8.733 0.111 1
1 270 . 2 1 1 A 28 28 THR HA H 28 4.485 4.808 -0.323 1
1 275 . 2 1 1 A 28 28 THR C C 28 172.773 173.595 -0.822 1
1 276 . 2 1 1 A 28 28 THR CA C 28 60.052 60.017 0.035 1
1 277 . 2 1 1 A 28 28 THR CB C 28 71.704 71.152 0.552 1
1 279 . 2 1 1 A 28 28 THR N N 28 112.165 114.529 -2.364 1
1 280 . 2 1 1 A 29 29 TRP H H 29 7.395 7.810 -0.415 1
1 281 . 2 1 1 A 29 29 TRP HA H 29 4.915 5.777 -0.862 1
1 290 . 2 1 1 A 29 29 TRP C C 29 174.013 175.098 -1.085 1
1 291 . 2 1 1 A 29 29 TRP CA C 29 56.626 54.441 2.185 1
1 292 . 2 1 1 A 29 29 TRP CB C 29 29.487 31.999 -2.512 1
1 298 . 2 1 1 A 29 29 TRP N N 29 115.623 119.920 -4.297 1
1 300 . 2 1 1 A 30 30 GLN H H 30 8.759 8.600 0.159 1
1 301 . 2 1 1 A 30 30 GLN HA H 30 4.641 4.644 -0.003 1
1 308 . 2 1 1 A 30 30 GLN C C 30 175.072 174.310 0.762 1
1 309 . 2 1 1 A 30 30 GLN CA C 30 52.975 54.275 -1.300 1
1 310 . 2 1 1 A 30 30 GLN CB C 30 28.398 28.155 0.243 1
1 312 . 2 1 1 A 30 30 GLN N N 30 117.497 120.128 -2.631 1
1 314 . 2 1 1 A 31 31 PRO HA H 31 4.487 4.568 -0.081 1
1 320 . 2 1 1 A 31 31 PRO C C 31 177.034 176.422 0.612 1
1 321 . 2 1 1 A 31 31 PRO CA C 31 62.710 63.040 -0.330 1
1 322 . 2 1 1 A 31 31 PRO CB C 31 32.738 32.201 0.537 1
1 325 . 2 1 1 A 32 32 SER H H 32 8.259 9.224 -0.965 1
1 326 . 2 1 1 A 32 32 SER HA H 32 4.670 4.647 0.023 1
1 329 . 2 1 1 A 32 32 SER C C 32 174.689 173.496 1.193 1
1 330 . 2 1 1 A 32 32 SER CA C 32 57.296 57.080 0.216 1
1 331 . 2 1 1 A 32 32 SER CB C 32 64.748 65.033 -0.285 1
1 332 . 2 1 1 A 32 32 SER N N 32 117.667 117.523 0.144 1
1 333 . 2 1 1 A 33 33 ALA H H 33 9.038 8.723 0.315 1
1 334 . 2 1 1 A 33 33 ALA HA H 33 4.126 4.849 -0.723 1
1 338 . 2 1 1 A 33 33 ALA C C 33 177.795 177.892 -0.097 1
1 339 . 2 1 1 A 33 33 ALA CA C 33 54.213 50.882 3.331 1
1 340 . 2 1 1 A 33 33 ALA CB C 33 17.948 21.406 -3.458 1
1 341 . 2 1 1 A 33 33 ALA N N 33 131.772 124.261 7.511 1
1 342 . 2 1 1 A 34 34 GLY H H 34 8.576 8.966 -0.390 1
1 343 . 2 1 1 A 34 34 GLY HA2 H 34 4.171 3.821 0.350 1
1 344 . 2 1 1 A 34 34 GLY HA3 H 34 3.592 3.828 -0.236 1
1 345 . 2 1 1 A 34 34 GLY C C 34 174.182 174.651 -0.469 1
1 346 . 2 1 1 A 34 34 GLY CA C 34 44.987 46.946 -1.959 1
1 347 . 2 1 1 A 34 34 GLY N N 34 111.339 110.731 0.608 1
1 348 . 2 1 1 A 35 35 ALA H H 35 7.637 7.970 -0.333 1
1 349 . 2 1 1 A 35 35 ALA HA H 35 4.210 4.473 -0.263 1
1 353 . 2 1 1 A 35 35 ALA C C 35 178.918 177.111 1.807 1
1 354 . 2 1 1 A 35 35 ALA CA C 35 52.671 51.264 1.407 1
1 355 . 2 1 1 A 35 35 ALA CB C 35 18.988 19.077 -0.089 1
1 356 . 2 1 1 A 35 35 ALA N N 35 121.531 122.508 -0.977 1
1 357 . 2 1 1 A 36 36 THR H H 36 9.428 8.199 1.229 1
1 358 . 2 1 1 A 36 36 THR HA H 36 4.402 4.101 0.301 1
1 363 . 2 1 1 A 36 36 THR C C 36 174.739 174.194 0.545 1
1 364 . 2 1 1 A 36 36 THR CA C 36 62.692 64.468 -1.776 1
1 365 . 2 1 1 A 36 36 THR CB C 36 69.482 69.295 0.187 1
1 367 . 2 1 1 A 36 36 THR N N 36 113.103 119.455 -6.352 1
1 368 . 2 1 1 A 37 37 HIS H H 37 7.857 6.860 0.997 1
1 369 . 2 1 1 A 37 37 HIS HA H 37 4.878 4.920 -0.042 1
1 374 . 2 1 1 A 37 37 HIS C C 37 171.103 171.963 -0.860 1
1 375 . 2 1 1 A 37 37 HIS CA C 37 55.867 54.584 1.283 1
1 376 . 2 1 1 A 37 37 HIS CB C 37 32.655 31.636 1.019 1
1 379 . 2 1 1 A 37 37 HIS N N 37 118.486 113.372 5.114 1
1 380 . 2 1 1 A 38 38 TYR H H 38 9.217 8.674 0.543 1
1 381 . 2 1 1 A 38 38 TYR HA H 38 5.303 5.351 -0.048 1
1 388 . 2 1 1 A 38 38 TYR C C 38 173.922 174.264 -0.342 1
1 389 . 2 1 1 A 38 38 TYR CA C 38 56.504 56.223 0.281 1
1 390 . 2 1 1 A 38 38 TYR CB C 38 41.823 41.602 0.221 1
1 395 . 2 1 1 A 38 38 TYR N N 38 114.077 117.263 -3.186 1
1 396 . 2 1 1 A 39 39 LEU H H 39 9.052 9.304 -0.252 1
1 397 . 2 1 1 A 39 39 LEU HA H 39 5.061 5.035 0.026 1
1 407 . 2 1 1 A 39 39 LEU C C 39 175.455 174.634 0.821 1
1 408 . 2 1 1 A 39 39 LEU CA C 39 53.855 54.105 -0.250 1
1 409 . 2 1 1 A 39 39 LEU CB C 39 45.254 44.459 0.795 1
1 413 . 2 1 1 A 39 39 LEU N N 39 123.997 126.600 -2.603 1
1 414 . 2 1 1 A 40 40 VAL H H 40 9.520 9.571 -0.051 1
1 415 . 2 1 1 A 40 40 VAL HA H 40 4.988 4.923 0.065 1
1 423 . 2 1 1 A 40 40 VAL C C 40 174.578 174.964 -0.386 1
1 424 . 2 1 1 A 40 40 VAL CA C 40 60.575 61.477 -0.902 1
1 425 . 2 1 1 A 40 40 VAL CB C 40 33.284 33.514 -0.230 1
1 428 . 2 1 1 A 40 40 VAL N N 40 129.678 128.656 1.022 1
1 429 . 2 1 1 A 41 41 ARG H H 41 9.096 9.116 -0.020 1
1 430 . 2 1 1 A 41 41 ARG HA H 41 5.384 5.139 0.245 1
1 437 . 2 1 1 A 41 41 ARG C C 41 175.100 174.553 0.547 1
1 438 . 2 1 1 A 41 41 ARG CA C 41 54.297 54.736 -0.439 1
1 439 . 2 1 1 A 41 41 ARG CB C 41 33.003 31.856 1.147 1
1 442 . 2 1 1 A 41 41 ARG N N 41 126.332 126.897 -0.565 1
1 443 . 2 1 1 A 42 42 CYS H H 42 9.004 9.042 -0.038 1
1 444 . 2 1 1 A 42 42 CYS HA H 42 5.309 5.368 -0.059 1
1 447 . 2 1 1 A 42 42 CYS C C 42 173.417 173.969 -0.552 1
1 448 . 2 1 1 A 42 42 CYS CA C 42 57.508 56.969 0.539 1
1 449 . 2 1 1 A 42 42 CYS CB C 42 28.859 30.357 -1.498 1
1 450 . 2 1 1 A 42 42 CYS N N 42 123.359 126.070 -2.711 1
1 451 . 2 1 1 A 43 43 SER H H 43 9.102 8.972 0.130 1
1 452 . 2 1 1 A 43 43 SER HA H 43 5.324 5.013 0.311 1
1 455 . 2 1 1 A 43 43 SER C C 43 171.429 171.438 -0.009 1
1 456 . 2 1 1 A 43 43 SER CA C 43 55.621 55.730 -0.109 1
1 457 . 2 1 1 A 43 43 SER CB C 43 64.856 65.457 -0.601 1
1 458 . 2 1 1 A 43 43 SER N N 43 125.444 120.610 4.834 1
1 459 . 2 1 1 A 44 44 PRO HA H 44 4.389 4.613 -0.224 1
1 466 . 2 1 1 A 44 44 PRO C C 44 176.559 177.277 -0.718 1
1 467 . 2 1 1 A 44 44 PRO CA C 44 63.027 62.727 0.300 1
1 468 . 2 1 1 A 44 44 PRO CB C 44 31.935 32.430 -0.495 1
1 471 . 2 1 1 A 45 45 ALA H H 45 8.261 8.269 -0.008 1
1 472 . 2 1 1 A 45 45 ALA HA H 45 4.157 4.106 0.051 1
1 476 . 2 1 1 A 45 45 ALA C C 45 177.706 178.079 -0.373 1
1 477 . 2 1 1 A 45 45 ALA CA C 45 53.284 54.704 -1.420 1
1 478 . 2 1 1 A 45 45 ALA CB C 45 18.978 19.316 -0.338 1
1 479 . 2 1 1 A 45 45 ALA N N 45 126.162 124.601 1.561 1
1 480 . 2 1 1 A 46 46 SER H H 46 8.275 7.642 0.633 1
1 481 . 2 1 1 A 46 46 SER HA H 46 4.779 4.603 0.176 1
1 484 . 2 1 1 A 46 46 SER C C 46 172.182 174.333 -2.151 1
1 485 . 2 1 1 A 46 46 SER CA C 46 55.091 56.427 -1.336 1
1 486 . 2 1 1 A 46 46 SER CB C 46 63.130 63.148 -0.018 1
1 487 . 2 1 1 A 46 46 SER N N 46 113.009 111.377 1.632 1
1 488 . 2 1 1 A 47 47 PRO HA H 47 4.336 4.585 -0.249 1
1 493 . 2 1 1 A 47 47 PRO C C 47 177.165 176.442 0.723 1
1 494 . 2 1 1 A 47 47 PRO CA C 47 63.268 63.928 -0.660 1
1 495 . 2 1 1 A 47 47 PRO CB C 47 32.528 31.606 0.922 1
1 498 . 2 1 1 A 48 48 LYS H H 48 9.089 8.037 1.052 1
1 499 . 2 1 1 A 48 48 LYS HA H 48 4.408 4.475 -0.067 1
1 508 . 2 1 1 A 48 48 LYS C C 48 176.917 176.225 0.692 1
1 509 . 2 1 1 A 48 48 LYS CA C 48 55.893 55.970 -0.077 1
1 510 . 2 1 1 A 48 48 LYS CB C 48 32.997 30.609 2.388 1
1 514 . 2 1 1 A 48 48 LYS N N 48 122.579 118.832 3.747 1
1 515 . 2 1 1 A 49 49 GLY HA2 H 49 4.021 4.133 -0.112 1
1 516 . 2 1 1 A 49 49 GLY HA3 H 49 3.881 4.136 -0.255 1
1 517 . 2 1 1 A 49 49 GLY C C 49 174.552 173.416 1.136 1
1 518 . 2 1 1 A 49 49 GLY CA C 49 46.011 45.612 0.399 1
1 519 . 2 1 1 A 50 50 GLU H H 50 8.608 8.791 -0.183 1
1 520 . 2 1 1 A 50 50 GLU HA H 50 4.335 4.486 -0.151 1
1 525 . 2 1 1 A 50 50 GLU C C 50 176.672 176.347 0.325 1
1 526 . 2 1 1 A 50 50 GLU CA C 50 56.978 55.752 1.226 1
1 527 . 2 1 1 A 50 50 GLU CB C 50 29.458 29.140 0.318 1
1 529 . 2 1 1 A 50 50 GLU N N 50 121.378 121.919 -0.541 1
1 530 . 2 1 1 A 51 51 GLU H H 51 8.287 7.686 0.601 1
1 531 . 2 1 1 A 51 51 GLU HA H 51 4.381 4.589 -0.208 1
1 536 . 2 1 1 A 51 51 GLU C C 51 176.218 176.184 0.034 1
1 537 . 2 1 1 A 51 51 GLU CA C 51 56.996 55.680 1.316 1
1 538 . 2 1 1 A 51 51 GLU CB C 51 31.066 30.542 0.524 1
1 540 . 2 1 1 A 51 51 GLU N N 51 120.863 120.592 0.271 1
1 541 . 2 1 1 A 52 52 GLU H H 52 8.445 8.567 -0.122 1
1 542 . 2 1 1 A 52 52 GLU HA H 52 4.464 4.186 0.278 1
1 547 . 2 1 1 A 52 52 GLU C C 52 176.128 176.794 -0.666 1
1 548 . 2 1 1 A 52 52 GLU CA C 52 55.955 57.383 -1.428 1
1 549 . 2 1 1 A 52 52 GLU CB C 52 31.691 30.150 1.541 1
1 551 . 2 1 1 A 52 52 GLU N N 52 121.103 123.775 -2.672 1
1 552 . 2 1 1 A 53 53 GLU H H 53 8.441 8.611 -0.170 1
1 553 . 2 1 1 A 53 53 GLU HA H 53 4.609 4.456 0.153 1
1 558 . 2 1 1 A 53 53 GLU C C 53 175.816 176.120 -0.304 1
1 559 . 2 1 1 A 53 53 GLU CA C 53 56.697 56.909 -0.212 1
1 560 . 2 1 1 A 53 53 GLU CB C 53 31.022 30.447 0.575 1
1 562 . 2 1 1 A 53 53 GLU N N 53 121.949 121.618 0.331 1
1 563 . 2 1 1 A 54 54 ARG H H 54 8.569 8.612 -0.043 1
1 564 . 2 1 1 A 54 54 ARG HA H 54 4.768 4.819 -0.051 1
1 571 . 2 1 1 A 54 54 ARG C C 54 174.881 175.073 -0.192 1
1 572 . 2 1 1 A 54 54 ARG CA C 54 54.950 55.537 -0.587 1
1 573 . 2 1 1 A 54 54 ARG CB C 54 33.374 31.478 1.896 1
1 576 . 2 1 1 A 54 54 ARG N N 54 123.714 123.575 0.139 1
1 577 . 2 1 1 A 55 55 GLU H H 55 8.650 8.902 -0.252 1
1 578 . 2 1 1 A 55 55 GLU HA H 55 5.493 5.166 0.327 1
1 583 . 2 1 1 A 55 55 GLU C C 55 175.566 175.637 -0.071 1
1 584 . 2 1 1 A 55 55 GLU CA C 55 54.915 54.964 -0.049 1
1 585 . 2 1 1 A 55 55 GLU CB C 55 33.250 31.813 1.437 1
1 587 . 2 1 1 A 55 55 GLU N N 55 123.537 125.680 -2.143 1
1 588 . 2 1 1 A 56 56 VAL H H 56 9.419 8.904 0.515 1
1 589 . 2 1 1 A 56 56 VAL HA H 56 4.524 4.966 -0.442 1
1 597 . 2 1 1 A 56 56 VAL C C 56 173.502 174.201 -0.699 1
1 598 . 2 1 1 A 56 56 VAL CA C 56 60.981 58.739 2.242 1
1 599 . 2 1 1 A 56 56 VAL CB C 56 36.117 35.758 0.359 1
1 602 . 2 1 1 A 56 56 VAL N N 56 123.343 118.096 5.247 1
1 603 . 2 1 1 A 57 57 GLN H H 57 8.767 8.810 -0.043 1
1 604 . 2 1 1 A 57 57 GLN HA H 57 5.671 5.331 0.340 1
1 611 . 2 1 1 A 57 57 GLN C C 57 176.357 174.808 1.549 1
1 612 . 2 1 1 A 57 57 GLN CA C 57 54.735 54.121 0.614 1
1 613 . 2 1 1 A 57 57 GLN CB C 57 30.781 31.493 -0.712 1
1 615 . 2 1 1 A 57 57 GLN N N 57 125.639 121.189 4.450 1
1 617 . 2 1 1 A 58 58 VAL H H 58 9.217 9.218 -0.001 1
1 618 . 2 1 1 A 58 58 VAL HA H 58 5.129 4.888 0.241 1
1 626 . 2 1 1 A 58 58 VAL C C 58 175.925 176.775 -0.850 1
1 627 . 2 1 1 A 58 58 VAL CA C 58 59.652 59.803 -0.151 1
1 628 . 2 1 1 A 58 58 VAL CB C 58 36.540 34.989 1.551 1
1 631 . 2 1 1 A 58 58 VAL N N 58 117.022 118.267 -1.245 1
1 632 . 2 1 1 A 59 59 GLY H H 59 9.008 8.810 0.198 1
1 633 . 2 1 1 A 59 59 GLY HA2 H 59 4.670 3.920 0.750 1
1 634 . 2 1 1 A 59 59 GLY HA3 H 59 3.914 4.002 -0.088 1
1 635 . 2 1 1 A 59 59 GLY C C 59 173.386 173.708 -0.322 1
1 636 . 2 1 1 A 59 59 GLY CA C 59 45.093 45.882 -0.789 1
1 637 . 2 1 1 A 59 59 GLY N N 59 109.174 111.026 -1.852 1
1 638 . 2 1 1 A 60 60 ARG H H 60 7.695 7.572 0.123 1
1 639 . 2 1 1 A 60 60 ARG HA H 60 4.866 4.827 0.039 1
1 645 . 2 1 1 A 60 60 ARG C C 60 173.760 175.899 -2.139 1
1 646 . 2 1 1 A 60 60 ARG CA C 60 52.764 52.915 -0.151 1
1 647 . 2 1 1 A 60 60 ARG CB C 60 31.785 31.651 0.134 1
1 650 . 2 1 1 A 60 60 ARG N N 60 118.520 119.139 -0.619 1
1 651 . 2 1 1 A 61 61 PRO HA H 61 3.539 3.843 -0.304 1
1 658 . 2 1 1 A 61 61 PRO C C 61 173.175 173.723 -0.548 1
1 659 . 2 1 1 A 61 61 PRO CA C 61 62.265 62.816 -0.551 1
1 660 . 2 1 1 A 61 61 PRO CB C 61 27.546 30.746 -3.200 1
1 663 . 2 1 1 A 62 62 GLU H H 62 7.879 7.723 0.156 1
1 664 . 2 1 1 A 62 62 GLU HA H 62 4.071 4.596 -0.525 1
1 669 . 2 1 1 A 62 62 GLU C C 62 174.107 174.749 -0.642 1
1 670 . 2 1 1 A 62 62 GLU CA C 62 55.229 54.702 0.527 1
1 671 . 2 1 1 A 62 62 GLU CB C 62 32.838 31.836 1.002 1
1 673 . 2 1 1 A 62 62 GLU N N 62 118.173 114.003 4.170 1
1 674 . 2 1 1 A 63 63 VAL H H 63 8.930 8.568 0.362 1
1 675 . 2 1 1 A 63 63 VAL HA H 63 4.548 5.124 -0.576 1
1 683 . 2 1 1 A 63 63 VAL C C 63 170.325 173.542 -3.217 1
1 684 . 2 1 1 A 63 63 VAL CA C 63 60.770 59.380 1.390 1
1 685 . 2 1 1 A 63 63 VAL CB C 63 35.394 35.062 0.332 1
1 688 . 2 1 1 A 63 63 VAL N N 63 117.161 123.679 -6.518 1
1 689 . 2 1 1 A 64 64 LEU H H 64 8.332 8.981 -0.649 1
1 690 . 2 1 1 A 64 64 LEU HA H 64 5.122 5.327 -0.205 1
1 700 . 2 1 1 A 64 64 LEU C C 64 176.243 174.583 1.660 1
1 701 . 2 1 1 A 64 64 LEU CA C 64 53.346 53.592 -0.246 1
1 702 . 2 1 1 A 64 64 LEU CB C 64 42.649 45.269 -2.620 1
1 706 . 2 1 1 A 64 64 LEU N N 64 130.510 128.815 1.695 1
1 707 . 2 1 1 A 65 65 LEU H H 65 9.261 9.429 -0.168 1
1 708 . 2 1 1 A 65 65 LEU HA H 65 4.443 4.778 -0.335 1
1 718 . 2 1 1 A 65 65 LEU C C 65 174.016 175.955 -1.939 1
1 719 . 2 1 1 A 65 65 LEU CA C 65 53.920 54.023 -0.103 1
1 720 . 2 1 1 A 65 65 LEU CB C 65 42.976 41.830 1.146 1
1 724 . 2 1 1 A 65 65 LEU N N 65 128.611 128.721 -0.110 1
1 725 . 2 1 1 A 66 66 ASP H H 66 8.105 8.688 -0.583 1
1 726 . 2 1 1 A 66 66 ASP HA H 66 5.207 4.804 0.403 1
1 729 . 2 1 1 A 66 66 ASP C C 66 176.161 176.518 -0.357 1
1 730 . 2 1 1 A 66 66 ASP CA C 66 51.001 54.458 -3.457 1
1 731 . 2 1 1 A 66 66 ASP CB C 66 42.836 41.167 1.669 1
1 732 . 2 1 1 A 66 66 ASP N N 66 121.799 125.637 -3.838 1
1 733 . 2 1 1 A 67 67 GLY H H 67 8.688 8.328 0.360 1
1 734 . 2 1 1 A 67 67 GLY HA2 H 67 3.923 3.979 -0.056 1
1 735 . 2 1 1 A 67 67 GLY HA3 H 67 3.808 3.985 -0.177 1
1 736 . 2 1 1 A 67 67 GLY C C 67 175.500 174.084 1.416 1
1 737 . 2 1 1 A 67 67 GLY CA C 67 46.591 46.733 -0.142 1
1 738 . 2 1 1 A 67 67 GLY N N 67 106.518 111.043 -4.525 1
1 739 . 2 1 1 A 68 68 LEU H H 68 8.125 7.565 0.560 1
1 740 . 2 1 1 A 68 68 LEU HA H 68 4.252 4.946 -0.694 1
1 750 . 2 1 1 A 68 68 LEU C C 68 174.914 175.207 -0.293 1
1 751 . 2 1 1 A 68 68 LEU CA C 68 53.469 53.184 0.285 1
1 752 . 2 1 1 A 68 68 LEU CB C 68 40.422 45.778 -5.356 1
1 756 . 2 1 1 A 68 68 LEU N N 68 119.345 119.765 -0.420 1
1 757 . 2 1 1 A 69 69 GLU H H 69 8.207 9.011 -0.804 1
1 758 . 2 1 1 A 69 69 GLU HA H 69 4.908 5.019 -0.111 1
1 763 . 2 1 1 A 69 69 GLU C C 69 174.464 174.222 0.242 1
1 764 . 2 1 1 A 69 69 GLU CA C 69 53.081 53.316 -0.235 1
1 765 . 2 1 1 A 69 69 GLU CB C 69 31.538 32.684 -1.146 1
1 767 . 2 1 1 A 69 69 GLU N N 69 119.486 118.058 1.428 1
1 768 . 2 1 1 A 70 70 PRO HA H 70 4.866 4.316 0.550 1
1 775 . 2 1 1 A 70 70 PRO C C 70 178.285 177.319 0.966 1
1 776 . 2 1 1 A 70 70 PRO CA C 70 63.203 63.526 -0.323 1
1 777 . 2 1 1 A 70 70 PRO CB C 70 33.726 32.307 1.419 1
1 780 . 2 1 1 A 71 71 GLY H H 71 7.362 9.424 -2.062 1
1 781 . 2 1 1 A 71 71 GLY HA2 H 71 3.807 3.881 -0.074 1
1 782 . 2 1 1 A 71 71 GLY HA3 H 71 3.756 3.886 -0.130 1
1 783 . 2 1 1 A 71 71 GLY C C 71 174.664 173.832 0.832 1
1 784 . 2 1 1 A 71 71 GLY CA C 71 46.926 47.107 -0.181 1
1 785 . 2 1 1 A 71 71 GLY N N 71 113.776 111.363 2.413 1
1 786 . 2 1 1 A 72 72 ARG H H 72 8.036 7.637 0.399 1
1 787 . 2 1 1 A 72 72 ARG HA H 72 4.597 4.842 -0.245 1
1 793 . 2 1 1 A 72 72 ARG C C 72 173.293 173.824 -0.531 1
1 794 . 2 1 1 A 72 72 ARG CA C 72 54.633 54.469 0.164 1
1 795 . 2 1 1 A 72 72 ARG CB C 72 33.704 33.395 0.309 1
1 798 . 2 1 1 A 72 72 ARG N N 72 119.611 119.823 -0.212 1
1 799 . 2 1 1 A 73 73 ASP H H 73 7.785 8.893 -1.108 1
1 800 . 2 1 1 A 73 73 ASP HA H 73 5.276 5.380 -0.104 1
1 803 . 2 1 1 A 73 73 ASP C C 73 175.904 174.802 1.102 1
1 804 . 2 1 1 A 73 73 ASP CA C 73 53.568 53.485 0.083 1
1 805 . 2 1 1 A 73 73 ASP CB C 73 42.970 41.656 1.314 1
1 806 . 2 1 1 A 73 73 ASP N N 73 118.900 125.856 -6.956 1
1 807 . 2 1 1 A 74 74 TYR H H 74 9.516 8.676 0.840 1
1 808 . 2 1 1 A 74 74 TYR HA H 74 4.800 5.092 -0.292 1
1 815 . 2 1 1 A 74 74 TYR C C 74 174.631 175.238 -0.607 1
1 816 . 2 1 1 A 74 74 TYR CA C 74 58.548 57.005 1.543 1
1 817 . 2 1 1 A 74 74 TYR CB C 74 42.029 41.169 0.860 1
1 822 . 2 1 1 A 74 74 TYR N N 74 121.903 123.792 -1.889 1
1 823 . 2 1 1 A 75 75 GLU H H 75 9.248 9.244 0.004 1
1 824 . 2 1 1 A 75 75 GLU HA H 75 4.756 5.050 -0.294 1
1 829 . 2 1 1 A 75 75 GLU C C 75 175.524 175.592 -0.068 1
1 830 . 2 1 1 A 75 75 GLU CA C 75 55.621 55.731 -0.110 1
1 831 . 2 1 1 A 75 75 GLU CB C 75 30.778 31.598 -0.820 1
1 833 . 2 1 1 A 75 75 GLU N N 75 122.425 121.684 0.741 1
1 834 . 2 1 1 A 76 76 VAL H H 76 8.884 8.759 0.125 1
1 835 . 2 1 1 A 76 76 VAL HA H 76 5.246 5.042 0.204 1
1 843 . 2 1 1 A 76 76 VAL C C 76 174.800 174.745 0.055 1
1 844 . 2 1 1 A 76 76 VAL CA C 76 60.199 61.420 -1.221 1
1 845 . 2 1 1 A 76 76 VAL CB C 76 33.449 33.388 0.061 1
1 848 . 2 1 1 A 76 76 VAL N N 76 126.853 126.310 0.543 1
1 849 . 2 1 1 A 77 77 SER H H 77 9.234 9.127 0.107 1
1 850 . 2 1 1 A 77 77 SER HA H 77 5.398 5.040 0.358 1
1 853 . 2 1 1 A 77 77 SER C C 77 173.138 173.650 -0.512 1
1 854 . 2 1 1 A 77 77 SER CA C 77 56.032 57.711 -1.679 1
1 855 . 2 1 1 A 77 77 SER CB C 77 66.374 64.303 2.071 1
1 856 . 2 1 1 A 77 77 SER N N 77 120.852 125.940 -5.088 1
1 857 . 2 1 1 A 78 78 VAL H H 78 9.092 8.579 0.513 1
1 858 . 2 1 1 A 78 78 VAL HA H 78 4.756 4.542 0.214 1
1 866 . 2 1 1 A 78 78 VAL C C 78 173.641 174.288 -0.647 1
1 867 . 2 1 1 A 78 78 VAL CA C 78 61.246 61.067 0.179 1
1 868 . 2 1 1 A 78 78 VAL CB C 78 34.467 32.391 2.076 1
1 871 . 2 1 1 A 78 78 VAL N N 78 122.453 127.387 -4.934 1
1 872 . 2 1 1 A 79 79 GLN H H 79 8.587 8.972 -0.385 1
1 873 . 2 1 1 A 79 79 GLN HA H 79 4.438 4.931 -0.493 1
1 880 . 2 1 1 A 79 79 GLN C C 79 174.999 174.354 0.645 1
1 881 . 2 1 1 A 79 79 GLN CA C 79 54.227 54.089 0.138 1
1 882 . 2 1 1 A 79 79 GLN CB C 79 33.587 32.613 0.974 1
1 884 . 2 1 1 A 79 79 GLN N N 79 125.619 127.582 -1.963 1
1 886 . 2 1 1 A 80 80 SER H H 80 8.623 9.023 -0.400 1
1 887 . 2 1 1 A 80 80 SER HA H 80 4.756 4.514 0.242 1
1 890 . 2 1 1 A 80 80 SER C C 80 172.264 173.992 -1.728 1
1 891 . 2 1 1 A 80 80 SER CA C 80 58.177 59.057 -0.880 1
1 892 . 2 1 1 A 80 80 SER CB C 80 63.920 63.097 0.823 1
1 893 . 2 1 1 A 80 80 SER N N 80 122.844 124.503 -1.659 1
1 894 . 2 1 1 A 81 81 LEU H H 81 8.348 8.985 -0.637 1
1 895 . 2 1 1 A 81 81 LEU HA H 81 5.124 4.423 0.701 1
1 905 . 2 1 1 A 81 81 LEU C C 81 175.775 177.563 -1.788 1
1 906 . 2 1 1 A 81 81 LEU CA C 81 54.033 54.042 -0.009 1
1 907 . 2 1 1 A 81 81 LEU CB C 81 44.690 42.905 1.785 1
1 911 . 2 1 1 A 81 81 LEU N N 81 123.191 127.772 -4.581 1
1 912 . 2 1 1 A 82 82 ARG H H 82 8.374 8.216 0.158 1
1 913 . 2 1 1 A 82 82 ARG HA H 82 4.616 4.437 0.179 1
1 919 . 2 1 1 A 82 82 ARG C C 82 176.864 176.156 0.708 1
1 920 . 2 1 1 A 82 82 ARG CA C 82 55.868 54.779 1.089 1
1 921 . 2 1 1 A 82 82 ARG CB C 82 32.322 30.909 1.413 1
1 924 . 2 1 1 A 82 82 ARG N N 82 121.029 117.713 3.316 1
1 925 . 2 1 1 A 83 83 GLY H H 83 8.309 7.432 0.877 1
1 926 . 2 1 1 A 83 83 GLY HA2 H 83 4.031 3.952 0.079 1
1 927 . 2 1 1 A 83 83 GLY HA3 H 83 3.888 3.992 -0.104 1
1 928 . 2 1 1 A 83 83 GLY C C 83 174.562 174.708 -0.146 1
1 929 . 2 1 1 A 83 83 GLY CA C 83 45.963 45.463 0.500 1
1 930 . 2 1 1 A 83 83 GLY N N 83 109.937 109.262 0.675 1
1 931 . 2 1 1 A 84 84 PRO HA H 84 4.573 4.382 0.191 1
1 938 . 2 1 1 A 84 84 PRO C C 84 176.533 176.099 0.434 1
1 939 . 2 1 1 A 84 84 PRO CA C 84 63.485 64.810 -1.325 1
1 940 . 2 1 1 A 84 84 PRO CB C 84 32.409 32.024 0.385 1
1 943 . 2 1 1 A 85 85 GLU H H 85 7.799 7.573 0.226 1
1 944 . 2 1 1 A 85 85 GLU HA H 85 4.369 4.799 -0.430 1
1 949 . 2 1 1 A 85 85 GLU C C 85 174.722 175.942 -1.220 1
1 950 . 2 1 1 A 85 85 GLU CA C 85 55.899 54.866 1.033 1
1 951 . 2 1 1 A 85 85 GLU CB C 85 31.911 33.037 -1.126 1
1 953 . 2 1 1 A 85 85 GLU N N 85 122.093 112.251 9.842 1
1 954 . 2 1 1 A 86 86 GLY H H 86 8.329 8.695 -0.366 1
1 955 . 2 1 1 A 86 86 GLY HA2 H 86 5.298 4.155 1.143 1
1 956 . 2 1 1 A 86 86 GLY HA3 H 86 3.559 4.185 -0.626 1
1 957 . 2 1 1 A 86 86 GLY C C 86 174.355 173.146 1.209 1
1 958 . 2 1 1 A 86 86 GLY CA C 86 44.034 43.933 0.101 1
1 959 . 2 1 1 A 86 86 GLY N N 86 109.387 109.195 0.192 1
1 960 . 2 1 1 A 87 87 SER H H 87 8.807 8.464 0.343 1
1 961 . 2 1 1 A 87 87 SER HA H 87 4.670 4.618 0.052 1
1 964 . 2 1 1 A 87 87 SER C C 87 175.195 174.588 0.607 1
1 965 . 2 1 1 A 87 87 SER CA C 87 57.737 57.674 0.063 1
1 966 . 2 1 1 A 87 87 SER CB C 87 67.829 65.862 1.967 1
1 967 . 2 1 1 A 87 87 SER N N 87 117.698 113.094 4.604 1
1 968 . 2 1 1 A 88 88 GLU H H 88 8.754 8.605 0.149 1
1 969 . 2 1 1 A 88 88 GLU HA H 88 4.357 4.295 0.062 1
1 974 . 2 1 1 A 88 88 GLU C C 88 177.474 176.768 0.706 1
1 975 . 2 1 1 A 88 88 GLU CA C 88 57.525 56.984 0.541 1
1 976 . 2 1 1 A 88 88 GLU CB C 88 31.162 30.584 0.578 1
1 978 . 2 1 1 A 88 88 GLU N N 88 118.709 120.511 -1.802 1
1 979 . 2 1 1 A 89 89 ALA H H 89 8.855 8.383 0.472 1
1 980 . 2 1 1 A 89 89 ALA HA H 89 4.792 4.604 0.188 1
1 984 . 2 1 1 A 89 89 ALA C C 89 178.379 176.679 1.700 1
1 985 . 2 1 1 A 89 89 ALA CA C 89 51.264 51.757 -0.493 1
1 986 . 2 1 1 A 89 89 ALA CB C 89 20.040 19.731 0.309 1
1 987 . 2 1 1 A 89 89 ALA N N 89 127.301 124.444 2.857 1
1 988 . 2 1 1 A 90 90 ARG H H 90 8.549 8.440 0.109 1
1 989 . 2 1 1 A 90 90 ARG HA H 90 4.658 4.919 -0.261 1
1 996 . 2 1 1 A 90 90 ARG C C 90 174.720 175.467 -0.747 1
1 997 . 2 1 1 A 90 90 ARG CA C 90 53.575 54.472 -0.897 1
1 998 . 2 1 1 A 90 90 ARG CB C 90 33.456 31.663 1.793 1
1 1001 . 2 1 1 A 90 90 ARG N N 90 121.289 123.541 -2.252 1
1 1002 . 2 1 1 A 91 91 GLY H H 91 8.396 8.999 -0.603 1
1 1003 . 2 1 1 A 91 91 GLY HA2 H 91 5.306 4.121 1.185 1
1 1004 . 2 1 1 A 91 91 GLY HA3 H 91 3.700 4.160 -0.460 1
1 1005 . 2 1 1 A 91 91 GLY C C 91 173.191 172.102 1.089 1
1 1006 . 2 1 1 A 91 91 GLY CA C 91 44.493 43.833 0.660 1
1 1007 . 2 1 1 A 91 91 GLY N N 91 108.579 111.599 -3.020 1
1 1008 . 2 1 1 A 92 92 ILE H H 92 8.891 8.428 0.463 1
1 1009 . 2 1 1 A 92 92 ILE HA H 92 4.499 4.947 -0.448 1
1 1019 . 2 1 1 A 92 92 ILE C C 92 171.877 173.968 -2.091 1
1 1020 . 2 1 1 A 92 92 ILE CA C 92 60.682 59.248 1.434 1
1 1021 . 2 1 1 A 92 92 ILE CB C 92 42.425 42.049 0.376 1
1 1025 . 2 1 1 A 92 92 ILE N N 92 118.313 121.359 -3.046 1
1 1026 . 2 1 1 A 93 93 ARG H H 93 7.980 8.528 -0.548 1
1 1027 . 2 1 1 A 93 93 ARG HA H 93 5.224 4.912 0.312 1
1 1034 . 2 1 1 A 93 93 ARG C C 93 175.072 175.726 -0.654 1
1 1035 . 2 1 1 A 93 93 ARG CA C 93 54.499 56.051 -1.552 1
1 1036 . 2 1 1 A 93 93 ARG CB C 93 31.767 30.858 0.909 1
1 1039 . 2 1 1 A 93 93 ARG N N 93 124.879 129.415 -4.536 1
1 1040 . 2 1 1 A 94 94 ALA H H 94 9.064 8.503 0.561 1
1 1041 . 2 1 1 A 94 94 ALA HA H 94 4.731 4.540 0.191 1
1 1045 . 2 1 1 A 94 94 ALA C C 94 174.494 177.355 -2.861 1
1 1046 . 2 1 1 A 94 94 ALA CA C 94 50.577 52.720 -2.143 1
1 1047 . 2 1 1 A 94 94 ALA CB C 94 23.082 19.810 3.272 1
1 1048 . 2 1 1 A 94 94 ALA N N 94 126.095 129.720 -3.625 1
1 1049 . 2 1 1 A 95 95 ARG H H 95 8.263 8.999 -0.736 1
1 1050 . 2 1 1 A 95 95 ARG HA H 95 5.548 5.273 0.275 1
1 1058 . 2 1 1 A 95 95 ARG C C 95 176.901 174.485 2.416 1
1 1059 . 2 1 1 A 95 95 ARG CA C 95 53.787 54.352 -0.565 1
1 1060 . 2 1 1 A 95 95 ARG CB C 95 32.426 34.391 -1.965 1
1 1063 . 2 1 1 A 95 95 ARG N N 95 123.374 117.775 5.599 1
1 1065 . 2 1 1 A 96 96 THR H H 96 9.208 8.819 0.389 1
1 1066 . 2 1 1 A 96 96 THR HA H 96 4.461 5.055 -0.594 1
1 1071 . 2 1 1 A 96 96 THR CA C 96 58.248 58.433 -0.185 1
1 1072 . 2 1 1 A 96 96 THR CB C 96 68.466 71.118 -2.652 1
1 1074 . 2 1 1 A 96 96 THR N N 96 119.492 112.080 7.412 1
1 1075 . 2 1 1 A 97 97 PRO HA H 97 4.636 4.610 0.026 1
1 1082 . 2 1 1 A 97 97 PRO C C 97 175.725 175.589 0.136 1
1 1083 . 2 1 1 A 97 97 PRO CA C 97 61.907 62.340 -0.433 1
1 1084 . 2 1 1 A 97 97 PRO CB C 97 32.590 33.441 -0.851 1
1 1087 . 2 1 1 A 98 98 THR H H 98 7.943 8.308 -0.365 1
1 1088 . 2 1 1 A 98 98 THR HA H 98 4.208 5.102 -0.894 1
1 1093 . 2 1 1 A 98 98 THR C C 98 175.058 173.055 2.003 1
1 1094 . 2 1 1 A 98 98 THR CA C 98 62.069 60.206 1.863 1
1 1095 . 2 1 1 A 98 98 THR CB C 98 69.719 70.141 -0.422 1
1 1097 . 2 1 1 A 98 98 THR N N 98 107.148 110.269 -3.121 1
1 1098 . 2 1 1 A 99 99 SER H H 99 8.163 9.005 -0.842 1
1 1099 . 2 1 1 A 99 99 SER HA H 99 4.524 4.509 0.015 1
1 1102 . 2 1 1 A 99 99 SER C C 99 174.319 174.020 0.299 1
1 1103 . 2 1 1 A 99 99 SER CA C 99 58.107 59.322 -1.215 1
1 1104 . 2 1 1 A 99 99 SER CB C 99 64.492 63.754 0.738 1
1 1105 . 2 1 1 A 99 99 SER N N 99 115.114 123.647 -8.533 1
1 1106 . 2 1 1 A 100 100 GLY H H 100 8.336 8.503 -0.167 1
1 1107 . 2 1 1 A 100 100 GLY HA2 H 100 4.222 4.177 0.045 1
1 1108 . 2 1 1 A 100 100 GLY HA3 H 100 4.222 4.178 0.044 1
1 1109 . 2 1 1 A 100 100 GLY C C 100 171.696 172.565 -0.869 1
1 1110 . 2 1 1 A 100 100 GLY CA C 100 44.617 44.392 0.225 1
1 1111 . 2 1 1 A 100 100 GLY N N 100 110.678 112.560 -1.882 1
1 1112 . 2 1 1 A 101 101 PRO HA H 101 4.506 4.741 -0.235 1
1 1118 . 2 1 1 A 101 101 PRO CA C 101 63.358 62.715 0.643 1
1 1119 . 2 1 1 A 101 101 PRO CB C 101 32.313 32.149 0.164 1
1 1 . 3 1 1 A 6 6 SER HA H 6 4.528 4.743 -0.215 1
1 3 . 3 1 1 A 6 6 SER CA C 6 58.373 57.510 0.863 1
1 4 . 3 1 1 A 6 6 SER CB C 6 63.978 64.116 -0.138 1
1 5 . 3 1 1 A 7 7 GLY H H 7 8.228 8.100 0.128 1
1 6 . 3 1 1 A 7 7 GLY HA2 H 7 4.134 4.134 0.000 1
1 7 . 3 1 1 A 7 7 GLY HA3 H 7 4.134 4.135 -0.001 1
1 8 . 3 1 1 A 7 7 GLY CA C 7 44.607 44.806 -0.199 1
1 9 . 3 1 1 A 7 7 GLY N N 7 110.638 115.909 -5.271 1
1 10 . 3 1 1 A 8 8 PRO HA H 8 4.419 4.676 -0.257 1
1 17 . 3 1 1 A 8 8 PRO C C 8 176.908 175.400 1.508 1
1 18 . 3 1 1 A 8 8 PRO CA C 8 62.851 62.822 0.029 1
1 19 . 3 1 1 A 8 8 PRO CB C 8 32.243 32.333 -0.090 1
1 22 . 3 1 1 A 9 9 LEU H H 9 8.462 8.466 -0.004 1
1 23 . 3 1 1 A 9 9 LEU HA H 9 4.494 4.941 -0.447 1
1 33 . 3 1 1 A 9 9 LEU C C 9 174.124 174.516 -0.392 1
1 34 . 3 1 1 A 9 9 LEU CA C 9 52.587 51.692 0.895 1
1 35 . 3 1 1 A 9 9 LEU CB C 9 43.150 43.578 -0.428 1
1 39 . 3 1 1 A 9 9 LEU N N 9 126.015 123.225 2.790 1
1 40 . 3 1 1 A 10 10 PRO HA H 10 4.820 4.579 0.241 1
1 47 . 3 1 1 A 10 10 PRO CA C 10 61.368 62.082 -0.714 1
1 48 . 3 1 1 A 10 10 PRO CB C 10 31.391 31.925 -0.534 1
1 51 . 3 1 1 A 11 11 PRO HA H 11 4.949 4.531 0.418 1
1 58 . 3 1 1 A 11 11 PRO CA C 11 61.183 61.787 -0.604 1
1 59 . 3 1 1 A 11 11 PRO CB C 11 30.656 31.885 -1.229 1
1 62 . 3 1 1 A 12 12 PRO HA H 12 4.341 4.617 -0.276 1
1 69 . 3 1 1 A 12 12 PRO C C 12 174.849 176.623 -1.774 1
1 70 . 3 1 1 A 12 12 PRO CA C 12 63.062 62.535 0.527 1
1 71 . 3 1 1 A 12 12 PRO CB C 12 31.831 31.721 0.110 1
1 74 . 3 1 1 A 13 13 ARG H H 13 7.828 8.261 -0.433 1
1 75 . 3 1 1 A 13 13 ARG HA H 13 4.536 4.482 0.054 1
1 82 . 3 1 1 A 13 13 ARG C C 13 174.608 176.582 -1.974 1
1 83 . 3 1 1 A 13 13 ARG CA C 13 54.774 56.334 -1.560 1
1 84 . 3 1 1 A 13 13 ARG CB C 13 33.250 31.992 1.258 1
1 87 . 3 1 1 A 13 13 ARG N N 13 120.532 117.079 3.453 1
1 88 . 3 1 1 A 14 14 ALA H H 14 8.694 7.814 0.880 1
1 89 . 3 1 1 A 14 14 ALA HA H 14 3.986 4.356 -0.370 1
1 93 . 3 1 1 A 14 14 ALA C C 14 177.232 176.699 0.533 1
1 94 . 3 1 1 A 14 14 ALA CA C 14 52.461 52.369 0.092 1
1 95 . 3 1 1 A 14 14 ALA CB C 14 16.806 17.403 -0.597 1
1 96 . 3 1 1 A 14 14 ALA N N 14 121.921 120.944 0.977 1
1 97 . 3 1 1 A 15 15 LEU H H 15 8.097 7.913 0.184 1
1 98 . 3 1 1 A 15 15 LEU HA H 15 4.670 4.724 -0.054 1
1 108 . 3 1 1 A 15 15 LEU C C 15 177.364 175.581 1.783 1
1 109 . 3 1 1 A 15 15 LEU CA C 15 57.543 54.335 3.208 1
1 110 . 3 1 1 A 15 15 LEU CB C 15 41.877 40.731 1.146 1
1 114 . 3 1 1 A 15 15 LEU N N 15 122.215 120.786 1.429 1
1 115 . 3 1 1 A 16 16 THR H H 16 9.520 8.652 0.868 1
1 116 . 3 1 1 A 16 16 THR HA H 16 4.369 4.942 -0.573 1
1 121 . 3 1 1 A 16 16 THR C C 16 172.453 173.333 -0.880 1
1 122 . 3 1 1 A 16 16 THR CA C 16 62.480 61.412 1.068 1
1 123 . 3 1 1 A 16 16 THR CB C 16 72.198 71.877 0.321 1
1 125 . 3 1 1 A 16 16 THR N N 16 122.214 119.888 2.326 1
1 126 . 3 1 1 A 17 17 LEU H H 17 8.847 8.577 0.270 1
1 127 . 3 1 1 A 17 17 LEU HA H 17 4.573 4.348 0.225 1
1 137 . 3 1 1 A 17 17 LEU C C 17 174.695 176.761 -2.066 1
1 138 . 3 1 1 A 17 17 LEU CA C 17 53.840 55.226 -1.386 1
1 139 . 3 1 1 A 17 17 LEU CB C 17 40.290 42.458 -2.168 1
1 143 . 3 1 1 A 17 17 LEU N N 17 127.415 127.818 -0.403 1
1 144 . 3 1 1 A 18 18 ALA H H 18 8.647 8.646 0.001 1
1 145 . 3 1 1 A 18 18 ALA HA H 18 4.106 4.018 0.088 1
1 149 . 3 1 1 A 18 18 ALA C C 18 178.236 177.544 0.692 1
1 150 . 3 1 1 A 18 18 ALA CA C 18 53.926 54.397 -0.471 1
1 151 . 3 1 1 A 18 18 ALA CB C 18 18.876 18.994 -0.118 1
1 152 . 3 1 1 A 18 18 ALA N N 18 133.362 130.582 2.780 1
1 153 . 3 1 1 A 19 19 ALA H H 19 7.772 7.106 0.666 1
1 154 . 3 1 1 A 19 19 ALA HA H 19 4.561 4.694 -0.133 1
1 158 . 3 1 1 A 19 19 ALA C C 19 176.032 174.950 1.082 1
1 159 . 3 1 1 A 19 19 ALA CA C 19 53.011 51.666 1.345 1
1 160 . 3 1 1 A 19 19 ALA CB C 19 21.869 22.135 -0.266 1
1 161 . 3 1 1 A 19 19 ALA N N 19 115.654 116.675 -1.021 1
1 162 . 3 1 1 A 20 20 VAL H H 20 8.697 8.856 -0.159 1
1 163 . 3 1 1 A 20 20 VAL HA H 20 4.951 4.645 0.306 1
1 171 . 3 1 1 A 20 20 VAL C C 20 174.314 174.301 0.013 1
1 172 . 3 1 1 A 20 20 VAL CA C 20 61.352 61.050 0.302 1
1 173 . 3 1 1 A 20 20 VAL CB C 20 35.394 32.886 2.508 1
1 176 . 3 1 1 A 20 20 VAL N N 20 120.848 124.547 -3.699 1
1 177 . 3 1 1 A 21 21 THR H H 21 9.198 8.425 0.773 1
1 178 . 3 1 1 A 21 21 THR HA H 21 4.941 4.785 0.156 1
1 183 . 3 1 1 A 21 21 THR C C 21 174.416 174.615 -0.199 1
1 184 . 3 1 1 A 21 21 THR CA C 21 60.347 59.016 1.331 1
1 185 . 3 1 1 A 21 21 THR CB C 21 68.713 71.876 -3.163 1
1 187 . 3 1 1 A 21 21 THR N N 21 120.326 125.441 -5.115 1
1 188 . 3 1 1 A 22 22 PRO HA H 22 4.634 4.545 0.089 1
1 194 . 3 1 1 A 22 22 PRO C C 22 173.606 177.131 -3.525 1
1 195 . 3 1 1 A 22 22 PRO CA C 22 66.519 64.358 2.161 1
1 196 . 3 1 1 A 22 22 PRO CB C 22 32.078 31.682 0.396 1
1 199 . 3 1 1 A 23 23 ARG H H 23 6.621 8.265 -1.644 1
1 200 . 3 1 1 A 23 23 ARG HA H 23 4.591 4.464 0.127 1
1 207 . 3 1 1 A 23 23 ARG C C 23 176.554 175.904 0.650 1
1 208 . 3 1 1 A 23 23 ARG CA C 23 53.892 56.606 -2.714 1
1 209 . 3 1 1 A 23 23 ARG CB C 23 33.498 32.948 0.550 1
1 212 . 3 1 1 A 23 23 ARG N N 23 102.938 117.195 -14.257 1
1 213 . 3 1 1 A 24 24 THR H H 24 7.352 8.102 -0.750 1
1 214 . 3 1 1 A 24 24 THR HA H 24 5.593 5.132 0.461 1
1 219 . 3 1 1 A 24 24 THR C C 24 172.345 172.407 -0.062 1
1 220 . 3 1 1 A 24 24 THR CA C 24 59.311 60.403 -1.092 1
1 221 . 3 1 1 A 24 24 THR CB C 24 73.311 72.056 1.255 1
1 223 . 3 1 1 A 24 24 THR N N 24 108.792 110.009 -1.217 1
1 224 . 3 1 1 A 25 25 VAL H H 25 8.437 8.530 -0.093 1
1 225 . 3 1 1 A 25 25 VAL HA H 25 4.512 4.930 -0.418 1
1 233 . 3 1 1 A 25 25 VAL C C 25 172.854 174.089 -1.235 1
1 234 . 3 1 1 A 25 25 VAL CA C 25 61.617 61.013 0.604 1
1 235 . 3 1 1 A 25 25 VAL CB C 25 36.742 34.019 2.723 1
1 238 . 3 1 1 A 25 25 VAL N N 25 117.023 121.104 -4.081 1
1 239 . 3 1 1 A 26 26 HIS H H 26 8.915 8.731 0.184 1
1 240 . 3 1 1 A 26 26 HIS HA H 26 5.765 5.455 0.310 1
1 245 . 3 1 1 A 26 26 HIS C C 26 173.976 173.282 0.694 1
1 246 . 3 1 1 A 26 26 HIS CA C 26 52.896 53.737 -0.841 1
1 247 . 3 1 1 A 26 26 HIS CB C 26 34.004 33.039 0.965 1
1 250 . 3 1 1 A 26 26 HIS N N 26 128.155 127.655 0.500 1
1 251 . 3 1 1 A 27 27 LEU H H 27 9.034 9.107 -0.073 1
1 252 . 3 1 1 A 27 27 LEU HA H 27 5.505 5.064 0.441 1
1 262 . 3 1 1 A 27 27 LEU C C 27 174.821 174.881 -0.060 1
1 263 . 3 1 1 A 27 27 LEU CA C 27 53.376 53.339 0.037 1
1 264 . 3 1 1 A 27 27 LEU CB C 27 46.306 46.782 -0.476 1
1 268 . 3 1 1 A 27 27 LEU N N 27 128.569 129.834 -1.265 1
1 269 . 3 1 1 A 28 28 THR H H 28 8.844 8.322 0.522 1
1 270 . 3 1 1 A 28 28 THR HA H 28 4.485 4.942 -0.457 1
1 275 . 3 1 1 A 28 28 THR C C 28 172.773 173.582 -0.809 1
1 276 . 3 1 1 A 28 28 THR CA C 28 60.052 59.685 0.367 1
1 277 . 3 1 1 A 28 28 THR CB C 28 71.704 71.323 0.381 1
1 279 . 3 1 1 A 28 28 THR N N 28 112.165 114.054 -1.889 1
1 280 . 3 1 1 A 29 29 TRP H H 29 7.395 8.041 -0.646 1
1 281 . 3 1 1 A 29 29 TRP HA H 29 4.915 5.656 -0.741 1
1 290 . 3 1 1 A 29 29 TRP C C 29 174.013 173.336 0.677 1
1 291 . 3 1 1 A 29 29 TRP CA C 29 56.626 54.901 1.725 1
1 292 . 3 1 1 A 29 29 TRP CB C 29 29.487 31.543 -2.056 1
1 298 . 3 1 1 A 29 29 TRP N N 29 115.623 119.809 -4.186 1
1 300 . 3 1 1 A 30 30 GLN H H 30 8.759 8.455 0.304 1
1 301 . 3 1 1 A 30 30 GLN HA H 30 4.641 4.847 -0.206 1
1 308 . 3 1 1 A 30 30 GLN C C 30 175.072 174.002 1.070 1
1 309 . 3 1 1 A 30 30 GLN CA C 30 52.975 53.175 -0.200 1
1 310 . 3 1 1 A 30 30 GLN CB C 30 28.398 28.818 -0.420 1
1 312 . 3 1 1 A 30 30 GLN N N 30 117.497 120.083 -2.586 1
1 314 . 3 1 1 A 31 31 PRO HA H 31 4.487 4.468 0.019 1
1 320 . 3 1 1 A 31 31 PRO C C 31 177.034 175.998 1.036 1
1 321 . 3 1 1 A 31 31 PRO CA C 31 62.710 62.821 -0.111 1
1 322 . 3 1 1 A 31 31 PRO CB C 31 32.738 32.310 0.428 1
1 325 . 3 1 1 A 32 32 SER H H 32 8.259 8.691 -0.432 1
1 326 . 3 1 1 A 32 32 SER HA H 32 4.670 4.792 -0.122 1
1 329 . 3 1 1 A 32 32 SER C C 32 174.689 173.953 0.736 1
1 330 . 3 1 1 A 32 32 SER CA C 32 57.296 57.585 -0.289 1
1 331 . 3 1 1 A 32 32 SER CB C 32 64.748 64.409 0.339 1
1 332 . 3 1 1 A 32 32 SER N N 32 117.667 117.184 0.483 1
1 333 . 3 1 1 A 33 33 ALA H H 33 9.038 8.634 0.404 1
1 334 . 3 1 1 A 33 33 ALA HA H 33 4.126 3.990 0.136 1
1 338 . 3 1 1 A 33 33 ALA C C 33 177.795 178.299 -0.504 1
1 339 . 3 1 1 A 33 33 ALA CA C 33 54.213 53.974 0.239 1
1 340 . 3 1 1 A 33 33 ALA CB C 33 17.948 18.284 -0.336 1
1 341 . 3 1 1 A 33 33 ALA N N 33 131.772 128.734 3.038 1
1 342 . 3 1 1 A 34 34 GLY H H 34 8.576 8.956 -0.380 1
1 343 . 3 1 1 A 34 34 GLY HA2 H 34 4.171 4.006 0.165 1
1 344 . 3 1 1 A 34 34 GLY HA3 H 34 3.592 4.008 -0.416 1
1 345 . 3 1 1 A 34 34 GLY C C 34 174.182 174.380 -0.198 1
1 346 . 3 1 1 A 34 34 GLY CA C 34 44.987 45.033 -0.046 1
1 347 . 3 1 1 A 34 34 GLY N N 34 111.339 110.953 0.386 1
1 348 . 3 1 1 A 35 35 ALA H H 35 7.637 7.847 -0.210 1
1 349 . 3 1 1 A 35 35 ALA HA H 35 4.210 4.228 -0.018 1
1 353 . 3 1 1 A 35 35 ALA C C 35 178.918 178.229 0.689 1
1 354 . 3 1 1 A 35 35 ALA CA C 35 52.671 52.527 0.144 1
1 355 . 3 1 1 A 35 35 ALA CB C 35 18.988 19.355 -0.367 1
1 356 . 3 1 1 A 35 35 ALA N N 35 121.531 123.426 -1.895 1
1 357 . 3 1 1 A 36 36 THR H H 36 9.428 8.582 0.846 1
1 358 . 3 1 1 A 36 36 THR HA H 36 4.402 4.336 0.066 1
1 363 . 3 1 1 A 36 36 THR C C 36 174.739 174.181 0.558 1
1 364 . 3 1 1 A 36 36 THR CA C 36 62.692 63.379 -0.687 1
1 365 . 3 1 1 A 36 36 THR CB C 36 69.482 69.777 -0.295 1
1 367 . 3 1 1 A 36 36 THR N N 36 113.103 118.274 -5.171 1
1 368 . 3 1 1 A 37 37 HIS H H 37 7.857 6.852 1.005 1
1 369 . 3 1 1 A 37 37 HIS HA H 37 4.878 4.266 0.612 1
1 374 . 3 1 1 A 37 37 HIS C C 37 171.103 171.805 -0.702 1
1 375 . 3 1 1 A 37 37 HIS CA C 37 55.867 54.423 1.444 1
1 376 . 3 1 1 A 37 37 HIS CB C 37 32.655 31.147 1.508 1
1 379 . 3 1 1 A 37 37 HIS N N 37 118.486 116.483 2.003 1
1 380 . 3 1 1 A 38 38 TYR H H 38 9.217 8.223 0.994 1
1 381 . 3 1 1 A 38 38 TYR HA H 38 5.303 5.163 0.140 1
1 388 . 3 1 1 A 38 38 TYR C C 38 173.922 174.472 -0.550 1
1 389 . 3 1 1 A 38 38 TYR CA C 38 56.504 56.304 0.200 1
1 390 . 3 1 1 A 38 38 TYR CB C 38 41.823 42.975 -1.152 1
1 395 . 3 1 1 A 38 38 TYR N N 38 114.077 117.637 -3.560 1
1 396 . 3 1 1 A 39 39 LEU H H 39 9.052 9.165 -0.113 1
1 397 . 3 1 1 A 39 39 LEU HA H 39 5.061 5.033 0.028 1
1 407 . 3 1 1 A 39 39 LEU C C 39 175.455 174.417 1.038 1
1 408 . 3 1 1 A 39 39 LEU CA C 39 53.855 53.982 -0.127 1
1 409 . 3 1 1 A 39 39 LEU CB C 39 45.254 44.948 0.306 1
1 413 . 3 1 1 A 39 39 LEU N N 39 123.997 124.718 -0.721 1
1 414 . 3 1 1 A 40 40 VAL H H 40 9.520 9.480 0.040 1
1 415 . 3 1 1 A 40 40 VAL HA H 40 4.988 4.673 0.315 1
1 423 . 3 1 1 A 40 40 VAL C C 40 174.578 174.851 -0.273 1
1 424 . 3 1 1 A 40 40 VAL CA C 40 60.575 61.419 -0.844 1
1 425 . 3 1 1 A 40 40 VAL CB C 40 33.284 33.527 -0.243 1
1 428 . 3 1 1 A 40 40 VAL N N 40 129.678 127.278 2.400 1
1 429 . 3 1 1 A 41 41 ARG H H 41 9.096 8.951 0.145 1
1 430 . 3 1 1 A 41 41 ARG HA H 41 5.384 5.210 0.174 1
1 437 . 3 1 1 A 41 41 ARG C C 41 175.100 174.401 0.699 1
1 438 . 3 1 1 A 41 41 ARG CA C 41 54.297 54.944 -0.647 1
1 439 . 3 1 1 A 41 41 ARG CB C 41 33.003 31.550 1.453 1
1 442 . 3 1 1 A 41 41 ARG N N 41 126.332 127.278 -0.946 1
1 443 . 3 1 1 A 42 42 CYS H H 42 9.004 9.012 -0.008 1
1 444 . 3 1 1 A 42 42 CYS HA H 42 5.309 5.169 0.140 1
1 447 . 3 1 1 A 42 42 CYS C C 42 173.417 173.857 -0.440 1
1 448 . 3 1 1 A 42 42 CYS CA C 42 57.508 57.102 0.406 1
1 449 . 3 1 1 A 42 42 CYS CB C 42 28.859 29.543 -0.684 1
1 450 . 3 1 1 A 42 42 CYS N N 42 123.359 125.551 -2.192 1
1 451 . 3 1 1 A 43 43 SER H H 43 9.102 8.259 0.843 1
1 452 . 3 1 1 A 43 43 SER HA H 43 5.324 5.000 0.324 1
1 455 . 3 1 1 A 43 43 SER C C 43 171.429 171.581 -0.152 1
1 456 . 3 1 1 A 43 43 SER CA C 43 55.621 55.892 -0.271 1
1 457 . 3 1 1 A 43 43 SER CB C 43 64.856 66.003 -1.147 1
1 458 . 3 1 1 A 43 43 SER N N 43 125.444 122.291 3.153 1
1 459 . 3 1 1 A 44 44 PRO HA H 44 4.389 4.691 -0.302 1
1 466 . 3 1 1 A 44 44 PRO C C 44 176.559 176.600 -0.041 1
1 467 . 3 1 1 A 44 44 PRO CA C 44 63.027 63.104 -0.077 1
1 468 . 3 1 1 A 44 44 PRO CB C 44 31.935 32.878 -0.943 1
1 471 . 3 1 1 A 45 45 ALA H H 45 8.261 7.926 0.335 1
1 472 . 3 1 1 A 45 45 ALA HA H 45 4.157 4.195 -0.038 1
1 476 . 3 1 1 A 45 45 ALA C C 45 177.706 176.787 0.919 1
1 477 . 3 1 1 A 45 45 ALA CA C 45 53.284 53.766 -0.482 1
1 478 . 3 1 1 A 45 45 ALA CB C 45 18.978 19.738 -0.760 1
1 479 . 3 1 1 A 45 45 ALA N N 45 126.162 122.710 3.452 1
1 480 . 3 1 1 A 46 46 SER H H 46 8.275 7.599 0.676 1
1 481 . 3 1 1 A 46 46 SER HA H 46 4.779 4.731 0.048 1
1 484 . 3 1 1 A 46 46 SER C C 46 172.182 174.122 -1.940 1
1 485 . 3 1 1 A 46 46 SER CA C 46 55.091 55.004 0.087 1
1 486 . 3 1 1 A 46 46 SER CB C 46 63.130 64.267 -1.137 1
1 487 . 3 1 1 A 46 46 SER N N 46 113.009 115.015 -2.006 1
1 488 . 3 1 1 A 47 47 PRO HA H 47 4.336 4.488 -0.152 1
1 493 . 3 1 1 A 47 47 PRO C C 47 177.165 177.905 -0.740 1
1 494 . 3 1 1 A 47 47 PRO CA C 47 63.268 63.888 -0.620 1
1 495 . 3 1 1 A 47 47 PRO CB C 47 32.528 31.860 0.668 1
1 498 . 3 1 1 A 48 48 LYS H H 48 9.089 8.423 0.666 1
1 499 . 3 1 1 A 48 48 LYS HA H 48 4.408 3.995 0.413 1
1 508 . 3 1 1 A 48 48 LYS C C 48 176.917 177.173 -0.256 1
1 509 . 3 1 1 A 48 48 LYS CA C 48 55.893 59.285 -3.392 1
1 510 . 3 1 1 A 48 48 LYS CB C 48 32.997 32.111 0.886 1
1 514 . 3 1 1 A 48 48 LYS N N 48 122.579 118.863 3.716 1
1 515 . 3 1 1 A 49 49 GLY HA2 H 49 4.021 4.067 -0.046 1
1 516 . 3 1 1 A 49 49 GLY HA3 H 49 3.881 4.072 -0.191 1
1 517 . 3 1 1 A 49 49 GLY C C 49 174.552 174.293 0.259 1
1 518 . 3 1 1 A 49 49 GLY CA C 49 46.011 44.411 1.600 1
1 519 . 3 1 1 A 50 50 GLU H H 50 8.608 8.312 0.296 1
1 520 . 3 1 1 A 50 50 GLU HA H 50 4.335 4.655 -0.320 1
1 525 . 3 1 1 A 50 50 GLU C C 50 176.672 176.439 0.233 1
1 526 . 3 1 1 A 50 50 GLU CA C 50 56.978 55.156 1.822 1
1 527 . 3 1 1 A 50 50 GLU CB C 50 29.458 29.445 0.013 1
1 529 . 3 1 1 A 50 50 GLU N N 50 121.378 116.350 5.028 1
1 530 . 3 1 1 A 51 51 GLU H H 51 8.287 7.814 0.473 1
1 531 . 3 1 1 A 51 51 GLU HA H 51 4.381 4.467 -0.086 1
1 536 . 3 1 1 A 51 51 GLU C C 51 176.218 176.441 -0.223 1
1 537 . 3 1 1 A 51 51 GLU CA C 51 56.996 55.826 1.170 1
1 538 . 3 1 1 A 51 51 GLU CB C 51 31.066 30.494 0.572 1
1 540 . 3 1 1 A 51 51 GLU N N 51 120.863 121.094 -0.231 1
1 541 . 3 1 1 A 52 52 GLU H H 52 8.445 8.533 -0.088 1
1 542 . 3 1 1 A 52 52 GLU HA H 52 4.464 4.183 0.281 1
1 547 . 3 1 1 A 52 52 GLU C C 52 176.128 176.656 -0.528 1
1 548 . 3 1 1 A 52 52 GLU CA C 52 55.955 57.590 -1.635 1
1 549 . 3 1 1 A 52 52 GLU CB C 52 31.691 29.932 1.759 1
1 551 . 3 1 1 A 52 52 GLU N N 52 121.103 123.146 -2.043 1
1 552 . 3 1 1 A 53 53 GLU H H 53 8.441 8.634 -0.193 1
1 553 . 3 1 1 A 53 53 GLU HA H 53 4.609 4.527 0.082 1
1 558 . 3 1 1 A 53 53 GLU C C 53 175.816 176.132 -0.316 1
1 559 . 3 1 1 A 53 53 GLU CA C 53 56.697 56.418 0.279 1
1 560 . 3 1 1 A 53 53 GLU CB C 53 31.022 30.337 0.685 1
1 562 . 3 1 1 A 53 53 GLU N N 53 121.949 122.577 -0.628 1
1 563 . 3 1 1 A 54 54 ARG H H 54 8.569 8.437 0.132 1
1 564 . 3 1 1 A 54 54 ARG HA H 54 4.768 4.633 0.135 1
1 571 . 3 1 1 A 54 54 ARG C C 54 174.881 175.491 -0.610 1
1 572 . 3 1 1 A 54 54 ARG CA C 54 54.950 56.579 -1.629 1
1 573 . 3 1 1 A 54 54 ARG CB C 54 33.374 31.130 2.244 1
1 576 . 3 1 1 A 54 54 ARG N N 54 123.714 125.575 -1.861 1
1 577 . 3 1 1 A 55 55 GLU H H 55 8.650 9.226 -0.576 1
1 578 . 3 1 1 A 55 55 GLU HA H 55 5.493 5.531 -0.038 1
1 583 . 3 1 1 A 55 55 GLU C C 55 175.566 175.027 0.539 1
1 584 . 3 1 1 A 55 55 GLU CA C 55 54.915 54.712 0.203 1
1 585 . 3 1 1 A 55 55 GLU CB C 55 33.250 32.360 0.890 1
1 587 . 3 1 1 A 55 55 GLU N N 55 123.537 122.879 0.658 1
1 588 . 3 1 1 A 56 56 VAL H H 56 9.419 9.356 0.063 1
1 589 . 3 1 1 A 56 56 VAL HA H 56 4.524 4.996 -0.472 1
1 597 . 3 1 1 A 56 56 VAL C C 56 173.502 173.953 -0.451 1
1 598 . 3 1 1 A 56 56 VAL CA C 56 60.981 58.991 1.990 1
1 599 . 3 1 1 A 56 56 VAL CB C 56 36.117 35.492 0.625 1
1 602 . 3 1 1 A 56 56 VAL N N 56 123.343 119.498 3.845 1
1 603 . 3 1 1 A 57 57 GLN H H 57 8.767 8.826 -0.059 1
1 604 . 3 1 1 A 57 57 GLN HA H 57 5.671 5.197 0.474 1
1 611 . 3 1 1 A 57 57 GLN C C 57 176.357 175.254 1.103 1
1 612 . 3 1 1 A 57 57 GLN CA C 57 54.735 54.239 0.496 1
1 613 . 3 1 1 A 57 57 GLN CB C 57 30.781 31.301 -0.520 1
1 615 . 3 1 1 A 57 57 GLN N N 57 125.639 121.514 4.125 1
1 617 . 3 1 1 A 58 58 VAL H H 58 9.217 8.773 0.444 1
1 618 . 3 1 1 A 58 58 VAL HA H 58 5.129 4.811 0.318 1
1 626 . 3 1 1 A 58 58 VAL C C 58 175.925 176.448 -0.523 1
1 627 . 3 1 1 A 58 58 VAL CA C 58 59.652 59.618 0.034 1
1 628 . 3 1 1 A 58 58 VAL CB C 58 36.540 35.282 1.258 1
1 631 . 3 1 1 A 58 58 VAL N N 58 117.022 118.442 -1.420 1
1 632 . 3 1 1 A 59 59 GLY H H 59 9.008 8.722 0.286 1
1 633 . 3 1 1 A 59 59 GLY HA2 H 59 4.670 3.825 0.845 1
1 634 . 3 1 1 A 59 59 GLY HA3 H 59 3.914 3.861 0.053 1
1 635 . 3 1 1 A 59 59 GLY C C 59 173.386 174.049 -0.663 1
1 636 . 3 1 1 A 59 59 GLY CA C 59 45.093 45.642 -0.549 1
1 637 . 3 1 1 A 59 59 GLY N N 59 109.174 110.935 -1.761 1
1 638 . 3 1 1 A 60 60 ARG H H 60 7.695 7.627 0.068 1
1 639 . 3 1 1 A 60 60 ARG HA H 60 4.866 5.103 -0.237 1
1 645 . 3 1 1 A 60 60 ARG C C 60 173.760 175.741 -1.981 1
1 646 . 3 1 1 A 60 60 ARG CA C 60 52.764 53.497 -0.733 1
1 647 . 3 1 1 A 60 60 ARG CB C 60 31.785 32.275 -0.490 1
1 650 . 3 1 1 A 60 60 ARG N N 60 118.520 118.352 0.168 1
1 651 . 3 1 1 A 61 61 PRO HA H 61 3.539 4.284 -0.745 1
1 658 . 3 1 1 A 61 61 PRO C C 61 173.175 173.904 -0.729 1
1 659 . 3 1 1 A 61 61 PRO CA C 61 62.265 63.305 -1.040 1
1 660 . 3 1 1 A 61 61 PRO CB C 61 27.546 31.040 -3.494 1
1 663 . 3 1 1 A 62 62 GLU H H 62 7.879 7.690 0.189 1
1 664 . 3 1 1 A 62 62 GLU HA H 62 4.071 4.602 -0.531 1
1 669 . 3 1 1 A 62 62 GLU C C 62 174.107 174.512 -0.405 1
1 670 . 3 1 1 A 62 62 GLU CA C 62 55.229 54.212 1.017 1
1 671 . 3 1 1 A 62 62 GLU CB C 62 32.838 32.074 0.764 1
1 673 . 3 1 1 A 62 62 GLU N N 62 118.173 114.252 3.921 1
1 674 . 3 1 1 A 63 63 VAL H H 63 8.930 8.505 0.425 1
1 675 . 3 1 1 A 63 63 VAL HA H 63 4.548 5.112 -0.564 1
1 683 . 3 1 1 A 63 63 VAL C C 63 170.325 173.604 -3.279 1
1 684 . 3 1 1 A 63 63 VAL CA C 63 60.770 59.475 1.295 1
1 685 . 3 1 1 A 63 63 VAL CB C 63 35.394 34.715 0.679 1
1 688 . 3 1 1 A 63 63 VAL N N 63 117.161 124.658 -7.497 1
1 689 . 3 1 1 A 64 64 LEU H H 64 8.332 8.924 -0.592 1
1 690 . 3 1 1 A 64 64 LEU HA H 64 5.122 5.228 -0.106 1
1 700 . 3 1 1 A 64 64 LEU C C 64 176.243 174.755 1.488 1
1 701 . 3 1 1 A 64 64 LEU CA C 64 53.346 53.527 -0.181 1
1 702 . 3 1 1 A 64 64 LEU CB C 64 42.649 45.208 -2.559 1
1 706 . 3 1 1 A 64 64 LEU N N 64 130.510 128.769 1.741 1
1 707 . 3 1 1 A 65 65 LEU H H 65 9.261 9.232 0.029 1
1 708 . 3 1 1 A 65 65 LEU HA H 65 4.443 4.900 -0.457 1
1 718 . 3 1 1 A 65 65 LEU C C 65 174.016 175.896 -1.880 1
1 719 . 3 1 1 A 65 65 LEU CA C 65 53.920 53.875 0.045 1
1 720 . 3 1 1 A 65 65 LEU CB C 65 42.976 43.019 -0.043 1
1 724 . 3 1 1 A 65 65 LEU N N 65 128.611 128.346 0.265 1
1 725 . 3 1 1 A 66 66 ASP H H 66 8.105 8.705 -0.600 1
1 726 . 3 1 1 A 66 66 ASP HA H 66 5.207 5.335 -0.128 1
1 729 . 3 1 1 A 66 66 ASP C C 66 176.161 176.360 -0.199 1
1 730 . 3 1 1 A 66 66 ASP CA C 66 51.001 52.880 -1.879 1
1 731 . 3 1 1 A 66 66 ASP CB C 66 42.836 43.009 -0.173 1
1 732 . 3 1 1 A 66 66 ASP N N 66 121.799 124.140 -2.341 1
1 733 . 3 1 1 A 67 67 GLY H H 67 8.688 8.302 0.386 1
1 734 . 3 1 1 A 67 67 GLY HA2 H 67 3.923 3.950 -0.027 1
1 735 . 3 1 1 A 67 67 GLY HA3 H 67 3.808 3.957 -0.149 1
1 736 . 3 1 1 A 67 67 GLY C C 67 175.500 174.198 1.302 1
1 737 . 3 1 1 A 67 67 GLY CA C 67 46.591 46.634 -0.043 1
1 738 . 3 1 1 A 67 67 GLY N N 67 106.518 111.096 -4.578 1
1 739 . 3 1 1 A 68 68 LEU H H 68 8.125 7.413 0.712 1
1 740 . 3 1 1 A 68 68 LEU HA H 68 4.252 4.916 -0.664 1
1 750 . 3 1 1 A 68 68 LEU C C 68 174.914 175.386 -0.472 1
1 751 . 3 1 1 A 68 68 LEU CA C 68 53.469 53.126 0.343 1
1 752 . 3 1 1 A 68 68 LEU CB C 68 40.422 45.508 -5.086 1
1 756 . 3 1 1 A 68 68 LEU N N 68 119.345 120.079 -0.734 1
1 757 . 3 1 1 A 69 69 GLU H H 69 8.207 8.436 -0.229 1
1 758 . 3 1 1 A 69 69 GLU HA H 69 4.908 4.792 0.116 1
1 763 . 3 1 1 A 69 69 GLU C C 69 174.464 174.134 0.330 1
1 764 . 3 1 1 A 69 69 GLU CA C 69 53.081 52.855 0.226 1
1 765 . 3 1 1 A 69 69 GLU CB C 69 31.538 31.251 0.287 1
1 767 . 3 1 1 A 69 69 GLU N N 69 119.486 120.492 -1.006 1
1 768 . 3 1 1 A 70 70 PRO HA H 70 4.866 4.339 0.527 1
1 775 . 3 1 1 A 70 70 PRO C C 70 178.285 177.363 0.922 1
1 776 . 3 1 1 A 70 70 PRO CA C 70 63.203 63.598 -0.395 1
1 777 . 3 1 1 A 70 70 PRO CB C 70 33.726 32.047 1.679 1
1 780 . 3 1 1 A 71 71 GLY H H 71 7.362 8.975 -1.613 1
1 781 . 3 1 1 A 71 71 GLY HA2 H 71 3.807 3.925 -0.118 1
1 782 . 3 1 1 A 71 71 GLY HA3 H 71 3.756 3.927 -0.171 1
1 783 . 3 1 1 A 71 71 GLY C C 71 174.664 173.709 0.955 1
1 784 . 3 1 1 A 71 71 GLY CA C 71 46.926 46.437 0.489 1
1 785 . 3 1 1 A 71 71 GLY N N 71 113.776 111.505 2.271 1
1 786 . 3 1 1 A 72 72 ARG H H 72 8.036 7.276 0.760 1
1 787 . 3 1 1 A 72 72 ARG HA H 72 4.597 4.816 -0.219 1
1 793 . 3 1 1 A 72 72 ARG C C 72 173.293 173.627 -0.334 1
1 794 . 3 1 1 A 72 72 ARG CA C 72 54.633 54.411 0.222 1
1 795 . 3 1 1 A 72 72 ARG CB C 72 33.704 33.367 0.337 1
1 798 . 3 1 1 A 72 72 ARG N N 72 119.611 119.473 0.138 1
1 799 . 3 1 1 A 73 73 ASP H H 73 7.785 8.487 -0.702 1
1 800 . 3 1 1 A 73 73 ASP HA H 73 5.276 5.261 0.015 1
1 803 . 3 1 1 A 73 73 ASP C C 73 175.904 174.566 1.338 1
1 804 . 3 1 1 A 73 73 ASP CA C 73 53.568 52.589 0.979 1
1 805 . 3 1 1 A 73 73 ASP CB C 73 42.970 42.961 0.009 1
1 806 . 3 1 1 A 73 73 ASP N N 73 118.900 125.052 -6.152 1
1 807 . 3 1 1 A 74 74 TYR H H 74 9.516 8.748 0.768 1
1 808 . 3 1 1 A 74 74 TYR HA H 74 4.800 5.132 -0.332 1
1 815 . 3 1 1 A 74 74 TYR C C 74 174.631 174.887 -0.256 1
1 816 . 3 1 1 A 74 74 TYR CA C 74 58.548 56.666 1.882 1
1 817 . 3 1 1 A 74 74 TYR CB C 74 42.029 43.511 -1.482 1
1 822 . 3 1 1 A 74 74 TYR N N 74 121.903 120.631 1.272 1
1 823 . 3 1 1 A 75 75 GLU H H 75 9.248 9.128 0.120 1
1 824 . 3 1 1 A 75 75 GLU HA H 75 4.756 5.046 -0.290 1
1 829 . 3 1 1 A 75 75 GLU C C 75 175.524 175.610 -0.086 1
1 830 . 3 1 1 A 75 75 GLU CA C 75 55.621 55.492 0.129 1
1 831 . 3 1 1 A 75 75 GLU CB C 75 30.778 31.436 -0.658 1
1 833 . 3 1 1 A 75 75 GLU N N 75 122.425 121.334 1.091 1
1 834 . 3 1 1 A 76 76 VAL H H 76 8.884 8.691 0.193 1
1 835 . 3 1 1 A 76 76 VAL HA H 76 5.246 4.924 0.322 1
1 843 . 3 1 1 A 76 76 VAL C C 76 174.800 174.745 0.055 1
1 844 . 3 1 1 A 76 76 VAL CA C 76 60.199 61.247 -1.048 1
1 845 . 3 1 1 A 76 76 VAL CB C 76 33.449 32.936 0.513 1
1 848 . 3 1 1 A 76 76 VAL N N 76 126.853 126.751 0.102 1
1 849 . 3 1 1 A 77 77 SER H H 77 9.234 8.730 0.504 1
1 850 . 3 1 1 A 77 77 SER HA H 77 5.398 5.108 0.290 1
1 853 . 3 1 1 A 77 77 SER C C 77 173.138 173.580 -0.442 1
1 854 . 3 1 1 A 77 77 SER CA C 77 56.032 56.757 -0.725 1
1 855 . 3 1 1 A 77 77 SER CB C 77 66.374 64.931 1.443 1
1 856 . 3 1 1 A 77 77 SER N N 77 120.852 123.148 -2.296 1
1 857 . 3 1 1 A 78 78 VAL H H 78 9.092 8.792 0.300 1
1 858 . 3 1 1 A 78 78 VAL HA H 78 4.756 4.975 -0.219 1
1 866 . 3 1 1 A 78 78 VAL C C 78 173.641 174.432 -0.791 1
1 867 . 3 1 1 A 78 78 VAL CA C 78 61.246 60.849 0.397 1
1 868 . 3 1 1 A 78 78 VAL CB C 78 34.467 34.016 0.451 1
1 871 . 3 1 1 A 78 78 VAL N N 78 122.453 125.745 -3.292 1
1 872 . 3 1 1 A 79 79 GLN H H 79 8.587 8.684 -0.097 1
1 873 . 3 1 1 A 79 79 GLN HA H 79 4.438 4.858 -0.420 1
1 880 . 3 1 1 A 79 79 GLN C C 79 174.999 174.618 0.381 1
1 881 . 3 1 1 A 79 79 GLN CA C 79 54.227 53.958 0.269 1
1 882 . 3 1 1 A 79 79 GLN CB C 79 33.587 32.520 1.067 1
1 884 . 3 1 1 A 79 79 GLN N N 79 125.619 127.517 -1.898 1
1 886 . 3 1 1 A 80 80 SER H H 80 8.623 8.914 -0.291 1
1 887 . 3 1 1 A 80 80 SER HA H 80 4.756 4.863 -0.107 1
1 890 . 3 1 1 A 80 80 SER C C 80 172.264 174.306 -2.042 1
1 891 . 3 1 1 A 80 80 SER CA C 80 58.177 59.696 -1.519 1
1 892 . 3 1 1 A 80 80 SER CB C 80 63.920 63.159 0.761 1
1 893 . 3 1 1 A 80 80 SER N N 80 122.844 123.863 -1.019 1
1 894 . 3 1 1 A 81 81 LEU H H 81 8.348 8.906 -0.558 1
1 895 . 3 1 1 A 81 81 LEU HA H 81 5.124 4.607 0.517 1
1 905 . 3 1 1 A 81 81 LEU C C 81 175.775 176.198 -0.423 1
1 906 . 3 1 1 A 81 81 LEU CA C 81 54.033 53.572 0.461 1
1 907 . 3 1 1 A 81 81 LEU CB C 81 44.690 43.039 1.651 1
1 911 . 3 1 1 A 81 81 LEU N N 81 123.191 127.870 -4.679 1
1 912 . 3 1 1 A 82 82 ARG H H 82 8.374 9.053 -0.679 1
1 913 . 3 1 1 A 82 82 ARG HA H 82 4.616 4.305 0.311 1
1 919 . 3 1 1 A 82 82 ARG C C 82 176.864 176.040 0.824 1
1 920 . 3 1 1 A 82 82 ARG CA C 82 55.868 56.783 -0.915 1
1 921 . 3 1 1 A 82 82 ARG CB C 82 32.322 32.622 -0.300 1
1 924 . 3 1 1 A 82 82 ARG N N 82 121.029 125.715 -4.686 1
1 925 . 3 1 1 A 83 83 GLY H H 83 8.309 7.419 0.890 1
1 926 . 3 1 1 A 83 83 GLY HA2 H 83 4.031 4.105 -0.074 1
1 927 . 3 1 1 A 83 83 GLY HA3 H 83 3.888 4.160 -0.272 1
1 928 . 3 1 1 A 83 83 GLY C C 83 174.562 174.124 0.438 1
1 929 . 3 1 1 A 83 83 GLY CA C 83 45.963 46.127 -0.164 1
1 930 . 3 1 1 A 83 83 GLY N N 83 109.937 106.569 3.368 1
1 931 . 3 1 1 A 84 84 PRO HA H 84 4.573 4.344 0.229 1
1 938 . 3 1 1 A 84 84 PRO C C 84 176.533 176.102 0.431 1
1 939 . 3 1 1 A 84 84 PRO CA C 84 63.485 64.826 -1.341 1
1 940 . 3 1 1 A 84 84 PRO CB C 84 32.409 31.964 0.445 1
1 943 . 3 1 1 A 85 85 GLU H H 85 7.799 7.600 0.199 1
1 944 . 3 1 1 A 85 85 GLU HA H 85 4.369 4.824 -0.455 1
1 949 . 3 1 1 A 85 85 GLU C C 85 174.722 175.419 -0.697 1
1 950 . 3 1 1 A 85 85 GLU CA C 85 55.899 54.877 1.022 1
1 951 . 3 1 1 A 85 85 GLU CB C 85 31.911 32.975 -1.064 1
1 953 . 3 1 1 A 85 85 GLU N N 85 122.093 112.244 9.849 1
1 954 . 3 1 1 A 86 86 GLY H H 86 8.329 8.652 -0.323 1
1 955 . 3 1 1 A 86 86 GLY HA2 H 86 5.298 4.155 1.143 1
1 956 . 3 1 1 A 86 86 GLY HA3 H 86 3.559 4.167 -0.608 1
1 957 . 3 1 1 A 86 86 GLY C C 86 174.355 172.583 1.772 1
1 958 . 3 1 1 A 86 86 GLY CA C 86 44.034 44.139 -0.105 1
1 959 . 3 1 1 A 86 86 GLY N N 86 109.387 109.236 0.151 1
1 960 . 3 1 1 A 87 87 SER H H 87 8.807 8.566 0.241 1
1 961 . 3 1 1 A 87 87 SER HA H 87 4.670 4.923 -0.253 1
1 964 . 3 1 1 A 87 87 SER C C 87 175.195 173.706 1.489 1
1 965 . 3 1 1 A 87 87 SER CA C 87 57.737 56.106 1.631 1
1 966 . 3 1 1 A 87 87 SER CB C 87 67.829 65.853 1.976 1
1 967 . 3 1 1 A 87 87 SER N N 87 117.698 115.156 2.542 1
1 968 . 3 1 1 A 88 88 GLU H H 88 8.754 8.459 0.295 1
1 969 . 3 1 1 A 88 88 GLU HA H 88 4.357 4.302 0.055 1
1 974 . 3 1 1 A 88 88 GLU C C 88 177.474 176.967 0.507 1
1 975 . 3 1 1 A 88 88 GLU CA C 88 57.525 56.857 0.668 1
1 976 . 3 1 1 A 88 88 GLU CB C 88 31.162 30.543 0.619 1
1 978 . 3 1 1 A 88 88 GLU N N 88 118.709 122.473 -3.764 1
1 979 . 3 1 1 A 89 89 ALA H H 89 8.855 8.342 0.513 1
1 980 . 3 1 1 A 89 89 ALA HA H 89 4.792 4.525 0.267 1
1 984 . 3 1 1 A 89 89 ALA C C 89 178.379 176.794 1.585 1
1 985 . 3 1 1 A 89 89 ALA CA C 89 51.264 51.774 -0.510 1
1 986 . 3 1 1 A 89 89 ALA CB C 89 20.040 19.678 0.362 1
1 987 . 3 1 1 A 89 89 ALA N N 89 127.301 124.354 2.947 1
1 988 . 3 1 1 A 90 90 ARG H H 90 8.549 8.422 0.127 1
1 989 . 3 1 1 A 90 90 ARG HA H 90 4.658 4.900 -0.242 1
1 996 . 3 1 1 A 90 90 ARG C C 90 174.720 175.443 -0.723 1
1 997 . 3 1 1 A 90 90 ARG CA C 90 53.575 54.359 -0.784 1
1 998 . 3 1 1 A 90 90 ARG CB C 90 33.456 31.535 1.921 1
1 1001 . 3 1 1 A 90 90 ARG N N 90 121.289 123.444 -2.155 1
1 1002 . 3 1 1 A 91 91 GLY H H 91 8.396 8.981 -0.585 1
1 1003 . 3 1 1 A 91 91 GLY HA2 H 91 5.306 4.172 1.134 1
1 1004 . 3 1 1 A 91 91 GLY HA3 H 91 3.700 4.203 -0.503 1
1 1005 . 3 1 1 A 91 91 GLY C C 91 173.191 172.200 0.991 1
1 1006 . 3 1 1 A 91 91 GLY CA C 91 44.493 43.828 0.665 1
1 1007 . 3 1 1 A 91 91 GLY N N 91 108.579 112.080 -3.501 1
1 1008 . 3 1 1 A 92 92 ILE H H 92 8.891 8.603 0.288 1
1 1009 . 3 1 1 A 92 92 ILE HA H 92 4.499 4.954 -0.455 1
1 1019 . 3 1 1 A 92 92 ILE C C 92 171.877 175.136 -3.259 1
1 1020 . 3 1 1 A 92 92 ILE CA C 92 60.682 59.098 1.584 1
1 1021 . 3 1 1 A 92 92 ILE CB C 92 42.425 42.341 0.084 1
1 1025 . 3 1 1 A 92 92 ILE N N 92 118.313 121.080 -2.767 1
1 1026 . 3 1 1 A 93 93 ARG H H 93 7.980 8.432 -0.452 1
1 1027 . 3 1 1 A 93 93 ARG HA H 93 5.224 4.300 0.924 1
1 1034 . 3 1 1 A 93 93 ARG C C 93 175.072 175.754 -0.682 1
1 1035 . 3 1 1 A 93 93 ARG CA C 93 54.499 57.361 -2.862 1
1 1036 . 3 1 1 A 93 93 ARG CB C 93 31.767 30.700 1.067 1
1 1039 . 3 1 1 A 93 93 ARG N N 93 124.879 126.577 -1.698 1
1 1040 . 3 1 1 A 94 94 ALA H H 94 9.064 8.390 0.674 1
1 1041 . 3 1 1 A 94 94 ALA HA H 94 4.731 5.008 -0.277 1
1 1045 . 3 1 1 A 94 94 ALA C C 94 174.494 176.669 -2.175 1
1 1046 . 3 1 1 A 94 94 ALA CA C 94 50.577 50.604 -0.027 1
1 1047 . 3 1 1 A 94 94 ALA CB C 94 23.082 20.140 2.942 1
1 1048 . 3 1 1 A 94 94 ALA N N 94 126.095 124.391 1.704 1
1 1049 . 3 1 1 A 95 95 ARG H H 95 8.263 8.512 -0.249 1
1 1050 . 3 1 1 A 95 95 ARG HA H 95 5.548 4.954 0.594 1
1 1058 . 3 1 1 A 95 95 ARG C C 95 176.901 175.893 1.008 1
1 1059 . 3 1 1 A 95 95 ARG CA C 95 53.787 55.477 -1.690 1
1 1060 . 3 1 1 A 95 95 ARG CB C 95 32.426 31.833 0.593 1
1 1063 . 3 1 1 A 95 95 ARG N N 95 123.374 121.252 2.122 1
1 1065 . 3 1 1 A 96 96 THR H H 96 9.208 8.843 0.365 1
1 1066 . 3 1 1 A 96 96 THR HA H 96 4.461 5.062 -0.601 1
1 1071 . 3 1 1 A 96 96 THR CA C 96 58.248 58.254 -0.006 1
1 1072 . 3 1 1 A 96 96 THR CB C 96 68.466 70.951 -2.485 1
1 1074 . 3 1 1 A 96 96 THR N N 96 119.492 110.817 8.675 1
1 1075 . 3 1 1 A 97 97 PRO HA H 97 4.636 4.596 0.040 1
1 1082 . 3 1 1 A 97 97 PRO C C 97 175.725 175.927 -0.202 1
1 1083 . 3 1 1 A 97 97 PRO CA C 97 61.907 62.296 -0.389 1
1 1084 . 3 1 1 A 97 97 PRO CB C 97 32.590 33.435 -0.845 1
1 1087 . 3 1 1 A 98 98 THR H H 98 7.943 8.328 -0.385 1
1 1088 . 3 1 1 A 98 98 THR HA H 98 4.208 4.987 -0.779 1
1 1093 . 3 1 1 A 98 98 THR C C 98 175.058 173.382 1.676 1
1 1094 . 3 1 1 A 98 98 THR CA C 98 62.069 60.493 1.576 1
1 1095 . 3 1 1 A 98 98 THR CB C 98 69.719 70.975 -1.256 1
1 1097 . 3 1 1 A 98 98 THR N N 98 107.148 111.196 -4.048 1
1 1098 . 3 1 1 A 99 99 SER H H 99 8.163 9.040 -0.877 1
1 1099 . 3 1 1 A 99 99 SER HA H 99 4.524 4.583 -0.059 1
1 1102 . 3 1 1 A 99 99 SER C C 99 174.319 174.178 0.141 1
1 1103 . 3 1 1 A 99 99 SER CA C 99 58.107 57.990 0.117 1
1 1104 . 3 1 1 A 99 99 SER CB C 99 64.492 63.054 1.438 1
1 1105 . 3 1 1 A 99 99 SER N N 99 115.114 122.043 -6.929 1
1 1106 . 3 1 1 A 100 100 GLY H H 100 8.336 8.266 0.070 1
1 1107 . 3 1 1 A 100 100 GLY HA2 H 100 4.222 4.065 0.157 1
1 1108 . 3 1 1 A 100 100 GLY HA3 H 100 4.222 4.066 0.156 1
1 1109 . 3 1 1 A 100 100 GLY C C 100 171.696 173.013 -1.317 1
1 1110 . 3 1 1 A 100 100 GLY CA C 100 44.617 44.243 0.374 1
1 1111 . 3 1 1 A 100 100 GLY N N 100 110.678 110.008 0.670 1
1 1112 . 3 1 1 A 101 101 PRO HA H 101 4.506 4.688 -0.182 1
1 1118 . 3 1 1 A 101 101 PRO CA C 101 63.358 62.592 0.766 1
1 1119 . 3 1 1 A 101 101 PRO CB C 101 32.313 31.248 1.065 1
1 1 . 4 1 1 A 6 6 SER HA H 6 4.528 4.681 -0.153 1
1 3 . 4 1 1 A 6 6 SER CA C 6 58.373 58.095 0.278 1
1 4 . 4 1 1 A 6 6 SER CB C 6 63.978 63.736 0.242 1
1 5 . 4 1 1 A 7 7 GLY H H 7 8.228 7.627 0.601 1
1 6 . 4 1 1 A 7 7 GLY HA2 H 7 4.134 4.101 0.033 1
1 7 . 4 1 1 A 7 7 GLY HA3 H 7 4.134 4.102 0.032 1
1 8 . 4 1 1 A 7 7 GLY CA C 7 44.607 44.589 0.018 1
1 9 . 4 1 1 A 7 7 GLY N N 7 110.638 109.045 1.593 1
1 10 . 4 1 1 A 8 8 PRO HA H 8 4.419 4.703 -0.284 1
1 17 . 4 1 1 A 8 8 PRO C C 8 176.908 175.283 1.625 1
1 18 . 4 1 1 A 8 8 PRO CA C 8 62.851 62.787 0.064 1
1 19 . 4 1 1 A 8 8 PRO CB C 8 32.243 32.324 -0.081 1
1 22 . 4 1 1 A 9 9 LEU H H 9 8.462 8.458 0.004 1
1 23 . 4 1 1 A 9 9 LEU HA H 9 4.494 4.936 -0.442 1
1 33 . 4 1 1 A 9 9 LEU C C 9 174.124 174.514 -0.390 1
1 34 . 4 1 1 A 9 9 LEU CA C 9 52.587 51.775 0.812 1
1 35 . 4 1 1 A 9 9 LEU CB C 9 43.150 43.550 -0.400 1
1 39 . 4 1 1 A 9 9 LEU N N 9 126.015 123.322 2.693 1
1 40 . 4 1 1 A 10 10 PRO HA H 10 4.820 4.542 0.278 1
1 47 . 4 1 1 A 10 10 PRO CA C 10 61.368 62.076 -0.708 1
1 48 . 4 1 1 A 10 10 PRO CB C 10 31.391 32.000 -0.609 1
1 51 . 4 1 1 A 11 11 PRO HA H 11 4.949 4.539 0.410 1
1 58 . 4 1 1 A 11 11 PRO CA C 11 61.183 61.792 -0.609 1
1 59 . 4 1 1 A 11 11 PRO CB C 11 30.656 31.889 -1.233 1
1 62 . 4 1 1 A 12 12 PRO HA H 12 4.341 4.591 -0.250 1
1 69 . 4 1 1 A 12 12 PRO C C 12 174.849 176.977 -2.128 1
1 70 . 4 1 1 A 12 12 PRO CA C 12 63.062 62.606 0.456 1
1 71 . 4 1 1 A 12 12 PRO CB C 12 31.831 31.658 0.173 1
1 74 . 4 1 1 A 13 13 ARG H H 13 7.828 8.844 -1.016 1
1 75 . 4 1 1 A 13 13 ARG HA H 13 4.536 4.459 0.077 1
1 82 . 4 1 1 A 13 13 ARG C C 13 174.608 177.278 -2.670 1
1 83 . 4 1 1 A 13 13 ARG CA C 13 54.774 57.090 -2.316 1
1 84 . 4 1 1 A 13 13 ARG CB C 13 33.250 31.848 1.402 1
1 87 . 4 1 1 A 13 13 ARG N N 13 120.532 123.262 -2.730 1
1 88 . 4 1 1 A 14 14 ALA H H 14 8.694 7.502 1.192 1
1 89 . 4 1 1 A 14 14 ALA HA H 14 3.986 4.340 -0.354 1
1 93 . 4 1 1 A 14 14 ALA C C 14 177.232 176.843 0.389 1
1 94 . 4 1 1 A 14 14 ALA CA C 14 52.461 52.314 0.147 1
1 95 . 4 1 1 A 14 14 ALA CB C 14 16.806 17.433 -0.627 1
1 96 . 4 1 1 A 14 14 ALA N N 14 121.921 120.183 1.738 1
1 97 . 4 1 1 A 15 15 LEU H H 15 8.097 7.795 0.302 1
1 98 . 4 1 1 A 15 15 LEU HA H 15 4.670 4.489 0.181 1
1 108 . 4 1 1 A 15 15 LEU C C 15 177.364 176.330 1.034 1
1 109 . 4 1 1 A 15 15 LEU CA C 15 57.543 55.059 2.484 1
1 110 . 4 1 1 A 15 15 LEU CB C 15 41.877 41.876 0.001 1
1 114 . 4 1 1 A 15 15 LEU N N 15 122.215 120.938 1.277 1
1 115 . 4 1 1 A 16 16 THR H H 16 9.520 8.595 0.925 1
1 116 . 4 1 1 A 16 16 THR HA H 16 4.369 4.647 -0.278 1
1 121 . 4 1 1 A 16 16 THR C C 16 172.453 172.923 -0.470 1
1 122 . 4 1 1 A 16 16 THR CA C 16 62.480 61.220 1.260 1
1 123 . 4 1 1 A 16 16 THR CB C 16 72.198 72.330 -0.132 1
1 125 . 4 1 1 A 16 16 THR N N 16 122.214 120.631 1.583 1
1 126 . 4 1 1 A 17 17 LEU H H 17 8.847 8.668 0.179 1
1 127 . 4 1 1 A 17 17 LEU HA H 17 4.573 4.470 0.103 1
1 137 . 4 1 1 A 17 17 LEU C C 17 174.695 176.603 -1.908 1
1 138 . 4 1 1 A 17 17 LEU CA C 17 53.840 55.249 -1.409 1
1 139 . 4 1 1 A 17 17 LEU CB C 17 40.290 42.667 -2.377 1
1 143 . 4 1 1 A 17 17 LEU N N 17 127.415 127.780 -0.365 1
1 144 . 4 1 1 A 18 18 ALA H H 18 8.647 8.588 0.059 1
1 145 . 4 1 1 A 18 18 ALA HA H 18 4.106 4.092 0.014 1
1 149 . 4 1 1 A 18 18 ALA C C 18 178.236 177.678 0.558 1
1 150 . 4 1 1 A 18 18 ALA CA C 18 53.926 54.256 -0.330 1
1 151 . 4 1 1 A 18 18 ALA CB C 18 18.876 19.092 -0.216 1
1 152 . 4 1 1 A 18 18 ALA N N 18 133.362 130.092 3.270 1
1 153 . 4 1 1 A 19 19 ALA H H 19 7.772 7.563 0.209 1
1 154 . 4 1 1 A 19 19 ALA HA H 19 4.561 4.715 -0.154 1
1 158 . 4 1 1 A 19 19 ALA C C 19 176.032 174.987 1.045 1
1 159 . 4 1 1 A 19 19 ALA CA C 19 53.011 51.607 1.404 1
1 160 . 4 1 1 A 19 19 ALA CB C 19 21.869 22.249 -0.380 1
1 161 . 4 1 1 A 19 19 ALA N N 19 115.654 116.946 -1.292 1
1 162 . 4 1 1 A 20 20 VAL H H 20 8.697 8.886 -0.189 1
1 163 . 4 1 1 A 20 20 VAL HA H 20 4.951 4.635 0.316 1
1 171 . 4 1 1 A 20 20 VAL C C 20 174.314 174.220 0.094 1
1 172 . 4 1 1 A 20 20 VAL CA C 20 61.352 61.143 0.209 1
1 173 . 4 1 1 A 20 20 VAL CB C 20 35.394 33.030 2.364 1
1 176 . 4 1 1 A 20 20 VAL N N 20 120.848 124.068 -3.220 1
1 177 . 4 1 1 A 21 21 THR H H 21 9.198 8.281 0.917 1
1 178 . 4 1 1 A 21 21 THR HA H 21 4.941 4.726 0.215 1
1 183 . 4 1 1 A 21 21 THR C C 21 174.416 174.557 -0.141 1
1 184 . 4 1 1 A 21 21 THR CA C 21 60.347 59.043 1.304 1
1 185 . 4 1 1 A 21 21 THR CB C 21 68.713 71.064 -2.351 1
1 187 . 4 1 1 A 21 21 THR N N 21 120.326 124.548 -4.222 1
1 188 . 4 1 1 A 22 22 PRO HA H 22 4.634 4.542 0.092 1
1 194 . 4 1 1 A 22 22 PRO C C 22 173.606 177.002 -3.396 1
1 195 . 4 1 1 A 22 22 PRO CA C 22 66.519 64.355 2.164 1
1 196 . 4 1 1 A 22 22 PRO CB C 22 32.078 31.678 0.400 1
1 199 . 4 1 1 A 23 23 ARG H H 23 6.621 8.302 -1.681 1
1 200 . 4 1 1 A 23 23 ARG HA H 23 4.591 4.471 0.120 1
1 207 . 4 1 1 A 23 23 ARG C C 23 176.554 175.993 0.561 1
1 208 . 4 1 1 A 23 23 ARG CA C 23 53.892 56.619 -2.727 1
1 209 . 4 1 1 A 23 23 ARG CB C 23 33.498 32.925 0.573 1
1 212 . 4 1 1 A 23 23 ARG N N 23 102.938 117.056 -14.118 1
1 213 . 4 1 1 A 24 24 THR H H 24 7.352 7.982 -0.630 1
1 214 . 4 1 1 A 24 24 THR HA H 24 5.593 5.143 0.450 1
1 219 . 4 1 1 A 24 24 THR C C 24 172.345 172.306 0.039 1
1 220 . 4 1 1 A 24 24 THR CA C 24 59.311 60.464 -1.153 1
1 221 . 4 1 1 A 24 24 THR CB C 24 73.311 71.614 1.697 1
1 223 . 4 1 1 A 24 24 THR N N 24 108.792 109.793 -1.001 1
1 224 . 4 1 1 A 25 25 VAL H H 25 8.437 8.914 -0.477 1
1 225 . 4 1 1 A 25 25 VAL HA H 25 4.512 4.632 -0.120 1
1 233 . 4 1 1 A 25 25 VAL C C 25 172.854 174.373 -1.519 1
1 234 . 4 1 1 A 25 25 VAL CA C 25 61.617 61.043 0.574 1
1 235 . 4 1 1 A 25 25 VAL CB C 25 36.742 32.904 3.838 1
1 238 . 4 1 1 A 25 25 VAL N N 25 117.023 123.804 -6.781 1
1 239 . 4 1 1 A 26 26 HIS H H 26 8.915 8.600 0.315 1
1 240 . 4 1 1 A 26 26 HIS HA H 26 5.765 5.498 0.267 1
1 245 . 4 1 1 A 26 26 HIS C C 26 173.976 173.367 0.609 1
1 246 . 4 1 1 A 26 26 HIS CA C 26 52.896 53.725 -0.829 1
1 247 . 4 1 1 A 26 26 HIS CB C 26 34.004 32.953 1.051 1
1 250 . 4 1 1 A 26 26 HIS N N 26 128.155 127.441 0.714 1
1 251 . 4 1 1 A 27 27 LEU H H 27 9.034 9.390 -0.356 1
1 252 . 4 1 1 A 27 27 LEU HA H 27 5.505 5.064 0.441 1
1 262 . 4 1 1 A 27 27 LEU C C 27 174.821 174.811 0.010 1
1 263 . 4 1 1 A 27 27 LEU CA C 27 53.376 53.534 -0.158 1
1 264 . 4 1 1 A 27 27 LEU CB C 27 46.306 47.105 -0.799 1
1 268 . 4 1 1 A 27 27 LEU N N 27 128.569 129.579 -1.010 1
1 269 . 4 1 1 A 28 28 THR H H 28 8.844 8.411 0.433 1
1 270 . 4 1 1 A 28 28 THR HA H 28 4.485 4.918 -0.433 1
1 275 . 4 1 1 A 28 28 THR C C 28 172.773 173.164 -0.391 1
1 276 . 4 1 1 A 28 28 THR CA C 28 60.052 59.872 0.180 1
1 277 . 4 1 1 A 28 28 THR CB C 28 71.704 71.917 -0.213 1
1 279 . 4 1 1 A 28 28 THR N N 28 112.165 112.735 -0.570 1
1 280 . 4 1 1 A 29 29 TRP H H 29 7.395 7.996 -0.601 1
1 281 . 4 1 1 A 29 29 TRP HA H 29 4.915 5.601 -0.686 1
1 290 . 4 1 1 A 29 29 TRP C C 29 174.013 173.214 0.799 1
1 291 . 4 1 1 A 29 29 TRP CA C 29 56.626 55.220 1.406 1
1 292 . 4 1 1 A 29 29 TRP CB C 29 29.487 31.326 -1.839 1
1 298 . 4 1 1 A 29 29 TRP N N 29 115.623 119.292 -3.669 1
1 300 . 4 1 1 A 30 30 GLN H H 30 8.759 8.515 0.244 1
1 301 . 4 1 1 A 30 30 GLN HA H 30 4.641 4.774 -0.133 1
1 308 . 4 1 1 A 30 30 GLN C C 30 175.072 174.072 1.000 1
1 309 . 4 1 1 A 30 30 GLN CA C 30 52.975 53.488 -0.513 1
1 310 . 4 1 1 A 30 30 GLN CB C 30 28.398 28.506 -0.108 1
1 312 . 4 1 1 A 30 30 GLN N N 30 117.497 120.281 -2.784 1
1 314 . 4 1 1 A 31 31 PRO HA H 31 4.487 4.243 0.244 1
1 320 . 4 1 1 A 31 31 PRO C C 31 177.034 176.161 0.873 1
1 321 . 4 1 1 A 31 31 PRO CA C 31 62.710 62.678 0.032 1
1 322 . 4 1 1 A 31 31 PRO CB C 31 32.738 31.935 0.803 1
1 325 . 4 1 1 A 32 32 SER H H 32 8.259 8.341 -0.082 1
1 326 . 4 1 1 A 32 32 SER HA H 32 4.670 4.563 0.107 1
1 329 . 4 1 1 A 32 32 SER C C 32 174.689 173.644 1.045 1
1 330 . 4 1 1 A 32 32 SER CA C 32 57.296 57.068 0.228 1
1 331 . 4 1 1 A 32 32 SER CB C 32 64.748 64.811 -0.063 1
1 332 . 4 1 1 A 32 32 SER N N 32 117.667 117.005 0.662 1
1 333 . 4 1 1 A 33 33 ALA H H 33 9.038 8.439 0.599 1
1 334 . 4 1 1 A 33 33 ALA HA H 33 4.126 4.735 -0.609 1
1 338 . 4 1 1 A 33 33 ALA C C 33 177.795 177.835 -0.040 1
1 339 . 4 1 1 A 33 33 ALA CA C 33 54.213 50.686 3.527 1
1 340 . 4 1 1 A 33 33 ALA CB C 33 17.948 20.479 -2.531 1
1 341 . 4 1 1 A 33 33 ALA N N 33 131.772 124.175 7.597 1
1 342 . 4 1 1 A 34 34 GLY H H 34 8.576 8.958 -0.382 1
1 343 . 4 1 1 A 34 34 GLY HA2 H 34 4.171 3.999 0.172 1
1 344 . 4 1 1 A 34 34 GLY HA3 H 34 3.592 4.002 -0.410 1
1 345 . 4 1 1 A 34 34 GLY C C 34 174.182 174.501 -0.319 1
1 346 . 4 1 1 A 34 34 GLY CA C 34 44.987 45.025 -0.038 1
1 347 . 4 1 1 A 34 34 GLY N N 34 111.339 111.508 -0.169 1
1 348 . 4 1 1 A 35 35 ALA H H 35 7.637 7.842 -0.205 1
1 349 . 4 1 1 A 35 35 ALA HA H 35 4.210 4.274 -0.064 1
1 353 . 4 1 1 A 35 35 ALA C C 35 178.918 177.385 1.533 1
1 354 . 4 1 1 A 35 35 ALA CA C 35 52.671 52.546 0.125 1
1 355 . 4 1 1 A 35 35 ALA CB C 35 18.988 19.649 -0.661 1
1 356 . 4 1 1 A 35 35 ALA N N 35 121.531 123.416 -1.885 1
1 357 . 4 1 1 A 36 36 THR H H 36 9.428 8.360 1.068 1
1 358 . 4 1 1 A 36 36 THR HA H 36 4.402 4.356 0.046 1
1 363 . 4 1 1 A 36 36 THR C C 36 174.739 174.423 0.316 1
1 364 . 4 1 1 A 36 36 THR CA C 36 62.692 63.295 -0.603 1
1 365 . 4 1 1 A 36 36 THR CB C 36 69.482 69.833 -0.351 1
1 367 . 4 1 1 A 36 36 THR N N 36 113.103 116.339 -3.236 1
1 368 . 4 1 1 A 37 37 HIS H H 37 7.857 6.971 0.886 1
1 369 . 4 1 1 A 37 37 HIS HA H 37 4.878 4.479 0.399 1
1 374 . 4 1 1 A 37 37 HIS C C 37 171.103 172.126 -1.023 1
1 375 . 4 1 1 A 37 37 HIS CA C 37 55.867 54.481 1.386 1
1 376 . 4 1 1 A 37 37 HIS CB C 37 32.655 31.062 1.593 1
1 379 . 4 1 1 A 37 37 HIS N N 37 118.486 115.726 2.760 1
1 380 . 4 1 1 A 38 38 TYR H H 38 9.217 8.405 0.812 1
1 381 . 4 1 1 A 38 38 TYR HA H 38 5.303 5.009 0.294 1
1 388 . 4 1 1 A 38 38 TYR C C 38 173.922 174.866 -0.944 1
1 389 . 4 1 1 A 38 38 TYR CA C 38 56.504 56.459 0.045 1
1 390 . 4 1 1 A 38 38 TYR CB C 38 41.823 41.794 0.029 1
1 395 . 4 1 1 A 38 38 TYR N N 38 114.077 119.042 -4.965 1
1 396 . 4 1 1 A 39 39 LEU H H 39 9.052 8.683 0.369 1
1 397 . 4 1 1 A 39 39 LEU HA H 39 5.061 5.110 -0.049 1
1 407 . 4 1 1 A 39 39 LEU C C 39 175.455 174.902 0.553 1
1 408 . 4 1 1 A 39 39 LEU CA C 39 53.855 54.228 -0.373 1
1 409 . 4 1 1 A 39 39 LEU CB C 39 45.254 44.026 1.228 1
1 413 . 4 1 1 A 39 39 LEU N N 39 123.997 125.736 -1.739 1
1 414 . 4 1 1 A 40 40 VAL H H 40 9.520 9.028 0.492 1
1 415 . 4 1 1 A 40 40 VAL HA H 40 4.988 4.800 0.188 1
1 423 . 4 1 1 A 40 40 VAL C C 40 174.578 174.614 -0.036 1
1 424 . 4 1 1 A 40 40 VAL CA C 40 60.575 61.819 -1.244 1
1 425 . 4 1 1 A 40 40 VAL CB C 40 33.284 34.432 -1.148 1
1 428 . 4 1 1 A 40 40 VAL N N 40 129.678 125.470 4.208 1
1 429 . 4 1 1 A 41 41 ARG H H 41 9.096 9.149 -0.053 1
1 430 . 4 1 1 A 41 41 ARG HA H 41 5.384 5.147 0.237 1
1 437 . 4 1 1 A 41 41 ARG C C 41 175.100 175.158 -0.058 1
1 438 . 4 1 1 A 41 41 ARG CA C 41 54.297 55.607 -1.310 1
1 439 . 4 1 1 A 41 41 ARG CB C 41 33.003 31.165 1.838 1
1 442 . 4 1 1 A 41 41 ARG N N 41 126.332 126.743 -0.411 1
1 443 . 4 1 1 A 42 42 CYS H H 42 9.004 9.342 -0.338 1
1 444 . 4 1 1 A 42 42 CYS HA H 42 5.309 5.345 -0.036 1
1 447 . 4 1 1 A 42 42 CYS C C 42 173.417 173.928 -0.511 1
1 448 . 4 1 1 A 42 42 CYS CA C 42 57.508 57.281 0.227 1
1 449 . 4 1 1 A 42 42 CYS CB C 42 28.859 29.102 -0.243 1
1 450 . 4 1 1 A 42 42 CYS N N 42 123.359 124.192 -0.833 1
1 451 . 4 1 1 A 43 43 SER H H 43 9.102 9.070 0.032 1
1 452 . 4 1 1 A 43 43 SER HA H 43 5.324 5.012 0.312 1
1 455 . 4 1 1 A 43 43 SER C C 43 171.429 171.860 -0.431 1
1 456 . 4 1 1 A 43 43 SER CA C 43 55.621 55.564 0.057 1
1 457 . 4 1 1 A 43 43 SER CB C 43 64.856 65.944 -1.088 1
1 458 . 4 1 1 A 43 43 SER N N 43 125.444 119.500 5.944 1
1 459 . 4 1 1 A 44 44 PRO HA H 44 4.389 4.624 -0.235 1
1 466 . 4 1 1 A 44 44 PRO C C 44 176.559 177.030 -0.471 1
1 467 . 4 1 1 A 44 44 PRO CA C 44 63.027 62.786 0.241 1
1 468 . 4 1 1 A 44 44 PRO CB C 44 31.935 32.752 -0.817 1
1 471 . 4 1 1 A 45 45 ALA H H 45 8.261 7.958 0.303 1
1 472 . 4 1 1 A 45 45 ALA HA H 45 4.157 4.147 0.010 1
1 476 . 4 1 1 A 45 45 ALA C C 45 177.706 177.099 0.607 1
1 477 . 4 1 1 A 45 45 ALA CA C 45 53.284 53.507 -0.223 1
1 478 . 4 1 1 A 45 45 ALA CB C 45 18.978 19.298 -0.320 1
1 479 . 4 1 1 A 45 45 ALA N N 45 126.162 123.537 2.625 1
1 480 . 4 1 1 A 46 46 SER H H 46 8.275 7.664 0.611 1
1 481 . 4 1 1 A 46 46 SER HA H 46 4.779 4.762 0.017 1
1 484 . 4 1 1 A 46 46 SER C C 46 172.182 174.062 -1.880 1
1 485 . 4 1 1 A 46 46 SER CA C 46 55.091 54.981 0.110 1
1 486 . 4 1 1 A 46 46 SER CB C 46 63.130 64.238 -1.108 1
1 487 . 4 1 1 A 46 46 SER N N 46 113.009 110.586 2.423 1
1 488 . 4 1 1 A 47 47 PRO HA H 47 4.336 4.580 -0.244 1
1 493 . 4 1 1 A 47 47 PRO C C 47 177.165 176.494 0.671 1
1 494 . 4 1 1 A 47 47 PRO CA C 47 63.268 63.782 -0.514 1
1 495 . 4 1 1 A 47 47 PRO CB C 47 32.528 31.585 0.943 1
1 498 . 4 1 1 A 48 48 LYS H H 48 9.089 7.604 1.485 1
1 499 . 4 1 1 A 48 48 LYS HA H 48 4.408 4.373 0.035 1
1 508 . 4 1 1 A 48 48 LYS C C 48 176.917 176.097 0.820 1
1 509 . 4 1 1 A 48 48 LYS CA C 48 55.893 56.181 -0.288 1
1 510 . 4 1 1 A 48 48 LYS CB C 48 32.997 32.342 0.655 1
1 514 . 4 1 1 A 48 48 LYS N N 48 122.579 116.396 6.183 1
1 515 . 4 1 1 A 49 49 GLY HA2 H 49 4.021 4.065 -0.044 1
1 516 . 4 1 1 A 49 49 GLY HA3 H 49 3.881 4.065 -0.184 1
1 517 . 4 1 1 A 49 49 GLY C C 49 174.552 172.444 2.108 1
1 518 . 4 1 1 A 49 49 GLY CA C 49 46.011 44.290 1.721 1
1 519 . 4 1 1 A 50 50 GLU H H 50 8.608 8.485 0.123 1
1 520 . 4 1 1 A 50 50 GLU HA H 50 4.335 4.540 -0.205 1
1 525 . 4 1 1 A 50 50 GLU C C 50 176.672 175.295 1.377 1
1 526 . 4 1 1 A 50 50 GLU CA C 50 56.978 54.957 2.021 1
1 527 . 4 1 1 A 50 50 GLU CB C 50 29.458 29.579 -0.121 1
1 529 . 4 1 1 A 50 50 GLU N N 50 121.378 123.752 -2.374 1
1 530 . 4 1 1 A 51 51 GLU H H 51 8.287 8.371 -0.084 1
1 531 . 4 1 1 A 51 51 GLU HA H 51 4.381 4.290 0.091 1
1 536 . 4 1 1 A 51 51 GLU C C 51 176.218 176.297 -0.079 1
1 537 . 4 1 1 A 51 51 GLU CA C 51 56.996 56.834 0.162 1
1 538 . 4 1 1 A 51 51 GLU CB C 51 31.066 29.708 1.358 1
1 540 . 4 1 1 A 51 51 GLU N N 51 120.863 125.950 -5.087 1
1 541 . 4 1 1 A 52 52 GLU H H 52 8.445 8.366 0.079 1
1 542 . 4 1 1 A 52 52 GLU HA H 52 4.464 4.690 -0.226 1
1 547 . 4 1 1 A 52 52 GLU C C 52 176.128 174.369 1.759 1
1 548 . 4 1 1 A 52 52 GLU CA C 52 55.955 56.220 -0.265 1
1 549 . 4 1 1 A 52 52 GLU CB C 52 31.691 33.925 -2.234 1
1 551 . 4 1 1 A 52 52 GLU N N 52 121.103 124.956 -3.853 1
1 552 . 4 1 1 A 53 53 GLU H H 53 8.441 8.721 -0.280 1
1 553 . 4 1 1 A 53 53 GLU HA H 53 4.609 4.959 -0.350 1
1 558 . 4 1 1 A 53 53 GLU C C 53 175.816 174.821 0.995 1
1 559 . 4 1 1 A 53 53 GLU CA C 53 56.697 55.144 1.553 1
1 560 . 4 1 1 A 53 53 GLU CB C 53 31.022 31.951 -0.929 1
1 562 . 4 1 1 A 53 53 GLU N N 53 121.949 125.608 -3.659 1
1 563 . 4 1 1 A 54 54 ARG H H 54 8.569 9.094 -0.525 1
1 564 . 4 1 1 A 54 54 ARG HA H 54 4.768 4.752 0.016 1
1 571 . 4 1 1 A 54 54 ARG C C 54 174.881 175.155 -0.274 1
1 572 . 4 1 1 A 54 54 ARG CA C 54 54.950 54.964 -0.014 1
1 573 . 4 1 1 A 54 54 ARG CB C 54 33.374 31.560 1.814 1
1 576 . 4 1 1 A 54 54 ARG N N 54 123.714 123.877 -0.163 1
1 577 . 4 1 1 A 55 55 GLU H H 55 8.650 8.915 -0.265 1
1 578 . 4 1 1 A 55 55 GLU HA H 55 5.493 4.883 0.610 1
1 583 . 4 1 1 A 55 55 GLU C C 55 175.566 176.323 -0.757 1
1 584 . 4 1 1 A 55 55 GLU CA C 55 54.915 55.680 -0.765 1
1 585 . 4 1 1 A 55 55 GLU CB C 55 33.250 31.001 2.249 1
1 587 . 4 1 1 A 55 55 GLU N N 55 123.537 128.551 -5.014 1
1 588 . 4 1 1 A 56 56 VAL H H 56 9.419 8.643 0.776 1
1 589 . 4 1 1 A 56 56 VAL HA H 56 4.524 4.923 -0.399 1
1 597 . 4 1 1 A 56 56 VAL C C 56 173.502 173.997 -0.495 1
1 598 . 4 1 1 A 56 56 VAL CA C 56 60.981 58.937 2.044 1
1 599 . 4 1 1 A 56 56 VAL CB C 56 36.117 35.808 0.309 1
1 602 . 4 1 1 A 56 56 VAL N N 56 123.343 120.795 2.548 1
1 603 . 4 1 1 A 57 57 GLN H H 57 8.767 8.771 -0.004 1
1 604 . 4 1 1 A 57 57 GLN HA H 57 5.671 4.966 0.705 1
1 611 . 4 1 1 A 57 57 GLN C C 57 176.357 175.222 1.135 1
1 612 . 4 1 1 A 57 57 GLN CA C 57 54.735 55.011 -0.276 1
1 613 . 4 1 1 A 57 57 GLN CB C 57 30.781 30.033 0.748 1
1 615 . 4 1 1 A 57 57 GLN N N 57 125.639 121.556 4.083 1
1 617 . 4 1 1 A 58 58 VAL H H 58 9.217 9.387 -0.170 1
1 618 . 4 1 1 A 58 58 VAL HA H 58 5.129 4.822 0.307 1
1 626 . 4 1 1 A 58 58 VAL C C 58 175.925 176.625 -0.700 1
1 627 . 4 1 1 A 58 58 VAL CA C 58 59.652 60.858 -1.206 1
1 628 . 4 1 1 A 58 58 VAL CB C 58 36.540 34.301 2.239 1
1 631 . 4 1 1 A 58 58 VAL N N 58 117.022 120.273 -3.251 1
1 632 . 4 1 1 A 59 59 GLY H H 59 9.008 8.737 0.271 1
1 633 . 4 1 1 A 59 59 GLY HA2 H 59 4.670 3.809 0.861 1
1 634 . 4 1 1 A 59 59 GLY HA3 H 59 3.914 3.852 0.062 1
1 635 . 4 1 1 A 59 59 GLY C C 59 173.386 174.048 -0.662 1
1 636 . 4 1 1 A 59 59 GLY CA C 59 45.093 45.792 -0.699 1
1 637 . 4 1 1 A 59 59 GLY N N 59 109.174 111.028 -1.854 1
1 638 . 4 1 1 A 60 60 ARG H H 60 7.695 7.602 0.093 1
1 639 . 4 1 1 A 60 60 ARG HA H 60 4.866 5.078 -0.212 1
1 645 . 4 1 1 A 60 60 ARG C C 60 173.760 175.705 -1.945 1
1 646 . 4 1 1 A 60 60 ARG CA C 60 52.764 53.485 -0.721 1
1 647 . 4 1 1 A 60 60 ARG CB C 60 31.785 32.246 -0.461 1
1 650 . 4 1 1 A 60 60 ARG N N 60 118.520 118.294 0.226 1
1 651 . 4 1 1 A 61 61 PRO HA H 61 3.539 4.109 -0.570 1
1 658 . 4 1 1 A 61 61 PRO C C 61 173.175 173.797 -0.622 1
1 659 . 4 1 1 A 61 61 PRO CA C 61 62.265 63.131 -0.866 1
1 660 . 4 1 1 A 61 61 PRO CB C 61 27.546 30.913 -3.367 1
1 663 . 4 1 1 A 62 62 GLU H H 62 7.879 7.649 0.230 1
1 664 . 4 1 1 A 62 62 GLU HA H 62 4.071 4.645 -0.574 1
1 669 . 4 1 1 A 62 62 GLU C C 62 174.107 174.536 -0.429 1
1 670 . 4 1 1 A 62 62 GLU CA C 62 55.229 54.250 0.979 1
1 671 . 4 1 1 A 62 62 GLU CB C 62 32.838 32.118 0.720 1
1 673 . 4 1 1 A 62 62 GLU N N 62 118.173 113.966 4.207 1
1 674 . 4 1 1 A 63 63 VAL H H 63 8.930 8.766 0.164 1
1 675 . 4 1 1 A 63 63 VAL HA H 63 4.548 5.097 -0.549 1
1 683 . 4 1 1 A 63 63 VAL C C 63 170.325 173.623 -3.298 1
1 684 . 4 1 1 A 63 63 VAL CA C 63 60.770 59.441 1.329 1
1 685 . 4 1 1 A 63 63 VAL CB C 63 35.394 34.668 0.726 1
1 688 . 4 1 1 A 63 63 VAL N N 63 117.161 124.482 -7.321 1
1 689 . 4 1 1 A 64 64 LEU H H 64 8.332 8.917 -0.585 1
1 690 . 4 1 1 A 64 64 LEU HA H 64 5.122 5.217 -0.095 1
1 700 . 4 1 1 A 64 64 LEU C C 64 176.243 174.928 1.315 1
1 701 . 4 1 1 A 64 64 LEU CA C 64 53.346 53.498 -0.152 1
1 702 . 4 1 1 A 64 64 LEU CB C 64 42.649 44.612 -1.963 1
1 706 . 4 1 1 A 64 64 LEU N N 64 130.510 129.298 1.212 1
1 707 . 4 1 1 A 65 65 LEU H H 65 9.261 9.382 -0.121 1
1 708 . 4 1 1 A 65 65 LEU HA H 65 4.443 4.570 -0.127 1
1 718 . 4 1 1 A 65 65 LEU C C 65 174.016 176.058 -2.042 1
1 719 . 4 1 1 A 65 65 LEU CA C 65 53.920 54.562 -0.642 1
1 720 . 4 1 1 A 65 65 LEU CB C 65 42.976 41.367 1.609 1
1 724 . 4 1 1 A 65 65 LEU N N 65 128.611 128.772 -0.161 1
1 725 . 4 1 1 A 66 66 ASP H H 66 8.105 8.726 -0.621 1
1 726 . 4 1 1 A 66 66 ASP HA H 66 5.207 5.046 0.161 1
1 729 . 4 1 1 A 66 66 ASP C C 66 176.161 176.483 -0.322 1
1 730 . 4 1 1 A 66 66 ASP CA C 66 51.001 53.694 -2.693 1
1 731 . 4 1 1 A 66 66 ASP CB C 66 42.836 42.108 0.728 1
1 732 . 4 1 1 A 66 66 ASP N N 66 121.799 124.966 -3.167 1
1 733 . 4 1 1 A 67 67 GLY H H 67 8.688 8.335 0.353 1
1 734 . 4 1 1 A 67 67 GLY HA2 H 67 3.923 3.969 -0.046 1
1 735 . 4 1 1 A 67 67 GLY HA3 H 67 3.808 3.971 -0.163 1
1 736 . 4 1 1 A 67 67 GLY C C 67 175.500 174.180 1.320 1
1 737 . 4 1 1 A 67 67 GLY CA C 67 46.591 46.770 -0.179 1
1 738 . 4 1 1 A 67 67 GLY N N 67 106.518 110.912 -4.394 1
1 739 . 4 1 1 A 68 68 LEU H H 68 8.125 7.469 0.656 1
1 740 . 4 1 1 A 68 68 LEU HA H 68 4.252 4.967 -0.715 1
1 750 . 4 1 1 A 68 68 LEU C C 68 174.914 175.198 -0.284 1
1 751 . 4 1 1 A 68 68 LEU CA C 68 53.469 53.207 0.262 1
1 752 . 4 1 1 A 68 68 LEU CB C 68 40.422 45.989 -5.567 1
1 756 . 4 1 1 A 68 68 LEU N N 68 119.345 120.069 -0.724 1
1 757 . 4 1 1 A 69 69 GLU H H 69 8.207 8.541 -0.334 1
1 758 . 4 1 1 A 69 69 GLU HA H 69 4.908 4.852 0.056 1
1 763 . 4 1 1 A 69 69 GLU C C 69 174.464 174.161 0.303 1
1 764 . 4 1 1 A 69 69 GLU CA C 69 53.081 53.077 0.004 1
1 765 . 4 1 1 A 69 69 GLU CB C 69 31.538 30.951 0.587 1
1 767 . 4 1 1 A 69 69 GLU N N 69 119.486 121.321 -1.835 1
1 768 . 4 1 1 A 70 70 PRO HA H 70 4.866 4.340 0.526 1
1 775 . 4 1 1 A 70 70 PRO C C 70 178.285 177.445 0.840 1
1 776 . 4 1 1 A 70 70 PRO CA C 70 63.203 63.608 -0.405 1
1 777 . 4 1 1 A 70 70 PRO CB C 70 33.726 31.996 1.730 1
1 780 . 4 1 1 A 71 71 GLY H H 71 7.362 9.253 -1.891 1
1 781 . 4 1 1 A 71 71 GLY HA2 H 71 3.807 3.975 -0.168 1
1 782 . 4 1 1 A 71 71 GLY HA3 H 71 3.756 3.981 -0.225 1
1 783 . 4 1 1 A 71 71 GLY C C 71 174.664 173.802 0.862 1
1 784 . 4 1 1 A 71 71 GLY CA C 71 46.926 46.147 0.779 1
1 785 . 4 1 1 A 71 71 GLY N N 71 113.776 111.451 2.325 1
1 786 . 4 1 1 A 72 72 ARG H H 72 8.036 7.400 0.636 1
1 787 . 4 1 1 A 72 72 ARG HA H 72 4.597 4.829 -0.232 1
1 793 . 4 1 1 A 72 72 ARG C C 72 173.293 174.070 -0.777 1
1 794 . 4 1 1 A 72 72 ARG CA C 72 54.633 54.447 0.186 1
1 795 . 4 1 1 A 72 72 ARG CB C 72 33.704 33.266 0.438 1
1 798 . 4 1 1 A 72 72 ARG N N 72 119.611 120.021 -0.410 1
1 799 . 4 1 1 A 73 73 ASP H H 73 7.785 8.508 -0.723 1
1 800 . 4 1 1 A 73 73 ASP HA H 73 5.276 5.413 -0.137 1
1 803 . 4 1 1 A 73 73 ASP C C 73 175.904 175.080 0.824 1
1 804 . 4 1 1 A 73 73 ASP CA C 73 53.568 53.032 0.536 1
1 805 . 4 1 1 A 73 73 ASP CB C 73 42.970 42.934 0.036 1
1 806 . 4 1 1 A 73 73 ASP N N 73 118.900 125.600 -6.700 1
1 807 . 4 1 1 A 74 74 TYR H H 74 9.516 8.919 0.597 1
1 808 . 4 1 1 A 74 74 TYR HA H 74 4.800 5.127 -0.327 1
1 815 . 4 1 1 A 74 74 TYR C C 74 174.631 174.957 -0.326 1
1 816 . 4 1 1 A 74 74 TYR CA C 74 58.548 56.796 1.752 1
1 817 . 4 1 1 A 74 74 TYR CB C 74 42.029 43.504 -1.475 1
1 822 . 4 1 1 A 74 74 TYR N N 74 121.903 120.802 1.101 1
1 823 . 4 1 1 A 75 75 GLU H H 75 9.248 9.236 0.012 1
1 824 . 4 1 1 A 75 75 GLU HA H 75 4.756 5.163 -0.407 1
1 829 . 4 1 1 A 75 75 GLU C C 75 175.524 175.606 -0.082 1
1 830 . 4 1 1 A 75 75 GLU CA C 75 55.621 55.615 0.006 1
1 831 . 4 1 1 A 75 75 GLU CB C 75 30.778 31.860 -1.082 1
1 833 . 4 1 1 A 75 75 GLU N N 75 122.425 120.797 1.628 1
1 834 . 4 1 1 A 76 76 VAL H H 76 8.884 8.561 0.323 1
1 835 . 4 1 1 A 76 76 VAL HA H 76 5.246 5.134 0.112 1
1 843 . 4 1 1 A 76 76 VAL C C 76 174.800 174.311 0.489 1
1 844 . 4 1 1 A 76 76 VAL CA C 76 60.199 61.183 -0.984 1
1 845 . 4 1 1 A 76 76 VAL CB C 76 33.449 33.807 -0.358 1
1 848 . 4 1 1 A 76 76 VAL N N 76 126.853 125.892 0.961 1
1 849 . 4 1 1 A 77 77 SER H H 77 9.234 8.777 0.457 1
1 850 . 4 1 1 A 77 77 SER HA H 77 5.398 5.094 0.304 1
1 853 . 4 1 1 A 77 77 SER C C 77 173.138 173.471 -0.333 1
1 854 . 4 1 1 A 77 77 SER CA C 77 56.032 56.630 -0.598 1
1 855 . 4 1 1 A 77 77 SER CB C 77 66.374 65.053 1.321 1
1 856 . 4 1 1 A 77 77 SER N N 77 120.852 122.887 -2.035 1
1 857 . 4 1 1 A 78 78 VAL H H 78 9.092 8.909 0.183 1
1 858 . 4 1 1 A 78 78 VAL HA H 78 4.756 4.737 0.019 1
1 866 . 4 1 1 A 78 78 VAL C C 78 173.641 174.370 -0.729 1
1 867 . 4 1 1 A 78 78 VAL CA C 78 61.246 60.919 0.327 1
1 868 . 4 1 1 A 78 78 VAL CB C 78 34.467 33.785 0.682 1
1 871 . 4 1 1 A 78 78 VAL N N 78 122.453 125.187 -2.734 1
1 872 . 4 1 1 A 79 79 GLN H H 79 8.587 8.457 0.130 1
1 873 . 4 1 1 A 79 79 GLN HA H 79 4.438 4.858 -0.420 1
1 880 . 4 1 1 A 79 79 GLN C C 79 174.999 174.746 0.253 1
1 881 . 4 1 1 A 79 79 GLN CA C 79 54.227 53.982 0.245 1
1 882 . 4 1 1 A 79 79 GLN CB C 79 33.587 31.865 1.722 1
1 884 . 4 1 1 A 79 79 GLN N N 79 125.619 128.134 -2.515 1
1 886 . 4 1 1 A 80 80 SER H H 80 8.623 8.865 -0.242 1
1 887 . 4 1 1 A 80 80 SER HA H 80 4.756 4.773 -0.017 1
1 890 . 4 1 1 A 80 80 SER C C 80 172.264 174.282 -2.018 1
1 891 . 4 1 1 A 80 80 SER CA C 80 58.177 59.901 -1.724 1
1 892 . 4 1 1 A 80 80 SER CB C 80 63.920 63.482 0.438 1
1 893 . 4 1 1 A 80 80 SER N N 80 122.844 123.634 -0.790 1
1 894 . 4 1 1 A 81 81 LEU H H 81 8.348 8.917 -0.569 1
1 895 . 4 1 1 A 81 81 LEU HA H 81 5.124 4.593 0.531 1
1 905 . 4 1 1 A 81 81 LEU C C 81 175.775 176.116 -0.341 1
1 906 . 4 1 1 A 81 81 LEU CA C 81 54.033 53.381 0.652 1
1 907 . 4 1 1 A 81 81 LEU CB C 81 44.690 43.312 1.378 1
1 911 . 4 1 1 A 81 81 LEU N N 81 123.191 127.039 -3.848 1
1 912 . 4 1 1 A 82 82 ARG H H 82 8.374 9.030 -0.656 1
1 913 . 4 1 1 A 82 82 ARG HA H 82 4.616 4.350 0.266 1
1 919 . 4 1 1 A 82 82 ARG C C 82 176.864 175.870 0.994 1
1 920 . 4 1 1 A 82 82 ARG CA C 82 55.868 56.895 -1.027 1
1 921 . 4 1 1 A 82 82 ARG CB C 82 32.322 33.151 -0.829 1
1 924 . 4 1 1 A 82 82 ARG N N 82 121.029 125.920 -4.891 1
1 925 . 4 1 1 A 83 83 GLY H H 83 8.309 7.893 0.416 1
1 926 . 4 1 1 A 83 83 GLY HA2 H 83 4.031 4.127 -0.096 1
1 927 . 4 1 1 A 83 83 GLY HA3 H 83 3.888 4.151 -0.263 1
1 928 . 4 1 1 A 83 83 GLY C C 83 174.562 174.461 0.101 1
1 929 . 4 1 1 A 83 83 GLY CA C 83 45.963 44.665 1.298 1
1 930 . 4 1 1 A 83 83 GLY N N 83 109.937 106.664 3.273 1
1 931 . 4 1 1 A 84 84 PRO HA H 84 4.573 4.522 0.051 1
1 938 . 4 1 1 A 84 84 PRO C C 84 176.533 175.470 1.063 1
1 939 . 4 1 1 A 84 84 PRO CA C 84 63.485 64.085 -0.600 1
1 940 . 4 1 1 A 84 84 PRO CB C 84 32.409 31.881 0.528 1
1 943 . 4 1 1 A 85 85 GLU H H 85 7.799 7.575 0.224 1
1 944 . 4 1 1 A 85 85 GLU HA H 85 4.369 4.916 -0.547 1
1 949 . 4 1 1 A 85 85 GLU C C 85 174.722 175.651 -0.929 1
1 950 . 4 1 1 A 85 85 GLU CA C 85 55.899 54.662 1.237 1
1 951 . 4 1 1 A 85 85 GLU CB C 85 31.911 33.005 -1.094 1
1 953 . 4 1 1 A 85 85 GLU N N 85 122.093 113.253 8.840 1
1 954 . 4 1 1 A 86 86 GLY H H 86 8.329 8.936 -0.607 1
1 955 . 4 1 1 A 86 86 GLY HA2 H 86 5.298 4.278 1.020 1
1 956 . 4 1 1 A 86 86 GLY HA3 H 86 3.559 4.288 -0.729 1
1 957 . 4 1 1 A 86 86 GLY C C 86 174.355 172.571 1.784 1
1 958 . 4 1 1 A 86 86 GLY CA C 86 44.034 43.708 0.326 1
1 959 . 4 1 1 A 86 86 GLY N N 86 109.387 109.978 -0.591 1
1 960 . 4 1 1 A 87 87 SER H H 87 8.807 8.402 0.405 1
1 961 . 4 1 1 A 87 87 SER HA H 87 4.670 4.456 0.214 1
1 964 . 4 1 1 A 87 87 SER C C 87 175.195 174.335 0.860 1
1 965 . 4 1 1 A 87 87 SER CA C 87 57.737 57.246 0.491 1
1 966 . 4 1 1 A 87 87 SER CB C 87 67.829 63.773 4.056 1
1 967 . 4 1 1 A 87 87 SER N N 87 117.698 115.734 1.964 1
1 968 . 4 1 1 A 88 88 GLU H H 88 8.754 8.655 0.099 1
1 969 . 4 1 1 A 88 88 GLU HA H 88 4.357 4.316 0.041 1
1 974 . 4 1 1 A 88 88 GLU C C 88 177.474 176.566 0.908 1
1 975 . 4 1 1 A 88 88 GLU CA C 88 57.525 56.749 0.776 1
1 976 . 4 1 1 A 88 88 GLU CB C 88 31.162 30.725 0.437 1
1 978 . 4 1 1 A 88 88 GLU N N 88 118.709 122.297 -3.588 1
1 979 . 4 1 1 A 89 89 ALA H H 89 8.855 8.491 0.364 1
1 980 . 4 1 1 A 89 89 ALA HA H 89 4.792 4.750 0.042 1
1 984 . 4 1 1 A 89 89 ALA C C 89 178.379 176.269 2.110 1
1 985 . 4 1 1 A 89 89 ALA CA C 89 51.264 51.141 0.123 1
1 986 . 4 1 1 A 89 89 ALA CB C 89 20.040 20.053 -0.013 1
1 987 . 4 1 1 A 89 89 ALA N N 89 127.301 123.857 3.444 1
1 988 . 4 1 1 A 90 90 ARG H H 90 8.549 8.319 0.230 1
1 989 . 4 1 1 A 90 90 ARG HA H 90 4.658 4.917 -0.259 1
1 996 . 4 1 1 A 90 90 ARG C C 90 174.720 175.256 -0.536 1
1 997 . 4 1 1 A 90 90 ARG CA C 90 53.575 54.467 -0.892 1
1 998 . 4 1 1 A 90 90 ARG CB C 90 33.456 31.849 1.607 1
1 1001 . 4 1 1 A 90 90 ARG N N 90 121.289 123.442 -2.153 1
1 1002 . 4 1 1 A 91 91 GLY H H 91 8.396 8.837 -0.441 1
1 1003 . 4 1 1 A 91 91 GLY HA2 H 91 5.306 4.221 1.085 1
1 1004 . 4 1 1 A 91 91 GLY HA3 H 91 3.700 4.253 -0.553 1
1 1005 . 4 1 1 A 91 91 GLY C C 91 173.191 172.193 0.998 1
1 1006 . 4 1 1 A 91 91 GLY CA C 91 44.493 43.906 0.587 1
1 1007 . 4 1 1 A 91 91 GLY N N 91 108.579 111.953 -3.374 1
1 1008 . 4 1 1 A 92 92 ILE H H 92 8.891 8.324 0.567 1
1 1009 . 4 1 1 A 92 92 ILE HA H 92 4.499 5.060 -0.561 1
1 1019 . 4 1 1 A 92 92 ILE C C 92 171.877 174.085 -2.208 1
1 1020 . 4 1 1 A 92 92 ILE CA C 92 60.682 59.046 1.636 1
1 1021 . 4 1 1 A 92 92 ILE CB C 92 42.425 41.913 0.512 1
1 1025 . 4 1 1 A 92 92 ILE N N 92 118.313 121.593 -3.280 1
1 1026 . 4 1 1 A 93 93 ARG H H 93 7.980 8.530 -0.550 1
1 1027 . 4 1 1 A 93 93 ARG HA H 93 5.224 4.737 0.487 1
1 1034 . 4 1 1 A 93 93 ARG C C 93 175.072 174.988 0.084 1
1 1035 . 4 1 1 A 93 93 ARG CA C 93 54.499 55.440 -0.941 1
1 1036 . 4 1 1 A 93 93 ARG CB C 93 31.767 29.873 1.894 1
1 1039 . 4 1 1 A 93 93 ARG N N 93 124.879 128.880 -4.001 1
1 1040 . 4 1 1 A 94 94 ALA H H 94 9.064 8.166 0.898 1
1 1041 . 4 1 1 A 94 94 ALA HA H 94 4.731 4.407 0.324 1
1 1045 . 4 1 1 A 94 94 ALA C C 94 174.494 177.750 -3.256 1
1 1046 . 4 1 1 A 94 94 ALA CA C 94 50.577 53.129 -2.552 1
1 1047 . 4 1 1 A 94 94 ALA CB C 94 23.082 19.387 3.695 1
1 1048 . 4 1 1 A 94 94 ALA N N 94 126.095 129.482 -3.387 1
1 1049 . 4 1 1 A 95 95 ARG H H 95 8.263 8.974 -0.711 1
1 1050 . 4 1 1 A 95 95 ARG HA H 95 5.548 5.282 0.266 1
1 1058 . 4 1 1 A 95 95 ARG C C 95 176.901 174.902 1.999 1
1 1059 . 4 1 1 A 95 95 ARG CA C 95 53.787 54.305 -0.518 1
1 1060 . 4 1 1 A 95 95 ARG CB C 95 32.426 33.678 -1.252 1
1 1063 . 4 1 1 A 95 95 ARG N N 95 123.374 118.731 4.643 1
1 1065 . 4 1 1 A 96 96 THR H H 96 9.208 8.794 0.414 1
1 1066 . 4 1 1 A 96 96 THR HA H 96 4.461 5.074 -0.613 1
1 1071 . 4 1 1 A 96 96 THR CA C 96 58.248 58.377 -0.129 1
1 1072 . 4 1 1 A 96 96 THR CB C 96 68.466 71.135 -2.669 1
1 1074 . 4 1 1 A 96 96 THR N N 96 119.492 111.395 8.097 1
1 1075 . 4 1 1 A 97 97 PRO HA H 97 4.636 4.615 0.021 1
1 1082 . 4 1 1 A 97 97 PRO C C 97 175.725 175.844 -0.119 1
1 1083 . 4 1 1 A 97 97 PRO CA C 97 61.907 62.331 -0.424 1
1 1084 . 4 1 1 A 97 97 PRO CB C 97 32.590 33.411 -0.821 1
1 1087 . 4 1 1 A 98 98 THR H H 98 7.943 8.417 -0.474 1
1 1088 . 4 1 1 A 98 98 THR HA H 98 4.208 5.255 -1.047 1
1 1093 . 4 1 1 A 98 98 THR C C 98 175.058 173.233 1.825 1
1 1094 . 4 1 1 A 98 98 THR CA C 98 62.069 60.176 1.893 1
1 1095 . 4 1 1 A 98 98 THR CB C 98 69.719 70.840 -1.121 1
1 1097 . 4 1 1 A 98 98 THR N N 98 107.148 110.955 -3.807 1
1 1098 . 4 1 1 A 99 99 SER H H 99 8.163 8.981 -0.818 1
1 1099 . 4 1 1 A 99 99 SER HA H 99 4.524 5.456 -0.932 1
1 1102 . 4 1 1 A 99 99 SER C C 99 174.319 173.090 1.229 1
1 1103 . 4 1 1 A 99 99 SER CA C 99 58.107 56.514 1.593 1
1 1104 . 4 1 1 A 99 99 SER CB C 99 64.492 66.185 -1.693 1
1 1105 . 4 1 1 A 99 99 SER N N 99 115.114 120.095 -4.981 1
1 1106 . 4 1 1 A 100 100 GLY H H 100 8.336 8.378 -0.042 1
1 1107 . 4 1 1 A 100 100 GLY HA2 H 100 4.222 4.219 0.003 1
1 1108 . 4 1 1 A 100 100 GLY HA3 H 100 4.222 4.220 0.002 1
1 1109 . 4 1 1 A 100 100 GLY C C 100 171.696 174.218 -2.522 1
1 1110 . 4 1 1 A 100 100 GLY CA C 100 44.617 45.617 -1.000 1
1 1111 . 4 1 1 A 100 100 GLY N N 100 110.678 112.668 -1.990 1
1 1112 . 4 1 1 A 101 101 PRO HA H 101 4.506 4.441 0.065 1
1 1118 . 4 1 1 A 101 101 PRO CA C 101 63.358 64.417 -1.059 1
1 1119 . 4 1 1 A 101 101 PRO CB C 101 32.313 32.283 0.030 1
1 1 . 5 1 1 A 6 6 SER HA H 6 4.528 5.144 -0.616 1
1 3 . 5 1 1 A 6 6 SER CA C 6 58.373 57.638 0.735 1
1 4 . 5 1 1 A 6 6 SER CB C 6 63.978 65.321 -1.343 1
1 5 . 5 1 1 A 7 7 GLY H H 7 8.228 8.436 -0.208 1
1 6 . 5 1 1 A 7 7 GLY HA2 H 7 4.134 4.158 -0.024 1
1 7 . 5 1 1 A 7 7 GLY HA3 H 7 4.134 4.162 -0.028 1
1 8 . 5 1 1 A 7 7 GLY CA C 7 44.607 44.962 -0.355 1
1 9 . 5 1 1 A 7 7 GLY N N 7 110.638 113.161 -2.523 1
1 10 . 5 1 1 A 8 8 PRO HA H 8 4.419 4.557 -0.138 1
1 17 . 5 1 1 A 8 8 PRO C C 8 176.908 175.268 1.640 1
1 18 . 5 1 1 A 8 8 PRO CA C 8 62.851 62.793 0.058 1
1 19 . 5 1 1 A 8 8 PRO CB C 8 32.243 32.490 -0.247 1
1 22 . 5 1 1 A 9 9 LEU H H 9 8.462 8.427 0.035 1
1 23 . 5 1 1 A 9 9 LEU HA H 9 4.494 4.910 -0.416 1
1 33 . 5 1 1 A 9 9 LEU C C 9 174.124 174.472 -0.348 1
1 34 . 5 1 1 A 9 9 LEU CA C 9 52.587 51.714 0.873 1
1 35 . 5 1 1 A 9 9 LEU CB C 9 43.150 43.541 -0.391 1
1 39 . 5 1 1 A 9 9 LEU N N 9 126.015 122.924 3.091 1
1 40 . 5 1 1 A 10 10 PRO HA H 10 4.820 4.576 0.244 1
1 47 . 5 1 1 A 10 10 PRO CA C 10 61.368 62.559 -1.191 1
1 48 . 5 1 1 A 10 10 PRO CB C 10 31.391 31.710 -0.319 1
1 51 . 5 1 1 A 11 11 PRO HA H 11 4.949 4.839 0.110 1
1 58 . 5 1 1 A 11 11 PRO CA C 11 61.183 61.833 -0.650 1
1 59 . 5 1 1 A 11 11 PRO CB C 11 30.656 31.994 -1.338 1
1 62 . 5 1 1 A 12 12 PRO HA H 12 4.341 4.740 -0.399 1
1 69 . 5 1 1 A 12 12 PRO C C 12 174.849 176.960 -2.111 1
1 70 . 5 1 1 A 12 12 PRO CA C 12 63.062 62.724 0.338 1
1 71 . 5 1 1 A 12 12 PRO CB C 12 31.831 31.845 -0.014 1
1 74 . 5 1 1 A 13 13 ARG H H 13 7.828 8.398 -0.570 1
1 75 . 5 1 1 A 13 13 ARG HA H 13 4.536 4.452 0.084 1
1 82 . 5 1 1 A 13 13 ARG C C 13 174.608 176.568 -1.960 1
1 83 . 5 1 1 A 13 13 ARG CA C 13 54.774 56.873 -2.099 1
1 84 . 5 1 1 A 13 13 ARG CB C 13 33.250 31.521 1.729 1
1 87 . 5 1 1 A 13 13 ARG N N 13 120.532 119.266 1.266 1
1 88 . 5 1 1 A 14 14 ALA H H 14 8.694 7.956 0.738 1
1 89 . 5 1 1 A 14 14 ALA HA H 14 3.986 4.392 -0.406 1
1 93 . 5 1 1 A 14 14 ALA C C 14 177.232 176.868 0.364 1
1 94 . 5 1 1 A 14 14 ALA CA C 14 52.461 52.161 0.300 1
1 95 . 5 1 1 A 14 14 ALA CB C 14 16.806 17.387 -0.581 1
1 96 . 5 1 1 A 14 14 ALA N N 14 121.921 120.452 1.469 1
1 97 . 5 1 1 A 15 15 LEU H H 15 8.097 8.096 0.001 1
1 98 . 5 1 1 A 15 15 LEU HA H 15 4.670 4.787 -0.117 1
1 108 . 5 1 1 A 15 15 LEU C C 15 177.364 175.529 1.835 1
1 109 . 5 1 1 A 15 15 LEU CA C 15 57.543 54.545 2.998 1
1 110 . 5 1 1 A 15 15 LEU CB C 15 41.877 40.566 1.311 1
1 114 . 5 1 1 A 15 15 LEU N N 15 122.215 120.834 1.381 1
1 115 . 5 1 1 A 16 16 THR H H 16 9.520 8.557 0.963 1
1 116 . 5 1 1 A 16 16 THR HA H 16 4.369 4.886 -0.517 1
1 121 . 5 1 1 A 16 16 THR C C 16 172.453 173.801 -1.348 1
1 122 . 5 1 1 A 16 16 THR CA C 16 62.480 61.276 1.204 1
1 123 . 5 1 1 A 16 16 THR CB C 16 72.198 71.582 0.616 1
1 125 . 5 1 1 A 16 16 THR N N 16 122.214 121.001 1.213 1
1 126 . 5 1 1 A 17 17 LEU H H 17 8.847 8.401 0.446 1
1 127 . 5 1 1 A 17 17 LEU HA H 17 4.573 4.406 0.167 1
1 137 . 5 1 1 A 17 17 LEU C C 17 174.695 177.156 -2.461 1
1 138 . 5 1 1 A 17 17 LEU CA C 17 53.840 55.281 -1.441 1
1 139 . 5 1 1 A 17 17 LEU CB C 17 40.290 42.761 -2.471 1
1 143 . 5 1 1 A 17 17 LEU N N 17 127.415 127.637 -0.222 1
1 144 . 5 1 1 A 18 18 ALA H H 18 8.647 8.608 0.039 1
1 145 . 5 1 1 A 18 18 ALA HA H 18 4.106 3.942 0.164 1
1 149 . 5 1 1 A 18 18 ALA C C 18 178.236 177.282 0.954 1
1 150 . 5 1 1 A 18 18 ALA CA C 18 53.926 54.487 -0.561 1
1 151 . 5 1 1 A 18 18 ALA CB C 18 18.876 18.894 -0.018 1
1 152 . 5 1 1 A 18 18 ALA N N 18 133.362 130.646 2.716 1
1 153 . 5 1 1 A 19 19 ALA H H 19 7.772 7.316 0.456 1
1 154 . 5 1 1 A 19 19 ALA HA H 19 4.561 4.640 -0.079 1
1 158 . 5 1 1 A 19 19 ALA C C 19 176.032 174.955 1.077 1
1 159 . 5 1 1 A 19 19 ALA CA C 19 53.011 51.912 1.099 1
1 160 . 5 1 1 A 19 19 ALA CB C 19 21.869 22.241 -0.372 1
1 161 . 5 1 1 A 19 19 ALA N N 19 115.654 116.405 -0.751 1
1 162 . 5 1 1 A 20 20 VAL H H 20 8.697 8.872 -0.175 1
1 163 . 5 1 1 A 20 20 VAL HA H 20 4.951 4.673 0.278 1
1 171 . 5 1 1 A 20 20 VAL C C 20 174.314 174.464 -0.150 1
1 172 . 5 1 1 A 20 20 VAL CA C 20 61.352 61.005 0.347 1
1 173 . 5 1 1 A 20 20 VAL CB C 20 35.394 32.949 2.445 1
1 176 . 5 1 1 A 20 20 VAL N N 20 120.848 123.925 -3.077 1
1 177 . 5 1 1 A 21 21 THR H H 21 9.198 8.423 0.775 1
1 178 . 5 1 1 A 21 21 THR HA H 21 4.941 4.783 0.158 1
1 183 . 5 1 1 A 21 21 THR C C 21 174.416 174.636 -0.220 1
1 184 . 5 1 1 A 21 21 THR CA C 21 60.347 59.016 1.331 1
1 185 . 5 1 1 A 21 21 THR CB C 21 68.713 71.888 -3.175 1
1 187 . 5 1 1 A 21 21 THR N N 21 120.326 125.155 -4.829 1
1 188 . 5 1 1 A 22 22 PRO HA H 22 4.634 4.558 0.076 1
1 194 . 5 1 1 A 22 22 PRO C C 22 173.606 176.630 -3.024 1
1 195 . 5 1 1 A 22 22 PRO CA C 22 66.519 64.251 2.268 1
1 196 . 5 1 1 A 22 22 PRO CB C 22 32.078 31.621 0.457 1
1 199 . 5 1 1 A 23 23 ARG H H 23 6.621 8.116 -1.495 1
1 200 . 5 1 1 A 23 23 ARG HA H 23 4.591 4.490 0.101 1
1 207 . 5 1 1 A 23 23 ARG C C 23 176.554 175.701 0.853 1
1 208 . 5 1 1 A 23 23 ARG CA C 23 53.892 56.297 -2.405 1
1 209 . 5 1 1 A 23 23 ARG CB C 23 33.498 33.179 0.319 1
1 212 . 5 1 1 A 23 23 ARG N N 23 102.938 116.939 -14.001 1
1 213 . 5 1 1 A 24 24 THR H H 24 7.352 7.920 -0.568 1
1 214 . 5 1 1 A 24 24 THR HA H 24 5.593 5.404 0.189 1
1 219 . 5 1 1 A 24 24 THR C C 24 172.345 172.183 0.162 1
1 220 . 5 1 1 A 24 24 THR CA C 24 59.311 60.797 -1.486 1
1 221 . 5 1 1 A 24 24 THR CB C 24 73.311 71.768 1.543 1
1 223 . 5 1 1 A 24 24 THR N N 24 108.792 111.022 -2.230 1
1 224 . 5 1 1 A 25 25 VAL H H 25 8.437 8.520 -0.083 1
1 225 . 5 1 1 A 25 25 VAL HA H 25 4.512 4.916 -0.404 1
1 233 . 5 1 1 A 25 25 VAL C C 25 172.854 173.907 -1.053 1
1 234 . 5 1 1 A 25 25 VAL CA C 25 61.617 61.037 0.580 1
1 235 . 5 1 1 A 25 25 VAL CB C 25 36.742 34.200 2.542 1
1 238 . 5 1 1 A 25 25 VAL N N 25 117.023 121.181 -4.158 1
1 239 . 5 1 1 A 26 26 HIS H H 26 8.915 8.929 -0.014 1
1 240 . 5 1 1 A 26 26 HIS HA H 26 5.765 5.692 0.073 1
1 245 . 5 1 1 A 26 26 HIS C C 26 173.976 173.308 0.668 1
1 246 . 5 1 1 A 26 26 HIS CA C 26 52.896 53.653 -0.757 1
1 247 . 5 1 1 A 26 26 HIS CB C 26 34.004 32.559 1.445 1
1 250 . 5 1 1 A 26 26 HIS N N 26 128.155 127.749 0.406 1
1 251 . 5 1 1 A 27 27 LEU H H 27 9.034 9.359 -0.325 1
1 252 . 5 1 1 A 27 27 LEU HA H 27 5.505 5.338 0.167 1
1 262 . 5 1 1 A 27 27 LEU C C 27 174.821 175.285 -0.464 1
1 263 . 5 1 1 A 27 27 LEU CA C 27 53.376 53.462 -0.086 1
1 264 . 5 1 1 A 27 27 LEU CB C 27 46.306 46.246 0.060 1
1 268 . 5 1 1 A 27 27 LEU N N 27 128.569 130.534 -1.965 1
1 269 . 5 1 1 A 28 28 THR H H 28 8.844 8.506 0.338 1
1 270 . 5 1 1 A 28 28 THR HA H 28 4.485 5.011 -0.526 1
1 275 . 5 1 1 A 28 28 THR C C 28 172.773 173.461 -0.688 1
1 276 . 5 1 1 A 28 28 THR CA C 28 60.052 59.298 0.754 1
1 277 . 5 1 1 A 28 28 THR CB C 28 71.704 71.738 -0.034 1
1 279 . 5 1 1 A 28 28 THR N N 28 112.165 115.381 -3.216 1
1 280 . 5 1 1 A 29 29 TRP H H 29 7.395 7.776 -0.381 1
1 281 . 5 1 1 A 29 29 TRP HA H 29 4.915 5.324 -0.409 1
1 290 . 5 1 1 A 29 29 TRP C C 29 174.013 174.740 -0.727 1
1 291 . 5 1 1 A 29 29 TRP CA C 29 56.626 54.893 1.733 1
1 292 . 5 1 1 A 29 29 TRP CB C 29 29.487 31.370 -1.883 1
1 298 . 5 1 1 A 29 29 TRP N N 29 115.623 119.553 -3.930 1
1 300 . 5 1 1 A 30 30 GLN H H 30 8.759 8.599 0.160 1
1 301 . 5 1 1 A 30 30 GLN HA H 30 4.641 4.654 -0.013 1
1 308 . 5 1 1 A 30 30 GLN C C 30 175.072 174.129 0.943 1
1 309 . 5 1 1 A 30 30 GLN CA C 30 52.975 54.385 -1.410 1
1 310 . 5 1 1 A 30 30 GLN CB C 30 28.398 28.331 0.067 1
1 312 . 5 1 1 A 30 30 GLN N N 30 117.497 120.129 -2.632 1
1 314 . 5 1 1 A 31 31 PRO HA H 31 4.487 4.547 -0.060 1
1 320 . 5 1 1 A 31 31 PRO C C 31 177.034 176.547 0.487 1
1 321 . 5 1 1 A 31 31 PRO CA C 31 62.710 62.594 0.116 1
1 322 . 5 1 1 A 31 31 PRO CB C 31 32.738 32.213 0.525 1
1 325 . 5 1 1 A 32 32 SER H H 32 8.259 8.624 -0.365 1
1 326 . 5 1 1 A 32 32 SER HA H 32 4.670 4.926 -0.256 1
1 329 . 5 1 1 A 32 32 SER C C 32 174.689 175.463 -0.774 1
1 330 . 5 1 1 A 32 32 SER CA C 32 57.296 57.074 0.222 1
1 331 . 5 1 1 A 32 32 SER CB C 32 64.748 64.516 0.232 1
1 332 . 5 1 1 A 32 32 SER N N 32 117.667 115.344 2.323 1
1 333 . 5 1 1 A 33 33 ALA H H 33 9.038 8.832 0.206 1
1 334 . 5 1 1 A 33 33 ALA HA H 33 4.126 4.595 -0.469 1
1 338 . 5 1 1 A 33 33 ALA C C 33 177.795 177.621 0.174 1
1 339 . 5 1 1 A 33 33 ALA CA C 33 54.213 51.834 2.379 1
1 340 . 5 1 1 A 33 33 ALA CB C 33 17.948 19.491 -1.543 1
1 341 . 5 1 1 A 33 33 ALA N N 33 131.772 125.639 6.133 1
1 342 . 5 1 1 A 34 34 GLY H H 34 8.576 7.652 0.924 1
1 343 . 5 1 1 A 34 34 GLY HA2 H 34 4.171 4.017 0.154 1
1 344 . 5 1 1 A 34 34 GLY HA3 H 34 3.592 4.026 -0.434 1
1 345 . 5 1 1 A 34 34 GLY C C 34 174.182 174.349 -0.167 1
1 346 . 5 1 1 A 34 34 GLY CA C 34 44.987 45.567 -0.580 1
1 347 . 5 1 1 A 34 34 GLY N N 34 111.339 105.010 6.329 1
1 348 . 5 1 1 A 35 35 ALA H H 35 7.637 7.757 -0.120 1
1 349 . 5 1 1 A 35 35 ALA HA H 35 4.210 4.140 0.070 1
1 353 . 5 1 1 A 35 35 ALA C C 35 178.918 177.016 1.902 1
1 354 . 5 1 1 A 35 35 ALA CA C 35 52.671 52.420 0.251 1
1 355 . 5 1 1 A 35 35 ALA CB C 35 18.988 19.802 -0.814 1
1 356 . 5 1 1 A 35 35 ALA N N 35 121.531 123.196 -1.665 1
1 357 . 5 1 1 A 36 36 THR H H 36 9.428 9.052 0.376 1
1 358 . 5 1 1 A 36 36 THR HA H 36 4.402 4.488 -0.086 1
1 363 . 5 1 1 A 36 36 THR C C 36 174.739 174.267 0.472 1
1 364 . 5 1 1 A 36 36 THR CA C 36 62.692 63.106 -0.414 1
1 365 . 5 1 1 A 36 36 THR CB C 36 69.482 70.765 -1.283 1
1 367 . 5 1 1 A 36 36 THR N N 36 113.103 113.966 -0.863 1
1 368 . 5 1 1 A 37 37 HIS H H 37 7.857 6.928 0.929 1
1 369 . 5 1 1 A 37 37 HIS HA H 37 4.878 4.996 -0.118 1
1 374 . 5 1 1 A 37 37 HIS C C 37 171.103 172.339 -1.236 1
1 375 . 5 1 1 A 37 37 HIS CA C 37 55.867 54.933 0.934 1
1 376 . 5 1 1 A 37 37 HIS CB C 37 32.655 31.166 1.489 1
1 379 . 5 1 1 A 37 37 HIS N N 37 118.486 114.871 3.615 1
1 380 . 5 1 1 A 38 38 TYR H H 38 9.217 9.039 0.178 1
1 381 . 5 1 1 A 38 38 TYR HA H 38 5.303 5.294 0.009 1
1 388 . 5 1 1 A 38 38 TYR C C 38 173.922 174.910 -0.988 1
1 389 . 5 1 1 A 38 38 TYR CA C 38 56.504 56.306 0.198 1
1 390 . 5 1 1 A 38 38 TYR CB C 38 41.823 41.606 0.217 1
1 395 . 5 1 1 A 38 38 TYR N N 38 114.077 118.929 -4.852 1
1 396 . 5 1 1 A 39 39 LEU H H 39 9.052 8.947 0.105 1
1 397 . 5 1 1 A 39 39 LEU HA H 39 5.061 4.955 0.106 1
1 407 . 5 1 1 A 39 39 LEU C C 39 175.455 174.716 0.739 1
1 408 . 5 1 1 A 39 39 LEU CA C 39 53.855 54.123 -0.268 1
1 409 . 5 1 1 A 39 39 LEU CB C 39 45.254 43.580 1.674 1
1 413 . 5 1 1 A 39 39 LEU N N 39 123.997 125.949 -1.952 1
1 414 . 5 1 1 A 40 40 VAL H H 40 9.520 9.447 0.073 1
1 415 . 5 1 1 A 40 40 VAL HA H 40 4.988 4.576 0.412 1
1 423 . 5 1 1 A 40 40 VAL C C 40 174.578 174.089 0.489 1
1 424 . 5 1 1 A 40 40 VAL CA C 40 60.575 61.764 -1.189 1
1 425 . 5 1 1 A 40 40 VAL CB C 40 33.284 32.920 0.364 1
1 428 . 5 1 1 A 40 40 VAL N N 40 129.678 129.375 0.303 1
1 429 . 5 1 1 A 41 41 ARG H H 41 9.096 8.951 0.145 1
1 430 . 5 1 1 A 41 41 ARG HA H 41 5.384 5.158 0.226 1
1 437 . 5 1 1 A 41 41 ARG C C 41 175.100 174.537 0.563 1
1 438 . 5 1 1 A 41 41 ARG CA C 41 54.297 54.692 -0.395 1
1 439 . 5 1 1 A 41 41 ARG CB C 41 33.003 32.375 0.628 1
1 442 . 5 1 1 A 41 41 ARG N N 41 126.332 128.695 -2.363 1
1 443 . 5 1 1 A 42 42 CYS H H 42 9.004 8.991 0.013 1
1 444 . 5 1 1 A 42 42 CYS HA H 42 5.309 5.204 0.105 1
1 447 . 5 1 1 A 42 42 CYS C C 42 173.417 174.044 -0.627 1
1 448 . 5 1 1 A 42 42 CYS CA C 42 57.508 57.604 -0.096 1
1 449 . 5 1 1 A 42 42 CYS CB C 42 28.859 29.223 -0.364 1
1 450 . 5 1 1 A 42 42 CYS N N 42 123.359 126.567 -3.208 1
1 451 . 5 1 1 A 43 43 SER H H 43 9.102 8.568 0.534 1
1 452 . 5 1 1 A 43 43 SER HA H 43 5.324 5.025 0.299 1
1 455 . 5 1 1 A 43 43 SER C C 43 171.429 171.491 -0.062 1
1 456 . 5 1 1 A 43 43 SER CA C 43 55.621 55.554 0.067 1
1 457 . 5 1 1 A 43 43 SER CB C 43 64.856 65.420 -0.564 1
1 458 . 5 1 1 A 43 43 SER N N 43 125.444 119.068 6.376 1
1 459 . 5 1 1 A 44 44 PRO HA H 44 4.389 4.774 -0.385 1
1 466 . 5 1 1 A 44 44 PRO C C 44 176.559 177.441 -0.882 1
1 467 . 5 1 1 A 44 44 PRO CA C 44 63.027 62.791 0.236 1
1 468 . 5 1 1 A 44 44 PRO CB C 44 31.935 32.374 -0.439 1
1 471 . 5 1 1 A 45 45 ALA H H 45 8.261 8.085 0.176 1
1 472 . 5 1 1 A 45 45 ALA HA H 45 4.157 4.126 0.031 1
1 476 . 5 1 1 A 45 45 ALA C C 45 177.706 177.449 0.257 1
1 477 . 5 1 1 A 45 45 ALA CA C 45 53.284 54.080 -0.796 1
1 478 . 5 1 1 A 45 45 ALA CB C 45 18.978 19.210 -0.232 1
1 479 . 5 1 1 A 45 45 ALA N N 45 126.162 124.650 1.512 1
1 480 . 5 1 1 A 46 46 SER H H 46 8.275 7.932 0.343 1
1 481 . 5 1 1 A 46 46 SER HA H 46 4.779 4.840 -0.061 1
1 484 . 5 1 1 A 46 46 SER C C 46 172.182 174.196 -2.014 1
1 485 . 5 1 1 A 46 46 SER CA C 46 55.091 55.447 -0.356 1
1 486 . 5 1 1 A 46 46 SER CB C 46 63.130 64.595 -1.465 1
1 487 . 5 1 1 A 46 46 SER N N 46 113.009 113.097 -0.088 1
1 488 . 5 1 1 A 47 47 PRO HA H 47 4.336 4.542 -0.206 1
1 493 . 5 1 1 A 47 47 PRO C C 47 177.165 175.278 1.887 1
1 494 . 5 1 1 A 47 47 PRO CA C 47 63.268 63.648 -0.380 1
1 495 . 5 1 1 A 47 47 PRO CB C 47 32.528 31.620 0.908 1
1 498 . 5 1 1 A 48 48 LYS H H 48 9.089 7.726 1.363 1
1 499 . 5 1 1 A 48 48 LYS HA H 48 4.408 4.773 -0.365 1
1 508 . 5 1 1 A 48 48 LYS C C 48 176.917 176.263 0.654 1
1 509 . 5 1 1 A 48 48 LYS CA C 48 55.893 55.098 0.795 1
1 510 . 5 1 1 A 48 48 LYS CB C 48 32.997 34.559 -1.562 1
1 514 . 5 1 1 A 48 48 LYS N N 48 122.579 114.791 7.788 1
1 515 . 5 1 1 A 49 49 GLY HA2 H 49 4.021 4.032 -0.011 1
1 516 . 5 1 1 A 49 49 GLY HA3 H 49 3.881 4.034 -0.153 1
1 517 . 5 1 1 A 49 49 GLY C C 49 174.552 173.438 1.114 1
1 518 . 5 1 1 A 49 49 GLY CA C 49 46.011 44.771 1.240 1
1 519 . 5 1 1 A 50 50 GLU H H 50 8.608 8.444 0.164 1
1 520 . 5 1 1 A 50 50 GLU HA H 50 4.335 4.435 -0.100 1
1 525 . 5 1 1 A 50 50 GLU C C 50 176.672 175.409 1.263 1
1 526 . 5 1 1 A 50 50 GLU CA C 50 56.978 55.169 1.809 1
1 527 . 5 1 1 A 50 50 GLU CB C 50 29.458 28.945 0.513 1
1 529 . 5 1 1 A 50 50 GLU N N 50 121.378 125.336 -3.958 1
1 530 . 5 1 1 A 51 51 GLU H H 51 8.287 8.165 0.122 1
1 531 . 5 1 1 A 51 51 GLU HA H 51 4.381 4.503 -0.122 1
1 536 . 5 1 1 A 51 51 GLU C C 51 176.218 175.840 0.378 1
1 537 . 5 1 1 A 51 51 GLU CA C 51 56.996 56.278 0.718 1
1 538 . 5 1 1 A 51 51 GLU CB C 51 31.066 28.692 2.374 1
1 540 . 5 1 1 A 51 51 GLU N N 51 120.863 126.359 -5.496 1
1 541 . 5 1 1 A 52 52 GLU H H 52 8.445 8.027 0.418 1
1 542 . 5 1 1 A 52 52 GLU HA H 52 4.464 4.652 -0.188 1
1 547 . 5 1 1 A 52 52 GLU C C 52 176.128 174.765 1.363 1
1 548 . 5 1 1 A 52 52 GLU CA C 52 55.955 55.736 0.219 1
1 549 . 5 1 1 A 52 52 GLU CB C 52 31.691 33.356 -1.665 1
1 551 . 5 1 1 A 52 52 GLU N N 52 121.103 124.458 -3.355 1
1 552 . 5 1 1 A 53 53 GLU H H 53 8.441 8.700 -0.259 1
1 553 . 5 1 1 A 53 53 GLU HA H 53 4.609 4.605 0.004 1
1 558 . 5 1 1 A 53 53 GLU C C 53 175.816 175.472 0.344 1
1 559 . 5 1 1 A 53 53 GLU CA C 53 56.697 56.966 -0.269 1
1 560 . 5 1 1 A 53 53 GLU CB C 53 31.022 30.715 0.307 1
1 562 . 5 1 1 A 53 53 GLU N N 53 121.949 126.180 -4.231 1
1 563 . 5 1 1 A 54 54 ARG H H 54 8.569 8.437 0.132 1
1 564 . 5 1 1 A 54 54 ARG HA H 54 4.768 5.247 -0.479 1
1 571 . 5 1 1 A 54 54 ARG C C 54 174.881 174.704 0.177 1
1 572 . 5 1 1 A 54 54 ARG CA C 54 54.950 54.215 0.735 1
1 573 . 5 1 1 A 54 54 ARG CB C 54 33.374 34.214 -0.840 1
1 576 . 5 1 1 A 54 54 ARG N N 54 123.714 123.012 0.702 1
1 577 . 5 1 1 A 55 55 GLU H H 55 8.650 8.778 -0.128 1
1 578 . 5 1 1 A 55 55 GLU HA H 55 5.493 5.177 0.316 1
1 583 . 5 1 1 A 55 55 GLU C C 55 175.566 174.869 0.697 1
1 584 . 5 1 1 A 55 55 GLU CA C 55 54.915 55.115 -0.200 1
1 585 . 5 1 1 A 55 55 GLU CB C 55 33.250 32.643 0.607 1
1 587 . 5 1 1 A 55 55 GLU N N 55 123.537 125.191 -1.654 1
1 588 . 5 1 1 A 56 56 VAL H H 56 9.419 9.015 0.404 1
1 589 . 5 1 1 A 56 56 VAL HA H 56 4.524 4.951 -0.427 1
1 597 . 5 1 1 A 56 56 VAL C C 56 173.502 174.162 -0.660 1
1 598 . 5 1 1 A 56 56 VAL CA C 56 60.981 58.851 2.130 1
1 599 . 5 1 1 A 56 56 VAL CB C 56 36.117 36.004 0.113 1
1 602 . 5 1 1 A 56 56 VAL N N 56 123.343 117.412 5.931 1
1 603 . 5 1 1 A 57 57 GLN H H 57 8.767 8.807 -0.040 1
1 604 . 5 1 1 A 57 57 GLN HA H 57 5.671 5.147 0.524 1
1 611 . 5 1 1 A 57 57 GLN C C 57 176.357 175.168 1.189 1
1 612 . 5 1 1 A 57 57 GLN CA C 57 54.735 54.208 0.527 1
1 613 . 5 1 1 A 57 57 GLN CB C 57 30.781 31.884 -1.103 1
1 615 . 5 1 1 A 57 57 GLN N N 57 125.639 120.847 4.792 1
1 617 . 5 1 1 A 58 58 VAL H H 58 9.217 9.029 0.188 1
1 618 . 5 1 1 A 58 58 VAL HA H 58 5.129 4.842 0.287 1
1 626 . 5 1 1 A 58 58 VAL C C 58 175.925 176.924 -0.999 1
1 627 . 5 1 1 A 58 58 VAL CA C 58 59.652 60.030 -0.378 1
1 628 . 5 1 1 A 58 58 VAL CB C 58 36.540 35.102 1.438 1
1 631 . 5 1 1 A 58 58 VAL N N 58 117.022 117.557 -0.535 1
1 632 . 5 1 1 A 59 59 GLY H H 59 9.008 8.796 0.212 1
1 633 . 5 1 1 A 59 59 GLY HA2 H 59 4.670 3.932 0.738 1
1 634 . 5 1 1 A 59 59 GLY HA3 H 59 3.914 3.999 -0.085 1
1 635 . 5 1 1 A 59 59 GLY C C 59 173.386 173.868 -0.482 1
1 636 . 5 1 1 A 59 59 GLY CA C 59 45.093 46.652 -1.559 1
1 637 . 5 1 1 A 59 59 GLY N N 59 109.174 111.384 -2.210 1
1 638 . 5 1 1 A 60 60 ARG H H 60 7.695 7.779 -0.084 1
1 639 . 5 1 1 A 60 60 ARG HA H 60 4.866 4.801 0.065 1
1 645 . 5 1 1 A 60 60 ARG C C 60 173.760 175.972 -2.212 1
1 646 . 5 1 1 A 60 60 ARG CA C 60 52.764 52.974 -0.210 1
1 647 . 5 1 1 A 60 60 ARG CB C 60 31.785 31.305 0.480 1
1 650 . 5 1 1 A 60 60 ARG N N 60 118.520 120.020 -1.500 1
1 651 . 5 1 1 A 61 61 PRO HA H 61 3.539 3.863 -0.324 1
1 658 . 5 1 1 A 61 61 PRO C C 61 173.175 173.775 -0.600 1
1 659 . 5 1 1 A 61 61 PRO CA C 61 62.265 62.882 -0.617 1
1 660 . 5 1 1 A 61 61 PRO CB C 61 27.546 30.739 -3.193 1
1 663 . 5 1 1 A 62 62 GLU H H 62 7.879 7.748 0.131 1
1 664 . 5 1 1 A 62 62 GLU HA H 62 4.071 4.582 -0.511 1
1 669 . 5 1 1 A 62 62 GLU C C 62 174.107 174.778 -0.671 1
1 670 . 5 1 1 A 62 62 GLU CA C 62 55.229 54.873 0.356 1
1 671 . 5 1 1 A 62 62 GLU CB C 62 32.838 31.865 0.973 1
1 673 . 5 1 1 A 62 62 GLU N N 62 118.173 114.017 4.156 1
1 674 . 5 1 1 A 63 63 VAL H H 63 8.930 8.846 0.084 1
1 675 . 5 1 1 A 63 63 VAL HA H 63 4.548 5.017 -0.469 1
1 683 . 5 1 1 A 63 63 VAL C C 63 170.325 173.163 -2.838 1
1 684 . 5 1 1 A 63 63 VAL CA C 63 60.770 59.435 1.335 1
1 685 . 5 1 1 A 63 63 VAL CB C 63 35.394 35.419 -0.025 1
1 688 . 5 1 1 A 63 63 VAL N N 63 117.161 122.380 -5.219 1
1 689 . 5 1 1 A 64 64 LEU H H 64 8.332 8.742 -0.410 1
1 690 . 5 1 1 A 64 64 LEU HA H 64 5.122 5.011 0.111 1
1 700 . 5 1 1 A 64 64 LEU C C 64 176.243 174.539 1.704 1
1 701 . 5 1 1 A 64 64 LEU CA C 64 53.346 53.725 -0.379 1
1 702 . 5 1 1 A 64 64 LEU CB C 64 42.649 45.149 -2.500 1
1 706 . 5 1 1 A 64 64 LEU N N 64 130.510 128.925 1.585 1
1 707 . 5 1 1 A 65 65 LEU H H 65 9.261 9.271 -0.010 1
1 708 . 5 1 1 A 65 65 LEU HA H 65 4.443 4.849 -0.406 1
1 718 . 5 1 1 A 65 65 LEU C C 65 174.016 176.003 -1.987 1
1 719 . 5 1 1 A 65 65 LEU CA C 65 53.920 53.839 0.081 1
1 720 . 5 1 1 A 65 65 LEU CB C 65 42.976 42.448 0.528 1
1 724 . 5 1 1 A 65 65 LEU N N 65 128.611 128.946 -0.335 1
1 725 . 5 1 1 A 66 66 ASP H H 66 8.105 8.638 -0.533 1
1 726 . 5 1 1 A 66 66 ASP HA H 66 5.207 4.959 0.248 1
1 729 . 5 1 1 A 66 66 ASP C C 66 176.161 176.183 -0.022 1
1 730 . 5 1 1 A 66 66 ASP CA C 66 51.001 53.117 -2.116 1
1 731 . 5 1 1 A 66 66 ASP CB C 66 42.836 42.414 0.422 1
1 732 . 5 1 1 A 66 66 ASP N N 66 121.799 124.698 -2.899 1
1 733 . 5 1 1 A 67 67 GLY H H 67 8.688 8.483 0.205 1
1 734 . 5 1 1 A 67 67 GLY HA2 H 67 3.923 3.917 0.006 1
1 735 . 5 1 1 A 67 67 GLY HA3 H 67 3.808 3.924 -0.116 1
1 736 . 5 1 1 A 67 67 GLY C C 67 175.500 174.257 1.243 1
1 737 . 5 1 1 A 67 67 GLY CA C 67 46.591 46.765 -0.174 1
1 738 . 5 1 1 A 67 67 GLY N N 67 106.518 110.821 -4.303 1
1 739 . 5 1 1 A 68 68 LEU H H 68 8.125 7.260 0.865 1
1 740 . 5 1 1 A 68 68 LEU HA H 68 4.252 4.932 -0.680 1
1 750 . 5 1 1 A 68 68 LEU C C 68 174.914 175.530 -0.616 1
1 751 . 5 1 1 A 68 68 LEU CA C 68 53.469 53.108 0.361 1
1 752 . 5 1 1 A 68 68 LEU CB C 68 40.422 45.127 -4.705 1
1 756 . 5 1 1 A 68 68 LEU N N 68 119.345 119.837 -0.492 1
1 757 . 5 1 1 A 69 69 GLU H H 69 8.207 8.230 -0.023 1
1 758 . 5 1 1 A 69 69 GLU HA H 69 4.908 4.850 0.058 1
1 763 . 5 1 1 A 69 69 GLU C C 69 174.464 174.170 0.294 1
1 764 . 5 1 1 A 69 69 GLU CA C 69 53.081 52.890 0.191 1
1 765 . 5 1 1 A 69 69 GLU CB C 69 31.538 30.955 0.583 1
1 767 . 5 1 1 A 69 69 GLU N N 69 119.486 120.237 -0.751 1
1 768 . 5 1 1 A 70 70 PRO HA H 70 4.866 4.333 0.533 1
1 775 . 5 1 1 A 70 70 PRO C C 70 178.285 177.433 0.852 1
1 776 . 5 1 1 A 70 70 PRO CA C 70 63.203 63.639 -0.436 1
1 777 . 5 1 1 A 70 70 PRO CB C 70 33.726 31.900 1.826 1
1 780 . 5 1 1 A 71 71 GLY H H 71 7.362 8.919 -1.557 1
1 781 . 5 1 1 A 71 71 GLY HA2 H 71 3.807 3.918 -0.111 1
1 782 . 5 1 1 A 71 71 GLY HA3 H 71 3.756 3.921 -0.165 1
1 783 . 5 1 1 A 71 71 GLY C C 71 174.664 173.868 0.796 1
1 784 . 5 1 1 A 71 71 GLY CA C 71 46.926 46.482 0.444 1
1 785 . 5 1 1 A 71 71 GLY N N 71 113.776 111.633 2.143 1
1 786 . 5 1 1 A 72 72 ARG H H 72 8.036 7.301 0.735 1
1 787 . 5 1 1 A 72 72 ARG HA H 72 4.597 4.713 -0.116 1
1 793 . 5 1 1 A 72 72 ARG C C 72 173.293 174.266 -0.973 1
1 794 . 5 1 1 A 72 72 ARG CA C 72 54.633 54.280 0.353 1
1 795 . 5 1 1 A 72 72 ARG CB C 72 33.704 33.091 0.613 1
1 798 . 5 1 1 A 72 72 ARG N N 72 119.611 119.660 -0.049 1
1 799 . 5 1 1 A 73 73 ASP H H 73 7.785 8.781 -0.996 1
1 800 . 5 1 1 A 73 73 ASP HA H 73 5.276 5.166 0.110 1
1 803 . 5 1 1 A 73 73 ASP C C 73 175.904 175.032 0.872 1
1 804 . 5 1 1 A 73 73 ASP CA C 73 53.568 53.236 0.332 1
1 805 . 5 1 1 A 73 73 ASP CB C 73 42.970 42.220 0.750 1
1 806 . 5 1 1 A 73 73 ASP N N 73 118.900 124.185 -5.285 1
1 807 . 5 1 1 A 74 74 TYR H H 74 9.516 9.104 0.412 1
1 808 . 5 1 1 A 74 74 TYR HA H 74 4.800 5.118 -0.318 1
1 815 . 5 1 1 A 74 74 TYR C C 74 174.631 174.990 -0.359 1
1 816 . 5 1 1 A 74 74 TYR CA C 74 58.548 56.687 1.861 1
1 817 . 5 1 1 A 74 74 TYR CB C 74 42.029 43.443 -1.414 1
1 822 . 5 1 1 A 74 74 TYR N N 74 121.903 121.385 0.518 1
1 823 . 5 1 1 A 75 75 GLU H H 75 9.248 9.174 0.074 1
1 824 . 5 1 1 A 75 75 GLU HA H 75 4.756 4.947 -0.191 1
1 829 . 5 1 1 A 75 75 GLU C C 75 175.524 175.292 0.232 1
1 830 . 5 1 1 A 75 75 GLU CA C 75 55.621 55.299 0.322 1
1 831 . 5 1 1 A 75 75 GLU CB C 75 30.778 30.747 0.031 1
1 833 . 5 1 1 A 75 75 GLU N N 75 122.425 121.227 1.198 1
1 834 . 5 1 1 A 76 76 VAL H H 76 8.884 8.841 0.043 1
1 835 . 5 1 1 A 76 76 VAL HA H 76 5.246 4.809 0.437 1
1 843 . 5 1 1 A 76 76 VAL C C 76 174.800 175.197 -0.397 1
1 844 . 5 1 1 A 76 76 VAL CA C 76 60.199 61.962 -1.763 1
1 845 . 5 1 1 A 76 76 VAL CB C 76 33.449 32.122 1.327 1
1 848 . 5 1 1 A 76 76 VAL N N 76 126.853 125.797 1.056 1
1 849 . 5 1 1 A 77 77 SER H H 77 9.234 9.065 0.169 1
1 850 . 5 1 1 A 77 77 SER HA H 77 5.398 5.078 0.320 1
1 853 . 5 1 1 A 77 77 SER C C 77 173.138 173.815 -0.677 1
1 854 . 5 1 1 A 77 77 SER CA C 77 56.032 57.753 -1.721 1
1 855 . 5 1 1 A 77 77 SER CB C 77 66.374 64.191 2.183 1
1 856 . 5 1 1 A 77 77 SER N N 77 120.852 125.512 -4.660 1
1 857 . 5 1 1 A 78 78 VAL H H 78 9.092 8.700 0.392 1
1 858 . 5 1 1 A 78 78 VAL HA H 78 4.756 4.828 -0.072 1
1 866 . 5 1 1 A 78 78 VAL C C 78 173.641 174.828 -1.187 1
1 867 . 5 1 1 A 78 78 VAL CA C 78 61.246 60.758 0.488 1
1 868 . 5 1 1 A 78 78 VAL CB C 78 34.467 32.789 1.678 1
1 871 . 5 1 1 A 78 78 VAL N N 78 122.453 127.527 -5.074 1
1 872 . 5 1 1 A 79 79 GLN H H 79 8.587 8.277 0.310 1
1 873 . 5 1 1 A 79 79 GLN HA H 79 4.438 4.664 -0.226 1
1 880 . 5 1 1 A 79 79 GLN C C 79 174.999 174.017 0.982 1
1 881 . 5 1 1 A 79 79 GLN CA C 79 54.227 54.785 -0.558 1
1 882 . 5 1 1 A 79 79 GLN CB C 79 33.587 32.603 0.984 1
1 884 . 5 1 1 A 79 79 GLN N N 79 125.619 125.829 -0.210 1
1 886 . 5 1 1 A 80 80 SER H H 80 8.623 8.713 -0.090 1
1 887 . 5 1 1 A 80 80 SER HA H 80 4.756 4.092 0.664 1
1 890 . 5 1 1 A 80 80 SER C C 80 172.264 173.972 -1.708 1
1 891 . 5 1 1 A 80 80 SER CA C 80 58.177 58.277 -0.100 1
1 892 . 5 1 1 A 80 80 SER CB C 80 63.920 63.483 0.437 1
1 893 . 5 1 1 A 80 80 SER N N 80 122.844 123.584 -0.740 1
1 894 . 5 1 1 A 81 81 LEU H H 81 8.348 8.700 -0.352 1
1 895 . 5 1 1 A 81 81 LEU HA H 81 5.124 4.522 0.602 1
1 905 . 5 1 1 A 81 81 LEU C C 81 175.775 176.254 -0.479 1
1 906 . 5 1 1 A 81 81 LEU CA C 81 54.033 53.609 0.424 1
1 907 . 5 1 1 A 81 81 LEU CB C 81 44.690 42.505 2.185 1
1 911 . 5 1 1 A 81 81 LEU N N 81 123.191 127.427 -4.236 1
1 912 . 5 1 1 A 82 82 ARG H H 82 8.374 9.004 -0.630 1
1 913 . 5 1 1 A 82 82 ARG HA H 82 4.616 4.292 0.324 1
1 919 . 5 1 1 A 82 82 ARG C C 82 176.864 175.847 1.017 1
1 920 . 5 1 1 A 82 82 ARG CA C 82 55.868 56.439 -0.571 1
1 921 . 5 1 1 A 82 82 ARG CB C 82 32.322 31.960 0.362 1
1 924 . 5 1 1 A 82 82 ARG N N 82 121.029 126.131 -5.102 1
1 925 . 5 1 1 A 83 83 GLY H H 83 8.309 7.324 0.985 1
1 926 . 5 1 1 A 83 83 GLY HA2 H 83 4.031 4.086 -0.055 1
1 927 . 5 1 1 A 83 83 GLY HA3 H 83 3.888 4.110 -0.222 1
1 928 . 5 1 1 A 83 83 GLY C C 83 174.562 173.979 0.583 1
1 929 . 5 1 1 A 83 83 GLY CA C 83 45.963 45.912 0.051 1
1 930 . 5 1 1 A 83 83 GLY N N 83 109.937 106.857 3.080 1
1 931 . 5 1 1 A 84 84 PRO HA H 84 4.573 4.340 0.233 1
1 938 . 5 1 1 A 84 84 PRO C C 84 176.533 176.103 0.430 1
1 939 . 5 1 1 A 84 84 PRO CA C 84 63.485 64.799 -1.314 1
1 940 . 5 1 1 A 84 84 PRO CB C 84 32.409 32.050 0.359 1
1 943 . 5 1 1 A 85 85 GLU H H 85 7.799 7.653 0.146 1
1 944 . 5 1 1 A 85 85 GLU HA H 85 4.369 4.779 -0.410 1
1 949 . 5 1 1 A 85 85 GLU C C 85 174.722 176.028 -1.306 1
1 950 . 5 1 1 A 85 85 GLU CA C 85 55.899 54.799 1.100 1
1 951 . 5 1 1 A 85 85 GLU CB C 85 31.911 33.172 -1.261 1
1 953 . 5 1 1 A 85 85 GLU N N 85 122.093 112.621 9.472 1
1 954 . 5 1 1 A 86 86 GLY H H 86 8.329 8.701 -0.372 1
1 955 . 5 1 1 A 86 86 GLY HA2 H 86 5.298 4.190 1.108 1
1 956 . 5 1 1 A 86 86 GLY HA3 H 86 3.559 4.215 -0.656 1
1 957 . 5 1 1 A 86 86 GLY C C 86 174.355 172.622 1.733 1
1 958 . 5 1 1 A 86 86 GLY CA C 86 44.034 44.026 0.008 1
1 959 . 5 1 1 A 86 86 GLY N N 86 109.387 109.158 0.229 1
1 960 . 5 1 1 A 87 87 SER H H 87 8.807 8.639 0.168 1
1 961 . 5 1 1 A 87 87 SER HA H 87 4.670 4.467 0.203 1
1 964 . 5 1 1 A 87 87 SER C C 87 175.195 174.238 0.957 1
1 965 . 5 1 1 A 87 87 SER CA C 87 57.737 57.174 0.563 1
1 966 . 5 1 1 A 87 87 SER CB C 87 67.829 64.391 3.438 1
1 967 . 5 1 1 A 87 87 SER N N 87 117.698 115.427 2.271 1
1 968 . 5 1 1 A 88 88 GLU H H 88 8.754 8.607 0.147 1
1 969 . 5 1 1 A 88 88 GLU HA H 88 4.357 4.315 0.042 1
1 974 . 5 1 1 A 88 88 GLU C C 88 177.474 176.573 0.901 1
1 975 . 5 1 1 A 88 88 GLU CA C 88 57.525 56.762 0.763 1
1 976 . 5 1 1 A 88 88 GLU CB C 88 31.162 30.730 0.432 1
1 978 . 5 1 1 A 88 88 GLU N N 88 118.709 122.321 -3.612 1
1 979 . 5 1 1 A 89 89 ALA H H 89 8.855 8.467 0.388 1
1 980 . 5 1 1 A 89 89 ALA HA H 89 4.792 4.678 0.114 1
1 984 . 5 1 1 A 89 89 ALA C C 89 178.379 176.643 1.736 1
1 985 . 5 1 1 A 89 89 ALA CA C 89 51.264 51.470 -0.206 1
1 986 . 5 1 1 A 89 89 ALA CB C 89 20.040 20.074 -0.034 1
1 987 . 5 1 1 A 89 89 ALA N N 89 127.301 123.902 3.399 1
1 988 . 5 1 1 A 90 90 ARG H H 90 8.549 8.821 -0.272 1
1 989 . 5 1 1 A 90 90 ARG HA H 90 4.658 4.907 -0.249 1
1 996 . 5 1 1 A 90 90 ARG C C 90 174.720 175.562 -0.842 1
1 997 . 5 1 1 A 90 90 ARG CA C 90 53.575 54.384 -0.809 1
1 998 . 5 1 1 A 90 90 ARG CB C 90 33.456 31.574 1.882 1
1 1001 . 5 1 1 A 90 90 ARG N N 90 121.289 123.460 -2.171 1
1 1002 . 5 1 1 A 91 91 GLY H H 91 8.396 9.066 -0.670 1
1 1003 . 5 1 1 A 91 91 GLY HA2 H 91 5.306 4.149 1.157 1
1 1004 . 5 1 1 A 91 91 GLY HA3 H 91 3.700 4.186 -0.486 1
1 1005 . 5 1 1 A 91 91 GLY C C 91 173.191 171.847 1.344 1
1 1006 . 5 1 1 A 91 91 GLY CA C 91 44.493 43.719 0.774 1
1 1007 . 5 1 1 A 91 91 GLY N N 91 108.579 112.002 -3.423 1
1 1008 . 5 1 1 A 92 92 ILE H H 92 8.891 8.421 0.470 1
1 1009 . 5 1 1 A 92 92 ILE HA H 92 4.499 4.835 -0.336 1
1 1019 . 5 1 1 A 92 92 ILE C C 92 171.877 174.745 -2.868 1
1 1020 . 5 1 1 A 92 92 ILE CA C 92 60.682 59.427 1.255 1
1 1021 . 5 1 1 A 92 92 ILE CB C 92 42.425 41.153 1.272 1
1 1025 . 5 1 1 A 92 92 ILE N N 92 118.313 122.717 -4.404 1
1 1026 . 5 1 1 A 93 93 ARG H H 93 7.980 8.490 -0.510 1
1 1027 . 5 1 1 A 93 93 ARG HA H 93 5.224 4.270 0.954 1
1 1034 . 5 1 1 A 93 93 ARG C C 93 175.072 175.748 -0.676 1
1 1035 . 5 1 1 A 93 93 ARG CA C 93 54.499 57.171 -2.672 1
1 1036 . 5 1 1 A 93 93 ARG CB C 93 31.767 30.591 1.176 1
1 1039 . 5 1 1 A 93 93 ARG N N 93 124.879 130.369 -5.490 1
1 1040 . 5 1 1 A 94 94 ALA H H 94 9.064 8.088 0.976 1
1 1041 . 5 1 1 A 94 94 ALA HA H 94 4.731 4.569 0.162 1
1 1045 . 5 1 1 A 94 94 ALA C C 94 174.494 176.660 -2.166 1
1 1046 . 5 1 1 A 94 94 ALA CA C 94 50.577 52.217 -1.640 1
1 1047 . 5 1 1 A 94 94 ALA CB C 94 23.082 20.230 2.852 1
1 1048 . 5 1 1 A 94 94 ALA N N 94 126.095 129.570 -3.475 1
1 1049 . 5 1 1 A 95 95 ARG H H 95 8.263 8.734 -0.471 1
1 1050 . 5 1 1 A 95 95 ARG HA H 95 5.548 4.797 0.751 1
1 1058 . 5 1 1 A 95 95 ARG C C 95 176.901 174.240 2.661 1
1 1059 . 5 1 1 A 95 95 ARG CA C 95 53.787 55.821 -2.034 1
1 1060 . 5 1 1 A 95 95 ARG CB C 95 32.426 34.200 -1.774 1
1 1063 . 5 1 1 A 95 95 ARG N N 95 123.374 119.427 3.947 1
1 1065 . 5 1 1 A 96 96 THR H H 96 9.208 8.728 0.480 1
1 1066 . 5 1 1 A 96 96 THR HA H 96 4.461 5.077 -0.616 1
1 1071 . 5 1 1 A 96 96 THR CA C 96 58.248 58.432 -0.184 1
1 1072 . 5 1 1 A 96 96 THR CB C 96 68.466 70.946 -2.480 1
1 1074 . 5 1 1 A 96 96 THR N N 96 119.492 115.015 4.477 1
1 1075 . 5 1 1 A 97 97 PRO HA H 97 4.636 4.609 0.027 1
1 1082 . 5 1 1 A 97 97 PRO C C 97 175.725 175.956 -0.231 1
1 1083 . 5 1 1 A 97 97 PRO CA C 97 61.907 62.327 -0.420 1
1 1084 . 5 1 1 A 97 97 PRO CB C 97 32.590 33.410 -0.820 1
1 1087 . 5 1 1 A 98 98 THR H H 98 7.943 8.386 -0.443 1
1 1088 . 5 1 1 A 98 98 THR HA H 98 4.208 5.129 -0.921 1
1 1093 . 5 1 1 A 98 98 THR C C 98 175.058 173.476 1.582 1
1 1094 . 5 1 1 A 98 98 THR CA C 98 62.069 60.354 1.715 1
1 1095 . 5 1 1 A 98 98 THR CB C 98 69.719 70.908 -1.189 1
1 1097 . 5 1 1 A 98 98 THR N N 98 107.148 111.488 -4.340 1
1 1098 . 5 1 1 A 99 99 SER H H 99 8.163 8.863 -0.700 1
1 1099 . 5 1 1 A 99 99 SER HA H 99 4.524 4.702 -0.178 1
1 1102 . 5 1 1 A 99 99 SER C C 99 174.319 174.673 -0.354 1
1 1103 . 5 1 1 A 99 99 SER CA C 99 58.107 57.273 0.834 1
1 1104 . 5 1 1 A 99 99 SER CB C 99 64.492 63.623 0.869 1
1 1105 . 5 1 1 A 99 99 SER N N 99 115.114 121.285 -6.171 1
1 1106 . 5 1 1 A 100 100 GLY H H 100 8.336 7.919 0.417 1
1 1107 . 5 1 1 A 100 100 GLY HA2 H 100 4.222 4.196 0.026 1
1 1108 . 5 1 1 A 100 100 GLY HA3 H 100 4.222 4.196 0.026 1
1 1109 . 5 1 1 A 100 100 GLY C C 100 171.696 172.821 -1.125 1
1 1110 . 5 1 1 A 100 100 GLY CA C 100 44.617 46.656 -2.039 1
1 1111 . 5 1 1 A 100 100 GLY N N 100 110.678 110.563 0.115 1
1 1112 . 5 1 1 A 101 101 PRO HA H 101 4.506 4.642 -0.136 1
1 1118 . 5 1 1 A 101 101 PRO CA C 101 63.358 62.293 1.065 1
1 1119 . 5 1 1 A 101 101 PRO CB C 101 32.313 29.506 2.807 1
1 1 . 6 1 1 A 6 6 SER HA H 6 4.528 4.041 0.487 1
1 3 . 6 1 1 A 6 6 SER CA C 6 58.373 59.147 -0.774 1
1 4 . 6 1 1 A 6 6 SER CB C 6 63.978 61.978 2.000 1
1 5 . 6 1 1 A 7 7 GLY H H 7 8.228 8.192 0.036 1
1 6 . 6 1 1 A 7 7 GLY HA2 H 7 4.134 4.055 0.079 1
1 7 . 6 1 1 A 7 7 GLY HA3 H 7 4.134 4.057 0.077 1
1 8 . 6 1 1 A 7 7 GLY CA C 7 44.607 45.408 -0.801 1
1 9 . 6 1 1 A 7 7 GLY N N 7 110.638 107.575 3.063 1
1 10 . 6 1 1 A 8 8 PRO HA H 8 4.419 4.540 -0.121 1
1 17 . 6 1 1 A 8 8 PRO C C 8 176.908 175.282 1.626 1
1 18 . 6 1 1 A 8 8 PRO CA C 8 62.851 62.439 0.412 1
1 19 . 6 1 1 A 8 8 PRO CB C 8 32.243 33.334 -1.091 1
1 22 . 6 1 1 A 9 9 LEU H H 9 8.462 8.475 -0.013 1
1 23 . 6 1 1 A 9 9 LEU HA H 9 4.494 4.851 -0.357 1
1 33 . 6 1 1 A 9 9 LEU C C 9 174.124 174.513 -0.389 1
1 34 . 6 1 1 A 9 9 LEU CA C 9 52.587 51.661 0.926 1
1 35 . 6 1 1 A 9 9 LEU CB C 9 43.150 44.062 -0.912 1
1 39 . 6 1 1 A 9 9 LEU N N 9 126.015 122.260 3.755 1
1 40 . 6 1 1 A 10 10 PRO HA H 10 4.820 4.682 0.138 1
1 47 . 6 1 1 A 10 10 PRO CA C 10 61.368 62.560 -1.192 1
1 48 . 6 1 1 A 10 10 PRO CB C 10 31.391 31.696 -0.305 1
1 51 . 6 1 1 A 11 11 PRO HA H 11 4.949 4.642 0.307 1
1 58 . 6 1 1 A 11 11 PRO CA C 11 61.183 61.835 -0.652 1
1 59 . 6 1 1 A 11 11 PRO CB C 11 30.656 31.972 -1.316 1
1 62 . 6 1 1 A 12 12 PRO HA H 12 4.341 4.704 -0.363 1
1 69 . 6 1 1 A 12 12 PRO C C 12 174.849 176.734 -1.885 1
1 70 . 6 1 1 A 12 12 PRO CA C 12 63.062 62.629 0.433 1
1 71 . 6 1 1 A 12 12 PRO CB C 12 31.831 31.820 0.011 1
1 74 . 6 1 1 A 13 13 ARG H H 13 7.828 8.362 -0.534 1
1 75 . 6 1 1 A 13 13 ARG HA H 13 4.536 4.454 0.082 1
1 82 . 6 1 1 A 13 13 ARG C C 13 174.608 176.221 -1.613 1
1 83 . 6 1 1 A 13 13 ARG CA C 13 54.774 56.700 -1.926 1
1 84 . 6 1 1 A 13 13 ARG CB C 13 33.250 31.825 1.425 1
1 87 . 6 1 1 A 13 13 ARG N N 13 120.532 117.734 2.798 1
1 88 . 6 1 1 A 14 14 ALA H H 14 8.694 7.867 0.827 1
1 89 . 6 1 1 A 14 14 ALA HA H 14 3.986 4.390 -0.404 1
1 93 . 6 1 1 A 14 14 ALA C C 14 177.232 176.615 0.617 1
1 94 . 6 1 1 A 14 14 ALA CA C 14 52.461 51.722 0.739 1
1 95 . 6 1 1 A 14 14 ALA CB C 14 16.806 17.128 -0.322 1
1 96 . 6 1 1 A 14 14 ALA N N 14 121.921 121.412 0.509 1
1 97 . 6 1 1 A 15 15 LEU H H 15 8.097 8.481 -0.384 1
1 98 . 6 1 1 A 15 15 LEU HA H 15 4.670 4.868 -0.198 1
1 108 . 6 1 1 A 15 15 LEU C C 15 177.364 175.703 1.661 1
1 109 . 6 1 1 A 15 15 LEU CA C 15 57.543 54.675 2.868 1
1 110 . 6 1 1 A 15 15 LEU CB C 15 41.877 40.845 1.032 1
1 114 . 6 1 1 A 15 15 LEU N N 15 122.215 121.404 0.811 1
1 115 . 6 1 1 A 16 16 THR H H 16 9.520 9.354 0.166 1
1 116 . 6 1 1 A 16 16 THR HA H 16 4.369 4.946 -0.577 1
1 121 . 6 1 1 A 16 16 THR C C 16 172.453 173.213 -0.760 1
1 122 . 6 1 1 A 16 16 THR CA C 16 62.480 61.425 1.055 1
1 123 . 6 1 1 A 16 16 THR CB C 16 72.198 71.493 0.705 1
1 125 . 6 1 1 A 16 16 THR N N 16 122.214 120.638 1.576 1
1 126 . 6 1 1 A 17 17 LEU H H 17 8.847 8.722 0.125 1
1 127 . 6 1 1 A 17 17 LEU HA H 17 4.573 4.535 0.038 1
1 137 . 6 1 1 A 17 17 LEU C C 17 174.695 176.253 -1.558 1
1 138 . 6 1 1 A 17 17 LEU CA C 17 53.840 54.812 -0.972 1
1 139 . 6 1 1 A 17 17 LEU CB C 17 40.290 42.228 -1.938 1
1 143 . 6 1 1 A 17 17 LEU N N 17 127.415 127.736 -0.321 1
1 144 . 6 1 1 A 18 18 ALA H H 18 8.647 8.340 0.307 1
1 145 . 6 1 1 A 18 18 ALA HA H 18 4.106 4.010 0.096 1
1 149 . 6 1 1 A 18 18 ALA C C 18 178.236 177.395 0.841 1
1 150 . 6 1 1 A 18 18 ALA CA C 18 53.926 53.911 0.015 1
1 151 . 6 1 1 A 18 18 ALA CB C 18 18.876 18.969 -0.093 1
1 152 . 6 1 1 A 18 18 ALA N N 18 133.362 129.514 3.848 1
1 153 . 6 1 1 A 19 19 ALA H H 19 7.772 7.013 0.759 1
1 154 . 6 1 1 A 19 19 ALA HA H 19 4.561 4.648 -0.087 1
1 158 . 6 1 1 A 19 19 ALA C C 19 176.032 174.328 1.704 1
1 159 . 6 1 1 A 19 19 ALA CA C 19 53.011 51.754 1.257 1
1 160 . 6 1 1 A 19 19 ALA CB C 19 21.869 22.578 -0.709 1
1 161 . 6 1 1 A 19 19 ALA N N 19 115.654 116.738 -1.084 1
1 162 . 6 1 1 A 20 20 VAL H H 20 8.697 8.880 -0.183 1
1 163 . 6 1 1 A 20 20 VAL HA H 20 4.951 4.848 0.103 1
1 171 . 6 1 1 A 20 20 VAL C C 20 174.314 174.219 0.095 1
1 172 . 6 1 1 A 20 20 VAL CA C 20 61.352 60.299 1.053 1
1 173 . 6 1 1 A 20 20 VAL CB C 20 35.394 33.993 1.401 1
1 176 . 6 1 1 A 20 20 VAL N N 20 120.848 120.697 0.151 1
1 177 . 6 1 1 A 21 21 THR H H 21 9.198 8.402 0.796 1
1 178 . 6 1 1 A 21 21 THR HA H 21 4.941 4.783 0.158 1
1 183 . 6 1 1 A 21 21 THR C C 21 174.416 174.638 -0.222 1
1 184 . 6 1 1 A 21 21 THR CA C 21 60.347 58.930 1.417 1
1 185 . 6 1 1 A 21 21 THR CB C 21 68.713 71.885 -3.172 1
1 187 . 6 1 1 A 21 21 THR N N 21 120.326 124.990 -4.664 1
1 188 . 6 1 1 A 22 22 PRO HA H 22 4.634 4.560 0.074 1
1 194 . 6 1 1 A 22 22 PRO C C 22 173.606 176.953 -3.347 1
1 195 . 6 1 1 A 22 22 PRO CA C 22 66.519 64.265 2.254 1
1 196 . 6 1 1 A 22 22 PRO CB C 22 32.078 31.629 0.449 1
1 199 . 6 1 1 A 23 23 ARG H H 23 6.621 8.204 -1.583 1
1 200 . 6 1 1 A 23 23 ARG HA H 23 4.591 4.492 0.099 1
1 207 . 6 1 1 A 23 23 ARG C C 23 176.554 175.778 0.776 1
1 208 . 6 1 1 A 23 23 ARG CA C 23 53.892 56.292 -2.400 1
1 209 . 6 1 1 A 23 23 ARG CB C 23 33.498 33.114 0.384 1
1 212 . 6 1 1 A 23 23 ARG N N 23 102.938 116.921 -13.983 1
1 213 . 6 1 1 A 24 24 THR H H 24 7.352 7.935 -0.583 1
1 214 . 6 1 1 A 24 24 THR HA H 24 5.593 5.339 0.254 1
1 219 . 6 1 1 A 24 24 THR C C 24 172.345 172.244 0.101 1
1 220 . 6 1 1 A 24 24 THR CA C 24 59.311 60.669 -1.358 1
1 221 . 6 1 1 A 24 24 THR CB C 24 73.311 71.666 1.645 1
1 223 . 6 1 1 A 24 24 THR N N 24 108.792 110.496 -1.704 1
1 224 . 6 1 1 A 25 25 VAL H H 25 8.437 9.003 -0.566 1
1 225 . 6 1 1 A 25 25 VAL HA H 25 4.512 4.764 -0.252 1
1 233 . 6 1 1 A 25 25 VAL C C 25 172.854 174.325 -1.471 1
1 234 . 6 1 1 A 25 25 VAL CA C 25 61.617 60.992 0.625 1
1 235 . 6 1 1 A 25 25 VAL CB C 25 36.742 33.619 3.123 1
1 238 . 6 1 1 A 25 25 VAL N N 25 117.023 122.737 -5.714 1
1 239 . 6 1 1 A 26 26 HIS H H 26 8.915 8.559 0.356 1
1 240 . 6 1 1 A 26 26 HIS HA H 26 5.765 5.575 0.190 1
1 245 . 6 1 1 A 26 26 HIS C C 26 173.976 172.857 1.119 1
1 246 . 6 1 1 A 26 26 HIS CA C 26 52.896 53.657 -0.761 1
1 247 . 6 1 1 A 26 26 HIS CB C 26 34.004 32.637 1.367 1
1 250 . 6 1 1 A 26 26 HIS N N 26 128.155 127.326 0.829 1
1 251 . 6 1 1 A 27 27 LEU H H 27 9.034 9.352 -0.318 1
1 252 . 6 1 1 A 27 27 LEU HA H 27 5.505 5.358 0.147 1
1 262 . 6 1 1 A 27 27 LEU C C 27 174.821 175.220 -0.399 1
1 263 . 6 1 1 A 27 27 LEU CA C 27 53.376 53.446 -0.070 1
1 264 . 6 1 1 A 27 27 LEU CB C 27 46.306 46.563 -0.257 1
1 268 . 6 1 1 A 27 27 LEU N N 27 128.569 130.853 -2.284 1
1 269 . 6 1 1 A 28 28 THR H H 28 8.844 9.096 -0.252 1
1 270 . 6 1 1 A 28 28 THR HA H 28 4.485 4.974 -0.489 1
1 275 . 6 1 1 A 28 28 THR C C 28 172.773 173.799 -1.026 1
1 276 . 6 1 1 A 28 28 THR CA C 28 60.052 59.748 0.304 1
1 277 . 6 1 1 A 28 28 THR CB C 28 71.704 71.387 0.317 1
1 279 . 6 1 1 A 28 28 THR N N 28 112.165 115.311 -3.146 1
1 280 . 6 1 1 A 29 29 TRP H H 29 7.395 7.916 -0.521 1
1 281 . 6 1 1 A 29 29 TRP HA H 29 4.915 5.462 -0.547 1
1 290 . 6 1 1 A 29 29 TRP C C 29 174.013 174.354 -0.341 1
1 291 . 6 1 1 A 29 29 TRP CA C 29 56.626 54.624 2.002 1
1 292 . 6 1 1 A 29 29 TRP CB C 29 29.487 31.834 -2.347 1
1 298 . 6 1 1 A 29 29 TRP N N 29 115.623 119.894 -4.271 1
1 300 . 6 1 1 A 30 30 GLN H H 30 8.759 8.561 0.198 1
1 301 . 6 1 1 A 30 30 GLN HA H 30 4.641 4.769 -0.128 1
1 308 . 6 1 1 A 30 30 GLN C C 30 175.072 174.257 0.815 1
1 309 . 6 1 1 A 30 30 GLN CA C 30 52.975 53.893 -0.918 1
1 310 . 6 1 1 A 30 30 GLN CB C 30 28.398 28.535 -0.137 1
1 312 . 6 1 1 A 30 30 GLN N N 30 117.497 120.118 -2.621 1
1 314 . 6 1 1 A 31 31 PRO HA H 31 4.487 4.580 -0.093 1
1 320 . 6 1 1 A 31 31 PRO C C 31 177.034 177.117 -0.083 1
1 321 . 6 1 1 A 31 31 PRO CA C 31 62.710 62.979 -0.269 1
1 322 . 6 1 1 A 31 31 PRO CB C 31 32.738 32.015 0.723 1
1 325 . 6 1 1 A 32 32 SER H H 32 8.259 8.639 -0.380 1
1 326 . 6 1 1 A 32 32 SER HA H 32 4.670 4.880 -0.210 1
1 329 . 6 1 1 A 32 32 SER C C 32 174.689 174.069 0.620 1
1 330 . 6 1 1 A 32 32 SER CA C 32 57.296 58.170 -0.874 1
1 331 . 6 1 1 A 32 32 SER CB C 32 64.748 64.356 0.392 1
1 332 . 6 1 1 A 32 32 SER N N 32 117.667 118.183 -0.516 1
1 333 . 6 1 1 A 33 33 ALA H H 33 9.038 8.338 0.700 1
1 334 . 6 1 1 A 33 33 ALA HA H 33 4.126 4.665 -0.539 1
1 338 . 6 1 1 A 33 33 ALA C C 33 177.795 177.293 0.502 1
1 339 . 6 1 1 A 33 33 ALA CA C 33 54.213 50.617 3.596 1
1 340 . 6 1 1 A 33 33 ALA CB C 33 17.948 19.887 -1.939 1
1 341 . 6 1 1 A 33 33 ALA N N 33 131.772 123.966 7.806 1
1 342 . 6 1 1 A 34 34 GLY H H 34 8.576 8.471 0.105 1
1 343 . 6 1 1 A 34 34 GLY HA2 H 34 4.171 3.981 0.190 1
1 344 . 6 1 1 A 34 34 GLY HA3 H 34 3.592 3.992 -0.400 1
1 345 . 6 1 1 A 34 34 GLY C C 34 174.182 174.336 -0.154 1
1 346 . 6 1 1 A 34 34 GLY CA C 34 44.987 45.151 -0.164 1
1 347 . 6 1 1 A 34 34 GLY N N 34 111.339 111.355 -0.016 1
1 348 . 6 1 1 A 35 35 ALA H H 35 7.637 7.763 -0.126 1
1 349 . 6 1 1 A 35 35 ALA HA H 35 4.210 4.072 0.138 1
1 353 . 6 1 1 A 35 35 ALA C C 35 178.918 178.319 0.599 1
1 354 . 6 1 1 A 35 35 ALA CA C 35 52.671 52.398 0.273 1
1 355 . 6 1 1 A 35 35 ALA CB C 35 18.988 19.153 -0.165 1
1 356 . 6 1 1 A 35 35 ALA N N 35 121.531 123.446 -1.915 1
1 357 . 6 1 1 A 36 36 THR H H 36 9.428 8.024 1.404 1
1 358 . 6 1 1 A 36 36 THR HA H 36 4.402 4.302 0.100 1
1 363 . 6 1 1 A 36 36 THR C C 36 174.739 174.481 0.258 1
1 364 . 6 1 1 A 36 36 THR CA C 36 62.692 63.482 -0.790 1
1 365 . 6 1 1 A 36 36 THR CB C 36 69.482 70.035 -0.553 1
1 367 . 6 1 1 A 36 36 THR N N 36 113.103 117.569 -4.466 1
1 368 . 6 1 1 A 37 37 HIS H H 37 7.857 6.745 1.112 1
1 369 . 6 1 1 A 37 37 HIS HA H 37 4.878 4.993 -0.115 1
1 374 . 6 1 1 A 37 37 HIS C C 37 171.103 172.059 -0.956 1
1 375 . 6 1 1 A 37 37 HIS CA C 37 55.867 54.518 1.349 1
1 376 . 6 1 1 A 37 37 HIS CB C 37 32.655 31.507 1.148 1
1 379 . 6 1 1 A 37 37 HIS N N 37 118.486 115.450 3.036 1
1 380 . 6 1 1 A 38 38 TYR H H 38 9.217 8.870 0.347 1
1 381 . 6 1 1 A 38 38 TYR HA H 38 5.303 5.280 0.023 1
1 388 . 6 1 1 A 38 38 TYR C C 38 173.922 174.436 -0.514 1
1 389 . 6 1 1 A 38 38 TYR CA C 38 56.504 56.205 0.299 1
1 390 . 6 1 1 A 38 38 TYR CB C 38 41.823 43.132 -1.309 1
1 395 . 6 1 1 A 38 38 TYR N N 38 114.077 117.935 -3.858 1
1 396 . 6 1 1 A 39 39 LEU H H 39 9.052 9.226 -0.174 1
1 397 . 6 1 1 A 39 39 LEU HA H 39 5.061 5.125 -0.064 1
1 407 . 6 1 1 A 39 39 LEU C C 39 175.455 174.709 0.746 1
1 408 . 6 1 1 A 39 39 LEU CA C 39 53.855 53.922 -0.067 1
1 409 . 6 1 1 A 39 39 LEU CB C 39 45.254 44.190 1.064 1
1 413 . 6 1 1 A 39 39 LEU N N 39 123.997 125.059 -1.062 1
1 414 . 6 1 1 A 40 40 VAL H H 40 9.520 9.459 0.061 1
1 415 . 6 1 1 A 40 40 VAL HA H 40 4.988 4.801 0.187 1
1 423 . 6 1 1 A 40 40 VAL C C 40 174.578 174.844 -0.266 1
1 424 . 6 1 1 A 40 40 VAL CA C 40 60.575 61.753 -1.178 1
1 425 . 6 1 1 A 40 40 VAL CB C 40 33.284 33.106 0.178 1
1 428 . 6 1 1 A 40 40 VAL N N 40 129.678 128.698 0.980 1
1 429 . 6 1 1 A 41 41 ARG H H 41 9.096 8.984 0.112 1
1 430 . 6 1 1 A 41 41 ARG HA H 41 5.384 5.239 0.145 1
1 437 . 6 1 1 A 41 41 ARG C C 41 175.100 174.128 0.972 1
1 438 . 6 1 1 A 41 41 ARG CA C 41 54.297 54.640 -0.343 1
1 439 . 6 1 1 A 41 41 ARG CB C 41 33.003 31.912 1.091 1
1 442 . 6 1 1 A 41 41 ARG N N 41 126.332 127.079 -0.747 1
1 443 . 6 1 1 A 42 42 CYS H H 42 9.004 9.249 -0.245 1
1 444 . 6 1 1 A 42 42 CYS HA H 42 5.309 4.957 0.352 1
1 447 . 6 1 1 A 42 42 CYS C C 42 173.417 173.574 -0.157 1
1 448 . 6 1 1 A 42 42 CYS CA C 42 57.508 57.272 0.236 1
1 449 . 6 1 1 A 42 42 CYS CB C 42 28.859 28.426 0.433 1
1 450 . 6 1 1 A 42 42 CYS N N 42 123.359 125.675 -2.316 1
1 451 . 6 1 1 A 43 43 SER H H 43 9.102 8.952 0.150 1
1 452 . 6 1 1 A 43 43 SER HA H 43 5.324 5.047 0.277 1
1 455 . 6 1 1 A 43 43 SER C C 43 171.429 172.157 -0.728 1
1 456 . 6 1 1 A 43 43 SER CA C 43 55.621 54.778 0.843 1
1 457 . 6 1 1 A 43 43 SER CB C 43 64.856 66.324 -1.468 1
1 458 . 6 1 1 A 43 43 SER N N 43 125.444 123.792 1.652 1
1 459 . 6 1 1 A 44 44 PRO HA H 44 4.389 4.770 -0.381 1
1 466 . 6 1 1 A 44 44 PRO C C 44 176.559 177.489 -0.930 1
1 467 . 6 1 1 A 44 44 PRO CA C 44 63.027 62.837 0.190 1
1 468 . 6 1 1 A 44 44 PRO CB C 44 31.935 32.379 -0.444 1
1 471 . 6 1 1 A 45 45 ALA H H 45 8.261 8.105 0.156 1
1 472 . 6 1 1 A 45 45 ALA HA H 45 4.157 4.098 0.059 1
1 476 . 6 1 1 A 45 45 ALA C C 45 177.706 177.953 -0.247 1
1 477 . 6 1 1 A 45 45 ALA CA C 45 53.284 54.475 -1.191 1
1 478 . 6 1 1 A 45 45 ALA CB C 45 18.978 18.879 0.099 1
1 479 . 6 1 1 A 45 45 ALA N N 45 126.162 125.079 1.083 1
1 480 . 6 1 1 A 46 46 SER H H 46 8.275 7.745 0.530 1
1 481 . 6 1 1 A 46 46 SER HA H 46 4.779 4.487 0.292 1
1 484 . 6 1 1 A 46 46 SER C C 46 172.182 174.132 -1.950 1
1 485 . 6 1 1 A 46 46 SER CA C 46 55.091 57.061 -1.970 1
1 486 . 6 1 1 A 46 46 SER CB C 46 63.130 62.928 0.202 1
1 487 . 6 1 1 A 46 46 SER N N 46 113.009 114.771 -1.762 1
1 488 . 6 1 1 A 47 47 PRO HA H 47 4.336 4.617 -0.281 1
1 493 . 6 1 1 A 47 47 PRO C C 47 177.165 176.259 0.906 1
1 494 . 6 1 1 A 47 47 PRO CA C 47 63.268 63.790 -0.522 1
1 495 . 6 1 1 A 47 47 PRO CB C 47 32.528 31.744 0.784 1
1 498 . 6 1 1 A 48 48 LYS H H 48 9.089 7.583 1.506 1
1 499 . 6 1 1 A 48 48 LYS HA H 48 4.408 4.145 0.263 1
1 508 . 6 1 1 A 48 48 LYS C C 48 176.917 177.261 -0.344 1
1 509 . 6 1 1 A 48 48 LYS CA C 48 55.893 57.890 -1.997 1
1 510 . 6 1 1 A 48 48 LYS CB C 48 32.997 32.033 0.964 1
1 514 . 6 1 1 A 48 48 LYS N N 48 122.579 118.886 3.693 1
1 515 . 6 1 1 A 49 49 GLY HA2 H 49 4.021 4.003 0.018 1
1 516 . 6 1 1 A 49 49 GLY HA3 H 49 3.881 4.005 -0.124 1
1 517 . 6 1 1 A 49 49 GLY C C 49 174.552 174.336 0.216 1
1 518 . 6 1 1 A 49 49 GLY CA C 49 46.011 45.814 0.197 1
1 519 . 6 1 1 A 50 50 GLU H H 50 8.608 8.850 -0.242 1
1 520 . 6 1 1 A 50 50 GLU HA H 50 4.335 4.597 -0.262 1
1 525 . 6 1 1 A 50 50 GLU C C 50 176.672 175.439 1.233 1
1 526 . 6 1 1 A 50 50 GLU CA C 50 56.978 55.148 1.830 1
1 527 . 6 1 1 A 50 50 GLU CB C 50 29.458 28.291 1.167 1
1 529 . 6 1 1 A 50 50 GLU N N 50 121.378 123.120 -1.742 1
1 530 . 6 1 1 A 51 51 GLU H H 51 8.287 8.129 0.158 1
1 531 . 6 1 1 A 51 51 GLU HA H 51 4.381 4.427 -0.046 1
1 536 . 6 1 1 A 51 51 GLU C C 51 176.218 176.552 -0.334 1
1 537 . 6 1 1 A 51 51 GLU CA C 51 56.996 55.937 1.059 1
1 538 . 6 1 1 A 51 51 GLU CB C 51 31.066 30.706 0.360 1
1 540 . 6 1 1 A 51 51 GLU N N 51 120.863 121.841 -0.978 1
1 541 . 6 1 1 A 52 52 GLU H H 52 8.445 8.496 -0.051 1
1 542 . 6 1 1 A 52 52 GLU HA H 52 4.464 4.210 0.254 1
1 547 . 6 1 1 A 52 52 GLU C C 52 176.128 176.823 -0.695 1
1 548 . 6 1 1 A 52 52 GLU CA C 52 55.955 57.391 -1.436 1
1 549 . 6 1 1 A 52 52 GLU CB C 52 31.691 29.792 1.899 1
1 551 . 6 1 1 A 52 52 GLU N N 52 121.103 121.059 0.044 1
1 552 . 6 1 1 A 53 53 GLU H H 53 8.441 8.725 -0.284 1
1 553 . 6 1 1 A 53 53 GLU HA H 53 4.609 4.484 0.125 1
1 558 . 6 1 1 A 53 53 GLU C C 53 175.816 176.247 -0.431 1
1 559 . 6 1 1 A 53 53 GLU CA C 53 56.697 56.440 0.257 1
1 560 . 6 1 1 A 53 53 GLU CB C 53 31.022 30.463 0.559 1
1 562 . 6 1 1 A 53 53 GLU N N 53 121.949 122.973 -1.024 1
1 563 . 6 1 1 A 54 54 ARG H H 54 8.569 8.302 0.267 1
1 564 . 6 1 1 A 54 54 ARG HA H 54 4.768 4.665 0.103 1
1 571 . 6 1 1 A 54 54 ARG C C 54 174.881 175.029 -0.148 1
1 572 . 6 1 1 A 54 54 ARG CA C 54 54.950 56.292 -1.342 1
1 573 . 6 1 1 A 54 54 ARG CB C 54 33.374 31.280 2.094 1
1 576 . 6 1 1 A 54 54 ARG N N 54 123.714 123.153 0.561 1
1 577 . 6 1 1 A 55 55 GLU H H 55 8.650 8.870 -0.220 1
1 578 . 6 1 1 A 55 55 GLU HA H 55 5.493 5.288 0.205 1
1 583 . 6 1 1 A 55 55 GLU C C 55 175.566 175.552 0.014 1
1 584 . 6 1 1 A 55 55 GLU CA C 55 54.915 54.821 0.094 1
1 585 . 6 1 1 A 55 55 GLU CB C 55 33.250 32.514 0.736 1
1 587 . 6 1 1 A 55 55 GLU N N 55 123.537 125.523 -1.986 1
1 588 . 6 1 1 A 56 56 VAL H H 56 9.419 8.900 0.519 1
1 589 . 6 1 1 A 56 56 VAL HA H 56 4.524 4.945 -0.421 1
1 597 . 6 1 1 A 56 56 VAL C C 56 173.502 174.270 -0.768 1
1 598 . 6 1 1 A 56 56 VAL CA C 56 60.981 58.774 2.207 1
1 599 . 6 1 1 A 56 56 VAL CB C 56 36.117 35.749 0.368 1
1 602 . 6 1 1 A 56 56 VAL N N 56 123.343 117.889 5.454 1
1 603 . 6 1 1 A 57 57 GLN H H 57 8.767 8.771 -0.004 1
1 604 . 6 1 1 A 57 57 GLN HA H 57 5.671 5.373 0.298 1
1 611 . 6 1 1 A 57 57 GLN C C 57 176.357 174.976 1.381 1
1 612 . 6 1 1 A 57 57 GLN CA C 57 54.735 54.199 0.536 1
1 613 . 6 1 1 A 57 57 GLN CB C 57 30.781 31.841 -1.060 1
1 615 . 6 1 1 A 57 57 GLN N N 57 125.639 121.274 4.365 1
1 617 . 6 1 1 A 58 58 VAL H H 58 9.217 8.636 0.581 1
1 618 . 6 1 1 A 58 58 VAL HA H 58 5.129 4.812 0.317 1
1 626 . 6 1 1 A 58 58 VAL C C 58 175.925 176.274 -0.349 1
1 627 . 6 1 1 A 58 58 VAL CA C 58 59.652 59.851 -0.199 1
1 628 . 6 1 1 A 58 58 VAL CB C 58 36.540 35.416 1.124 1
1 631 . 6 1 1 A 58 58 VAL N N 58 117.022 118.423 -1.401 1
1 632 . 6 1 1 A 59 59 GLY H H 59 9.008 8.924 0.084 1
1 633 . 6 1 1 A 59 59 GLY HA2 H 59 4.670 3.949 0.721 1
1 634 . 6 1 1 A 59 59 GLY HA3 H 59 3.914 4.039 -0.125 1
1 635 . 6 1 1 A 59 59 GLY C C 59 173.386 174.327 -0.941 1
1 636 . 6 1 1 A 59 59 GLY CA C 59 45.093 46.864 -1.771 1
1 637 . 6 1 1 A 59 59 GLY N N 59 109.174 111.144 -1.970 1
1 638 . 6 1 1 A 60 60 ARG H H 60 7.695 7.761 -0.066 1
1 639 . 6 1 1 A 60 60 ARG HA H 60 4.866 4.702 0.164 1
1 645 . 6 1 1 A 60 60 ARG C C 60 173.760 175.794 -2.034 1
1 646 . 6 1 1 A 60 60 ARG CA C 60 52.764 53.297 -0.533 1
1 647 . 6 1 1 A 60 60 ARG CB C 60 31.785 30.766 1.019 1
1 650 . 6 1 1 A 60 60 ARG N N 60 118.520 119.982 -1.462 1
1 651 . 6 1 1 A 61 61 PRO HA H 61 3.539 3.876 -0.337 1
1 658 . 6 1 1 A 61 61 PRO C C 61 173.175 173.732 -0.557 1
1 659 . 6 1 1 A 61 61 PRO CA C 61 62.265 62.912 -0.647 1
1 660 . 6 1 1 A 61 61 PRO CB C 61 27.546 30.843 -3.297 1
1 663 . 6 1 1 A 62 62 GLU H H 62 7.879 7.676 0.203 1
1 664 . 6 1 1 A 62 62 GLU HA H 62 4.071 4.521 -0.450 1
1 669 . 6 1 1 A 62 62 GLU C C 62 174.107 174.701 -0.594 1
1 670 . 6 1 1 A 62 62 GLU CA C 62 55.229 54.840 0.389 1
1 671 . 6 1 1 A 62 62 GLU CB C 62 32.838 31.984 0.854 1
1 673 . 6 1 1 A 62 62 GLU N N 62 118.173 114.504 3.669 1
1 674 . 6 1 1 A 63 63 VAL H H 63 8.930 8.576 0.354 1
1 675 . 6 1 1 A 63 63 VAL HA H 63 4.548 5.006 -0.458 1
1 683 . 6 1 1 A 63 63 VAL C C 63 170.325 173.128 -2.803 1
1 684 . 6 1 1 A 63 63 VAL CA C 63 60.770 59.562 1.208 1
1 685 . 6 1 1 A 63 63 VAL CB C 63 35.394 35.572 -0.178 1
1 688 . 6 1 1 A 63 63 VAL N N 63 117.161 122.066 -4.905 1
1 689 . 6 1 1 A 64 64 LEU H H 64 8.332 8.829 -0.497 1
1 690 . 6 1 1 A 64 64 LEU HA H 64 5.122 5.143 -0.021 1
1 700 . 6 1 1 A 64 64 LEU C C 64 176.243 174.551 1.692 1
1 701 . 6 1 1 A 64 64 LEU CA C 64 53.346 53.703 -0.357 1
1 702 . 6 1 1 A 64 64 LEU CB C 64 42.649 45.127 -2.478 1
1 706 . 6 1 1 A 64 64 LEU N N 64 130.510 128.567 1.943 1
1 707 . 6 1 1 A 65 65 LEU H H 65 9.261 9.414 -0.153 1
1 708 . 6 1 1 A 65 65 LEU HA H 65 4.443 4.848 -0.405 1
1 718 . 6 1 1 A 65 65 LEU C C 65 174.016 175.566 -1.550 1
1 719 . 6 1 1 A 65 65 LEU CA C 65 53.920 53.912 0.008 1
1 720 . 6 1 1 A 65 65 LEU CB C 65 42.976 42.273 0.703 1
1 724 . 6 1 1 A 65 65 LEU N N 65 128.611 128.389 0.222 1
1 725 . 6 1 1 A 66 66 ASP H H 66 8.105 8.766 -0.661 1
1 726 . 6 1 1 A 66 66 ASP HA H 66 5.207 5.406 -0.199 1
1 729 . 6 1 1 A 66 66 ASP C C 66 176.161 176.637 -0.476 1
1 730 . 6 1 1 A 66 66 ASP CA C 66 51.001 53.490 -2.489 1
1 731 . 6 1 1 A 66 66 ASP CB C 66 42.836 42.086 0.750 1
1 732 . 6 1 1 A 66 66 ASP N N 66 121.799 124.532 -2.733 1
1 733 . 6 1 1 A 67 67 GLY H H 67 8.688 8.721 -0.033 1
1 734 . 6 1 1 A 67 67 GLY HA2 H 67 3.923 4.005 -0.082 1
1 735 . 6 1 1 A 67 67 GLY HA3 H 67 3.808 4.015 -0.207 1
1 736 . 6 1 1 A 67 67 GLY C C 67 175.500 174.161 1.339 1
1 737 . 6 1 1 A 67 67 GLY CA C 67 46.591 46.529 0.062 1
1 738 . 6 1 1 A 67 67 GLY N N 67 106.518 111.191 -4.673 1
1 739 . 6 1 1 A 68 68 LEU H H 68 8.125 7.197 0.928 1
1 740 . 6 1 1 A 68 68 LEU HA H 68 4.252 4.926 -0.674 1
1 750 . 6 1 1 A 68 68 LEU C C 68 174.914 175.159 -0.245 1
1 751 . 6 1 1 A 68 68 LEU CA C 68 53.469 53.181 0.288 1
1 752 . 6 1 1 A 68 68 LEU CB C 68 40.422 45.641 -5.219 1
1 756 . 6 1 1 A 68 68 LEU N N 68 119.345 120.037 -0.692 1
1 757 . 6 1 1 A 69 69 GLU H H 69 8.207 8.849 -0.642 1
1 758 . 6 1 1 A 69 69 GLU HA H 69 4.908 4.815 0.093 1
1 763 . 6 1 1 A 69 69 GLU C C 69 174.464 174.100 0.364 1
1 764 . 6 1 1 A 69 69 GLU CA C 69 53.081 52.881 0.200 1
1 765 . 6 1 1 A 69 69 GLU CB C 69 31.538 31.422 0.116 1
1 767 . 6 1 1 A 69 69 GLU N N 69 119.486 119.437 0.049 1
1 768 . 6 1 1 A 70 70 PRO HA H 70 4.866 4.334 0.532 1
1 775 . 6 1 1 A 70 70 PRO C C 70 178.285 177.493 0.792 1
1 776 . 6 1 1 A 70 70 PRO CA C 70 63.203 63.627 -0.424 1
1 777 . 6 1 1 A 70 70 PRO CB C 70 33.726 31.807 1.919 1
1 780 . 6 1 1 A 71 71 GLY H H 71 7.362 8.763 -1.401 1
1 781 . 6 1 1 A 71 71 GLY HA2 H 71 3.807 3.929 -0.122 1
1 782 . 6 1 1 A 71 71 GLY HA3 H 71 3.756 3.931 -0.175 1
1 783 . 6 1 1 A 71 71 GLY C C 71 174.664 173.726 0.938 1
1 784 . 6 1 1 A 71 71 GLY CA C 71 46.926 46.327 0.599 1
1 785 . 6 1 1 A 71 71 GLY N N 71 113.776 111.642 2.134 1
1 786 . 6 1 1 A 72 72 ARG H H 72 8.036 7.228 0.808 1
1 787 . 6 1 1 A 72 72 ARG HA H 72 4.597 4.863 -0.266 1
1 793 . 6 1 1 A 72 72 ARG C C 72 173.293 173.670 -0.377 1
1 794 . 6 1 1 A 72 72 ARG CA C 72 54.633 54.362 0.271 1
1 795 . 6 1 1 A 72 72 ARG CB C 72 33.704 33.606 0.098 1
1 798 . 6 1 1 A 72 72 ARG N N 72 119.611 119.516 0.095 1
1 799 . 6 1 1 A 73 73 ASP H H 73 7.785 8.465 -0.680 1
1 800 . 6 1 1 A 73 73 ASP HA H 73 5.276 5.676 -0.400 1
1 803 . 6 1 1 A 73 73 ASP C C 73 175.904 175.022 0.882 1
1 804 . 6 1 1 A 73 73 ASP CA C 73 53.568 52.584 0.984 1
1 805 . 6 1 1 A 73 73 ASP CB C 73 42.970 43.078 -0.108 1
1 806 . 6 1 1 A 73 73 ASP N N 73 118.900 125.341 -6.441 1
1 807 . 6 1 1 A 74 74 TYR H H 74 9.516 8.847 0.669 1
1 808 . 6 1 1 A 74 74 TYR HA H 74 4.800 4.991 -0.191 1
1 815 . 6 1 1 A 74 74 TYR C C 74 174.631 174.973 -0.342 1
1 816 . 6 1 1 A 74 74 TYR CA C 74 58.548 56.330 2.218 1
1 817 . 6 1 1 A 74 74 TYR CB C 74 42.029 42.772 -0.743 1
1 822 . 6 1 1 A 74 74 TYR N N 74 121.903 120.528 1.375 1
1 823 . 6 1 1 A 75 75 GLU H H 75 9.248 9.089 0.159 1
1 824 . 6 1 1 A 75 75 GLU HA H 75 4.756 4.613 0.143 1
1 829 . 6 1 1 A 75 75 GLU C C 75 175.524 175.465 0.059 1
1 830 . 6 1 1 A 75 75 GLU CA C 75 55.621 55.508 0.113 1
1 831 . 6 1 1 A 75 75 GLU CB C 75 30.778 28.831 1.947 1
1 833 . 6 1 1 A 75 75 GLU N N 75 122.425 123.345 -0.920 1
1 834 . 6 1 1 A 76 76 VAL H H 76 8.884 8.311 0.573 1
1 835 . 6 1 1 A 76 76 VAL HA H 76 5.246 4.570 0.676 1
1 843 . 6 1 1 A 76 76 VAL C C 76 174.800 175.364 -0.564 1
1 844 . 6 1 1 A 76 76 VAL CA C 76 60.199 63.075 -2.876 1
1 845 . 6 1 1 A 76 76 VAL CB C 76 33.449 31.193 2.256 1
1 848 . 6 1 1 A 76 76 VAL N N 76 126.853 124.601 2.252 1
1 849 . 6 1 1 A 77 77 SER H H 77 9.234 8.882 0.352 1
1 850 . 6 1 1 A 77 77 SER HA H 77 5.398 5.042 0.356 1
1 853 . 6 1 1 A 77 77 SER C C 77 173.138 173.823 -0.685 1
1 854 . 6 1 1 A 77 77 SER CA C 77 56.032 57.845 -1.813 1
1 855 . 6 1 1 A 77 77 SER CB C 77 66.374 64.304 2.070 1
1 856 . 6 1 1 A 77 77 SER N N 77 120.852 123.542 -2.690 1
1 857 . 6 1 1 A 78 78 VAL H H 78 9.092 8.943 0.149 1
1 858 . 6 1 1 A 78 78 VAL HA H 78 4.756 4.718 0.038 1
1 866 . 6 1 1 A 78 78 VAL C C 78 173.641 174.713 -1.072 1
1 867 . 6 1 1 A 78 78 VAL CA C 78 61.246 60.343 0.903 1
1 868 . 6 1 1 A 78 78 VAL CB C 78 34.467 34.242 0.225 1
1 871 . 6 1 1 A 78 78 VAL N N 78 122.453 124.873 -2.420 1
1 872 . 6 1 1 A 79 79 GLN H H 79 8.587 8.491 0.096 1
1 873 . 6 1 1 A 79 79 GLN HA H 79 4.438 4.778 -0.340 1
1 880 . 6 1 1 A 79 79 GLN C C 79 174.999 174.320 0.679 1
1 881 . 6 1 1 A 79 79 GLN CA C 79 54.227 54.348 -0.121 1
1 882 . 6 1 1 A 79 79 GLN CB C 79 33.587 32.794 0.793 1
1 884 . 6 1 1 A 79 79 GLN N N 79 125.619 127.453 -1.834 1
1 886 . 6 1 1 A 80 80 SER H H 80 8.623 8.854 -0.231 1
1 887 . 6 1 1 A 80 80 SER HA H 80 4.756 4.697 0.059 1
1 890 . 6 1 1 A 80 80 SER C C 80 172.264 173.868 -1.604 1
1 891 . 6 1 1 A 80 80 SER CA C 80 58.177 58.970 -0.793 1
1 892 . 6 1 1 A 80 80 SER CB C 80 63.920 63.830 0.090 1
1 893 . 6 1 1 A 80 80 SER N N 80 122.844 123.931 -1.087 1
1 894 . 6 1 1 A 81 81 LEU H H 81 8.348 8.981 -0.633 1
1 895 . 6 1 1 A 81 81 LEU HA H 81 5.124 4.633 0.491 1
1 905 . 6 1 1 A 81 81 LEU C C 81 175.775 174.996 0.779 1
1 906 . 6 1 1 A 81 81 LEU CA C 81 54.033 53.588 0.445 1
1 907 . 6 1 1 A 81 81 LEU CB C 81 44.690 42.160 2.530 1
1 911 . 6 1 1 A 81 81 LEU N N 81 123.191 127.173 -3.982 1
1 912 . 6 1 1 A 82 82 ARG H H 82 8.374 8.030 0.344 1
1 913 . 6 1 1 A 82 82 ARG HA H 82 4.616 4.433 0.183 1
1 919 . 6 1 1 A 82 82 ARG C C 82 176.864 175.718 1.146 1
1 920 . 6 1 1 A 82 82 ARG CA C 82 55.868 54.547 1.321 1
1 921 . 6 1 1 A 82 82 ARG CB C 82 32.322 30.862 1.460 1
1 924 . 6 1 1 A 82 82 ARG N N 82 121.029 126.335 -5.306 1
1 925 . 6 1 1 A 83 83 GLY H H 83 8.309 7.847 0.462 1
1 926 . 6 1 1 A 83 83 GLY HA2 H 83 4.031 4.023 0.008 1
1 927 . 6 1 1 A 83 83 GLY HA3 H 83 3.888 4.037 -0.149 1
1 928 . 6 1 1 A 83 83 GLY C C 83 174.562 174.024 0.538 1
1 929 . 6 1 1 A 83 83 GLY CA C 83 45.963 44.114 1.849 1
1 930 . 6 1 1 A 83 83 GLY N N 83 109.937 113.555 -3.618 1
1 931 . 6 1 1 A 84 84 PRO HA H 84 4.573 4.507 0.066 1
1 938 . 6 1 1 A 84 84 PRO C C 84 176.533 175.500 1.033 1
1 939 . 6 1 1 A 84 84 PRO CA C 84 63.485 63.889 -0.404 1
1 940 . 6 1 1 A 84 84 PRO CB C 84 32.409 31.927 0.482 1
1 943 . 6 1 1 A 85 85 GLU H H 85 7.799 7.568 0.231 1
1 944 . 6 1 1 A 85 85 GLU HA H 85 4.369 4.921 -0.552 1
1 949 . 6 1 1 A 85 85 GLU C C 85 174.722 175.658 -0.936 1
1 950 . 6 1 1 A 85 85 GLU CA C 85 55.899 54.832 1.067 1
1 951 . 6 1 1 A 85 85 GLU CB C 85 31.911 33.065 -1.154 1
1 953 . 6 1 1 A 85 85 GLU N N 85 122.093 113.277 8.816 1
1 954 . 6 1 1 A 86 86 GLY H H 86 8.329 8.904 -0.575 1
1 955 . 6 1 1 A 86 86 GLY HA2 H 86 5.298 4.262 1.036 1
1 956 . 6 1 1 A 86 86 GLY HA3 H 86 3.559 4.287 -0.728 1
1 957 . 6 1 1 A 86 86 GLY C C 86 174.355 172.760 1.595 1
1 958 . 6 1 1 A 86 86 GLY CA C 86 44.034 43.544 0.490 1
1 959 . 6 1 1 A 86 86 GLY N N 86 109.387 109.534 -0.147 1
1 960 . 6 1 1 A 87 87 SER H H 87 8.807 8.936 -0.129 1
1 961 . 6 1 1 A 87 87 SER HA H 87 4.670 4.501 0.169 1
1 964 . 6 1 1 A 87 87 SER C C 87 175.195 174.438 0.757 1
1 965 . 6 1 1 A 87 87 SER CA C 87 57.737 57.532 0.205 1
1 966 . 6 1 1 A 87 87 SER CB C 87 67.829 63.948 3.881 1
1 967 . 6 1 1 A 87 87 SER N N 87 117.698 116.091 1.607 1
1 968 . 6 1 1 A 88 88 GLU H H 88 8.754 8.686 0.068 1
1 969 . 6 1 1 A 88 88 GLU HA H 88 4.357 4.398 -0.041 1
1 974 . 6 1 1 A 88 88 GLU C C 88 177.474 176.540 0.934 1
1 975 . 6 1 1 A 88 88 GLU CA C 88 57.525 56.664 0.861 1
1 976 . 6 1 1 A 88 88 GLU CB C 88 31.162 30.668 0.494 1
1 978 . 6 1 1 A 88 88 GLU N N 88 118.709 122.749 -4.040 1
1 979 . 6 1 1 A 89 89 ALA H H 89 8.855 8.484 0.371 1
1 980 . 6 1 1 A 89 89 ALA HA H 89 4.792 4.743 0.049 1
1 984 . 6 1 1 A 89 89 ALA C C 89 178.379 176.319 2.060 1
1 985 . 6 1 1 A 89 89 ALA CA C 89 51.264 51.342 -0.078 1
1 986 . 6 1 1 A 89 89 ALA CB C 89 20.040 19.928 0.112 1
1 987 . 6 1 1 A 89 89 ALA N N 89 127.301 123.910 3.391 1
1 988 . 6 1 1 A 90 90 ARG H H 90 8.549 8.703 -0.154 1
1 989 . 6 1 1 A 90 90 ARG HA H 90 4.658 4.981 -0.323 1
1 996 . 6 1 1 A 90 90 ARG C C 90 174.720 175.217 -0.497 1
1 997 . 6 1 1 A 90 90 ARG CA C 90 53.575 54.280 -0.705 1
1 998 . 6 1 1 A 90 90 ARG CB C 90 33.456 32.014 1.442 1
1 1001 . 6 1 1 A 90 90 ARG N N 90 121.289 124.087 -2.798 1
1 1002 . 6 1 1 A 91 91 GLY H H 91 8.396 9.049 -0.653 1
1 1003 . 6 1 1 A 91 91 GLY HA2 H 91 5.306 4.202 1.104 1
1 1004 . 6 1 1 A 91 91 GLY HA3 H 91 3.700 4.230 -0.530 1
1 1005 . 6 1 1 A 91 91 GLY C C 91 173.191 172.008 1.183 1
1 1006 . 6 1 1 A 91 91 GLY CA C 91 44.493 43.851 0.642 1
1 1007 . 6 1 1 A 91 91 GLY N N 91 108.579 112.279 -3.700 1
1 1008 . 6 1 1 A 92 92 ILE H H 92 8.891 8.286 0.605 1
1 1009 . 6 1 1 A 92 92 ILE HA H 92 4.499 5.006 -0.507 1
1 1019 . 6 1 1 A 92 92 ILE C C 92 171.877 174.505 -2.628 1
1 1020 . 6 1 1 A 92 92 ILE CA C 92 60.682 59.166 1.516 1
1 1021 . 6 1 1 A 92 92 ILE CB C 92 42.425 41.855 0.570 1
1 1025 . 6 1 1 A 92 92 ILE N N 92 118.313 121.561 -3.248 1
1 1026 . 6 1 1 A 93 93 ARG H H 93 7.980 8.496 -0.516 1
1 1027 . 6 1 1 A 93 93 ARG HA H 93 5.224 4.373 0.851 1
1 1034 . 6 1 1 A 93 93 ARG C C 93 175.072 175.465 -0.393 1
1 1035 . 6 1 1 A 93 93 ARG CA C 93 54.499 56.303 -1.804 1
1 1036 . 6 1 1 A 93 93 ARG CB C 93 31.767 30.360 1.407 1
1 1039 . 6 1 1 A 93 93 ARG N N 93 124.879 130.079 -5.200 1
1 1040 . 6 1 1 A 94 94 ALA H H 94 9.064 8.746 0.318 1
1 1041 . 6 1 1 A 94 94 ALA HA H 94 4.731 4.554 0.177 1
1 1045 . 6 1 1 A 94 94 ALA C C 94 174.494 177.308 -2.814 1
1 1046 . 6 1 1 A 94 94 ALA CA C 94 50.577 52.739 -2.162 1
1 1047 . 6 1 1 A 94 94 ALA CB C 94 23.082 19.822 3.260 1
1 1048 . 6 1 1 A 94 94 ALA N N 94 126.095 129.615 -3.520 1
1 1049 . 6 1 1 A 95 95 ARG H H 95 8.263 9.002 -0.739 1
1 1050 . 6 1 1 A 95 95 ARG HA H 95 5.548 5.272 0.276 1
1 1058 . 6 1 1 A 95 95 ARG C C 95 176.901 174.491 2.410 1
1 1059 . 6 1 1 A 95 95 ARG CA C 95 53.787 54.343 -0.556 1
1 1060 . 6 1 1 A 95 95 ARG CB C 95 32.426 34.231 -1.805 1
1 1063 . 6 1 1 A 95 95 ARG N N 95 123.374 117.851 5.523 1
1 1065 . 6 1 1 A 96 96 THR H H 96 9.208 8.795 0.413 1
1 1066 . 6 1 1 A 96 96 THR HA H 96 4.461 5.032 -0.571 1
1 1071 . 6 1 1 A 96 96 THR CA C 96 58.248 58.442 -0.194 1
1 1072 . 6 1 1 A 96 96 THR CB C 96 68.466 70.850 -2.384 1
1 1074 . 6 1 1 A 96 96 THR N N 96 119.492 111.634 7.858 1
1 1075 . 6 1 1 A 97 97 PRO HA H 97 4.636 4.606 0.030 1
1 1082 . 6 1 1 A 97 97 PRO C C 97 175.725 175.807 -0.082 1
1 1083 . 6 1 1 A 97 97 PRO CA C 97 61.907 62.290 -0.383 1
1 1084 . 6 1 1 A 97 97 PRO CB C 97 32.590 33.430 -0.840 1
1 1087 . 6 1 1 A 98 98 THR H H 98 7.943 8.232 -0.289 1
1 1088 . 6 1 1 A 98 98 THR HA H 98 4.208 5.027 -0.819 1
1 1093 . 6 1 1 A 98 98 THR C C 98 175.058 174.913 0.145 1
1 1094 . 6 1 1 A 98 98 THR CA C 98 62.069 60.371 1.698 1
1 1095 . 6 1 1 A 98 98 THR CB C 98 69.719 71.199 -1.480 1
1 1097 . 6 1 1 A 98 98 THR N N 98 107.148 111.812 -4.664 1
1 1098 . 6 1 1 A 99 99 SER H H 99 8.163 9.008 -0.845 1
1 1099 . 6 1 1 A 99 99 SER HA H 99 4.524 4.262 0.262 1
1 1102 . 6 1 1 A 99 99 SER C C 99 174.319 176.948 -2.629 1
1 1103 . 6 1 1 A 99 99 SER CA C 99 58.107 61.359 -3.252 1
1 1104 . 6 1 1 A 99 99 SER CB C 99 64.492 62.767 1.725 1
1 1105 . 6 1 1 A 99 99 SER N N 99 115.114 120.602 -5.488 1
1 1106 . 6 1 1 A 100 100 GLY H H 100 8.336 8.301 0.035 1
1 1107 . 6 1 1 A 100 100 GLY HA2 H 100 4.222 3.758 0.464 1
1 1108 . 6 1 1 A 100 100 GLY HA3 H 100 4.222 3.759 0.463 1
1 1109 . 6 1 1 A 100 100 GLY C C 100 171.696 174.605 -2.909 1
1 1110 . 6 1 1 A 100 100 GLY CA C 100 44.617 47.850 -3.233 1
1 1111 . 6 1 1 A 100 100 GLY N N 100 110.678 109.303 1.375 1
1 1112 . 6 1 1 A 101 101 PRO HA H 101 4.506 4.565 -0.059 1
1 1118 . 6 1 1 A 101 101 PRO CA C 101 63.358 62.922 0.436 1
1 1119 . 6 1 1 A 101 101 PRO CB C 101 32.313 32.342 -0.029 1
1 1 . 7 1 1 A 6 6 SER HA H 6 4.528 4.281 0.247 1
1 3 . 7 1 1 A 6 6 SER CA C 6 58.373 59.771 -1.398 1
1 4 . 7 1 1 A 6 6 SER CB C 6 63.978 63.902 0.076 1
1 5 . 7 1 1 A 7 7 GLY H H 7 8.228 8.317 -0.089 1
1 6 . 7 1 1 A 7 7 GLY HA2 H 7 4.134 4.118 0.016 1
1 7 . 7 1 1 A 7 7 GLY HA3 H 7 4.134 4.119 0.015 1
1 8 . 7 1 1 A 7 7 GLY CA C 7 44.607 44.071 0.536 1
1 9 . 7 1 1 A 7 7 GLY N N 7 110.638 111.282 -0.644 1
1 10 . 7 1 1 A 8 8 PRO HA H 8 4.419 4.682 -0.263 1
1 17 . 7 1 1 A 8 8 PRO C C 8 176.908 175.363 1.545 1
1 18 . 7 1 1 A 8 8 PRO CA C 8 62.851 62.728 0.123 1
1 19 . 7 1 1 A 8 8 PRO CB C 8 32.243 30.760 1.483 1
1 22 . 7 1 1 A 9 9 LEU H H 9 8.462 8.241 0.221 1
1 23 . 7 1 1 A 9 9 LEU HA H 9 4.494 4.599 -0.105 1
1 33 . 7 1 1 A 9 9 LEU C C 9 174.124 174.386 -0.262 1
1 34 . 7 1 1 A 9 9 LEU CA C 9 52.587 51.935 0.652 1
1 35 . 7 1 1 A 9 9 LEU CB C 9 43.150 43.893 -0.743 1
1 39 . 7 1 1 A 9 9 LEU N N 9 126.015 125.180 0.835 1
1 40 . 7 1 1 A 10 10 PRO HA H 10 4.820 4.629 0.191 1
1 47 . 7 1 1 A 10 10 PRO CA C 10 61.368 62.535 -1.167 1
1 48 . 7 1 1 A 10 10 PRO CB C 10 31.391 31.684 -0.293 1
1 51 . 7 1 1 A 11 11 PRO HA H 11 4.949 4.589 0.360 1
1 58 . 7 1 1 A 11 11 PRO CA C 11 61.183 61.774 -0.591 1
1 59 . 7 1 1 A 11 11 PRO CB C 11 30.656 31.896 -1.240 1
1 62 . 7 1 1 A 12 12 PRO HA H 12 4.341 4.635 -0.294 1
1 69 . 7 1 1 A 12 12 PRO C C 12 174.849 176.880 -2.031 1
1 70 . 7 1 1 A 12 12 PRO CA C 12 63.062 62.663 0.399 1
1 71 . 7 1 1 A 12 12 PRO CB C 12 31.831 31.528 0.303 1
1 74 . 7 1 1 A 13 13 ARG H H 13 7.828 8.991 -1.163 1
1 75 . 7 1 1 A 13 13 ARG HA H 13 4.536 4.455 0.081 1
1 82 . 7 1 1 A 13 13 ARG C C 13 174.608 176.967 -2.359 1
1 83 . 7 1 1 A 13 13 ARG CA C 13 54.774 57.197 -2.423 1
1 84 . 7 1 1 A 13 13 ARG CB C 13 33.250 31.834 1.416 1
1 87 . 7 1 1 A 13 13 ARG N N 13 120.532 123.733 -3.201 1
1 88 . 7 1 1 A 14 14 ALA H H 14 8.694 7.531 1.163 1
1 89 . 7 1 1 A 14 14 ALA HA H 14 3.986 4.363 -0.377 1
1 93 . 7 1 1 A 14 14 ALA C C 14 177.232 176.590 0.642 1
1 94 . 7 1 1 A 14 14 ALA CA C 14 52.461 52.006 0.455 1
1 95 . 7 1 1 A 14 14 ALA CB C 14 16.806 17.259 -0.453 1
1 96 . 7 1 1 A 14 14 ALA N N 14 121.921 120.032 1.889 1
1 97 . 7 1 1 A 15 15 LEU H H 15 8.097 8.499 -0.402 1
1 98 . 7 1 1 A 15 15 LEU HA H 15 4.670 4.815 -0.145 1
1 108 . 7 1 1 A 15 15 LEU C C 15 177.364 176.059 1.305 1
1 109 . 7 1 1 A 15 15 LEU CA C 15 57.543 54.351 3.192 1
1 110 . 7 1 1 A 15 15 LEU CB C 15 41.877 41.577 0.300 1
1 114 . 7 1 1 A 15 15 LEU N N 15 122.215 121.160 1.055 1
1 115 . 7 1 1 A 16 16 THR H H 16 9.520 8.467 1.053 1
1 116 . 7 1 1 A 16 16 THR HA H 16 4.369 4.691 -0.322 1
1 121 . 7 1 1 A 16 16 THR C C 16 172.453 173.333 -0.880 1
1 122 . 7 1 1 A 16 16 THR CA C 16 62.480 61.312 1.168 1
1 123 . 7 1 1 A 16 16 THR CB C 16 72.198 72.467 -0.269 1
1 125 . 7 1 1 A 16 16 THR N N 16 122.214 120.290 1.924 1
1 126 . 7 1 1 A 17 17 LEU H H 17 8.847 8.607 0.240 1
1 127 . 7 1 1 A 17 17 LEU HA H 17 4.573 4.354 0.219 1
1 137 . 7 1 1 A 17 17 LEU C C 17 174.695 177.089 -2.394 1
1 138 . 7 1 1 A 17 17 LEU CA C 17 53.840 55.809 -1.969 1
1 139 . 7 1 1 A 17 17 LEU CB C 17 40.290 42.678 -2.388 1
1 143 . 7 1 1 A 17 17 LEU N N 17 127.415 127.919 -0.504 1
1 144 . 7 1 1 A 18 18 ALA H H 18 8.647 8.294 0.353 1
1 145 . 7 1 1 A 18 18 ALA HA H 18 4.106 4.072 0.034 1
1 149 . 7 1 1 A 18 18 ALA C C 18 178.236 177.576 0.660 1
1 150 . 7 1 1 A 18 18 ALA CA C 18 53.926 53.914 0.012 1
1 151 . 7 1 1 A 18 18 ALA CB C 18 18.876 19.049 -0.173 1
1 152 . 7 1 1 A 18 18 ALA N N 18 133.362 130.648 2.714 1
1 153 . 7 1 1 A 19 19 ALA H H 19 7.772 7.183 0.589 1
1 154 . 7 1 1 A 19 19 ALA HA H 19 4.561 4.654 -0.093 1
1 158 . 7 1 1 A 19 19 ALA C C 19 176.032 175.159 0.873 1
1 159 . 7 1 1 A 19 19 ALA CA C 19 53.011 51.908 1.103 1
1 160 . 7 1 1 A 19 19 ALA CB C 19 21.869 21.930 -0.061 1
1 161 . 7 1 1 A 19 19 ALA N N 19 115.654 116.860 -1.206 1
1 162 . 7 1 1 A 20 20 VAL H H 20 8.697 8.932 -0.235 1
1 163 . 7 1 1 A 20 20 VAL HA H 20 4.951 4.649 0.302 1
1 171 . 7 1 1 A 20 20 VAL C C 20 174.314 174.390 -0.076 1
1 172 . 7 1 1 A 20 20 VAL CA C 20 61.352 61.076 0.276 1
1 173 . 7 1 1 A 20 20 VAL CB C 20 35.394 32.892 2.502 1
1 176 . 7 1 1 A 20 20 VAL N N 20 120.848 124.426 -3.578 1
1 177 . 7 1 1 A 21 21 THR H H 21 9.198 8.471 0.727 1
1 178 . 7 1 1 A 21 21 THR HA H 21 4.941 4.737 0.204 1
1 183 . 7 1 1 A 21 21 THR C C 21 174.416 174.628 -0.212 1
1 184 . 7 1 1 A 21 21 THR CA C 21 60.347 58.929 1.418 1
1 185 . 7 1 1 A 21 21 THR CB C 21 68.713 71.808 -3.095 1
1 187 . 7 1 1 A 21 21 THR N N 21 120.326 125.461 -5.135 1
1 188 . 7 1 1 A 22 22 PRO HA H 22 4.634 4.566 0.068 1
1 194 . 7 1 1 A 22 22 PRO C C 22 173.606 176.695 -3.089 1
1 195 . 7 1 1 A 22 22 PRO CA C 22 66.519 64.266 2.253 1
1 196 . 7 1 1 A 22 22 PRO CB C 22 32.078 31.629 0.449 1
1 199 . 7 1 1 A 23 23 ARG H H 23 6.621 8.114 -1.493 1
1 200 . 7 1 1 A 23 23 ARG HA H 23 4.591 4.580 0.011 1
1 207 . 7 1 1 A 23 23 ARG C C 23 176.554 175.679 0.875 1
1 208 . 7 1 1 A 23 23 ARG CA C 23 53.892 56.289 -2.397 1
1 209 . 7 1 1 A 23 23 ARG CB C 23 33.498 32.913 0.585 1
1 212 . 7 1 1 A 23 23 ARG N N 23 102.938 116.931 -13.993 1
1 213 . 7 1 1 A 24 24 THR H H 24 7.352 7.933 -0.581 1
1 214 . 7 1 1 A 24 24 THR HA H 24 5.593 5.424 0.169 1
1 219 . 7 1 1 A 24 24 THR C C 24 172.345 172.177 0.168 1
1 220 . 7 1 1 A 24 24 THR CA C 24 59.311 60.610 -1.299 1
1 221 . 7 1 1 A 24 24 THR CB C 24 73.311 71.972 1.339 1
1 223 . 7 1 1 A 24 24 THR N N 24 108.792 111.168 -2.376 1
1 224 . 7 1 1 A 25 25 VAL H H 25 8.437 8.476 -0.039 1
1 225 . 7 1 1 A 25 25 VAL HA H 25 4.512 4.938 -0.426 1
1 233 . 7 1 1 A 25 25 VAL C C 25 172.854 173.932 -1.078 1
1 234 . 7 1 1 A 25 25 VAL CA C 25 61.617 60.953 0.664 1
1 235 . 7 1 1 A 25 25 VAL CB C 25 36.742 34.358 2.384 1
1 238 . 7 1 1 A 25 25 VAL N N 25 117.023 121.016 -3.993 1
1 239 . 7 1 1 A 26 26 HIS H H 26 8.915 8.792 0.123 1
1 240 . 7 1 1 A 26 26 HIS HA H 26 5.765 5.651 0.114 1
1 245 . 7 1 1 A 26 26 HIS C C 26 173.976 173.185 0.791 1
1 246 . 7 1 1 A 26 26 HIS CA C 26 52.896 53.637 -0.741 1
1 247 . 7 1 1 A 26 26 HIS CB C 26 34.004 32.662 1.342 1
1 250 . 7 1 1 A 26 26 HIS N N 26 128.155 127.729 0.426 1
1 251 . 7 1 1 A 27 27 LEU H H 27 9.034 9.495 -0.461 1
1 252 . 7 1 1 A 27 27 LEU HA H 27 5.505 5.180 0.325 1
1 262 . 7 1 1 A 27 27 LEU C C 27 174.821 174.891 -0.070 1
1 263 . 7 1 1 A 27 27 LEU CA C 27 53.376 53.229 0.147 1
1 264 . 7 1 1 A 27 27 LEU CB C 27 46.306 46.911 -0.605 1
1 268 . 7 1 1 A 27 27 LEU N N 27 128.569 130.227 -1.658 1
1 269 . 7 1 1 A 28 28 THR H H 28 8.844 8.295 0.549 1
1 270 . 7 1 1 A 28 28 THR HA H 28 4.485 4.784 -0.299 1
1 275 . 7 1 1 A 28 28 THR C C 28 172.773 173.423 -0.650 1
1 276 . 7 1 1 A 28 28 THR CA C 28 60.052 60.023 0.029 1
1 277 . 7 1 1 A 28 28 THR CB C 28 71.704 71.102 0.602 1
1 279 . 7 1 1 A 28 28 THR N N 28 112.165 113.964 -1.799 1
1 280 . 7 1 1 A 29 29 TRP H H 29 7.395 7.888 -0.493 1
1 281 . 7 1 1 A 29 29 TRP HA H 29 4.915 5.818 -0.903 1
1 290 . 7 1 1 A 29 29 TRP C C 29 174.013 174.533 -0.520 1
1 291 . 7 1 1 A 29 29 TRP CA C 29 56.626 54.453 2.173 1
1 292 . 7 1 1 A 29 29 TRP CB C 29 29.487 31.890 -2.403 1
1 298 . 7 1 1 A 29 29 TRP N N 29 115.623 120.053 -4.430 1
1 300 . 7 1 1 A 30 30 GLN H H 30 8.759 8.584 0.175 1
1 301 . 7 1 1 A 30 30 GLN HA H 30 4.641 4.763 -0.122 1
1 308 . 7 1 1 A 30 30 GLN C C 30 175.072 174.158 0.914 1
1 309 . 7 1 1 A 30 30 GLN CA C 30 52.975 53.513 -0.538 1
1 310 . 7 1 1 A 30 30 GLN CB C 30 28.398 28.536 -0.138 1
1 312 . 7 1 1 A 30 30 GLN N N 30 117.497 120.089 -2.592 1
1 314 . 7 1 1 A 31 31 PRO HA H 31 4.487 4.620 -0.133 1
1 320 . 7 1 1 A 31 31 PRO C C 31 177.034 176.941 0.093 1
1 321 . 7 1 1 A 31 31 PRO CA C 31 62.710 62.727 -0.017 1
1 322 . 7 1 1 A 31 31 PRO CB C 31 32.738 32.072 0.666 1
1 325 . 7 1 1 A 32 32 SER H H 32 8.259 8.606 -0.347 1
1 326 . 7 1 1 A 32 32 SER HA H 32 4.670 4.927 -0.257 1
1 329 . 7 1 1 A 32 32 SER C C 32 174.689 174.287 0.402 1
1 330 . 7 1 1 A 32 32 SER CA C 32 57.296 57.994 -0.698 1
1 331 . 7 1 1 A 32 32 SER CB C 32 64.748 64.624 0.124 1
1 332 . 7 1 1 A 32 32 SER N N 32 117.667 117.583 0.084 1
1 333 . 7 1 1 A 33 33 ALA H H 33 9.038 8.439 0.599 1
1 334 . 7 1 1 A 33 33 ALA HA H 33 4.126 4.676 -0.550 1
1 338 . 7 1 1 A 33 33 ALA C C 33 177.795 177.385 0.410 1
1 339 . 7 1 1 A 33 33 ALA CA C 33 54.213 50.676 3.537 1
1 340 . 7 1 1 A 33 33 ALA CB C 33 17.948 19.314 -1.366 1
1 341 . 7 1 1 A 33 33 ALA N N 33 131.772 123.366 8.406 1
1 342 . 7 1 1 A 34 34 GLY H H 34 8.576 7.702 0.874 1
1 343 . 7 1 1 A 34 34 GLY HA2 H 34 4.171 4.031 0.140 1
1 344 . 7 1 1 A 34 34 GLY HA3 H 34 3.592 4.034 -0.442 1
1 345 . 7 1 1 A 34 34 GLY C C 34 174.182 174.593 -0.411 1
1 346 . 7 1 1 A 34 34 GLY CA C 34 44.987 45.458 -0.471 1
1 347 . 7 1 1 A 34 34 GLY N N 34 111.339 105.979 5.360 1
1 348 . 7 1 1 A 35 35 ALA H H 35 7.637 7.738 -0.101 1
1 349 . 7 1 1 A 35 35 ALA HA H 35 4.210 4.150 0.060 1
1 353 . 7 1 1 A 35 35 ALA C C 35 178.918 177.176 1.742 1
1 354 . 7 1 1 A 35 35 ALA CA C 35 52.671 52.490 0.181 1
1 355 . 7 1 1 A 35 35 ALA CB C 35 18.988 19.407 -0.419 1
1 356 . 7 1 1 A 35 35 ALA N N 35 121.531 123.412 -1.881 1
1 357 . 7 1 1 A 36 36 THR H H 36 9.428 8.123 1.305 1
1 358 . 7 1 1 A 36 36 THR HA H 36 4.402 4.287 0.115 1
1 363 . 7 1 1 A 36 36 THR C C 36 174.739 174.461 0.278 1
1 364 . 7 1 1 A 36 36 THR CA C 36 62.692 63.313 -0.621 1
1 365 . 7 1 1 A 36 36 THR CB C 36 69.482 69.973 -0.491 1
1 367 . 7 1 1 A 36 36 THR N N 36 113.103 116.090 -2.987 1
1 368 . 7 1 1 A 37 37 HIS H H 37 7.857 6.807 1.050 1
1 369 . 7 1 1 A 37 37 HIS HA H 37 4.878 4.652 0.226 1
1 374 . 7 1 1 A 37 37 HIS C C 37 171.103 171.817 -0.714 1
1 375 . 7 1 1 A 37 37 HIS CA C 37 55.867 54.257 1.610 1
1 376 . 7 1 1 A 37 37 HIS CB C 37 32.655 31.280 1.375 1
1 379 . 7 1 1 A 37 37 HIS N N 37 118.486 115.203 3.283 1
1 380 . 7 1 1 A 38 38 TYR H H 38 9.217 8.641 0.576 1
1 381 . 7 1 1 A 38 38 TYR HA H 38 5.303 5.057 0.246 1
1 388 . 7 1 1 A 38 38 TYR C C 38 173.922 174.562 -0.640 1
1 389 . 7 1 1 A 38 38 TYR CA C 38 56.504 56.324 0.180 1
1 390 . 7 1 1 A 38 38 TYR CB C 38 41.823 42.267 -0.444 1
1 395 . 7 1 1 A 38 38 TYR N N 38 114.077 118.378 -4.301 1
1 396 . 7 1 1 A 39 39 LEU H H 39 9.052 8.985 0.067 1
1 397 . 7 1 1 A 39 39 LEU HA H 39 5.061 4.964 0.097 1
1 407 . 7 1 1 A 39 39 LEU C C 39 175.455 174.456 0.999 1
1 408 . 7 1 1 A 39 39 LEU CA C 39 53.855 53.997 -0.142 1
1 409 . 7 1 1 A 39 39 LEU CB C 39 45.254 44.214 1.040 1
1 413 . 7 1 1 A 39 39 LEU N N 39 123.997 125.705 -1.708 1
1 414 . 7 1 1 A 40 40 VAL H H 40 9.520 9.675 -0.155 1
1 415 . 7 1 1 A 40 40 VAL HA H 40 4.988 4.565 0.423 1
1 423 . 7 1 1 A 40 40 VAL C C 40 174.578 174.116 0.462 1
1 424 . 7 1 1 A 40 40 VAL CA C 40 60.575 61.327 -0.752 1
1 425 . 7 1 1 A 40 40 VAL CB C 40 33.284 32.734 0.550 1
1 428 . 7 1 1 A 40 40 VAL N N 40 129.678 128.767 0.911 1
1 429 . 7 1 1 A 41 41 ARG H H 41 9.096 9.032 0.064 1
1 430 . 7 1 1 A 41 41 ARG HA H 41 5.384 5.081 0.303 1
1 437 . 7 1 1 A 41 41 ARG C C 41 175.100 174.910 0.190 1
1 438 . 7 1 1 A 41 41 ARG CA C 41 54.297 54.887 -0.590 1
1 439 . 7 1 1 A 41 41 ARG CB C 41 33.003 31.608 1.395 1
1 442 . 7 1 1 A 41 41 ARG N N 41 126.332 128.958 -2.626 1
1 443 . 7 1 1 A 42 42 CYS H H 42 9.004 9.388 -0.384 1
1 444 . 7 1 1 A 42 42 CYS HA H 42 5.309 5.223 0.086 1
1 447 . 7 1 1 A 42 42 CYS C C 42 173.417 174.092 -0.675 1
1 448 . 7 1 1 A 42 42 CYS CA C 42 57.508 57.781 -0.273 1
1 449 . 7 1 1 A 42 42 CYS CB C 42 28.859 29.691 -0.832 1
1 450 . 7 1 1 A 42 42 CYS N N 42 123.359 127.890 -4.531 1
1 451 . 7 1 1 A 43 43 SER H H 43 9.102 9.078 0.024 1
1 452 . 7 1 1 A 43 43 SER HA H 43 5.324 5.022 0.302 1
1 455 . 7 1 1 A 43 43 SER C C 43 171.429 171.500 -0.071 1
1 456 . 7 1 1 A 43 43 SER CA C 43 55.621 55.737 -0.116 1
1 457 . 7 1 1 A 43 43 SER CB C 43 64.856 65.245 -0.389 1
1 458 . 7 1 1 A 43 43 SER N N 43 125.444 120.457 4.987 1
1 459 . 7 1 1 A 44 44 PRO HA H 44 4.389 4.634 -0.245 1
1 466 . 7 1 1 A 44 44 PRO C C 44 176.559 177.318 -0.759 1
1 467 . 7 1 1 A 44 44 PRO CA C 44 63.027 62.926 0.101 1
1 468 . 7 1 1 A 44 44 PRO CB C 44 31.935 32.885 -0.950 1
1 471 . 7 1 1 A 45 45 ALA H H 45 8.261 8.048 0.213 1
1 472 . 7 1 1 A 45 45 ALA HA H 45 4.157 4.120 0.037 1
1 476 . 7 1 1 A 45 45 ALA C C 45 177.706 177.186 0.520 1
1 477 . 7 1 1 A 45 45 ALA CA C 45 53.284 54.467 -1.183 1
1 478 . 7 1 1 A 45 45 ALA CB C 45 18.978 19.407 -0.429 1
1 479 . 7 1 1 A 45 45 ALA N N 45 126.162 123.842 2.320 1
1 480 . 7 1 1 A 46 46 SER H H 46 8.275 7.638 0.637 1
1 481 . 7 1 1 A 46 46 SER HA H 46 4.779 4.820 -0.041 1
1 484 . 7 1 1 A 46 46 SER C C 46 172.182 173.775 -1.593 1
1 485 . 7 1 1 A 46 46 SER CA C 46 55.091 54.520 0.571 1
1 486 . 7 1 1 A 46 46 SER CB C 46 63.130 64.961 -1.831 1
1 487 . 7 1 1 A 46 46 SER N N 46 113.009 111.980 1.029 1
1 488 . 7 1 1 A 47 47 PRO HA H 47 4.336 4.599 -0.263 1
1 493 . 7 1 1 A 47 47 PRO C C 47 177.165 176.467 0.698 1
1 494 . 7 1 1 A 47 47 PRO CA C 47 63.268 63.694 -0.426 1
1 495 . 7 1 1 A 47 47 PRO CB C 47 32.528 31.721 0.807 1
1 498 . 7 1 1 A 48 48 LYS H H 48 9.089 7.124 1.965 1
1 499 . 7 1 1 A 48 48 LYS HA H 48 4.408 4.293 0.115 1
1 508 . 7 1 1 A 48 48 LYS C C 48 176.917 176.493 0.424 1
1 509 . 7 1 1 A 48 48 LYS CA C 48 55.893 56.532 -0.639 1
1 510 . 7 1 1 A 48 48 LYS CB C 48 32.997 32.526 0.471 1
1 514 . 7 1 1 A 48 48 LYS N N 48 122.579 117.171 5.408 1
1 515 . 7 1 1 A 49 49 GLY HA2 H 49 4.021 4.029 -0.008 1
1 516 . 7 1 1 A 49 49 GLY HA3 H 49 3.881 4.033 -0.152 1
1 517 . 7 1 1 A 49 49 GLY C C 49 174.552 174.081 0.471 1
1 518 . 7 1 1 A 49 49 GLY CA C 49 46.011 45.045 0.966 1
1 519 . 7 1 1 A 50 50 GLU H H 50 8.608 8.538 0.070 1
1 520 . 7 1 1 A 50 50 GLU HA H 50 4.335 4.593 -0.258 1
1 525 . 7 1 1 A 50 50 GLU C C 50 176.672 175.940 0.732 1
1 526 . 7 1 1 A 50 50 GLU CA C 50 56.978 55.313 1.665 1
1 527 . 7 1 1 A 50 50 GLU CB C 50 29.458 28.496 0.962 1
1 529 . 7 1 1 A 50 50 GLU N N 50 121.378 122.590 -1.212 1
1 530 . 7 1 1 A 51 51 GLU H H 51 8.287 8.200 0.087 1
1 531 . 7 1 1 A 51 51 GLU HA H 51 4.381 4.612 -0.231 1
1 536 . 7 1 1 A 51 51 GLU C C 51 176.218 175.415 0.803 1
1 537 . 7 1 1 A 51 51 GLU CA C 51 56.996 56.083 0.913 1
1 538 . 7 1 1 A 51 51 GLU CB C 51 31.066 30.479 0.587 1
1 540 . 7 1 1 A 51 51 GLU N N 51 120.863 123.992 -3.129 1
1 541 . 7 1 1 A 52 52 GLU H H 52 8.445 8.659 -0.214 1
1 542 . 7 1 1 A 52 52 GLU HA H 52 4.464 4.681 -0.217 1
1 547 . 7 1 1 A 52 52 GLU C C 52 176.128 174.374 1.754 1
1 548 . 7 1 1 A 52 52 GLU CA C 52 55.955 55.866 0.089 1
1 549 . 7 1 1 A 52 52 GLU CB C 52 31.691 33.607 -1.916 1
1 551 . 7 1 1 A 52 52 GLU N N 52 121.103 120.795 0.308 1
1 552 . 7 1 1 A 53 53 GLU H H 53 8.441 8.716 -0.275 1
1 553 . 7 1 1 A 53 53 GLU HA H 53 4.609 4.624 -0.015 1
1 558 . 7 1 1 A 53 53 GLU C C 53 175.816 175.447 0.369 1
1 559 . 7 1 1 A 53 53 GLU CA C 53 56.697 56.172 0.525 1
1 560 . 7 1 1 A 53 53 GLU CB C 53 31.022 30.227 0.795 1
1 562 . 7 1 1 A 53 53 GLU N N 53 121.949 126.227 -4.278 1
1 563 . 7 1 1 A 54 54 ARG H H 54 8.569 9.176 -0.607 1
1 564 . 7 1 1 A 54 54 ARG HA H 54 4.768 5.138 -0.370 1
1 571 . 7 1 1 A 54 54 ARG C C 54 174.881 174.931 -0.050 1
1 572 . 7 1 1 A 54 54 ARG CA C 54 54.950 54.453 0.497 1
1 573 . 7 1 1 A 54 54 ARG CB C 54 33.374 33.106 0.268 1
1 576 . 7 1 1 A 54 54 ARG N N 54 123.714 126.924 -3.210 1
1 577 . 7 1 1 A 55 55 GLU H H 55 8.650 9.136 -0.486 1
1 578 . 7 1 1 A 55 55 GLU HA H 55 5.493 5.423 0.070 1
1 583 . 7 1 1 A 55 55 GLU C C 55 175.566 175.101 0.465 1
1 584 . 7 1 1 A 55 55 GLU CA C 55 54.915 54.825 0.090 1
1 585 . 7 1 1 A 55 55 GLU CB C 55 33.250 33.368 -0.118 1
1 587 . 7 1 1 A 55 55 GLU N N 55 123.537 122.470 1.067 1
1 588 . 7 1 1 A 56 56 VAL H H 56 9.419 8.843 0.576 1
1 589 . 7 1 1 A 56 56 VAL HA H 56 4.524 4.880 -0.356 1
1 597 . 7 1 1 A 56 56 VAL C C 56 173.502 174.175 -0.673 1
1 598 . 7 1 1 A 56 56 VAL CA C 56 60.981 58.892 2.089 1
1 599 . 7 1 1 A 56 56 VAL CB C 56 36.117 36.038 0.079 1
1 602 . 7 1 1 A 56 56 VAL N N 56 123.343 119.473 3.870 1
1 603 . 7 1 1 A 57 57 GLN H H 57 8.767 8.819 -0.052 1
1 604 . 7 1 1 A 57 57 GLN HA H 57 5.671 5.169 0.502 1
1 611 . 7 1 1 A 57 57 GLN C C 57 176.357 175.165 1.192 1
1 612 . 7 1 1 A 57 57 GLN CA C 57 54.735 54.233 0.502 1
1 613 . 7 1 1 A 57 57 GLN CB C 57 30.781 31.219 -0.438 1
1 615 . 7 1 1 A 57 57 GLN N N 57 125.639 120.987 4.652 1
1 617 . 7 1 1 A 58 58 VAL H H 58 9.217 9.009 0.208 1
1 618 . 7 1 1 A 58 58 VAL HA H 58 5.129 4.827 0.302 1
1 626 . 7 1 1 A 58 58 VAL C C 58 175.925 176.602 -0.677 1
1 627 . 7 1 1 A 58 58 VAL CA C 58 59.652 59.898 -0.246 1
1 628 . 7 1 1 A 58 58 VAL CB C 58 36.540 34.952 1.588 1
1 631 . 7 1 1 A 58 58 VAL N N 58 117.022 118.659 -1.637 1
1 632 . 7 1 1 A 59 59 GLY H H 59 9.008 8.767 0.241 1
1 633 . 7 1 1 A 59 59 GLY HA2 H 59 4.670 3.935 0.735 1
1 634 . 7 1 1 A 59 59 GLY HA3 H 59 3.914 3.959 -0.045 1
1 635 . 7 1 1 A 59 59 GLY C C 59 173.386 173.930 -0.544 1
1 636 . 7 1 1 A 59 59 GLY CA C 59 45.093 46.341 -1.248 1
1 637 . 7 1 1 A 59 59 GLY N N 59 109.174 111.176 -2.002 1
1 638 . 7 1 1 A 60 60 ARG H H 60 7.695 7.923 -0.228 1
1 639 . 7 1 1 A 60 60 ARG HA H 60 4.866 4.855 0.011 1
1 645 . 7 1 1 A 60 60 ARG C C 60 173.760 176.147 -2.387 1
1 646 . 7 1 1 A 60 60 ARG CA C 60 52.764 53.272 -0.508 1
1 647 . 7 1 1 A 60 60 ARG CB C 60 31.785 31.038 0.747 1
1 650 . 7 1 1 A 60 60 ARG N N 60 118.520 120.259 -1.739 1
1 651 . 7 1 1 A 61 61 PRO HA H 61 3.539 3.707 -0.168 1
1 658 . 7 1 1 A 61 61 PRO C C 61 173.175 173.694 -0.519 1
1 659 . 7 1 1 A 61 61 PRO CA C 61 62.265 62.827 -0.562 1
1 660 . 7 1 1 A 61 61 PRO CB C 61 27.546 30.797 -3.251 1
1 663 . 7 1 1 A 62 62 GLU H H 62 7.879 7.453 0.426 1
1 664 . 7 1 1 A 62 62 GLU HA H 62 4.071 4.688 -0.617 1
1 669 . 7 1 1 A 62 62 GLU C C 62 174.107 174.759 -0.652 1
1 670 . 7 1 1 A 62 62 GLU CA C 62 55.229 54.810 0.419 1
1 671 . 7 1 1 A 62 62 GLU CB C 62 32.838 32.306 0.532 1
1 673 . 7 1 1 A 62 62 GLU N N 62 118.173 114.415 3.758 1
1 674 . 7 1 1 A 63 63 VAL H H 63 8.930 8.746 0.184 1
1 675 . 7 1 1 A 63 63 VAL HA H 63 4.548 5.023 -0.475 1
1 683 . 7 1 1 A 63 63 VAL C C 63 170.325 173.027 -2.702 1
1 684 . 7 1 1 A 63 63 VAL CA C 63 60.770 59.713 1.057 1
1 685 . 7 1 1 A 63 63 VAL CB C 63 35.394 35.812 -0.418 1
1 688 . 7 1 1 A 63 63 VAL N N 63 117.161 120.908 -3.747 1
1 689 . 7 1 1 A 64 64 LEU H H 64 8.332 9.117 -0.785 1
1 690 . 7 1 1 A 64 64 LEU HA H 64 5.122 5.464 -0.342 1
1 700 . 7 1 1 A 64 64 LEU C C 64 176.243 174.417 1.826 1
1 701 . 7 1 1 A 64 64 LEU CA C 64 53.346 53.577 -0.231 1
1 702 . 7 1 1 A 64 64 LEU CB C 64 42.649 45.427 -2.778 1
1 706 . 7 1 1 A 64 64 LEU N N 64 130.510 129.324 1.186 1
1 707 . 7 1 1 A 65 65 LEU H H 65 9.261 9.489 -0.228 1
1 708 . 7 1 1 A 65 65 LEU HA H 65 4.443 4.944 -0.501 1
1 718 . 7 1 1 A 65 65 LEU C C 65 174.016 176.009 -1.993 1
1 719 . 7 1 1 A 65 65 LEU CA C 65 53.920 53.869 0.051 1
1 720 . 7 1 1 A 65 65 LEU CB C 65 42.976 42.013 0.963 1
1 724 . 7 1 1 A 65 65 LEU N N 65 128.611 128.678 -0.067 1
1 725 . 7 1 1 A 66 66 ASP H H 66 8.105 8.699 -0.594 1
1 726 . 7 1 1 A 66 66 ASP HA H 66 5.207 4.628 0.579 1
1 729 . 7 1 1 A 66 66 ASP C C 66 176.161 176.571 -0.410 1
1 730 . 7 1 1 A 66 66 ASP CA C 66 51.001 54.665 -3.664 1
1 731 . 7 1 1 A 66 66 ASP CB C 66 42.836 41.103 1.733 1
1 732 . 7 1 1 A 66 66 ASP N N 66 121.799 125.445 -3.646 1
1 733 . 7 1 1 A 67 67 GLY H H 67 8.688 8.386 0.302 1
1 734 . 7 1 1 A 67 67 GLY HA2 H 67 3.923 3.950 -0.027 1
1 735 . 7 1 1 A 67 67 GLY HA3 H 67 3.808 3.956 -0.148 1
1 736 . 7 1 1 A 67 67 GLY C C 67 175.500 174.074 1.426 1
1 737 . 7 1 1 A 67 67 GLY CA C 67 46.591 46.729 -0.138 1
1 738 . 7 1 1 A 67 67 GLY N N 67 106.518 110.710 -4.192 1
1 739 . 7 1 1 A 68 68 LEU H H 68 8.125 7.773 0.352 1
1 740 . 7 1 1 A 68 68 LEU HA H 68 4.252 4.987 -0.735 1
1 750 . 7 1 1 A 68 68 LEU C C 68 174.914 175.229 -0.315 1
1 751 . 7 1 1 A 68 68 LEU CA C 68 53.469 53.247 0.222 1
1 752 . 7 1 1 A 68 68 LEU CB C 68 40.422 46.301 -5.879 1
1 756 . 7 1 1 A 68 68 LEU N N 68 119.345 120.085 -0.740 1
1 757 . 7 1 1 A 69 69 GLU H H 69 8.207 8.766 -0.559 1
1 758 . 7 1 1 A 69 69 GLU HA H 69 4.908 4.848 0.060 1
1 763 . 7 1 1 A 69 69 GLU C C 69 174.464 174.192 0.272 1
1 764 . 7 1 1 A 69 69 GLU CA C 69 53.081 53.055 0.026 1
1 765 . 7 1 1 A 69 69 GLU CB C 69 31.538 30.943 0.595 1
1 767 . 7 1 1 A 69 69 GLU N N 69 119.486 121.266 -1.780 1
1 768 . 7 1 1 A 70 70 PRO HA H 70 4.866 4.331 0.535 1
1 775 . 7 1 1 A 70 70 PRO C C 70 178.285 177.386 0.899 1
1 776 . 7 1 1 A 70 70 PRO CA C 70 63.203 63.607 -0.404 1
1 777 . 7 1 1 A 70 70 PRO CB C 70 33.726 31.938 1.788 1
1 780 . 7 1 1 A 71 71 GLY H H 71 7.362 9.014 -1.652 1
1 781 . 7 1 1 A 71 71 GLY HA2 H 71 3.807 3.931 -0.124 1
1 782 . 7 1 1 A 71 71 GLY HA3 H 71 3.756 3.935 -0.179 1
1 783 . 7 1 1 A 71 71 GLY C C 71 174.664 173.746 0.918 1
1 784 . 7 1 1 A 71 71 GLY CA C 71 46.926 46.327 0.599 1
1 785 . 7 1 1 A 71 71 GLY N N 71 113.776 111.517 2.259 1
1 786 . 7 1 1 A 72 72 ARG H H 72 8.036 7.318 0.718 1
1 787 . 7 1 1 A 72 72 ARG HA H 72 4.597 4.848 -0.251 1
1 793 . 7 1 1 A 72 72 ARG C C 72 173.293 173.556 -0.263 1
1 794 . 7 1 1 A 72 72 ARG CA C 72 54.633 54.445 0.188 1
1 795 . 7 1 1 A 72 72 ARG CB C 72 33.704 33.382 0.322 1
1 798 . 7 1 1 A 72 72 ARG N N 72 119.611 119.534 0.077 1
1 799 . 7 1 1 A 73 73 ASP H H 73 7.785 8.572 -0.787 1
1 800 . 7 1 1 A 73 73 ASP HA H 73 5.276 5.234 0.042 1
1 803 . 7 1 1 A 73 73 ASP C C 73 175.904 174.473 1.431 1
1 804 . 7 1 1 A 73 73 ASP CA C 73 53.568 53.125 0.443 1
1 805 . 7 1 1 A 73 73 ASP CB C 73 42.970 42.984 -0.014 1
1 806 . 7 1 1 A 73 73 ASP N N 73 118.900 126.929 -8.029 1
1 807 . 7 1 1 A 74 74 TYR H H 74 9.516 9.103 0.413 1
1 808 . 7 1 1 A 74 74 TYR HA H 74 4.800 5.174 -0.374 1
1 815 . 7 1 1 A 74 74 TYR C C 74 174.631 174.870 -0.239 1
1 816 . 7 1 1 A 74 74 TYR CA C 74 58.548 56.726 1.822 1
1 817 . 7 1 1 A 74 74 TYR CB C 74 42.029 43.512 -1.483 1
1 822 . 7 1 1 A 74 74 TYR N N 74 121.903 122.934 -1.031 1
1 823 . 7 1 1 A 75 75 GLU H H 75 9.248 9.407 -0.159 1
1 824 . 7 1 1 A 75 75 GLU HA H 75 4.756 5.145 -0.389 1
1 829 . 7 1 1 A 75 75 GLU C C 75 175.524 175.414 0.110 1
1 830 . 7 1 1 A 75 75 GLU CA C 75 55.621 55.388 0.233 1
1 831 . 7 1 1 A 75 75 GLU CB C 75 30.778 32.010 -1.232 1
1 833 . 7 1 1 A 75 75 GLU N N 75 122.425 120.718 1.707 1
1 834 . 7 1 1 A 76 76 VAL H H 76 8.884 9.088 -0.204 1
1 835 . 7 1 1 A 76 76 VAL HA H 76 5.246 5.061 0.185 1
1 843 . 7 1 1 A 76 76 VAL C C 76 174.800 174.882 -0.082 1
1 844 . 7 1 1 A 76 76 VAL CA C 76 60.199 61.132 -0.933 1
1 845 . 7 1 1 A 76 76 VAL CB C 76 33.449 34.215 -0.766 1
1 848 . 7 1 1 A 76 76 VAL N N 76 126.853 125.714 1.139 1
1 849 . 7 1 1 A 77 77 SER H H 77 9.234 8.879 0.355 1
1 850 . 7 1 1 A 77 77 SER HA H 77 5.398 5.391 0.007 1
1 853 . 7 1 1 A 77 77 SER C C 77 173.138 173.297 -0.159 1
1 854 . 7 1 1 A 77 77 SER CA C 77 56.032 56.532 -0.500 1
1 855 . 7 1 1 A 77 77 SER CB C 77 66.374 64.686 1.688 1
1 856 . 7 1 1 A 77 77 SER N N 77 120.852 121.878 -1.026 1
1 857 . 7 1 1 A 78 78 VAL H H 78 9.092 8.838 0.254 1
1 858 . 7 1 1 A 78 78 VAL HA H 78 4.756 4.682 0.074 1
1 866 . 7 1 1 A 78 78 VAL C C 78 173.641 174.258 -0.617 1
1 867 . 7 1 1 A 78 78 VAL CA C 78 61.246 61.088 0.158 1
1 868 . 7 1 1 A 78 78 VAL CB C 78 34.467 32.342 2.125 1
1 871 . 7 1 1 A 78 78 VAL N N 78 122.453 125.885 -3.432 1
1 872 . 7 1 1 A 79 79 GLN H H 79 8.587 8.810 -0.223 1
1 873 . 7 1 1 A 79 79 GLN HA H 79 4.438 4.875 -0.437 1
1 880 . 7 1 1 A 79 79 GLN C C 79 174.999 174.890 0.109 1
1 881 . 7 1 1 A 79 79 GLN CA C 79 54.227 53.975 0.252 1
1 882 . 7 1 1 A 79 79 GLN CB C 79 33.587 32.384 1.203 1
1 884 . 7 1 1 A 79 79 GLN N N 79 125.619 127.966 -2.347 1
1 886 . 7 1 1 A 80 80 SER H H 80 8.623 8.965 -0.342 1
1 887 . 7 1 1 A 80 80 SER HA H 80 4.756 4.674 0.082 1
1 890 . 7 1 1 A 80 80 SER C C 80 172.264 174.203 -1.939 1
1 891 . 7 1 1 A 80 80 SER CA C 80 58.177 60.043 -1.866 1
1 892 . 7 1 1 A 80 80 SER CB C 80 63.920 63.658 0.262 1
1 893 . 7 1 1 A 80 80 SER N N 80 122.844 124.002 -1.158 1
1 894 . 7 1 1 A 81 81 LEU H H 81 8.348 8.927 -0.579 1
1 895 . 7 1 1 A 81 81 LEU HA H 81 5.124 4.645 0.479 1
1 905 . 7 1 1 A 81 81 LEU C C 81 175.775 176.211 -0.436 1
1 906 . 7 1 1 A 81 81 LEU CA C 81 54.033 53.346 0.687 1
1 907 . 7 1 1 A 81 81 LEU CB C 81 44.690 42.626 2.064 1
1 911 . 7 1 1 A 81 81 LEU N N 81 123.191 127.106 -3.915 1
1 912 . 7 1 1 A 82 82 ARG H H 82 8.374 9.001 -0.627 1
1 913 . 7 1 1 A 82 82 ARG HA H 82 4.616 4.172 0.444 1
1 919 . 7 1 1 A 82 82 ARG C C 82 176.864 175.879 0.985 1
1 920 . 7 1 1 A 82 82 ARG CA C 82 55.868 56.684 -0.816 1
1 921 . 7 1 1 A 82 82 ARG CB C 82 32.322 31.626 0.696 1
1 924 . 7 1 1 A 82 82 ARG N N 82 121.029 126.841 -5.812 1
1 925 . 7 1 1 A 83 83 GLY H H 83 8.309 7.362 0.947 1
1 926 . 7 1 1 A 83 83 GLY HA2 H 83 4.031 4.058 -0.027 1
1 927 . 7 1 1 A 83 83 GLY HA3 H 83 3.888 4.100 -0.212 1
1 928 . 7 1 1 A 83 83 GLY C C 83 174.562 173.880 0.682 1
1 929 . 7 1 1 A 83 83 GLY CA C 83 45.963 46.008 -0.045 1
1 930 . 7 1 1 A 83 83 GLY N N 83 109.937 106.457 3.480 1
1 931 . 7 1 1 A 84 84 PRO HA H 84 4.573 4.362 0.211 1
1 938 . 7 1 1 A 84 84 PRO C C 84 176.533 176.046 0.487 1
1 939 . 7 1 1 A 84 84 PRO CA C 84 63.485 64.594 -1.109 1
1 940 . 7 1 1 A 84 84 PRO CB C 84 32.409 32.108 0.301 1
1 943 . 7 1 1 A 85 85 GLU H H 85 7.799 7.591 0.208 1
1 944 . 7 1 1 A 85 85 GLU HA H 85 4.369 4.820 -0.451 1
1 949 . 7 1 1 A 85 85 GLU C C 85 174.722 175.782 -1.060 1
1 950 . 7 1 1 A 85 85 GLU CA C 85 55.899 54.875 1.024 1
1 951 . 7 1 1 A 85 85 GLU CB C 85 31.911 33.063 -1.152 1
1 953 . 7 1 1 A 85 85 GLU N N 85 122.093 112.471 9.622 1
1 954 . 7 1 1 A 86 86 GLY H H 86 8.329 8.772 -0.443 1
1 955 . 7 1 1 A 86 86 GLY HA2 H 86 5.298 4.212 1.086 1
1 956 . 7 1 1 A 86 86 GLY HA3 H 86 3.559 4.228 -0.669 1
1 957 . 7 1 1 A 86 86 GLY C C 86 174.355 173.069 1.286 1
1 958 . 7 1 1 A 86 86 GLY CA C 86 44.034 43.895 0.139 1
1 959 . 7 1 1 A 86 86 GLY N N 86 109.387 108.755 0.632 1
1 960 . 7 1 1 A 87 87 SER H H 87 8.807 8.727 0.080 1
1 961 . 7 1 1 A 87 87 SER HA H 87 4.670 4.600 0.070 1
1 964 . 7 1 1 A 87 87 SER C C 87 175.195 174.643 0.552 1
1 965 . 7 1 1 A 87 87 SER CA C 87 57.737 57.627 0.110 1
1 966 . 7 1 1 A 87 87 SER CB C 87 67.829 65.720 2.109 1
1 967 . 7 1 1 A 87 87 SER N N 87 117.698 112.813 4.885 1
1 968 . 7 1 1 A 88 88 GLU H H 88 8.754 8.610 0.144 1
1 969 . 7 1 1 A 88 88 GLU HA H 88 4.357 4.291 0.066 1
1 974 . 7 1 1 A 88 88 GLU C C 88 177.474 176.698 0.776 1
1 975 . 7 1 1 A 88 88 GLU CA C 88 57.525 57.068 0.457 1
1 976 . 7 1 1 A 88 88 GLU CB C 88 31.162 30.575 0.587 1
1 978 . 7 1 1 A 88 88 GLU N N 88 118.709 120.890 -2.181 1
1 979 . 7 1 1 A 89 89 ALA H H 89 8.855 8.406 0.449 1
1 980 . 7 1 1 A 89 89 ALA HA H 89 4.792 4.598 0.194 1
1 984 . 7 1 1 A 89 89 ALA C C 89 178.379 176.748 1.631 1
1 985 . 7 1 1 A 89 89 ALA CA C 89 51.264 51.750 -0.486 1
1 986 . 7 1 1 A 89 89 ALA CB C 89 20.040 19.851 0.189 1
1 987 . 7 1 1 A 89 89 ALA N N 89 127.301 124.175 3.126 1
1 988 . 7 1 1 A 90 90 ARG H H 90 8.549 8.446 0.103 1
1 989 . 7 1 1 A 90 90 ARG HA H 90 4.658 4.884 -0.226 1
1 996 . 7 1 1 A 90 90 ARG C C 90 174.720 175.549 -0.829 1
1 997 . 7 1 1 A 90 90 ARG CA C 90 53.575 54.359 -0.784 1
1 998 . 7 1 1 A 90 90 ARG CB C 90 33.456 31.517 1.939 1
1 1001 . 7 1 1 A 90 90 ARG N N 90 121.289 123.446 -2.157 1
1 1002 . 7 1 1 A 91 91 GLY H H 91 8.396 9.069 -0.673 1
1 1003 . 7 1 1 A 91 91 GLY HA2 H 91 5.306 4.165 1.141 1
1 1004 . 7 1 1 A 91 91 GLY HA3 H 91 3.700 4.197 -0.497 1
1 1005 . 7 1 1 A 91 91 GLY C C 91 173.191 172.037 1.154 1
1 1006 . 7 1 1 A 91 91 GLY CA C 91 44.493 43.848 0.645 1
1 1007 . 7 1 1 A 91 91 GLY N N 91 108.579 111.830 -3.251 1
1 1008 . 7 1 1 A 92 92 ILE H H 92 8.891 8.291 0.600 1
1 1009 . 7 1 1 A 92 92 ILE HA H 92 4.499 5.005 -0.506 1
1 1019 . 7 1 1 A 92 92 ILE C C 92 171.877 174.446 -2.569 1
1 1020 . 7 1 1 A 92 92 ILE CA C 92 60.682 59.330 1.352 1
1 1021 . 7 1 1 A 92 92 ILE CB C 92 42.425 41.749 0.676 1
1 1025 . 7 1 1 A 92 92 ILE N N 92 118.313 122.448 -4.135 1
1 1026 . 7 1 1 A 93 93 ARG H H 93 7.980 8.530 -0.550 1
1 1027 . 7 1 1 A 93 93 ARG HA H 93 5.224 4.605 0.619 1
1 1034 . 7 1 1 A 93 93 ARG C C 93 175.072 175.819 -0.747 1
1 1035 . 7 1 1 A 93 93 ARG CA C 93 54.499 56.100 -1.601 1
1 1036 . 7 1 1 A 93 93 ARG CB C 93 31.767 30.740 1.027 1
1 1039 . 7 1 1 A 93 93 ARG N N 93 124.879 130.323 -5.444 1
1 1040 . 7 1 1 A 94 94 ALA H H 94 9.064 8.053 1.011 1
1 1041 . 7 1 1 A 94 94 ALA HA H 94 4.731 4.442 0.289 1
1 1045 . 7 1 1 A 94 94 ALA C C 94 174.494 176.939 -2.445 1
1 1046 . 7 1 1 A 94 94 ALA CA C 94 50.577 52.554 -1.977 1
1 1047 . 7 1 1 A 94 94 ALA CB C 94 23.082 20.003 3.079 1
1 1048 . 7 1 1 A 94 94 ALA N N 94 126.095 129.683 -3.588 1
1 1049 . 7 1 1 A 95 95 ARG H H 95 8.263 8.672 -0.409 1
1 1050 . 7 1 1 A 95 95 ARG HA H 95 5.548 4.806 0.742 1
1 1058 . 7 1 1 A 95 95 ARG C C 95 176.901 174.230 2.671 1
1 1059 . 7 1 1 A 95 95 ARG CA C 95 53.787 55.818 -2.031 1
1 1060 . 7 1 1 A 95 95 ARG CB C 95 32.426 34.190 -1.764 1
1 1063 . 7 1 1 A 95 95 ARG N N 95 123.374 119.398 3.976 1
1 1065 . 7 1 1 A 96 96 THR H H 96 9.208 8.801 0.407 1
1 1066 . 7 1 1 A 96 96 THR HA H 96 4.461 5.073 -0.612 1
1 1071 . 7 1 1 A 96 96 THR CA C 96 58.248 58.378 -0.130 1
1 1072 . 7 1 1 A 96 96 THR CB C 96 68.466 71.075 -2.609 1
1 1074 . 7 1 1 A 96 96 THR N N 96 119.492 115.406 4.086 1
1 1075 . 7 1 1 A 97 97 PRO HA H 97 4.636 4.611 0.025 1
1 1082 . 7 1 1 A 97 97 PRO C C 97 175.725 175.779 -0.054 1
1 1083 . 7 1 1 A 97 97 PRO CA C 97 61.907 62.333 -0.426 1
1 1084 . 7 1 1 A 97 97 PRO CB C 97 32.590 33.416 -0.826 1
1 1087 . 7 1 1 A 98 98 THR H H 98 7.943 8.371 -0.428 1
1 1088 . 7 1 1 A 98 98 THR HA H 98 4.208 5.174 -0.966 1
1 1093 . 7 1 1 A 98 98 THR C C 98 175.058 172.761 2.297 1
1 1094 . 7 1 1 A 98 98 THR CA C 98 62.069 60.282 1.787 1
1 1095 . 7 1 1 A 98 98 THR CB C 98 69.719 70.804 -1.085 1
1 1097 . 7 1 1 A 98 98 THR N N 98 107.148 111.225 -4.077 1
1 1098 . 7 1 1 A 99 99 SER H H 99 8.163 9.034 -0.871 1
1 1099 . 7 1 1 A 99 99 SER HA H 99 4.524 5.087 -0.563 1
1 1102 . 7 1 1 A 99 99 SER C C 99 174.319 173.365 0.954 1
1 1103 . 7 1 1 A 99 99 SER CA C 99 58.107 56.752 1.355 1
1 1104 . 7 1 1 A 99 99 SER CB C 99 64.492 64.540 -0.048 1
1 1105 . 7 1 1 A 99 99 SER N N 99 115.114 122.996 -7.882 1
1 1106 . 7 1 1 A 100 100 GLY H H 100 8.336 8.183 0.153 1
1 1107 . 7 1 1 A 100 100 GLY HA2 H 100 4.222 4.193 0.029 1
1 1108 . 7 1 1 A 100 100 GLY HA3 H 100 4.222 4.194 0.028 1
1 1109 . 7 1 1 A 100 100 GLY C C 100 171.696 171.790 -0.094 1
1 1110 . 7 1 1 A 100 100 GLY CA C 100 44.617 45.125 -0.508 1
1 1111 . 7 1 1 A 100 100 GLY N N 100 110.678 113.894 -3.216 1
1 1112 . 7 1 1 A 101 101 PRO HA H 101 4.506 4.773 -0.267 1
1 1118 . 7 1 1 A 101 101 PRO CA C 101 63.358 62.517 0.841 1
1 1119 . 7 1 1 A 101 101 PRO CB C 101 32.313 30.889 1.424 1
1 1 . 8 1 1 A 6 6 SER HA H 6 4.528 5.032 -0.504 1
1 3 . 8 1 1 A 6 6 SER CA C 6 58.373 57.832 0.541 1
1 4 . 8 1 1 A 6 6 SER CB C 6 63.978 66.586 -2.608 1
1 5 . 8 1 1 A 7 7 GLY H H 7 8.228 8.334 -0.106 1
1 6 . 8 1 1 A 7 7 GLY HA2 H 7 4.134 3.925 0.209 1
1 7 . 8 1 1 A 7 7 GLY HA3 H 7 4.134 3.925 0.209 1
1 8 . 8 1 1 A 7 7 GLY CA C 7 44.607 45.240 -0.633 1
1 9 . 8 1 1 A 7 7 GLY N N 7 110.638 111.522 -0.884 1
1 10 . 8 1 1 A 8 8 PRO HA H 8 4.419 4.563 -0.144 1
1 17 . 8 1 1 A 8 8 PRO C C 8 176.908 175.413 1.495 1
1 18 . 8 1 1 A 8 8 PRO CA C 8 62.851 62.589 0.262 1
1 19 . 8 1 1 A 8 8 PRO CB C 8 32.243 33.271 -1.028 1
1 22 . 8 1 1 A 9 9 LEU H H 9 8.462 8.268 0.194 1
1 23 . 8 1 1 A 9 9 LEU HA H 9 4.494 4.913 -0.419 1
1 33 . 8 1 1 A 9 9 LEU C C 9 174.124 174.722 -0.598 1
1 34 . 8 1 1 A 9 9 LEU CA C 9 52.587 51.558 1.029 1
1 35 . 8 1 1 A 9 9 LEU CB C 9 43.150 43.280 -0.130 1
1 39 . 8 1 1 A 9 9 LEU N N 9 126.015 121.976 4.039 1
1 40 . 8 1 1 A 10 10 PRO HA H 10 4.820 4.670 0.150 1
1 47 . 8 1 1 A 10 10 PRO CA C 10 61.368 62.544 -1.176 1
1 48 . 8 1 1 A 10 10 PRO CB C 10 31.391 31.686 -0.295 1
1 51 . 8 1 1 A 11 11 PRO HA H 11 4.949 4.590 0.359 1
1 58 . 8 1 1 A 11 11 PRO CA C 11 61.183 61.765 -0.582 1
1 59 . 8 1 1 A 11 11 PRO CB C 11 30.656 31.946 -1.290 1
1 62 . 8 1 1 A 12 12 PRO HA H 12 4.341 4.610 -0.269 1
1 69 . 8 1 1 A 12 12 PRO C C 12 174.849 176.833 -1.984 1
1 70 . 8 1 1 A 12 12 PRO CA C 12 63.062 62.592 0.470 1
1 71 . 8 1 1 A 12 12 PRO CB C 12 31.831 31.695 0.136 1
1 74 . 8 1 1 A 13 13 ARG H H 13 7.828 8.297 -0.469 1
1 75 . 8 1 1 A 13 13 ARG HA H 13 4.536 4.477 0.059 1
1 82 . 8 1 1 A 13 13 ARG C C 13 174.608 176.208 -1.600 1
1 83 . 8 1 1 A 13 13 ARG CA C 13 54.774 56.627 -1.853 1
1 84 . 8 1 1 A 13 13 ARG CB C 13 33.250 31.807 1.443 1
1 87 . 8 1 1 A 13 13 ARG N N 13 120.532 119.058 1.474 1
1 88 . 8 1 1 A 14 14 ALA H H 14 8.694 7.768 0.926 1
1 89 . 8 1 1 A 14 14 ALA HA H 14 3.986 4.369 -0.383 1
1 93 . 8 1 1 A 14 14 ALA C C 14 177.232 176.727 0.505 1
1 94 . 8 1 1 A 14 14 ALA CA C 14 52.461 51.786 0.675 1
1 95 . 8 1 1 A 14 14 ALA CB C 14 16.806 17.121 -0.315 1
1 96 . 8 1 1 A 14 14 ALA N N 14 121.921 121.296 0.625 1
1 97 . 8 1 1 A 15 15 LEU H H 15 8.097 8.547 -0.450 1
1 98 . 8 1 1 A 15 15 LEU HA H 15 4.670 4.876 -0.206 1
1 108 . 8 1 1 A 15 15 LEU C C 15 177.364 176.026 1.338 1
1 109 . 8 1 1 A 15 15 LEU CA C 15 57.543 54.355 3.188 1
1 110 . 8 1 1 A 15 15 LEU CB C 15 41.877 41.002 0.875 1
1 114 . 8 1 1 A 15 15 LEU N N 15 122.215 121.572 0.643 1
1 115 . 8 1 1 A 16 16 THR H H 16 9.520 9.338 0.182 1
1 116 . 8 1 1 A 16 16 THR HA H 16 4.369 4.978 -0.609 1
1 121 . 8 1 1 A 16 16 THR C C 16 172.453 173.107 -0.654 1
1 122 . 8 1 1 A 16 16 THR CA C 16 62.480 61.373 1.107 1
1 123 . 8 1 1 A 16 16 THR CB C 16 72.198 71.737 0.461 1
1 125 . 8 1 1 A 16 16 THR N N 16 122.214 120.484 1.730 1
1 126 . 8 1 1 A 17 17 LEU H H 17 8.847 8.674 0.173 1
1 127 . 8 1 1 A 17 17 LEU HA H 17 4.573 4.498 0.075 1
1 137 . 8 1 1 A 17 17 LEU C C 17 174.695 176.856 -2.161 1
1 138 . 8 1 1 A 17 17 LEU CA C 17 53.840 54.420 -0.580 1
1 139 . 8 1 1 A 17 17 LEU CB C 17 40.290 41.811 -1.521 1
1 143 . 8 1 1 A 17 17 LEU N N 17 127.415 127.212 0.203 1
1 144 . 8 1 1 A 18 18 ALA H H 18 8.647 8.680 -0.033 1
1 145 . 8 1 1 A 18 18 ALA HA H 18 4.106 3.983 0.123 1
1 149 . 8 1 1 A 18 18 ALA C C 18 178.236 177.253 0.983 1
1 150 . 8 1 1 A 18 18 ALA CA C 18 53.926 54.464 -0.538 1
1 151 . 8 1 1 A 18 18 ALA CB C 18 18.876 18.847 0.029 1
1 152 . 8 1 1 A 18 18 ALA N N 18 133.362 129.747 3.615 1
1 153 . 8 1 1 A 19 19 ALA H H 19 7.772 6.974 0.798 1
1 154 . 8 1 1 A 19 19 ALA HA H 19 4.561 4.663 -0.102 1
1 158 . 8 1 1 A 19 19 ALA C C 19 176.032 174.591 1.441 1
1 159 . 8 1 1 A 19 19 ALA CA C 19 53.011 51.673 1.338 1
1 160 . 8 1 1 A 19 19 ALA CB C 19 21.869 22.974 -1.105 1
1 161 . 8 1 1 A 19 19 ALA N N 19 115.654 116.489 -0.835 1
1 162 . 8 1 1 A 20 20 VAL H H 20 8.697 8.833 -0.136 1
1 163 . 8 1 1 A 20 20 VAL HA H 20 4.951 4.813 0.138 1
1 171 . 8 1 1 A 20 20 VAL C C 20 174.314 174.040 0.274 1
1 172 . 8 1 1 A 20 20 VAL CA C 20 61.352 60.094 1.258 1
1 173 . 8 1 1 A 20 20 VAL CB C 20 35.394 33.934 1.460 1
1 176 . 8 1 1 A 20 20 VAL N N 20 120.848 118.015 2.833 1
1 177 . 8 1 1 A 21 21 THR H H 21 9.198 8.397 0.801 1
1 178 . 8 1 1 A 21 21 THR HA H 21 4.941 4.788 0.153 1
1 183 . 8 1 1 A 21 21 THR C C 21 174.416 174.644 -0.228 1
1 184 . 8 1 1 A 21 21 THR CA C 21 60.347 58.930 1.417 1
1 185 . 8 1 1 A 21 21 THR CB C 21 68.713 71.829 -3.116 1
1 187 . 8 1 1 A 21 21 THR N N 21 120.326 124.596 -4.270 1
1 188 . 8 1 1 A 22 22 PRO HA H 22 4.634 4.563 0.071 1
1 194 . 8 1 1 A 22 22 PRO C C 22 173.606 176.601 -2.995 1
1 195 . 8 1 1 A 22 22 PRO CA C 22 66.519 64.252 2.267 1
1 196 . 8 1 1 A 22 22 PRO CB C 22 32.078 31.626 0.452 1
1 199 . 8 1 1 A 23 23 ARG H H 23 6.621 8.074 -1.453 1
1 200 . 8 1 1 A 23 23 ARG HA H 23 4.591 4.503 0.088 1
1 207 . 8 1 1 A 23 23 ARG C C 23 176.554 175.774 0.780 1
1 208 . 8 1 1 A 23 23 ARG CA C 23 53.892 56.453 -2.561 1
1 209 . 8 1 1 A 23 23 ARG CB C 23 33.498 33.139 0.359 1
1 212 . 8 1 1 A 23 23 ARG N N 23 102.938 116.919 -13.981 1
1 213 . 8 1 1 A 24 24 THR H H 24 7.352 8.055 -0.703 1
1 214 . 8 1 1 A 24 24 THR HA H 24 5.593 5.163 0.430 1
1 219 . 8 1 1 A 24 24 THR C C 24 172.345 172.313 0.032 1
1 220 . 8 1 1 A 24 24 THR CA C 24 59.311 60.628 -1.317 1
1 221 . 8 1 1 A 24 24 THR CB C 24 73.311 71.780 1.531 1
1 223 . 8 1 1 A 24 24 THR N N 24 108.792 110.506 -1.714 1
1 224 . 8 1 1 A 25 25 VAL H H 25 8.437 8.767 -0.330 1
1 225 . 8 1 1 A 25 25 VAL HA H 25 4.512 4.895 -0.383 1
1 233 . 8 1 1 A 25 25 VAL C C 25 172.854 173.986 -1.132 1
1 234 . 8 1 1 A 25 25 VAL CA C 25 61.617 60.945 0.672 1
1 235 . 8 1 1 A 25 25 VAL CB C 25 36.742 33.782 2.960 1
1 238 . 8 1 1 A 25 25 VAL N N 25 117.023 122.496 -5.473 1
1 239 . 8 1 1 A 26 26 HIS H H 26 8.915 8.575 0.340 1
1 240 . 8 1 1 A 26 26 HIS HA H 26 5.765 5.533 0.232 1
1 245 . 8 1 1 A 26 26 HIS C C 26 173.976 173.235 0.741 1
1 246 . 8 1 1 A 26 26 HIS CA C 26 52.896 53.582 -0.686 1
1 247 . 8 1 1 A 26 26 HIS CB C 26 34.004 32.494 1.510 1
1 250 . 8 1 1 A 26 26 HIS N N 26 128.155 127.644 0.511 1
1 251 . 8 1 1 A 27 27 LEU H H 27 9.034 9.540 -0.506 1
1 252 . 8 1 1 A 27 27 LEU HA H 27 5.505 5.310 0.195 1
1 262 . 8 1 1 A 27 27 LEU C C 27 174.821 175.053 -0.232 1
1 263 . 8 1 1 A 27 27 LEU CA C 27 53.376 53.425 -0.049 1
1 264 . 8 1 1 A 27 27 LEU CB C 27 46.306 46.864 -0.558 1
1 268 . 8 1 1 A 27 27 LEU N N 27 128.569 130.465 -1.896 1
1 269 . 8 1 1 A 28 28 THR H H 28 8.844 8.732 0.112 1
1 270 . 8 1 1 A 28 28 THR HA H 28 4.485 4.794 -0.309 1
1 275 . 8 1 1 A 28 28 THR C C 28 172.773 173.654 -0.881 1
1 276 . 8 1 1 A 28 28 THR CA C 28 60.052 60.017 0.035 1
1 277 . 8 1 1 A 28 28 THR CB C 28 71.704 71.362 0.342 1
1 279 . 8 1 1 A 28 28 THR N N 28 112.165 113.159 -0.994 1
1 280 . 8 1 1 A 29 29 TRP H H 29 7.395 7.878 -0.483 1
1 281 . 8 1 1 A 29 29 TRP HA H 29 4.915 5.666 -0.751 1
1 290 . 8 1 1 A 29 29 TRP C C 29 174.013 174.504 -0.491 1
1 291 . 8 1 1 A 29 29 TRP CA C 29 56.626 54.608 2.018 1
1 292 . 8 1 1 A 29 29 TRP CB C 29 29.487 31.776 -2.289 1
1 298 . 8 1 1 A 29 29 TRP N N 29 115.623 119.883 -4.260 1
1 300 . 8 1 1 A 30 30 GLN H H 30 8.759 8.529 0.230 1
1 301 . 8 1 1 A 30 30 GLN HA H 30 4.641 4.741 -0.100 1
1 308 . 8 1 1 A 30 30 GLN C C 30 175.072 174.103 0.969 1
1 309 . 8 1 1 A 30 30 GLN CA C 30 52.975 53.938 -0.963 1
1 310 . 8 1 1 A 30 30 GLN CB C 30 28.398 28.357 0.041 1
1 312 . 8 1 1 A 30 30 GLN N N 30 117.497 120.077 -2.580 1
1 314 . 8 1 1 A 31 31 PRO HA H 31 4.487 4.536 -0.049 1
1 320 . 8 1 1 A 31 31 PRO C C 31 177.034 176.949 0.085 1
1 321 . 8 1 1 A 31 31 PRO CA C 31 62.710 62.748 -0.038 1
1 322 . 8 1 1 A 31 31 PRO CB C 31 32.738 31.965 0.773 1
1 325 . 8 1 1 A 32 32 SER H H 32 8.259 8.530 -0.271 1
1 326 . 8 1 1 A 32 32 SER HA H 32 4.670 4.931 -0.261 1
1 329 . 8 1 1 A 32 32 SER C C 32 174.689 173.763 0.926 1
1 330 . 8 1 1 A 32 32 SER CA C 32 57.296 57.984 -0.688 1
1 331 . 8 1 1 A 32 32 SER CB C 32 64.748 64.825 -0.077 1
1 332 . 8 1 1 A 32 32 SER N N 32 117.667 117.608 0.059 1
1 333 . 8 1 1 A 33 33 ALA H H 33 9.038 8.498 0.540 1
1 334 . 8 1 1 A 33 33 ALA HA H 33 4.126 4.651 -0.525 1
1 338 . 8 1 1 A 33 33 ALA C C 33 177.795 177.281 0.514 1
1 339 . 8 1 1 A 33 33 ALA CA C 33 54.213 50.652 3.561 1
1 340 . 8 1 1 A 33 33 ALA CB C 33 17.948 20.115 -2.167 1
1 341 . 8 1 1 A 33 33 ALA N N 33 131.772 123.357 8.415 1
1 342 . 8 1 1 A 34 34 GLY H H 34 8.576 8.552 0.024 1
1 343 . 8 1 1 A 34 34 GLY HA2 H 34 4.171 4.030 0.141 1
1 344 . 8 1 1 A 34 34 GLY HA3 H 34 3.592 4.030 -0.438 1
1 345 . 8 1 1 A 34 34 GLY C C 34 174.182 174.493 -0.311 1
1 346 . 8 1 1 A 34 34 GLY CA C 34 44.987 45.081 -0.094 1
1 347 . 8 1 1 A 34 34 GLY N N 34 111.339 111.138 0.201 1
1 348 . 8 1 1 A 35 35 ALA H H 35 7.637 7.751 -0.114 1
1 349 . 8 1 1 A 35 35 ALA HA H 35 4.210 4.259 -0.049 1
1 353 . 8 1 1 A 35 35 ALA C C 35 178.918 177.374 1.544 1
1 354 . 8 1 1 A 35 35 ALA CA C 35 52.671 52.330 0.341 1
1 355 . 8 1 1 A 35 35 ALA CB C 35 18.988 19.713 -0.725 1
1 356 . 8 1 1 A 35 35 ALA N N 35 121.531 123.250 -1.719 1
1 357 . 8 1 1 A 36 36 THR H H 36 9.428 8.319 1.109 1
1 358 . 8 1 1 A 36 36 THR HA H 36 4.402 4.379 0.023 1
1 363 . 8 1 1 A 36 36 THR C C 36 174.739 174.297 0.442 1
1 364 . 8 1 1 A 36 36 THR CA C 36 62.692 62.846 -0.154 1
1 365 . 8 1 1 A 36 36 THR CB C 36 69.482 70.282 -0.800 1
1 367 . 8 1 1 A 36 36 THR N N 36 113.103 115.626 -2.523 1
1 368 . 8 1 1 A 37 37 HIS H H 37 7.857 6.913 0.944 1
1 369 . 8 1 1 A 37 37 HIS HA H 37 4.878 4.383 0.495 1
1 374 . 8 1 1 A 37 37 HIS C C 37 171.103 171.918 -0.815 1
1 375 . 8 1 1 A 37 37 HIS CA C 37 55.867 54.511 1.356 1
1 376 . 8 1 1 A 37 37 HIS CB C 37 32.655 30.870 1.785 1
1 379 . 8 1 1 A 37 37 HIS N N 37 118.486 115.914 2.572 1
1 380 . 8 1 1 A 38 38 TYR H H 38 9.217 8.442 0.775 1
1 381 . 8 1 1 A 38 38 TYR HA H 38 5.303 5.039 0.264 1
1 388 . 8 1 1 A 38 38 TYR C C 38 173.922 174.669 -0.747 1
1 389 . 8 1 1 A 38 38 TYR CA C 38 56.504 56.511 -0.007 1
1 390 . 8 1 1 A 38 38 TYR CB C 38 41.823 41.829 -0.006 1
1 395 . 8 1 1 A 38 38 TYR N N 38 114.077 118.569 -4.492 1
1 396 . 8 1 1 A 39 39 LEU H H 39 9.052 8.938 0.114 1
1 397 . 8 1 1 A 39 39 LEU HA H 39 5.061 5.043 0.018 1
1 407 . 8 1 1 A 39 39 LEU C C 39 175.455 174.645 0.810 1
1 408 . 8 1 1 A 39 39 LEU CA C 39 53.855 54.309 -0.454 1
1 409 . 8 1 1 A 39 39 LEU CB C 39 45.254 44.581 0.673 1
1 413 . 8 1 1 A 39 39 LEU N N 39 123.997 126.040 -2.043 1
1 414 . 8 1 1 A 40 40 VAL H H 40 9.520 9.431 0.089 1
1 415 . 8 1 1 A 40 40 VAL HA H 40 4.988 4.557 0.431 1
1 423 . 8 1 1 A 40 40 VAL C C 40 174.578 174.904 -0.326 1
1 424 . 8 1 1 A 40 40 VAL CA C 40 60.575 61.363 -0.788 1
1 425 . 8 1 1 A 40 40 VAL CB C 40 33.284 33.069 0.215 1
1 428 . 8 1 1 A 40 40 VAL N N 40 129.678 127.883 1.795 1
1 429 . 8 1 1 A 41 41 ARG H H 41 9.096 8.719 0.377 1
1 430 . 8 1 1 A 41 41 ARG HA H 41 5.384 5.117 0.267 1
1 437 . 8 1 1 A 41 41 ARG C C 41 175.100 174.765 0.335 1
1 438 . 8 1 1 A 41 41 ARG CA C 41 54.297 55.508 -1.211 1
1 439 . 8 1 1 A 41 41 ARG CB C 41 33.003 30.949 2.054 1
1 442 . 8 1 1 A 41 41 ARG N N 41 126.332 126.883 -0.551 1
1 443 . 8 1 1 A 42 42 CYS H H 42 9.004 9.278 -0.274 1
1 444 . 8 1 1 A 42 42 CYS HA H 42 5.309 5.098 0.211 1
1 447 . 8 1 1 A 42 42 CYS C C 42 173.417 173.645 -0.228 1
1 448 . 8 1 1 A 42 42 CYS CA C 42 57.508 57.628 -0.120 1
1 449 . 8 1 1 A 42 42 CYS CB C 42 28.859 29.024 -0.165 1
1 450 . 8 1 1 A 42 42 CYS N N 42 123.359 125.582 -2.223 1
1 451 . 8 1 1 A 43 43 SER H H 43 9.102 8.534 0.568 1
1 452 . 8 1 1 A 43 43 SER HA H 43 5.324 5.183 0.141 1
1 455 . 8 1 1 A 43 43 SER C C 43 171.429 172.109 -0.680 1
1 456 . 8 1 1 A 43 43 SER CA C 43 55.621 55.253 0.368 1
1 457 . 8 1 1 A 43 43 SER CB C 43 64.856 65.884 -1.028 1
1 458 . 8 1 1 A 43 43 SER N N 43 125.444 122.875 2.569 1
1 459 . 8 1 1 A 44 44 PRO HA H 44 4.389 4.645 -0.256 1
1 466 . 8 1 1 A 44 44 PRO C C 44 176.559 176.976 -0.417 1
1 467 . 8 1 1 A 44 44 PRO CA C 44 63.027 62.717 0.310 1
1 468 . 8 1 1 A 44 44 PRO CB C 44 31.935 32.725 -0.790 1
1 471 . 8 1 1 A 45 45 ALA H H 45 8.261 7.908 0.353 1
1 472 . 8 1 1 A 45 45 ALA HA H 45 4.157 4.249 -0.092 1
1 476 . 8 1 1 A 45 45 ALA C C 45 177.706 177.027 0.679 1
1 477 . 8 1 1 A 45 45 ALA CA C 45 53.284 53.263 0.021 1
1 478 . 8 1 1 A 45 45 ALA CB C 45 18.978 19.319 -0.341 1
1 479 . 8 1 1 A 45 45 ALA N N 45 126.162 123.099 3.063 1
1 480 . 8 1 1 A 46 46 SER H H 46 8.275 7.627 0.648 1
1 481 . 8 1 1 A 46 46 SER HA H 46 4.779 4.632 0.147 1
1 484 . 8 1 1 A 46 46 SER C C 46 172.182 174.530 -2.348 1
1 485 . 8 1 1 A 46 46 SER CA C 46 55.091 55.725 -0.634 1
1 486 . 8 1 1 A 46 46 SER CB C 46 63.130 64.022 -0.892 1
1 487 . 8 1 1 A 46 46 SER N N 46 113.009 115.462 -2.453 1
1 488 . 8 1 1 A 47 47 PRO HA H 47 4.336 4.505 -0.169 1
1 493 . 8 1 1 A 47 47 PRO C C 47 177.165 177.359 -0.194 1
1 494 . 8 1 1 A 47 47 PRO CA C 47 63.268 63.953 -0.685 1
1 495 . 8 1 1 A 47 47 PRO CB C 47 32.528 31.853 0.675 1
1 498 . 8 1 1 A 48 48 LYS H H 48 9.089 8.114 0.975 1
1 499 . 8 1 1 A 48 48 LYS HA H 48 4.408 4.025 0.383 1
1 508 . 8 1 1 A 48 48 LYS C C 48 176.917 176.489 0.428 1
1 509 . 8 1 1 A 48 48 LYS CA C 48 55.893 59.530 -3.637 1
1 510 . 8 1 1 A 48 48 LYS CB C 48 32.997 32.548 0.449 1
1 514 . 8 1 1 A 48 48 LYS N N 48 122.579 118.029 4.550 1
1 515 . 8 1 1 A 49 49 GLY HA2 H 49 4.021 4.128 -0.107 1
1 516 . 8 1 1 A 49 49 GLY HA3 H 49 3.881 4.130 -0.249 1
1 517 . 8 1 1 A 49 49 GLY C C 49 174.552 174.211 0.341 1
1 518 . 8 1 1 A 49 49 GLY CA C 49 46.011 44.356 1.655 1
1 519 . 8 1 1 A 50 50 GLU H H 50 8.608 8.950 -0.342 1
1 520 . 8 1 1 A 50 50 GLU HA H 50 4.335 4.482 -0.147 1
1 525 . 8 1 1 A 50 50 GLU C C 50 176.672 176.927 -0.255 1
1 526 . 8 1 1 A 50 50 GLU CA C 50 56.978 57.739 -0.761 1
1 527 . 8 1 1 A 50 50 GLU CB C 50 29.458 32.183 -2.725 1
1 529 . 8 1 1 A 50 50 GLU N N 50 121.378 119.618 1.760 1
1 530 . 8 1 1 A 51 51 GLU H H 51 8.287 8.132 0.155 1
1 531 . 8 1 1 A 51 51 GLU HA H 51 4.381 4.464 -0.083 1
1 536 . 8 1 1 A 51 51 GLU C C 51 176.218 175.698 0.520 1
1 537 . 8 1 1 A 51 51 GLU CA C 51 56.996 56.193 0.803 1
1 538 . 8 1 1 A 51 51 GLU CB C 51 31.066 29.889 1.177 1
1 540 . 8 1 1 A 51 51 GLU N N 51 120.863 118.810 2.053 1
1 541 . 8 1 1 A 52 52 GLU H H 52 8.445 7.963 0.482 1
1 542 . 8 1 1 A 52 52 GLU HA H 52 4.464 4.656 -0.192 1
1 547 . 8 1 1 A 52 52 GLU C C 52 176.128 175.190 0.938 1
1 548 . 8 1 1 A 52 52 GLU CA C 52 55.955 55.415 0.540 1
1 549 . 8 1 1 A 52 52 GLU CB C 52 31.691 30.547 1.144 1
1 551 . 8 1 1 A 52 52 GLU N N 52 121.103 118.883 2.220 1
1 552 . 8 1 1 A 53 53 GLU H H 53 8.441 8.717 -0.276 1
1 553 . 8 1 1 A 53 53 GLU HA H 53 4.609 5.011 -0.402 1
1 558 . 8 1 1 A 53 53 GLU C C 53 175.816 174.918 0.898 1
1 559 . 8 1 1 A 53 53 GLU CA C 53 56.697 54.653 2.044 1
1 560 . 8 1 1 A 53 53 GLU CB C 53 31.022 33.407 -2.385 1
1 562 . 8 1 1 A 53 53 GLU N N 53 121.949 121.472 0.477 1
1 563 . 8 1 1 A 54 54 ARG H H 54 8.569 8.888 -0.319 1
1 564 . 8 1 1 A 54 54 ARG HA H 54 4.768 4.645 0.123 1
1 571 . 8 1 1 A 54 54 ARG C C 54 174.881 174.835 0.046 1
1 572 . 8 1 1 A 54 54 ARG CA C 54 54.950 55.774 -0.824 1
1 573 . 8 1 1 A 54 54 ARG CB C 54 33.374 31.429 1.945 1
1 576 . 8 1 1 A 54 54 ARG N N 54 123.714 124.221 -0.507 1
1 577 . 8 1 1 A 55 55 GLU H H 55 8.650 8.622 0.028 1
1 578 . 8 1 1 A 55 55 GLU HA H 55 5.493 5.168 0.325 1
1 583 . 8 1 1 A 55 55 GLU C C 55 175.566 175.298 0.268 1
1 584 . 8 1 1 A 55 55 GLU CA C 55 54.915 55.065 -0.150 1
1 585 . 8 1 1 A 55 55 GLU CB C 55 33.250 32.292 0.958 1
1 587 . 8 1 1 A 55 55 GLU N N 55 123.537 124.957 -1.420 1
1 588 . 8 1 1 A 56 56 VAL H H 56 9.419 8.633 0.786 1
1 589 . 8 1 1 A 56 56 VAL HA H 56 4.524 4.957 -0.433 1
1 597 . 8 1 1 A 56 56 VAL C C 56 173.502 174.211 -0.709 1
1 598 . 8 1 1 A 56 56 VAL CA C 56 60.981 58.735 2.246 1
1 599 . 8 1 1 A 56 56 VAL CB C 56 36.117 35.656 0.461 1
1 602 . 8 1 1 A 56 56 VAL N N 56 123.343 117.841 5.502 1
1 603 . 8 1 1 A 57 57 GLN H H 57 8.767 8.831 -0.064 1
1 604 . 8 1 1 A 57 57 GLN HA H 57 5.671 5.260 0.411 1
1 611 . 8 1 1 A 57 57 GLN C C 57 176.357 174.874 1.483 1
1 612 . 8 1 1 A 57 57 GLN CA C 57 54.735 54.126 0.609 1
1 613 . 8 1 1 A 57 57 GLN CB C 57 30.781 31.249 -0.468 1
1 615 . 8 1 1 A 57 57 GLN N N 57 125.639 121.137 4.502 1
1 617 . 8 1 1 A 58 58 VAL H H 58 9.217 9.035 0.182 1
1 618 . 8 1 1 A 58 58 VAL HA H 58 5.129 4.852 0.277 1
1 626 . 8 1 1 A 58 58 VAL C C 58 175.925 176.690 -0.765 1
1 627 . 8 1 1 A 58 58 VAL CA C 58 59.652 60.549 -0.897 1
1 628 . 8 1 1 A 58 58 VAL CB C 58 36.540 34.534 2.006 1
1 631 . 8 1 1 A 58 58 VAL N N 58 117.022 118.889 -1.867 1
1 632 . 8 1 1 A 59 59 GLY H H 59 9.008 8.791 0.217 1
1 633 . 8 1 1 A 59 59 GLY HA2 H 59 4.670 3.874 0.796 1
1 634 . 8 1 1 A 59 59 GLY HA3 H 59 3.914 3.902 0.012 1
1 635 . 8 1 1 A 59 59 GLY C C 59 173.386 174.002 -0.616 1
1 636 . 8 1 1 A 59 59 GLY CA C 59 45.093 46.699 -1.606 1
1 637 . 8 1 1 A 59 59 GLY N N 59 109.174 111.763 -2.589 1
1 638 . 8 1 1 A 60 60 ARG H H 60 7.695 7.887 -0.192 1
1 639 . 8 1 1 A 60 60 ARG HA H 60 4.866 4.978 -0.112 1
1 645 . 8 1 1 A 60 60 ARG C C 60 173.760 176.108 -2.348 1
1 646 . 8 1 1 A 60 60 ARG CA C 60 52.764 53.126 -0.362 1
1 647 . 8 1 1 A 60 60 ARG CB C 60 31.785 31.434 0.351 1
1 650 . 8 1 1 A 60 60 ARG N N 60 118.520 120.141 -1.621 1
1 651 . 8 1 1 A 61 61 PRO HA H 61 3.539 4.052 -0.513 1
1 658 . 8 1 1 A 61 61 PRO C C 61 173.175 174.040 -0.865 1
1 659 . 8 1 1 A 61 61 PRO CA C 61 62.265 63.117 -0.852 1
1 660 . 8 1 1 A 61 61 PRO CB C 61 27.546 30.951 -3.405 1
1 663 . 8 1 1 A 62 62 GLU H H 62 7.879 7.949 -0.070 1
1 664 . 8 1 1 A 62 62 GLU HA H 62 4.071 4.498 -0.427 1
1 669 . 8 1 1 A 62 62 GLU C C 62 174.107 174.590 -0.483 1
1 670 . 8 1 1 A 62 62 GLU CA C 62 55.229 54.733 0.496 1
1 671 . 8 1 1 A 62 62 GLU CB C 62 32.838 31.346 1.492 1
1 673 . 8 1 1 A 62 62 GLU N N 62 118.173 114.184 3.989 1
1 674 . 8 1 1 A 63 63 VAL H H 63 8.930 8.549 0.381 1
1 675 . 8 1 1 A 63 63 VAL HA H 63 4.548 5.085 -0.537 1
1 683 . 8 1 1 A 63 63 VAL C C 63 170.325 173.626 -3.301 1
1 684 . 8 1 1 A 63 63 VAL CA C 63 60.770 59.613 1.157 1
1 685 . 8 1 1 A 63 63 VAL CB C 63 35.394 34.798 0.596 1
1 688 . 8 1 1 A 63 63 VAL N N 63 117.161 125.463 -8.302 1
1 689 . 8 1 1 A 64 64 LEU H H 64 8.332 8.700 -0.368 1
1 690 . 8 1 1 A 64 64 LEU HA H 64 5.122 5.181 -0.059 1
1 700 . 8 1 1 A 64 64 LEU C C 64 176.243 174.980 1.263 1
1 701 . 8 1 1 A 64 64 LEU CA C 64 53.346 53.922 -0.576 1
1 702 . 8 1 1 A 64 64 LEU CB C 64 42.649 45.116 -2.467 1
1 706 . 8 1 1 A 64 64 LEU N N 64 130.510 128.865 1.645 1
1 707 . 8 1 1 A 65 65 LEU H H 65 9.261 9.236 0.025 1
1 708 . 8 1 1 A 65 65 LEU HA H 65 4.443 4.815 -0.372 1
1 718 . 8 1 1 A 65 65 LEU C C 65 174.016 175.846 -1.830 1
1 719 . 8 1 1 A 65 65 LEU CA C 65 53.920 53.414 0.506 1
1 720 . 8 1 1 A 65 65 LEU CB C 65 42.976 43.197 -0.221 1
1 724 . 8 1 1 A 65 65 LEU N N 65 128.611 128.136 0.475 1
1 725 . 8 1 1 A 66 66 ASP H H 66 8.105 8.567 -0.462 1
1 726 . 8 1 1 A 66 66 ASP HA H 66 5.207 5.206 0.001 1
1 729 . 8 1 1 A 66 66 ASP C C 66 176.161 175.868 0.293 1
1 730 . 8 1 1 A 66 66 ASP CA C 66 51.001 52.240 -1.239 1
1 731 . 8 1 1 A 66 66 ASP CB C 66 42.836 44.177 -1.341 1
1 732 . 8 1 1 A 66 66 ASP N N 66 121.799 122.200 -0.401 1
1 733 . 8 1 1 A 67 67 GLY H H 67 8.688 8.585 0.103 1
1 734 . 8 1 1 A 67 67 GLY HA2 H 67 3.923 3.879 0.044 1
1 735 . 8 1 1 A 67 67 GLY HA3 H 67 3.808 3.889 -0.081 1
1 736 . 8 1 1 A 67 67 GLY C C 67 175.500 175.139 0.361 1
1 737 . 8 1 1 A 67 67 GLY CA C 67 46.591 45.614 0.977 1
1 738 . 8 1 1 A 67 67 GLY N N 67 106.518 111.133 -4.615 1
1 739 . 8 1 1 A 68 68 LEU H H 68 8.125 8.017 0.108 1
1 740 . 8 1 1 A 68 68 LEU HA H 68 4.252 4.323 -0.071 1
1 750 . 8 1 1 A 68 68 LEU C C 68 174.914 175.764 -0.850 1
1 751 . 8 1 1 A 68 68 LEU CA C 68 53.469 54.894 -1.425 1
1 752 . 8 1 1 A 68 68 LEU CB C 68 40.422 42.419 -1.997 1
1 756 . 8 1 1 A 68 68 LEU N N 68 119.345 122.250 -2.905 1
1 757 . 8 1 1 A 69 69 GLU H H 69 8.207 8.702 -0.495 1
1 758 . 8 1 1 A 69 69 GLU HA H 69 4.908 4.781 0.127 1
1 763 . 8 1 1 A 69 69 GLU C C 69 174.464 174.168 0.296 1
1 764 . 8 1 1 A 69 69 GLU CA C 69 53.081 52.845 0.236 1
1 765 . 8 1 1 A 69 69 GLU CB C 69 31.538 31.055 0.483 1
1 767 . 8 1 1 A 69 69 GLU N N 69 119.486 120.786 -1.300 1
1 768 . 8 1 1 A 70 70 PRO HA H 70 4.866 4.348 0.518 1
1 775 . 8 1 1 A 70 70 PRO C C 70 178.285 177.808 0.477 1
1 776 . 8 1 1 A 70 70 PRO CA C 70 63.203 63.800 -0.597 1
1 777 . 8 1 1 A 70 70 PRO CB C 70 33.726 31.287 2.439 1
1 780 . 8 1 1 A 71 71 GLY H H 71 7.362 8.525 -1.163 1
1 781 . 8 1 1 A 71 71 GLY HA2 H 71 3.807 3.982 -0.175 1
1 782 . 8 1 1 A 71 71 GLY HA3 H 71 3.756 3.987 -0.231 1
1 783 . 8 1 1 A 71 71 GLY C C 71 174.664 173.806 0.858 1
1 784 . 8 1 1 A 71 71 GLY CA C 71 46.926 45.783 1.143 1
1 785 . 8 1 1 A 71 71 GLY N N 71 113.776 112.496 1.280 1
1 786 . 8 1 1 A 72 72 ARG H H 72 8.036 7.325 0.711 1
1 787 . 8 1 1 A 72 72 ARG HA H 72 4.597 4.681 -0.084 1
1 793 . 8 1 1 A 72 72 ARG C C 72 173.293 174.306 -1.013 1
1 794 . 8 1 1 A 72 72 ARG CA C 72 54.633 54.322 0.311 1
1 795 . 8 1 1 A 72 72 ARG CB C 72 33.704 33.046 0.658 1
1 798 . 8 1 1 A 72 72 ARG N N 72 119.611 120.473 -0.862 1
1 799 . 8 1 1 A 73 73 ASP H H 73 7.785 8.610 -0.825 1
1 800 . 8 1 1 A 73 73 ASP HA H 73 5.276 5.556 -0.280 1
1 803 . 8 1 1 A 73 73 ASP C C 73 175.904 175.035 0.869 1
1 804 . 8 1 1 A 73 73 ASP CA C 73 53.568 53.015 0.553 1
1 805 . 8 1 1 A 73 73 ASP CB C 73 42.970 42.262 0.708 1
1 806 . 8 1 1 A 73 73 ASP N N 73 118.900 125.997 -7.097 1
1 807 . 8 1 1 A 74 74 TYR H H 74 9.516 9.326 0.190 1
1 808 . 8 1 1 A 74 74 TYR HA H 74 4.800 5.112 -0.312 1
1 815 . 8 1 1 A 74 74 TYR C C 74 174.631 174.946 -0.315 1
1 816 . 8 1 1 A 74 74 TYR CA C 74 58.548 56.339 2.209 1
1 817 . 8 1 1 A 74 74 TYR CB C 74 42.029 41.788 0.241 1
1 822 . 8 1 1 A 74 74 TYR N N 74 121.903 122.581 -0.678 1
1 823 . 8 1 1 A 75 75 GLU H H 75 9.248 9.227 0.021 1
1 824 . 8 1 1 A 75 75 GLU HA H 75 4.756 4.710 0.046 1
1 829 . 8 1 1 A 75 75 GLU C C 75 175.524 175.208 0.316 1
1 830 . 8 1 1 A 75 75 GLU CA C 75 55.621 55.865 -0.244 1
1 831 . 8 1 1 A 75 75 GLU CB C 75 30.778 29.841 0.937 1
1 833 . 8 1 1 A 75 75 GLU N N 75 122.425 123.147 -0.722 1
1 834 . 8 1 1 A 76 76 VAL H H 76 8.884 8.667 0.217 1
1 835 . 8 1 1 A 76 76 VAL HA H 76 5.246 4.737 0.509 1
1 843 . 8 1 1 A 76 76 VAL C C 76 174.800 175.210 -0.410 1
1 844 . 8 1 1 A 76 76 VAL CA C 76 60.199 61.430 -1.231 1
1 845 . 8 1 1 A 76 76 VAL CB C 76 33.449 32.945 0.504 1
1 848 . 8 1 1 A 76 76 VAL N N 76 126.853 126.413 0.440 1
1 849 . 8 1 1 A 77 77 SER H H 77 9.234 8.837 0.397 1
1 850 . 8 1 1 A 77 77 SER HA H 77 5.398 5.079 0.319 1
1 853 . 8 1 1 A 77 77 SER C C 77 173.138 173.857 -0.719 1
1 854 . 8 1 1 A 77 77 SER CA C 77 56.032 57.774 -1.742 1
1 855 . 8 1 1 A 77 77 SER CB C 77 66.374 64.075 2.299 1
1 856 . 8 1 1 A 77 77 SER N N 77 120.852 125.454 -4.602 1
1 857 . 8 1 1 A 78 78 VAL H H 78 9.092 9.075 0.017 1
1 858 . 8 1 1 A 78 78 VAL HA H 78 4.756 4.583 0.173 1
1 866 . 8 1 1 A 78 78 VAL C C 78 173.641 174.648 -1.007 1
1 867 . 8 1 1 A 78 78 VAL CA C 78 61.246 61.051 0.195 1
1 868 . 8 1 1 A 78 78 VAL CB C 78 34.467 32.535 1.932 1
1 871 . 8 1 1 A 78 78 VAL N N 78 122.453 127.476 -5.023 1
1 872 . 8 1 1 A 79 79 GLN H H 79 8.587 8.487 0.100 1
1 873 . 8 1 1 A 79 79 GLN HA H 79 4.438 4.719 -0.281 1
1 880 . 8 1 1 A 79 79 GLN C C 79 174.999 174.598 0.401 1
1 881 . 8 1 1 A 79 79 GLN CA C 79 54.227 54.310 -0.083 1
1 882 . 8 1 1 A 79 79 GLN CB C 79 33.587 32.324 1.263 1
1 884 . 8 1 1 A 79 79 GLN N N 79 125.619 127.482 -1.863 1
1 886 . 8 1 1 A 80 80 SER H H 80 8.623 8.812 -0.189 1
1 887 . 8 1 1 A 80 80 SER HA H 80 4.756 4.786 -0.030 1
1 890 . 8 1 1 A 80 80 SER C C 80 172.264 174.185 -1.921 1
1 891 . 8 1 1 A 80 80 SER CA C 80 58.177 60.108 -1.931 1
1 892 . 8 1 1 A 80 80 SER CB C 80 63.920 63.232 0.688 1
1 893 . 8 1 1 A 80 80 SER N N 80 122.844 124.062 -1.218 1
1 894 . 8 1 1 A 81 81 LEU H H 81 8.348 8.922 -0.574 1
1 895 . 8 1 1 A 81 81 LEU HA H 81 5.124 4.501 0.623 1
1 905 . 8 1 1 A 81 81 LEU C C 81 175.775 176.218 -0.443 1
1 906 . 8 1 1 A 81 81 LEU CA C 81 54.033 53.730 0.303 1
1 907 . 8 1 1 A 81 81 LEU CB C 81 44.690 41.903 2.787 1
1 911 . 8 1 1 A 81 81 LEU N N 81 123.191 128.439 -5.248 1
1 912 . 8 1 1 A 82 82 ARG H H 82 8.374 9.011 -0.637 1
1 913 . 8 1 1 A 82 82 ARG HA H 82 4.616 4.248 0.368 1
1 919 . 8 1 1 A 82 82 ARG C C 82 176.864 175.977 0.887 1
1 920 . 8 1 1 A 82 82 ARG CA C 82 55.868 56.598 -0.730 1
1 921 . 8 1 1 A 82 82 ARG CB C 82 32.322 31.731 0.591 1
1 924 . 8 1 1 A 82 82 ARG N N 82 121.029 126.628 -5.599 1
1 925 . 8 1 1 A 83 83 GLY H H 83 8.309 7.361 0.948 1
1 926 . 8 1 1 A 83 83 GLY HA2 H 83 4.031 4.074 -0.043 1
1 927 . 8 1 1 A 83 83 GLY HA3 H 83 3.888 4.121 -0.233 1
1 928 . 8 1 1 A 83 83 GLY C C 83 174.562 173.999 0.563 1
1 929 . 8 1 1 A 83 83 GLY CA C 83 45.963 45.988 -0.025 1
1 930 . 8 1 1 A 83 83 GLY N N 83 109.937 106.875 3.062 1
1 931 . 8 1 1 A 84 84 PRO HA H 84 4.573 4.342 0.231 1
1 938 . 8 1 1 A 84 84 PRO C C 84 176.533 176.092 0.441 1
1 939 . 8 1 1 A 84 84 PRO CA C 84 63.485 64.803 -1.318 1
1 940 . 8 1 1 A 84 84 PRO CB C 84 32.409 32.013 0.396 1
1 943 . 8 1 1 A 85 85 GLU H H 85 7.799 7.605 0.194 1
1 944 . 8 1 1 A 85 85 GLU HA H 85 4.369 4.843 -0.474 1
1 949 . 8 1 1 A 85 85 GLU C C 85 174.722 175.564 -0.842 1
1 950 . 8 1 1 A 85 85 GLU CA C 85 55.899 54.918 0.981 1
1 951 . 8 1 1 A 85 85 GLU CB C 85 31.911 32.958 -1.047 1
1 953 . 8 1 1 A 85 85 GLU N N 85 122.093 112.521 9.572 1
1 954 . 8 1 1 A 86 86 GLY H H 86 8.329 8.793 -0.464 1
1 955 . 8 1 1 A 86 86 GLY HA2 H 86 5.298 4.229 1.069 1
1 956 . 8 1 1 A 86 86 GLY HA3 H 86 3.559 4.242 -0.683 1
1 957 . 8 1 1 A 86 86 GLY C C 86 174.355 172.658 1.697 1
1 958 . 8 1 1 A 86 86 GLY CA C 86 44.034 44.097 -0.063 1
1 959 . 8 1 1 A 86 86 GLY N N 86 109.387 109.280 0.107 1
1 960 . 8 1 1 A 87 87 SER H H 87 8.807 8.757 0.050 1
1 961 . 8 1 1 A 87 87 SER HA H 87 4.670 4.448 0.222 1
1 964 . 8 1 1 A 87 87 SER C C 87 175.195 174.138 1.057 1
1 965 . 8 1 1 A 87 87 SER CA C 87 57.737 57.211 0.526 1
1 966 . 8 1 1 A 87 87 SER CB C 87 67.829 64.263 3.566 1
1 967 . 8 1 1 A 87 87 SER N N 87 117.698 115.763 1.935 1
1 968 . 8 1 1 A 88 88 GLU H H 88 8.754 8.648 0.106 1
1 969 . 8 1 1 A 88 88 GLU HA H 88 4.357 4.296 0.061 1
1 974 . 8 1 1 A 88 88 GLU C C 88 177.474 176.317 1.157 1
1 975 . 8 1 1 A 88 88 GLU CA C 88 57.525 57.243 0.282 1
1 976 . 8 1 1 A 88 88 GLU CB C 88 31.162 30.633 0.529 1
1 978 . 8 1 1 A 88 88 GLU N N 88 118.709 122.173 -3.464 1
1 979 . 8 1 1 A 89 89 ALA H H 89 8.855 8.504 0.351 1
1 980 . 8 1 1 A 89 89 ALA HA H 89 4.792 4.990 -0.198 1
1 984 . 8 1 1 A 89 89 ALA C C 89 178.379 176.615 1.764 1
1 985 . 8 1 1 A 89 89 ALA CA C 89 51.264 50.931 0.333 1
1 986 . 8 1 1 A 89 89 ALA CB C 89 20.040 20.164 -0.124 1
1 987 . 8 1 1 A 89 89 ALA N N 89 127.301 123.020 4.281 1
1 988 . 8 1 1 A 90 90 ARG H H 90 8.549 8.598 -0.049 1
1 989 . 8 1 1 A 90 90 ARG HA H 90 4.658 5.061 -0.403 1
1 996 . 8 1 1 A 90 90 ARG C C 90 174.720 175.203 -0.483 1
1 997 . 8 1 1 A 90 90 ARG CA C 90 53.575 54.275 -0.700 1
1 998 . 8 1 1 A 90 90 ARG CB C 90 33.456 32.461 0.995 1
1 1001 . 8 1 1 A 90 90 ARG N N 90 121.289 122.955 -1.666 1
1 1002 . 8 1 1 A 91 91 GLY H H 91 8.396 8.989 -0.593 1
1 1003 . 8 1 1 A 91 91 GLY HA2 H 91 5.306 4.207 1.099 1
1 1004 . 8 1 1 A 91 91 GLY HA3 H 91 3.700 4.244 -0.544 1
1 1005 . 8 1 1 A 91 91 GLY C C 91 173.191 171.986 1.205 1
1 1006 . 8 1 1 A 91 91 GLY CA C 91 44.493 43.855 0.638 1
1 1007 . 8 1 1 A 91 91 GLY N N 91 108.579 112.429 -3.850 1
1 1008 . 8 1 1 A 92 92 ILE H H 92 8.891 8.477 0.414 1
1 1009 . 8 1 1 A 92 92 ILE HA H 92 4.499 4.955 -0.456 1
1 1019 . 8 1 1 A 92 92 ILE C C 92 171.877 174.258 -2.381 1
1 1020 . 8 1 1 A 92 92 ILE CA C 92 60.682 59.149 1.533 1
1 1021 . 8 1 1 A 92 92 ILE CB C 92 42.425 41.981 0.444 1
1 1025 . 8 1 1 A 92 92 ILE N N 92 118.313 121.450 -3.137 1
1 1026 . 8 1 1 A 93 93 ARG H H 93 7.980 8.473 -0.493 1
1 1027 . 8 1 1 A 93 93 ARG HA H 93 5.224 4.418 0.806 1
1 1034 . 8 1 1 A 93 93 ARG C C 93 175.072 175.145 -0.073 1
1 1035 . 8 1 1 A 93 93 ARG CA C 93 54.499 56.299 -1.800 1
1 1036 . 8 1 1 A 93 93 ARG CB C 93 31.767 30.511 1.256 1
1 1039 . 8 1 1 A 93 93 ARG N N 93 124.879 130.109 -5.230 1
1 1040 . 8 1 1 A 94 94 ALA H H 94 9.064 8.281 0.783 1
1 1041 . 8 1 1 A 94 94 ALA HA H 94 4.731 4.739 -0.008 1
1 1045 . 8 1 1 A 94 94 ALA C C 94 174.494 177.577 -3.083 1
1 1046 . 8 1 1 A 94 94 ALA CA C 94 50.577 51.895 -1.318 1
1 1047 . 8 1 1 A 94 94 ALA CB C 94 23.082 19.941 3.141 1
1 1048 . 8 1 1 A 94 94 ALA N N 94 126.095 129.535 -3.440 1
1 1049 . 8 1 1 A 95 95 ARG H H 95 8.263 9.090 -0.827 1
1 1050 . 8 1 1 A 95 95 ARG HA H 95 5.548 5.279 0.269 1
1 1058 . 8 1 1 A 95 95 ARG C C 95 176.901 174.969 1.932 1
1 1059 . 8 1 1 A 95 95 ARG CA C 95 53.787 54.066 -0.279 1
1 1060 . 8 1 1 A 95 95 ARG CB C 95 32.426 34.256 -1.830 1
1 1063 . 8 1 1 A 95 95 ARG N N 95 123.374 120.709 2.665 1
1 1065 . 8 1 1 A 96 96 THR H H 96 9.208 8.888 0.320 1
1 1066 . 8 1 1 A 96 96 THR HA H 96 4.461 5.039 -0.578 1
1 1071 . 8 1 1 A 96 96 THR CA C 96 58.248 58.438 -0.190 1
1 1072 . 8 1 1 A 96 96 THR CB C 96 68.466 70.868 -2.402 1
1 1074 . 8 1 1 A 96 96 THR N N 96 119.492 111.686 7.806 1
1 1075 . 8 1 1 A 97 97 PRO HA H 97 4.636 4.637 -0.001 1
1 1082 . 8 1 1 A 97 97 PRO C C 97 175.725 175.865 -0.140 1
1 1083 . 8 1 1 A 97 97 PRO CA C 97 61.907 62.339 -0.432 1
1 1084 . 8 1 1 A 97 97 PRO CB C 97 32.590 33.411 -0.821 1
1 1087 . 8 1 1 A 98 98 THR H H 98 7.943 8.326 -0.383 1
1 1088 . 8 1 1 A 98 98 THR HA H 98 4.208 4.963 -0.755 1
1 1093 . 8 1 1 A 98 98 THR C C 98 175.058 173.485 1.573 1
1 1094 . 8 1 1 A 98 98 THR CA C 98 62.069 60.526 1.543 1
1 1095 . 8 1 1 A 98 98 THR CB C 98 69.719 70.333 -0.614 1
1 1097 . 8 1 1 A 98 98 THR N N 98 107.148 111.627 -4.479 1
1 1098 . 8 1 1 A 99 99 SER H H 99 8.163 8.686 -0.523 1
1 1099 . 8 1 1 A 99 99 SER HA H 99 4.524 4.326 0.198 1
1 1102 . 8 1 1 A 99 99 SER C C 99 174.319 173.955 0.364 1
1 1103 . 8 1 1 A 99 99 SER CA C 99 58.107 59.612 -1.505 1
1 1104 . 8 1 1 A 99 99 SER CB C 99 64.492 63.122 1.370 1
1 1105 . 8 1 1 A 99 99 SER N N 99 115.114 122.700 -7.586 1
1 1106 . 8 1 1 A 100 100 GLY H H 100 8.336 8.201 0.135 1
1 1107 . 8 1 1 A 100 100 GLY HA2 H 100 4.222 4.138 0.084 1
1 1108 . 8 1 1 A 100 100 GLY HA3 H 100 4.222 4.138 0.084 1
1 1109 . 8 1 1 A 100 100 GLY C C 100 171.696 173.817 -2.121 1
1 1110 . 8 1 1 A 100 100 GLY CA C 100 44.617 45.966 -1.349 1
1 1111 . 8 1 1 A 100 100 GLY N N 100 110.678 114.088 -3.410 1
1 1112 . 8 1 1 A 101 101 PRO HA H 101 4.506 4.493 0.013 1
1 1118 . 8 1 1 A 101 101 PRO CA C 101 63.358 64.126 -0.768 1
1 1119 . 8 1 1 A 101 101 PRO CB C 101 32.313 31.897 0.416 1
1 1 . 9 1 1 A 6 6 SER HA H 6 4.528 4.504 0.024 1
1 3 . 9 1 1 A 6 6 SER CA C 6 58.373 58.841 -0.468 1
1 4 . 9 1 1 A 6 6 SER CB C 6 63.978 64.456 -0.478 1
1 5 . 9 1 1 A 7 7 GLY H H 7 8.228 8.799 -0.571 1
1 6 . 9 1 1 A 7 7 GLY HA2 H 7 4.134 3.943 0.191 1
1 7 . 9 1 1 A 7 7 GLY HA3 H 7 4.134 3.945 0.189 1
1 8 . 9 1 1 A 7 7 GLY CA C 7 44.607 46.605 -1.998 1
1 9 . 9 1 1 A 7 7 GLY N N 7 110.638 112.444 -1.806 1
1 10 . 9 1 1 A 8 8 PRO HA H 8 4.419 4.592 -0.173 1
1 17 . 9 1 1 A 8 8 PRO C C 8 176.908 175.389 1.519 1
1 18 . 9 1 1 A 8 8 PRO CA C 8 62.851 62.703 0.148 1
1 19 . 9 1 1 A 8 8 PRO CB C 8 32.243 33.590 -1.347 1
1 22 . 9 1 1 A 9 9 LEU H H 9 8.462 8.380 0.082 1
1 23 . 9 1 1 A 9 9 LEU HA H 9 4.494 4.898 -0.404 1
1 33 . 9 1 1 A 9 9 LEU C C 9 174.124 174.630 -0.506 1
1 34 . 9 1 1 A 9 9 LEU CA C 9 52.587 51.500 1.087 1
1 35 . 9 1 1 A 9 9 LEU CB C 9 43.150 43.614 -0.464 1
1 39 . 9 1 1 A 9 9 LEU N N 9 126.015 122.149 3.866 1
1 40 . 9 1 1 A 10 10 PRO HA H 10 4.820 4.614 0.206 1
1 47 . 9 1 1 A 10 10 PRO CA C 10 61.368 62.351 -0.983 1
1 48 . 9 1 1 A 10 10 PRO CB C 10 31.391 31.713 -0.322 1
1 51 . 9 1 1 A 11 11 PRO HA H 11 4.949 4.635 0.314 1
1 58 . 9 1 1 A 11 11 PRO CA C 11 61.183 61.808 -0.625 1
1 59 . 9 1 1 A 11 11 PRO CB C 11 30.656 31.941 -1.285 1
1 62 . 9 1 1 A 12 12 PRO HA H 12 4.341 4.691 -0.350 1
1 69 . 9 1 1 A 12 12 PRO C C 12 174.849 177.244 -2.395 1
1 70 . 9 1 1 A 12 12 PRO CA C 12 63.062 62.663 0.399 1
1 71 . 9 1 1 A 12 12 PRO CB C 12 31.831 31.593 0.238 1
1 74 . 9 1 1 A 13 13 ARG H H 13 7.828 8.963 -1.135 1
1 75 . 9 1 1 A 13 13 ARG HA H 13 4.536 4.362 0.174 1
1 82 . 9 1 1 A 13 13 ARG C C 13 174.608 177.217 -2.609 1
1 83 . 9 1 1 A 13 13 ARG CA C 13 54.774 58.443 -3.669 1
1 84 . 9 1 1 A 13 13 ARG CB C 13 33.250 30.800 2.450 1
1 87 . 9 1 1 A 13 13 ARG N N 13 120.532 124.800 -4.268 1
1 88 . 9 1 1 A 14 14 ALA H H 14 8.694 7.677 1.017 1
1 89 . 9 1 1 A 14 14 ALA HA H 14 3.986 4.381 -0.395 1
1 93 . 9 1 1 A 14 14 ALA C C 14 177.232 176.758 0.474 1
1 94 . 9 1 1 A 14 14 ALA CA C 14 52.461 52.050 0.411 1
1 95 . 9 1 1 A 14 14 ALA CB C 14 16.806 17.363 -0.557 1
1 96 . 9 1 1 A 14 14 ALA N N 14 121.921 120.149 1.772 1
1 97 . 9 1 1 A 15 15 LEU H H 15 8.097 7.931 0.166 1
1 98 . 9 1 1 A 15 15 LEU HA H 15 4.670 4.703 -0.033 1
1 108 . 9 1 1 A 15 15 LEU C C 15 177.364 175.577 1.787 1
1 109 . 9 1 1 A 15 15 LEU CA C 15 57.543 54.473 3.070 1
1 110 . 9 1 1 A 15 15 LEU CB C 15 41.877 40.673 1.204 1
1 114 . 9 1 1 A 15 15 LEU N N 15 122.215 120.948 1.267 1
1 115 . 9 1 1 A 16 16 THR H H 16 9.520 8.879 0.641 1
1 116 . 9 1 1 A 16 16 THR HA H 16 4.369 5.110 -0.741 1
1 121 . 9 1 1 A 16 16 THR C C 16 172.453 172.674 -0.221 1
1 122 . 9 1 1 A 16 16 THR CA C 16 62.480 60.955 1.525 1
1 123 . 9 1 1 A 16 16 THR CB C 16 72.198 72.242 -0.044 1
1 125 . 9 1 1 A 16 16 THR N N 16 122.214 121.171 1.043 1
1 126 . 9 1 1 A 17 17 LEU H H 17 8.847 8.724 0.123 1
1 127 . 9 1 1 A 17 17 LEU HA H 17 4.573 4.531 0.042 1
1 137 . 9 1 1 A 17 17 LEU C C 17 174.695 176.559 -1.864 1
1 138 . 9 1 1 A 17 17 LEU CA C 17 53.840 54.378 -0.538 1
1 139 . 9 1 1 A 17 17 LEU CB C 17 40.290 42.261 -1.971 1
1 143 . 9 1 1 A 17 17 LEU N N 17 127.415 126.935 0.480 1
1 144 . 9 1 1 A 18 18 ALA H H 18 8.647 8.725 -0.078 1
1 145 . 9 1 1 A 18 18 ALA HA H 18 4.106 4.021 0.085 1
1 149 . 9 1 1 A 18 18 ALA C C 18 178.236 177.422 0.814 1
1 150 . 9 1 1 A 18 18 ALA CA C 18 53.926 54.094 -0.168 1
1 151 . 9 1 1 A 18 18 ALA CB C 18 18.876 19.058 -0.182 1
1 152 . 9 1 1 A 18 18 ALA N N 18 133.362 129.896 3.466 1
1 153 . 9 1 1 A 19 19 ALA H H 19 7.772 7.507 0.265 1
1 154 . 9 1 1 A 19 19 ALA HA H 19 4.561 4.662 -0.101 1
1 158 . 9 1 1 A 19 19 ALA C C 19 176.032 174.344 1.688 1
1 159 . 9 1 1 A 19 19 ALA CA C 19 53.011 51.675 1.336 1
1 160 . 9 1 1 A 19 19 ALA CB C 19 21.869 22.811 -0.942 1
1 161 . 9 1 1 A 19 19 ALA N N 19 115.654 116.405 -0.751 1
1 162 . 9 1 1 A 20 20 VAL H H 20 8.697 8.844 -0.147 1
1 163 . 9 1 1 A 20 20 VAL HA H 20 4.951 4.897 0.054 1
1 171 . 9 1 1 A 20 20 VAL C C 20 174.314 174.070 0.244 1
1 172 . 9 1 1 A 20 20 VAL CA C 20 61.352 60.122 1.230 1
1 173 . 9 1 1 A 20 20 VAL CB C 20 35.394 34.224 1.170 1
1 176 . 9 1 1 A 20 20 VAL N N 20 120.848 121.120 -0.272 1
1 177 . 9 1 1 A 21 21 THR H H 21 9.198 8.433 0.765 1
1 178 . 9 1 1 A 21 21 THR HA H 21 4.941 4.756 0.185 1
1 183 . 9 1 1 A 21 21 THR C C 21 174.416 174.615 -0.199 1
1 184 . 9 1 1 A 21 21 THR CA C 21 60.347 58.935 1.412 1
1 185 . 9 1 1 A 21 21 THR CB C 21 68.713 71.883 -3.170 1
1 187 . 9 1 1 A 21 21 THR N N 21 120.326 125.255 -4.929 1
1 188 . 9 1 1 A 22 22 PRO HA H 22 4.634 4.557 0.077 1
1 194 . 9 1 1 A 22 22 PRO C C 22 173.606 177.237 -3.631 1
1 195 . 9 1 1 A 22 22 PRO CA C 22 66.519 64.312 2.207 1
1 196 . 9 1 1 A 22 22 PRO CB C 22 32.078 31.728 0.350 1
1 199 . 9 1 1 A 23 23 ARG H H 23 6.621 8.390 -1.769 1
1 200 . 9 1 1 A 23 23 ARG HA H 23 4.591 4.526 0.065 1
1 207 . 9 1 1 A 23 23 ARG C C 23 176.554 175.467 1.087 1
1 208 . 9 1 1 A 23 23 ARG CA C 23 53.892 55.861 -1.969 1
1 209 . 9 1 1 A 23 23 ARG CB C 23 33.498 31.810 1.688 1
1 212 . 9 1 1 A 23 23 ARG N N 23 102.938 115.832 -12.894 1
1 213 . 9 1 1 A 24 24 THR H H 24 7.352 7.827 -0.475 1
1 214 . 9 1 1 A 24 24 THR HA H 24 5.593 5.208 0.385 1
1 219 . 9 1 1 A 24 24 THR C C 24 172.345 172.175 0.170 1
1 220 . 9 1 1 A 24 24 THR CA C 24 59.311 60.791 -1.480 1
1 221 . 9 1 1 A 24 24 THR CB C 24 73.311 71.894 1.417 1
1 223 . 9 1 1 A 24 24 THR N N 24 108.792 109.522 -0.730 1
1 224 . 9 1 1 A 25 25 VAL H H 25 8.437 8.496 -0.059 1
1 225 . 9 1 1 A 25 25 VAL HA H 25 4.512 4.815 -0.303 1
1 233 . 9 1 1 A 25 25 VAL C C 25 172.854 173.883 -1.029 1
1 234 . 9 1 1 A 25 25 VAL CA C 25 61.617 61.063 0.554 1
1 235 . 9 1 1 A 25 25 VAL CB C 25 36.742 34.468 2.274 1
1 238 . 9 1 1 A 25 25 VAL N N 25 117.023 120.775 -3.752 1
1 239 . 9 1 1 A 26 26 HIS H H 26 8.915 8.681 0.234 1
1 240 . 9 1 1 A 26 26 HIS HA H 26 5.765 5.697 0.068 1
1 245 . 9 1 1 A 26 26 HIS C C 26 173.976 173.317 0.659 1
1 246 . 9 1 1 A 26 26 HIS CA C 26 52.896 53.673 -0.777 1
1 247 . 9 1 1 A 26 26 HIS CB C 26 34.004 33.004 1.000 1
1 250 . 9 1 1 A 26 26 HIS N N 26 128.155 127.864 0.291 1
1 251 . 9 1 1 A 27 27 LEU H H 27 9.034 9.511 -0.477 1
1 252 . 9 1 1 A 27 27 LEU HA H 27 5.505 5.303 0.202 1
1 262 . 9 1 1 A 27 27 LEU C C 27 174.821 175.122 -0.301 1
1 263 . 9 1 1 A 27 27 LEU CA C 27 53.376 53.508 -0.132 1
1 264 . 9 1 1 A 27 27 LEU CB C 27 46.306 46.867 -0.561 1
1 268 . 9 1 1 A 27 27 LEU N N 27 128.569 130.148 -1.579 1
1 269 . 9 1 1 A 28 28 THR H H 28 8.844 8.620 0.224 1
1 270 . 9 1 1 A 28 28 THR HA H 28 4.485 4.921 -0.436 1
1 275 . 9 1 1 A 28 28 THR C C 28 172.773 173.760 -0.987 1
1 276 . 9 1 1 A 28 28 THR CA C 28 60.052 59.782 0.270 1
1 277 . 9 1 1 A 28 28 THR CB C 28 71.704 71.319 0.385 1
1 279 . 9 1 1 A 28 28 THR N N 28 112.165 114.646 -2.481 1
1 280 . 9 1 1 A 29 29 TRP H H 29 7.395 7.822 -0.427 1
1 281 . 9 1 1 A 29 29 TRP HA H 29 4.915 5.753 -0.838 1
1 290 . 9 1 1 A 29 29 TRP C C 29 174.013 174.044 -0.031 1
1 291 . 9 1 1 A 29 29 TRP CA C 29 56.626 54.601 2.025 1
1 292 . 9 1 1 A 29 29 TRP CB C 29 29.487 31.956 -2.469 1
1 298 . 9 1 1 A 29 29 TRP N N 29 115.623 119.879 -4.256 1
1 300 . 9 1 1 A 30 30 GLN H H 30 8.759 8.552 0.207 1
1 301 . 9 1 1 A 30 30 GLN HA H 30 4.641 4.733 -0.092 1
1 308 . 9 1 1 A 30 30 GLN C C 30 175.072 174.036 1.036 1
1 309 . 9 1 1 A 30 30 GLN CA C 30 52.975 53.726 -0.751 1
1 310 . 9 1 1 A 30 30 GLN CB C 30 28.398 28.321 0.077 1
1 312 . 9 1 1 A 30 30 GLN N N 30 117.497 120.331 -2.834 1
1 314 . 9 1 1 A 31 31 PRO HA H 31 4.487 4.792 -0.305 1
1 320 . 9 1 1 A 31 31 PRO C C 31 177.034 176.216 0.818 1
1 321 . 9 1 1 A 31 31 PRO CA C 31 62.710 62.552 0.158 1
1 322 . 9 1 1 A 31 31 PRO CB C 31 32.738 32.716 0.022 1
1 325 . 9 1 1 A 32 32 SER H H 32 8.259 8.454 -0.195 1
1 326 . 9 1 1 A 32 32 SER HA H 32 4.670 5.048 -0.378 1
1 329 . 9 1 1 A 32 32 SER C C 32 174.689 173.557 1.132 1
1 330 . 9 1 1 A 32 32 SER CA C 32 57.296 56.815 0.481 1
1 331 . 9 1 1 A 32 32 SER CB C 32 64.748 66.071 -1.323 1
1 332 . 9 1 1 A 32 32 SER N N 32 117.667 114.455 3.212 1
1 333 . 9 1 1 A 33 33 ALA H H 33 9.038 8.550 0.488 1
1 334 . 9 1 1 A 33 33 ALA HA H 33 4.126 4.607 -0.481 1
1 338 . 9 1 1 A 33 33 ALA C C 33 177.795 177.839 -0.044 1
1 339 . 9 1 1 A 33 33 ALA CA C 33 54.213 52.139 2.074 1
1 340 . 9 1 1 A 33 33 ALA CB C 33 17.948 18.089 -0.141 1
1 341 . 9 1 1 A 33 33 ALA N N 33 131.772 125.763 6.009 1
1 342 . 9 1 1 A 34 34 GLY H H 34 8.576 8.082 0.494 1
1 343 . 9 1 1 A 34 34 GLY HA2 H 34 4.171 3.983 0.188 1
1 344 . 9 1 1 A 34 34 GLY HA3 H 34 3.592 3.988 -0.396 1
1 345 . 9 1 1 A 34 34 GLY C C 34 174.182 174.453 -0.271 1
1 346 . 9 1 1 A 34 34 GLY CA C 34 44.987 45.452 -0.465 1
1 347 . 9 1 1 A 34 34 GLY N N 34 111.339 110.513 0.826 1
1 348 . 9 1 1 A 35 35 ALA H H 35 7.637 7.679 -0.042 1
1 349 . 9 1 1 A 35 35 ALA HA H 35 4.210 4.137 0.073 1
1 353 . 9 1 1 A 35 35 ALA C C 35 178.918 177.056 1.862 1
1 354 . 9 1 1 A 35 35 ALA CA C 35 52.671 52.360 0.311 1
1 355 . 9 1 1 A 35 35 ALA CB C 35 18.988 19.391 -0.403 1
1 356 . 9 1 1 A 35 35 ALA N N 35 121.531 123.825 -2.294 1
1 357 . 9 1 1 A 36 36 THR H H 36 9.428 8.163 1.265 1
1 358 . 9 1 1 A 36 36 THR HA H 36 4.402 4.393 0.009 1
1 363 . 9 1 1 A 36 36 THR C C 36 174.739 174.040 0.699 1
1 364 . 9 1 1 A 36 36 THR CA C 36 62.692 62.999 -0.307 1
1 365 . 9 1 1 A 36 36 THR CB C 36 69.482 70.458 -0.976 1
1 367 . 9 1 1 A 36 36 THR N N 36 113.103 116.064 -2.961 1
1 368 . 9 1 1 A 37 37 HIS H H 37 7.857 7.090 0.767 1
1 369 . 9 1 1 A 37 37 HIS HA H 37 4.878 5.256 -0.378 1
1 374 . 9 1 1 A 37 37 HIS C C 37 171.103 172.406 -1.303 1
1 375 . 9 1 1 A 37 37 HIS CA C 37 55.867 53.437 2.430 1
1 376 . 9 1 1 A 37 37 HIS CB C 37 32.655 33.589 -0.934 1
1 379 . 9 1 1 A 37 37 HIS N N 37 118.486 116.239 2.247 1
1 380 . 9 1 1 A 38 38 TYR H H 38 9.217 8.753 0.464 1
1 381 . 9 1 1 A 38 38 TYR HA H 38 5.303 5.316 -0.013 1
1 388 . 9 1 1 A 38 38 TYR C C 38 173.922 174.844 -0.922 1
1 389 . 9 1 1 A 38 38 TYR CA C 38 56.504 56.779 -0.275 1
1 390 . 9 1 1 A 38 38 TYR CB C 38 41.823 42.763 -0.940 1
1 395 . 9 1 1 A 38 38 TYR N N 38 114.077 119.113 -5.036 1
1 396 . 9 1 1 A 39 39 LEU H H 39 9.052 8.932 0.120 1
1 397 . 9 1 1 A 39 39 LEU HA H 39 5.061 5.079 -0.018 1
1 407 . 9 1 1 A 39 39 LEU C C 39 175.455 174.852 0.603 1
1 408 . 9 1 1 A 39 39 LEU CA C 39 53.855 53.879 -0.024 1
1 409 . 9 1 1 A 39 39 LEU CB C 39 45.254 44.199 1.055 1
1 413 . 9 1 1 A 39 39 LEU N N 39 123.997 123.272 0.725 1
1 414 . 9 1 1 A 40 40 VAL H H 40 9.520 9.667 -0.147 1
1 415 . 9 1 1 A 40 40 VAL HA H 40 4.988 4.568 0.420 1
1 423 . 9 1 1 A 40 40 VAL C C 40 174.578 174.343 0.235 1
1 424 . 9 1 1 A 40 40 VAL CA C 40 60.575 61.597 -1.022 1
1 425 . 9 1 1 A 40 40 VAL CB C 40 33.284 32.438 0.846 1
1 428 . 9 1 1 A 40 40 VAL N N 40 129.678 128.712 0.966 1
1 429 . 9 1 1 A 41 41 ARG H H 41 9.096 9.212 -0.116 1
1 430 . 9 1 1 A 41 41 ARG HA H 41 5.384 5.022 0.362 1
1 437 . 9 1 1 A 41 41 ARG C C 41 175.100 174.536 0.564 1
1 438 . 9 1 1 A 41 41 ARG CA C 41 54.297 54.663 -0.366 1
1 439 . 9 1 1 A 41 41 ARG CB C 41 33.003 31.795 1.208 1
1 442 . 9 1 1 A 41 41 ARG N N 41 126.332 129.274 -2.942 1
1 443 . 9 1 1 A 42 42 CYS H H 42 9.004 9.517 -0.513 1
1 444 . 9 1 1 A 42 42 CYS HA H 42 5.309 5.008 0.301 1
1 447 . 9 1 1 A 42 42 CYS C C 42 173.417 173.513 -0.096 1
1 448 . 9 1 1 A 42 42 CYS CA C 42 57.508 57.329 0.179 1
1 449 . 9 1 1 A 42 42 CYS CB C 42 28.859 28.416 0.443 1
1 450 . 9 1 1 A 42 42 CYS N N 42 123.359 127.894 -4.535 1
1 451 . 9 1 1 A 43 43 SER H H 43 9.102 8.902 0.200 1
1 452 . 9 1 1 A 43 43 SER HA H 43 5.324 5.095 0.229 1
1 455 . 9 1 1 A 43 43 SER C C 43 171.429 172.237 -0.808 1
1 456 . 9 1 1 A 43 43 SER CA C 43 55.621 55.113 0.508 1
1 457 . 9 1 1 A 43 43 SER CB C 43 64.856 65.550 -0.694 1
1 458 . 9 1 1 A 43 43 SER N N 43 125.444 123.299 2.145 1
1 459 . 9 1 1 A 44 44 PRO HA H 44 4.389 4.621 -0.232 1
1 466 . 9 1 1 A 44 44 PRO C C 44 176.559 177.188 -0.629 1
1 467 . 9 1 1 A 44 44 PRO CA C 44 63.027 62.937 0.090 1
1 468 . 9 1 1 A 44 44 PRO CB C 44 31.935 32.842 -0.907 1
1 471 . 9 1 1 A 45 45 ALA H H 45 8.261 8.122 0.139 1
1 472 . 9 1 1 A 45 45 ALA HA H 45 4.157 4.093 0.064 1
1 476 . 9 1 1 A 45 45 ALA C C 45 177.706 177.515 0.191 1
1 477 . 9 1 1 A 45 45 ALA CA C 45 53.284 54.681 -1.397 1
1 478 . 9 1 1 A 45 45 ALA CB C 45 18.978 19.093 -0.115 1
1 479 . 9 1 1 A 45 45 ALA N N 45 126.162 124.707 1.455 1
1 480 . 9 1 1 A 46 46 SER H H 46 8.275 7.599 0.676 1
1 481 . 9 1 1 A 46 46 SER HA H 46 4.779 4.628 0.151 1
1 484 . 9 1 1 A 46 46 SER C C 46 172.182 174.258 -2.076 1
1 485 . 9 1 1 A 46 46 SER CA C 46 55.091 55.816 -0.725 1
1 486 . 9 1 1 A 46 46 SER CB C 46 63.130 64.389 -1.259 1
1 487 . 9 1 1 A 46 46 SER N N 46 113.009 114.168 -1.159 1
1 488 . 9 1 1 A 47 47 PRO HA H 47 4.336 4.550 -0.214 1
1 493 . 9 1 1 A 47 47 PRO C C 47 177.165 176.295 0.870 1
1 494 . 9 1 1 A 47 47 PRO CA C 47 63.268 63.819 -0.551 1
1 495 . 9 1 1 A 47 47 PRO CB C 47 32.528 31.593 0.935 1
1 498 . 9 1 1 A 48 48 LYS H H 48 9.089 7.764 1.325 1
1 499 . 9 1 1 A 48 48 LYS HA H 48 4.408 4.116 0.292 1
1 508 . 9 1 1 A 48 48 LYS C C 48 176.917 176.943 -0.026 1
1 509 . 9 1 1 A 48 48 LYS CA C 48 55.893 56.941 -1.048 1
1 510 . 9 1 1 A 48 48 LYS CB C 48 32.997 30.923 2.074 1
1 514 . 9 1 1 A 48 48 LYS N N 48 122.579 119.065 3.514 1
1 515 . 9 1 1 A 49 49 GLY HA2 H 49 4.021 4.125 -0.104 1
1 516 . 9 1 1 A 49 49 GLY HA3 H 49 3.881 4.126 -0.245 1
1 517 . 9 1 1 A 49 49 GLY C C 49 174.552 172.631 1.921 1
1 518 . 9 1 1 A 49 49 GLY CA C 49 46.011 44.740 1.271 1
1 519 . 9 1 1 A 50 50 GLU H H 50 8.608 8.725 -0.117 1
1 520 . 9 1 1 A 50 50 GLU HA H 50 4.335 4.588 -0.253 1
1 525 . 9 1 1 A 50 50 GLU C C 50 176.672 176.037 0.635 1
1 526 . 9 1 1 A 50 50 GLU CA C 50 56.978 54.953 2.025 1
1 527 . 9 1 1 A 50 50 GLU CB C 50 29.458 30.056 -0.598 1
1 529 . 9 1 1 A 50 50 GLU N N 50 121.378 124.113 -2.735 1
1 530 . 9 1 1 A 51 51 GLU H H 51 8.287 8.167 0.120 1
1 531 . 9 1 1 A 51 51 GLU HA H 51 4.381 4.020 0.361 1
1 536 . 9 1 1 A 51 51 GLU C C 51 176.218 175.916 0.302 1
1 537 . 9 1 1 A 51 51 GLU CA C 51 56.996 57.290 -0.294 1
1 538 . 9 1 1 A 51 51 GLU CB C 51 31.066 27.375 3.691 1
1 540 . 9 1 1 A 51 51 GLU N N 51 120.863 119.779 1.084 1
1 541 . 9 1 1 A 52 52 GLU H H 52 8.445 8.022 0.423 1
1 542 . 9 1 1 A 52 52 GLU HA H 52 4.464 4.227 0.237 1
1 547 . 9 1 1 A 52 52 GLU C C 52 176.128 175.771 0.357 1
1 548 . 9 1 1 A 52 52 GLU CA C 52 55.955 56.972 -1.017 1
1 549 . 9 1 1 A 52 52 GLU CB C 52 31.691 30.188 1.503 1
1 551 . 9 1 1 A 52 52 GLU N N 52 121.103 120.324 0.779 1
1 552 . 9 1 1 A 53 53 GLU H H 53 8.441 8.714 -0.273 1
1 553 . 9 1 1 A 53 53 GLU HA H 53 4.609 5.192 -0.583 1
1 558 . 9 1 1 A 53 53 GLU C C 53 175.816 174.404 1.412 1
1 559 . 9 1 1 A 53 53 GLU CA C 53 56.697 55.170 1.527 1
1 560 . 9 1 1 A 53 53 GLU CB C 53 31.022 33.374 -2.352 1
1 562 . 9 1 1 A 53 53 GLU N N 53 121.949 125.946 -3.997 1
1 563 . 9 1 1 A 54 54 ARG H H 54 8.569 8.686 -0.117 1
1 564 . 9 1 1 A 54 54 ARG HA H 54 4.768 4.986 -0.218 1
1 571 . 9 1 1 A 54 54 ARG C C 54 174.881 174.613 0.268 1
1 572 . 9 1 1 A 54 54 ARG CA C 54 54.950 55.129 -0.179 1
1 573 . 9 1 1 A 54 54 ARG CB C 54 33.374 33.494 -0.120 1
1 576 . 9 1 1 A 54 54 ARG N N 54 123.714 126.782 -3.068 1
1 577 . 9 1 1 A 55 55 GLU H H 55 8.650 8.931 -0.281 1
1 578 . 9 1 1 A 55 55 GLU HA H 55 5.493 5.212 0.281 1
1 583 . 9 1 1 A 55 55 GLU C C 55 175.566 175.646 -0.080 1
1 584 . 9 1 1 A 55 55 GLU CA C 55 54.915 55.569 -0.654 1
1 585 . 9 1 1 A 55 55 GLU CB C 55 33.250 30.817 2.433 1
1 587 . 9 1 1 A 55 55 GLU N N 55 123.537 126.014 -2.477 1
1 588 . 9 1 1 A 56 56 VAL H H 56 9.419 9.231 0.188 1
1 589 . 9 1 1 A 56 56 VAL HA H 56 4.524 5.106 -0.582 1
1 597 . 9 1 1 A 56 56 VAL C C 56 173.502 174.480 -0.978 1
1 598 . 9 1 1 A 56 56 VAL CA C 56 60.981 59.541 1.440 1
1 599 . 9 1 1 A 56 56 VAL CB C 56 36.117 34.551 1.566 1
1 602 . 9 1 1 A 56 56 VAL N N 56 123.343 120.025 3.318 1
1 603 . 9 1 1 A 57 57 GLN H H 57 8.767 8.691 0.076 1
1 604 . 9 1 1 A 57 57 GLN HA H 57 5.671 5.281 0.390 1
1 611 . 9 1 1 A 57 57 GLN C C 57 176.357 175.035 1.322 1
1 612 . 9 1 1 A 57 57 GLN CA C 57 54.735 54.249 0.486 1
1 613 . 9 1 1 A 57 57 GLN CB C 57 30.781 31.183 -0.402 1
1 615 . 9 1 1 A 57 57 GLN N N 57 125.639 120.697 4.942 1
1 617 . 9 1 1 A 58 58 VAL H H 58 9.217 8.895 0.322 1
1 618 . 9 1 1 A 58 58 VAL HA H 58 5.129 4.842 0.287 1
1 626 . 9 1 1 A 58 58 VAL C C 58 175.925 177.070 -1.145 1
1 627 . 9 1 1 A 58 58 VAL CA C 58 59.652 59.994 -0.342 1
1 628 . 9 1 1 A 58 58 VAL CB C 58 36.540 34.813 1.727 1
1 631 . 9 1 1 A 58 58 VAL N N 58 117.022 119.207 -2.185 1
1 632 . 9 1 1 A 59 59 GLY H H 59 9.008 8.776 0.232 1
1 633 . 9 1 1 A 59 59 GLY HA2 H 59 4.670 3.928 0.742 1
1 634 . 9 1 1 A 59 59 GLY HA3 H 59 3.914 3.981 -0.067 1
1 635 . 9 1 1 A 59 59 GLY C C 59 173.386 174.239 -0.853 1
1 636 . 9 1 1 A 59 59 GLY CA C 59 45.093 46.465 -1.372 1
1 637 . 9 1 1 A 59 59 GLY N N 59 109.174 111.197 -2.023 1
1 638 . 9 1 1 A 60 60 ARG H H 60 7.695 7.613 0.082 1
1 639 . 9 1 1 A 60 60 ARG HA H 60 4.866 4.879 -0.013 1
1 645 . 9 1 1 A 60 60 ARG C C 60 173.760 175.521 -1.761 1
1 646 . 9 1 1 A 60 60 ARG CA C 60 52.764 53.727 -0.963 1
1 647 . 9 1 1 A 60 60 ARG CB C 60 31.785 31.618 0.167 1
1 650 . 9 1 1 A 60 60 ARG N N 60 118.520 118.560 -0.040 1
1 651 . 9 1 1 A 61 61 PRO HA H 61 3.539 3.846 -0.307 1
1 658 . 9 1 1 A 61 61 PRO C C 61 173.175 173.730 -0.555 1
1 659 . 9 1 1 A 61 61 PRO CA C 61 62.265 62.926 -0.661 1
1 660 . 9 1 1 A 61 61 PRO CB C 61 27.546 30.804 -3.258 1
1 663 . 9 1 1 A 62 62 GLU H H 62 7.879 7.516 0.363 1
1 664 . 9 1 1 A 62 62 GLU HA H 62 4.071 4.660 -0.589 1
1 669 . 9 1 1 A 62 62 GLU C C 62 174.107 174.816 -0.709 1
1 670 . 9 1 1 A 62 62 GLU CA C 62 55.229 54.749 0.480 1
1 671 . 9 1 1 A 62 62 GLU CB C 62 32.838 32.298 0.540 1
1 673 . 9 1 1 A 62 62 GLU N N 62 118.173 114.429 3.744 1
1 674 . 9 1 1 A 63 63 VAL H H 63 8.930 8.593 0.337 1
1 675 . 9 1 1 A 63 63 VAL HA H 63 4.548 4.908 -0.360 1
1 683 . 9 1 1 A 63 63 VAL C C 63 170.325 173.161 -2.836 1
1 684 . 9 1 1 A 63 63 VAL CA C 63 60.770 59.590 1.180 1
1 685 . 9 1 1 A 63 63 VAL CB C 63 35.394 35.940 -0.546 1
1 688 . 9 1 1 A 63 63 VAL N N 63 117.161 120.697 -3.536 1
1 689 . 9 1 1 A 64 64 LEU H H 64 8.332 8.766 -0.434 1
1 690 . 9 1 1 A 64 64 LEU HA H 64 5.122 5.108 0.014 1
1 700 . 9 1 1 A 64 64 LEU C C 64 176.243 175.037 1.206 1
1 701 . 9 1 1 A 64 64 LEU CA C 64 53.346 53.671 -0.325 1
1 702 . 9 1 1 A 64 64 LEU CB C 64 42.649 44.570 -1.921 1
1 706 . 9 1 1 A 64 64 LEU N N 64 130.510 128.540 1.970 1
1 707 . 9 1 1 A 65 65 LEU H H 65 9.261 9.231 0.030 1
1 708 . 9 1 1 A 65 65 LEU HA H 65 4.443 4.434 0.009 1
1 718 . 9 1 1 A 65 65 LEU C C 65 174.016 176.047 -2.031 1
1 719 . 9 1 1 A 65 65 LEU CA C 65 53.920 54.414 -0.494 1
1 720 . 9 1 1 A 65 65 LEU CB C 65 42.976 42.463 0.513 1
1 724 . 9 1 1 A 65 65 LEU N N 65 128.611 128.834 -0.223 1
1 725 . 9 1 1 A 66 66 ASP H H 66 8.105 8.609 -0.504 1
1 726 . 9 1 1 A 66 66 ASP HA H 66 5.207 5.213 -0.006 1
1 729 . 9 1 1 A 66 66 ASP C C 66 176.161 176.022 0.139 1
1 730 . 9 1 1 A 66 66 ASP CA C 66 51.001 52.375 -1.374 1
1 731 . 9 1 1 A 66 66 ASP CB C 66 42.836 43.957 -1.121 1
1 732 . 9 1 1 A 66 66 ASP N N 66 121.799 122.211 -0.412 1
1 733 . 9 1 1 A 67 67 GLY H H 67 8.688 8.366 0.322 1
1 734 . 9 1 1 A 67 67 GLY HA2 H 67 3.923 3.901 0.022 1
1 735 . 9 1 1 A 67 67 GLY HA3 H 67 3.808 3.906 -0.098 1
1 736 . 9 1 1 A 67 67 GLY C C 67 175.500 174.341 1.159 1
1 737 . 9 1 1 A 67 67 GLY CA C 67 46.591 46.803 -0.212 1
1 738 . 9 1 1 A 67 67 GLY N N 67 106.518 110.820 -4.302 1
1 739 . 9 1 1 A 68 68 LEU H H 68 8.125 7.164 0.961 1
1 740 . 9 1 1 A 68 68 LEU HA H 68 4.252 4.940 -0.688 1
1 750 . 9 1 1 A 68 68 LEU C C 68 174.914 175.514 -0.600 1
1 751 . 9 1 1 A 68 68 LEU CA C 68 53.469 53.096 0.373 1
1 752 . 9 1 1 A 68 68 LEU CB C 68 40.422 45.228 -4.806 1
1 756 . 9 1 1 A 68 68 LEU N N 68 119.345 119.862 -0.517 1
1 757 . 9 1 1 A 69 69 GLU H H 69 8.207 8.312 -0.105 1
1 758 . 9 1 1 A 69 69 GLU HA H 69 4.908 4.848 0.060 1
1 763 . 9 1 1 A 69 69 GLU C C 69 174.464 174.254 0.210 1
1 764 . 9 1 1 A 69 69 GLU CA C 69 53.081 53.000 0.081 1
1 765 . 9 1 1 A 69 69 GLU CB C 69 31.538 31.078 0.460 1
1 767 . 9 1 1 A 69 69 GLU N N 69 119.486 120.499 -1.013 1
1 768 . 9 1 1 A 70 70 PRO HA H 70 4.866 4.347 0.519 1
1 775 . 9 1 1 A 70 70 PRO C C 70 178.285 177.679 0.606 1
1 776 . 9 1 1 A 70 70 PRO CA C 70 63.203 63.718 -0.515 1
1 777 . 9 1 1 A 70 70 PRO CB C 70 33.726 31.299 2.427 1
1 780 . 9 1 1 A 71 71 GLY H H 71 7.362 8.561 -1.199 1
1 781 . 9 1 1 A 71 71 GLY HA2 H 71 3.807 3.953 -0.146 1
1 782 . 9 1 1 A 71 71 GLY HA3 H 71 3.756 3.958 -0.202 1
1 783 . 9 1 1 A 71 71 GLY C C 71 174.664 173.745 0.919 1
1 784 . 9 1 1 A 71 71 GLY CA C 71 46.926 46.509 0.417 1
1 785 . 9 1 1 A 71 71 GLY N N 71 113.776 112.169 1.607 1
1 786 . 9 1 1 A 72 72 ARG H H 72 8.036 7.414 0.622 1
1 787 . 9 1 1 A 72 72 ARG HA H 72 4.597 4.817 -0.220 1
1 793 . 9 1 1 A 72 72 ARG C C 72 173.293 173.860 -0.567 1
1 794 . 9 1 1 A 72 72 ARG CA C 72 54.633 54.424 0.209 1
1 795 . 9 1 1 A 72 72 ARG CB C 72 33.704 33.367 0.337 1
1 798 . 9 1 1 A 72 72 ARG N N 72 119.611 119.510 0.101 1
1 799 . 9 1 1 A 73 73 ASP H H 73 7.785 8.430 -0.645 1
1 800 . 9 1 1 A 73 73 ASP HA H 73 5.276 5.199 0.077 1
1 803 . 9 1 1 A 73 73 ASP C C 73 175.904 175.300 0.604 1
1 804 . 9 1 1 A 73 73 ASP CA C 73 53.568 53.003 0.565 1
1 805 . 9 1 1 A 73 73 ASP CB C 73 42.970 42.417 0.553 1
1 806 . 9 1 1 A 73 73 ASP N N 73 118.900 125.362 -6.462 1
1 807 . 9 1 1 A 74 74 TYR H H 74 9.516 8.722 0.794 1
1 808 . 9 1 1 A 74 74 TYR HA H 74 4.800 5.076 -0.276 1
1 815 . 9 1 1 A 74 74 TYR C C 74 174.631 174.926 -0.295 1
1 816 . 9 1 1 A 74 74 TYR CA C 74 58.548 56.506 2.042 1
1 817 . 9 1 1 A 74 74 TYR CB C 74 42.029 43.476 -1.447 1
1 822 . 9 1 1 A 74 74 TYR N N 74 121.903 120.884 1.019 1
1 823 . 9 1 1 A 75 75 GLU H H 75 9.248 8.896 0.352 1
1 824 . 9 1 1 A 75 75 GLU HA H 75 4.756 4.884 -0.128 1
1 829 . 9 1 1 A 75 75 GLU C C 75 175.524 175.437 0.087 1
1 830 . 9 1 1 A 75 75 GLU CA C 75 55.621 55.240 0.381 1
1 831 . 9 1 1 A 75 75 GLU CB C 75 30.778 30.623 0.155 1
1 833 . 9 1 1 A 75 75 GLU N N 75 122.425 122.256 0.169 1
1 834 . 9 1 1 A 76 76 VAL H H 76 8.884 8.502 0.382 1
1 835 . 9 1 1 A 76 76 VAL HA H 76 5.246 4.610 0.636 1
1 843 . 9 1 1 A 76 76 VAL C C 76 174.800 174.931 -0.131 1
1 844 . 9 1 1 A 76 76 VAL CA C 76 60.199 62.857 -2.658 1
1 845 . 9 1 1 A 76 76 VAL CB C 76 33.449 31.206 2.243 1
1 848 . 9 1 1 A 76 76 VAL N N 76 126.853 125.018 1.835 1
1 849 . 9 1 1 A 77 77 SER H H 77 9.234 8.859 0.375 1
1 850 . 9 1 1 A 77 77 SER HA H 77 5.398 5.227 0.171 1
1 853 . 9 1 1 A 77 77 SER C C 77 173.138 173.647 -0.509 1
1 854 . 9 1 1 A 77 77 SER CA C 77 56.032 56.881 -0.849 1
1 855 . 9 1 1 A 77 77 SER CB C 77 66.374 64.854 1.520 1
1 856 . 9 1 1 A 77 77 SER N N 77 120.852 123.249 -2.397 1
1 857 . 9 1 1 A 78 78 VAL H H 78 9.092 8.587 0.505 1
1 858 . 9 1 1 A 78 78 VAL HA H 78 4.756 5.023 -0.267 1
1 866 . 9 1 1 A 78 78 VAL C C 78 173.641 174.353 -0.712 1
1 867 . 9 1 1 A 78 78 VAL CA C 78 61.246 60.803 0.443 1
1 868 . 9 1 1 A 78 78 VAL CB C 78 34.467 33.971 0.496 1
1 871 . 9 1 1 A 78 78 VAL N N 78 122.453 125.335 -2.882 1
1 872 . 9 1 1 A 79 79 GLN H H 79 8.587 8.712 -0.125 1
1 873 . 9 1 1 A 79 79 GLN HA H 79 4.438 4.921 -0.483 1
1 880 . 9 1 1 A 79 79 GLN C C 79 174.999 174.796 0.203 1
1 881 . 9 1 1 A 79 79 GLN CA C 79 54.227 54.069 0.158 1
1 882 . 9 1 1 A 79 79 GLN CB C 79 33.587 32.004 1.583 1
1 884 . 9 1 1 A 79 79 GLN N N 79 125.619 127.951 -2.332 1
1 886 . 9 1 1 A 80 80 SER H H 80 8.623 8.936 -0.313 1
1 887 . 9 1 1 A 80 80 SER HA H 80 4.756 4.710 0.046 1
1 890 . 9 1 1 A 80 80 SER C C 80 172.264 174.197 -1.933 1
1 891 . 9 1 1 A 80 80 SER CA C 80 58.177 59.806 -1.629 1
1 892 . 9 1 1 A 80 80 SER CB C 80 63.920 63.278 0.642 1
1 893 . 9 1 1 A 80 80 SER N N 80 122.844 123.990 -1.146 1
1 894 . 9 1 1 A 81 81 LEU H H 81 8.348 8.778 -0.430 1
1 895 . 9 1 1 A 81 81 LEU HA H 81 5.124 4.603 0.521 1
1 905 . 9 1 1 A 81 81 LEU C C 81 175.775 175.933 -0.158 1
1 906 . 9 1 1 A 81 81 LEU CA C 81 54.033 53.162 0.871 1
1 907 . 9 1 1 A 81 81 LEU CB C 81 44.690 43.192 1.498 1
1 911 . 9 1 1 A 81 81 LEU N N 81 123.191 127.311 -4.120 1
1 912 . 9 1 1 A 82 82 ARG H H 82 8.374 8.895 -0.521 1
1 913 . 9 1 1 A 82 82 ARG HA H 82 4.616 4.293 0.323 1
1 919 . 9 1 1 A 82 82 ARG C C 82 176.864 175.884 0.980 1
1 920 . 9 1 1 A 82 82 ARG CA C 82 55.868 57.055 -1.187 1
1 921 . 9 1 1 A 82 82 ARG CB C 82 32.322 33.191 -0.869 1
1 924 . 9 1 1 A 82 82 ARG N N 82 121.029 126.001 -4.972 1
1 925 . 9 1 1 A 83 83 GLY H H 83 8.309 7.915 0.394 1
1 926 . 9 1 1 A 83 83 GLY HA2 H 83 4.031 4.108 -0.077 1
1 927 . 9 1 1 A 83 83 GLY HA3 H 83 3.888 4.125 -0.237 1
1 928 . 9 1 1 A 83 83 GLY C C 83 174.562 174.481 0.081 1
1 929 . 9 1 1 A 83 83 GLY CA C 83 45.963 44.452 1.511 1
1 930 . 9 1 1 A 83 83 GLY N N 83 109.937 106.728 3.209 1
1 931 . 9 1 1 A 84 84 PRO HA H 84 4.573 4.475 0.098 1
1 938 . 9 1 1 A 84 84 PRO C C 84 176.533 175.347 1.186 1
1 939 . 9 1 1 A 84 84 PRO CA C 84 63.485 64.200 -0.715 1
1 940 . 9 1 1 A 84 84 PRO CB C 84 32.409 31.762 0.647 1
1 943 . 9 1 1 A 85 85 GLU H H 85 7.799 7.628 0.171 1
1 944 . 9 1 1 A 85 85 GLU HA H 85 4.369 4.930 -0.561 1
1 949 . 9 1 1 A 85 85 GLU C C 85 174.722 175.407 -0.685 1
1 950 . 9 1 1 A 85 85 GLU CA C 85 55.899 54.730 1.169 1
1 951 . 9 1 1 A 85 85 GLU CB C 85 31.911 33.010 -1.099 1
1 953 . 9 1 1 A 85 85 GLU N N 85 122.093 113.445 8.648 1
1 954 . 9 1 1 A 86 86 GLY H H 86 8.329 8.928 -0.599 1
1 955 . 9 1 1 A 86 86 GLY HA2 H 86 5.298 4.267 1.031 1
1 956 . 9 1 1 A 86 86 GLY HA3 H 86 3.559 4.284 -0.725 1
1 957 . 9 1 1 A 86 86 GLY C C 86 174.355 172.521 1.834 1
1 958 . 9 1 1 A 86 86 GLY CA C 86 44.034 43.605 0.429 1
1 959 . 9 1 1 A 86 86 GLY N N 86 109.387 109.887 -0.500 1
1 960 . 9 1 1 A 87 87 SER H H 87 8.807 8.561 0.246 1
1 961 . 9 1 1 A 87 87 SER HA H 87 4.670 4.486 0.184 1
1 964 . 9 1 1 A 87 87 SER C C 87 175.195 174.385 0.810 1
1 965 . 9 1 1 A 87 87 SER CA C 87 57.737 57.660 0.077 1
1 966 . 9 1 1 A 87 87 SER CB C 87 67.829 63.823 4.006 1
1 967 . 9 1 1 A 87 87 SER N N 87 117.698 116.264 1.434 1
1 968 . 9 1 1 A 88 88 GLU H H 88 8.754 8.654 0.100 1
1 969 . 9 1 1 A 88 88 GLU HA H 88 4.357 4.319 0.038 1
1 974 . 9 1 1 A 88 88 GLU C C 88 177.474 176.816 0.658 1
1 975 . 9 1 1 A 88 88 GLU CA C 88 57.525 56.953 0.572 1
1 976 . 9 1 1 A 88 88 GLU CB C 88 31.162 30.335 0.827 1
1 978 . 9 1 1 A 88 88 GLU N N 88 118.709 122.610 -3.901 1
1 979 . 9 1 1 A 89 89 ALA H H 89 8.855 8.421 0.434 1
1 980 . 9 1 1 A 89 89 ALA HA H 89 4.792 4.730 0.062 1
1 984 . 9 1 1 A 89 89 ALA C C 89 178.379 176.694 1.685 1
1 985 . 9 1 1 A 89 89 ALA CA C 89 51.264 51.428 -0.164 1
1 986 . 9 1 1 A 89 89 ALA CB C 89 20.040 20.127 -0.087 1
1 987 . 9 1 1 A 89 89 ALA N N 89 127.301 124.491 2.810 1
1 988 . 9 1 1 A 90 90 ARG H H 90 8.549 8.329 0.220 1
1 989 . 9 1 1 A 90 90 ARG HA H 90 4.658 4.866 -0.208 1
1 996 . 9 1 1 A 90 90 ARG C C 90 174.720 175.374 -0.654 1
1 997 . 9 1 1 A 90 90 ARG CA C 90 53.575 54.392 -0.817 1
1 998 . 9 1 1 A 90 90 ARG CB C 90 33.456 31.452 2.004 1
1 1001 . 9 1 1 A 90 90 ARG N N 90 121.289 122.788 -1.499 1
1 1002 . 9 1 1 A 91 91 GLY H H 91 8.396 9.075 -0.679 1
1 1003 . 9 1 1 A 91 91 GLY HA2 H 91 5.306 4.170 1.136 1
1 1004 . 9 1 1 A 91 91 GLY HA3 H 91 3.700 4.197 -0.497 1
1 1005 . 9 1 1 A 91 91 GLY C C 91 173.191 171.741 1.450 1
1 1006 . 9 1 1 A 91 91 GLY CA C 91 44.493 43.933 0.560 1
1 1007 . 9 1 1 A 91 91 GLY N N 91 108.579 112.319 -3.740 1
1 1008 . 9 1 1 A 92 92 ILE H H 92 8.891 8.331 0.560 1
1 1009 . 9 1 1 A 92 92 ILE HA H 92 4.499 4.843 -0.344 1
1 1019 . 9 1 1 A 92 92 ILE C C 92 171.877 174.965 -3.088 1
1 1020 . 9 1 1 A 92 92 ILE CA C 92 60.682 59.589 1.093 1
1 1021 . 9 1 1 A 92 92 ILE CB C 92 42.425 41.335 1.090 1
1 1025 . 9 1 1 A 92 92 ILE N N 92 118.313 123.454 -5.141 1
1 1026 . 9 1 1 A 93 93 ARG H H 93 7.980 8.544 -0.564 1
1 1027 . 9 1 1 A 93 93 ARG HA H 93 5.224 4.346 0.878 1
1 1034 . 9 1 1 A 93 93 ARG C C 93 175.072 175.614 -0.542 1
1 1035 . 9 1 1 A 93 93 ARG CA C 93 54.499 56.990 -2.491 1
1 1036 . 9 1 1 A 93 93 ARG CB C 93 31.767 30.636 1.131 1
1 1039 . 9 1 1 A 93 93 ARG N N 93 124.879 130.663 -5.784 1
1 1040 . 9 1 1 A 94 94 ALA H H 94 9.064 8.527 0.537 1
1 1041 . 9 1 1 A 94 94 ALA HA H 94 4.731 4.669 0.062 1
1 1045 . 9 1 1 A 94 94 ALA C C 94 174.494 177.072 -2.578 1
1 1046 . 9 1 1 A 94 94 ALA CA C 94 50.577 52.196 -1.619 1
1 1047 . 9 1 1 A 94 94 ALA CB C 94 23.082 20.254 2.828 1
1 1048 . 9 1 1 A 94 94 ALA N N 94 126.095 129.692 -3.597 1
1 1049 . 9 1 1 A 95 95 ARG H H 95 8.263 9.079 -0.816 1
1 1050 . 9 1 1 A 95 95 ARG HA H 95 5.548 5.319 0.229 1
1 1058 . 9 1 1 A 95 95 ARG C C 95 176.901 174.653 2.248 1
1 1059 . 9 1 1 A 95 95 ARG CA C 95 53.787 54.442 -0.655 1
1 1060 . 9 1 1 A 95 95 ARG CB C 95 32.426 33.877 -1.451 1
1 1063 . 9 1 1 A 95 95 ARG N N 95 123.374 117.279 6.095 1
1 1065 . 9 1 1 A 96 96 THR H H 96 9.208 8.750 0.458 1
1 1066 . 9 1 1 A 96 96 THR HA H 96 4.461 5.073 -0.612 1
1 1071 . 9 1 1 A 96 96 THR CA C 96 58.248 58.409 -0.161 1
1 1072 . 9 1 1 A 96 96 THR CB C 96 68.466 71.065 -2.599 1
1 1074 . 9 1 1 A 96 96 THR N N 96 119.492 111.516 7.976 1
1 1075 . 9 1 1 A 97 97 PRO HA H 97 4.636 4.613 0.023 1
1 1082 . 9 1 1 A 97 97 PRO C C 97 175.725 175.998 -0.273 1
1 1083 . 9 1 1 A 97 97 PRO CA C 97 61.907 62.333 -0.426 1
1 1084 . 9 1 1 A 97 97 PRO CB C 97 32.590 33.418 -0.828 1
1 1087 . 9 1 1 A 98 98 THR H H 98 7.943 8.350 -0.407 1
1 1088 . 9 1 1 A 98 98 THR HA H 98 4.208 5.116 -0.908 1
1 1093 . 9 1 1 A 98 98 THR C C 98 175.058 172.831 2.227 1
1 1094 . 9 1 1 A 98 98 THR CA C 98 62.069 60.356 1.713 1
1 1095 . 9 1 1 A 98 98 THR CB C 98 69.719 70.758 -1.039 1
1 1097 . 9 1 1 A 98 98 THR N N 98 107.148 111.149 -4.001 1
1 1098 . 9 1 1 A 99 99 SER H H 99 8.163 8.924 -0.761 1
1 1099 . 9 1 1 A 99 99 SER HA H 99 4.524 4.625 -0.101 1
1 1102 . 9 1 1 A 99 99 SER C C 99 174.319 173.557 0.762 1
1 1103 . 9 1 1 A 99 99 SER CA C 99 58.107 57.398 0.709 1
1 1104 . 9 1 1 A 99 99 SER CB C 99 64.492 61.913 2.579 1
1 1105 . 9 1 1 A 99 99 SER N N 99 115.114 123.807 -8.693 1
1 1106 . 9 1 1 A 100 100 GLY H H 100 8.336 8.100 0.236 1
1 1107 . 9 1 1 A 100 100 GLY HA2 H 100 4.222 4.150 0.072 1
1 1108 . 9 1 1 A 100 100 GLY HA3 H 100 4.222 4.150 0.072 1
1 1109 . 9 1 1 A 100 100 GLY C C 100 171.696 171.099 0.597 1
1 1110 . 9 1 1 A 100 100 GLY CA C 100 44.617 45.348 -0.731 1
1 1111 . 9 1 1 A 100 100 GLY N N 100 110.678 113.783 -3.105 1
1 1112 . 9 1 1 A 101 101 PRO HA H 101 4.506 4.661 -0.155 1
1 1118 . 9 1 1 A 101 101 PRO CA C 101 63.358 62.771 0.587 1
1 1119 . 9 1 1 A 101 101 PRO CB C 101 32.313 32.212 0.101 1
1 1 . 10 1 1 A 6 6 SER HA H 6 4.528 4.201 0.327 1
1 3 . 10 1 1 A 6 6 SER CA C 6 58.373 59.533 -1.160 1
1 4 . 10 1 1 A 6 6 SER CB C 6 63.978 61.058 2.920 1
1 5 . 10 1 1 A 7 7 GLY H H 7 8.228 8.047 0.181 1
1 6 . 10 1 1 A 7 7 GLY HA2 H 7 4.134 4.064 0.070 1
1 7 . 10 1 1 A 7 7 GLY HA3 H 7 4.134 4.065 0.069 1
1 8 . 10 1 1 A 7 7 GLY CA C 7 44.607 45.615 -1.008 1
1 9 . 10 1 1 A 7 7 GLY N N 7 110.638 107.075 3.563 1
1 10 . 10 1 1 A 8 8 PRO HA H 8 4.419 4.706 -0.287 1
1 17 . 10 1 1 A 8 8 PRO C C 8 176.908 175.204 1.704 1
1 18 . 10 1 1 A 8 8 PRO CA C 8 62.851 62.721 0.130 1
1 19 . 10 1 1 A 8 8 PRO CB C 8 32.243 30.625 1.618 1
1 22 . 10 1 1 A 9 9 LEU H H 9 8.462 8.245 0.217 1
1 23 . 10 1 1 A 9 9 LEU HA H 9 4.494 4.761 -0.267 1
1 33 . 10 1 1 A 9 9 LEU C C 9 174.124 174.347 -0.223 1
1 34 . 10 1 1 A 9 9 LEU CA C 9 52.587 51.819 0.768 1
1 35 . 10 1 1 A 9 9 LEU CB C 9 43.150 44.282 -1.132 1
1 39 . 10 1 1 A 9 9 LEU N N 9 126.015 124.730 1.285 1
1 40 . 10 1 1 A 10 10 PRO HA H 10 4.820 4.637 0.183 1
1 47 . 10 1 1 A 10 10 PRO CA C 10 61.368 62.542 -1.174 1
1 48 . 10 1 1 A 10 10 PRO CB C 10 31.391 31.697 -0.306 1
1 51 . 10 1 1 A 11 11 PRO HA H 11 4.949 4.635 0.314 1
1 58 . 10 1 1 A 11 11 PRO CA C 11 61.183 61.802 -0.619 1
1 59 . 10 1 1 A 11 11 PRO CB C 11 30.656 31.951 -1.295 1
1 62 . 10 1 1 A 12 12 PRO HA H 12 4.341 4.715 -0.374 1
1 69 . 10 1 1 A 12 12 PRO C C 12 174.849 177.295 -2.446 1
1 70 . 10 1 1 A 12 12 PRO CA C 12 63.062 62.637 0.425 1
1 71 . 10 1 1 A 12 12 PRO CB C 12 31.831 31.385 0.446 1
1 74 . 10 1 1 A 13 13 ARG H H 13 7.828 8.410 -0.582 1
1 75 . 10 1 1 A 13 13 ARG HA H 13 4.536 4.280 0.256 1
1 82 . 10 1 1 A 13 13 ARG C C 13 174.608 176.762 -2.154 1
1 83 . 10 1 1 A 13 13 ARG CA C 13 54.774 58.717 -3.943 1
1 84 . 10 1 1 A 13 13 ARG CB C 13 33.250 30.524 2.726 1
1 87 . 10 1 1 A 13 13 ARG N N 13 120.532 122.845 -2.313 1
1 88 . 10 1 1 A 14 14 ALA H H 14 8.694 7.806 0.888 1
1 89 . 10 1 1 A 14 14 ALA HA H 14 3.986 4.397 -0.411 1
1 93 . 10 1 1 A 14 14 ALA C C 14 177.232 176.689 0.543 1
1 94 . 10 1 1 A 14 14 ALA CA C 14 52.461 51.717 0.744 1
1 95 . 10 1 1 A 14 14 ALA CB C 14 16.806 17.121 -0.315 1
1 96 . 10 1 1 A 14 14 ALA N N 14 121.921 120.525 1.396 1
1 97 . 10 1 1 A 15 15 LEU H H 15 8.097 8.507 -0.410 1
1 98 . 10 1 1 A 15 15 LEU HA H 15 4.670 4.774 -0.104 1
1 108 . 10 1 1 A 15 15 LEU C C 15 177.364 175.616 1.748 1
1 109 . 10 1 1 A 15 15 LEU CA C 15 57.543 54.730 2.813 1
1 110 . 10 1 1 A 15 15 LEU CB C 15 41.877 40.825 1.052 1
1 114 . 10 1 1 A 15 15 LEU N N 15 122.215 121.401 0.814 1
1 115 . 10 1 1 A 16 16 THR H H 16 9.520 9.167 0.353 1
1 116 . 10 1 1 A 16 16 THR HA H 16 4.369 4.892 -0.523 1
1 121 . 10 1 1 A 16 16 THR C C 16 172.453 173.541 -1.088 1
1 122 . 10 1 1 A 16 16 THR CA C 16 62.480 61.474 1.006 1
1 123 . 10 1 1 A 16 16 THR CB C 16 72.198 71.185 1.013 1
1 125 . 10 1 1 A 16 16 THR N N 16 122.214 120.620 1.594 1
1 126 . 10 1 1 A 17 17 LEU H H 17 8.847 8.561 0.286 1
1 127 . 10 1 1 A 17 17 LEU HA H 17 4.573 4.468 0.105 1
1 137 . 10 1 1 A 17 17 LEU C C 17 174.695 176.672 -1.977 1
1 138 . 10 1 1 A 17 17 LEU CA C 17 53.840 54.494 -0.654 1
1 139 . 10 1 1 A 17 17 LEU CB C 17 40.290 41.765 -1.475 1
1 143 . 10 1 1 A 17 17 LEU N N 17 127.415 127.209 0.206 1
1 144 . 10 1 1 A 18 18 ALA H H 18 8.647 8.735 -0.088 1
1 145 . 10 1 1 A 18 18 ALA HA H 18 4.106 3.937 0.169 1
1 149 . 10 1 1 A 18 18 ALA C C 18 178.236 177.119 1.117 1
1 150 . 10 1 1 A 18 18 ALA CA C 18 53.926 54.996 -1.070 1
1 151 . 10 1 1 A 18 18 ALA CB C 18 18.876 18.836 0.040 1
1 152 . 10 1 1 A 18 18 ALA N N 18 133.362 130.334 3.028 1
1 153 . 10 1 1 A 19 19 ALA H H 19 7.772 7.118 0.654 1
1 154 . 10 1 1 A 19 19 ALA HA H 19 4.561 4.653 -0.092 1
1 158 . 10 1 1 A 19 19 ALA C C 19 176.032 174.613 1.419 1
1 159 . 10 1 1 A 19 19 ALA CA C 19 53.011 51.736 1.275 1
1 160 . 10 1 1 A 19 19 ALA CB C 19 21.869 22.730 -0.861 1
1 161 . 10 1 1 A 19 19 ALA N N 19 115.654 116.090 -0.436 1
1 162 . 10 1 1 A 20 20 VAL H H 20 8.697 8.784 -0.087 1
1 163 . 10 1 1 A 20 20 VAL HA H 20 4.951 4.801 0.150 1
1 171 . 10 1 1 A 20 20 VAL C C 20 174.314 173.989 0.325 1
1 172 . 10 1 1 A 20 20 VAL CA C 20 61.352 60.302 1.050 1
1 173 . 10 1 1 A 20 20 VAL CB C 20 35.394 33.922 1.472 1
1 176 . 10 1 1 A 20 20 VAL N N 20 120.848 121.671 -0.823 1
1 177 . 10 1 1 A 21 21 THR H H 21 9.198 8.486 0.712 1
1 178 . 10 1 1 A 21 21 THR HA H 21 4.941 4.757 0.184 1
1 183 . 10 1 1 A 21 21 THR C C 21 174.416 174.616 -0.200 1
1 184 . 10 1 1 A 21 21 THR CA C 21 60.347 58.941 1.406 1
1 185 . 10 1 1 A 21 21 THR CB C 21 68.713 71.767 -3.054 1
1 187 . 10 1 1 A 21 21 THR N N 21 120.326 125.332 -5.006 1
1 188 . 10 1 1 A 22 22 PRO HA H 22 4.634 4.569 0.065 1
1 194 . 10 1 1 A 22 22 PRO C C 22 173.606 177.309 -3.703 1
1 195 . 10 1 1 A 22 22 PRO CA C 22 66.519 64.319 2.200 1
1 196 . 10 1 1 A 22 22 PRO CB C 22 32.078 31.712 0.366 1
1 199 . 10 1 1 A 23 23 ARG H H 23 6.621 8.382 -1.761 1
1 200 . 10 1 1 A 23 23 ARG HA H 23 4.591 4.621 -0.030 1
1 207 . 10 1 1 A 23 23 ARG C C 23 176.554 175.318 1.236 1
1 208 . 10 1 1 A 23 23 ARG CA C 23 53.892 55.666 -1.774 1
1 209 . 10 1 1 A 23 23 ARG CB C 23 33.498 31.949 1.549 1
1 212 . 10 1 1 A 23 23 ARG N N 23 102.938 115.783 -12.845 1
1 213 . 10 1 1 A 24 24 THR H H 24 7.352 7.778 -0.426 1
1 214 . 10 1 1 A 24 24 THR HA H 24 5.593 5.148 0.445 1
1 219 . 10 1 1 A 24 24 THR C C 24 172.345 172.072 0.273 1
1 220 . 10 1 1 A 24 24 THR CA C 24 59.311 60.864 -1.553 1
1 221 . 10 1 1 A 24 24 THR CB C 24 73.311 72.053 1.258 1
1 223 . 10 1 1 A 24 24 THR N N 24 108.792 109.697 -0.905 1
1 224 . 10 1 1 A 25 25 VAL H H 25 8.437 8.637 -0.200 1
1 225 . 10 1 1 A 25 25 VAL HA H 25 4.512 4.828 -0.316 1
1 233 . 10 1 1 A 25 25 VAL C C 25 172.854 173.896 -1.042 1
1 234 . 10 1 1 A 25 25 VAL CA C 25 61.617 61.140 0.477 1
1 235 . 10 1 1 A 25 25 VAL CB C 25 36.742 34.453 2.289 1
1 238 . 10 1 1 A 25 25 VAL N N 25 117.023 120.942 -3.919 1
1 239 . 10 1 1 A 26 26 HIS H H 26 8.915 8.796 0.119 1
1 240 . 10 1 1 A 26 26 HIS HA H 26 5.765 5.647 0.118 1
1 245 . 10 1 1 A 26 26 HIS C C 26 173.976 173.263 0.713 1
1 246 . 10 1 1 A 26 26 HIS CA C 26 52.896 53.603 -0.707 1
1 247 . 10 1 1 A 26 26 HIS CB C 26 34.004 32.602 1.402 1
1 250 . 10 1 1 A 26 26 HIS N N 26 128.155 128.021 0.134 1
1 251 . 10 1 1 A 27 27 LEU H H 27 9.034 9.734 -0.700 1
1 252 . 10 1 1 A 27 27 LEU HA H 27 5.505 5.287 0.218 1
1 262 . 10 1 1 A 27 27 LEU C C 27 174.821 174.964 -0.143 1
1 263 . 10 1 1 A 27 27 LEU CA C 27 53.376 53.385 -0.009 1
1 264 . 10 1 1 A 27 27 LEU CB C 27 46.306 46.748 -0.442 1
1 268 . 10 1 1 A 27 27 LEU N N 27 128.569 130.433 -1.864 1
1 269 . 10 1 1 A 28 28 THR H H 28 8.844 8.547 0.297 1
1 270 . 10 1 1 A 28 28 THR HA H 28 4.485 4.780 -0.295 1
1 275 . 10 1 1 A 28 28 THR C C 28 172.773 173.221 -0.448 1
1 276 . 10 1 1 A 28 28 THR CA C 28 60.052 60.543 -0.491 1
1 277 . 10 1 1 A 28 28 THR CB C 28 71.704 71.324 0.380 1
1 279 . 10 1 1 A 28 28 THR N N 28 112.165 112.900 -0.735 1
1 280 . 10 1 1 A 29 29 TRP H H 29 7.395 7.651 -0.256 1
1 281 . 10 1 1 A 29 29 TRP HA H 29 4.915 5.497 -0.582 1
1 290 . 10 1 1 A 29 29 TRP C C 29 174.013 175.120 -1.107 1
1 291 . 10 1 1 A 29 29 TRP CA C 29 56.626 54.446 2.180 1
1 292 . 10 1 1 A 29 29 TRP CB C 29 29.487 32.265 -2.778 1
1 298 . 10 1 1 A 29 29 TRP N N 29 115.623 120.032 -4.409 1
1 300 . 10 1 1 A 30 30 GLN H H 30 8.759 8.543 0.216 1
1 301 . 10 1 1 A 30 30 GLN HA H 30 4.641 4.727 -0.086 1
1 308 . 10 1 1 A 30 30 GLN C C 30 175.072 174.355 0.717 1
1 309 . 10 1 1 A 30 30 GLN CA C 30 52.975 53.874 -0.899 1
1 310 . 10 1 1 A 30 30 GLN CB C 30 28.398 28.572 -0.174 1
1 312 . 10 1 1 A 30 30 GLN N N 30 117.497 119.998 -2.501 1
1 314 . 10 1 1 A 31 31 PRO HA H 31 4.487 4.602 -0.115 1
1 320 . 10 1 1 A 31 31 PRO C C 31 177.034 176.649 0.385 1
1 321 . 10 1 1 A 31 31 PRO CA C 31 62.710 62.969 -0.259 1
1 322 . 10 1 1 A 31 31 PRO CB C 31 32.738 32.436 0.302 1
1 325 . 10 1 1 A 32 32 SER H H 32 8.259 8.708 -0.449 1
1 326 . 10 1 1 A 32 32 SER HA H 32 4.670 4.766 -0.096 1
1 329 . 10 1 1 A 32 32 SER C C 32 174.689 174.816 -0.127 1
1 330 . 10 1 1 A 32 32 SER CA C 32 57.296 58.174 -0.878 1
1 331 . 10 1 1 A 32 32 SER CB C 32 64.748 64.297 0.451 1
1 332 . 10 1 1 A 32 32 SER N N 32 117.667 117.300 0.367 1
1 333 . 10 1 1 A 33 33 ALA H H 33 9.038 8.430 0.608 1
1 334 . 10 1 1 A 33 33 ALA HA H 33 4.126 4.631 -0.505 1
1 338 . 10 1 1 A 33 33 ALA C C 33 177.795 177.416 0.379 1
1 339 . 10 1 1 A 33 33 ALA CA C 33 54.213 50.858 3.355 1
1 340 . 10 1 1 A 33 33 ALA CB C 33 17.948 18.422 -0.474 1
1 341 . 10 1 1 A 33 33 ALA N N 33 131.772 126.166 5.606 1
1 342 . 10 1 1 A 34 34 GLY H H 34 8.576 7.710 0.866 1
1 343 . 10 1 1 A 34 34 GLY HA2 H 34 4.171 4.018 0.153 1
1 344 . 10 1 1 A 34 34 GLY HA3 H 34 3.592 4.024 -0.432 1
1 345 . 10 1 1 A 34 34 GLY C C 34 174.182 174.598 -0.416 1
1 346 . 10 1 1 A 34 34 GLY CA C 34 44.987 45.435 -0.448 1
1 347 . 10 1 1 A 34 34 GLY N N 34 111.339 105.840 5.499 1
1 348 . 10 1 1 A 35 35 ALA H H 35 7.637 7.698 -0.061 1
1 349 . 10 1 1 A 35 35 ALA HA H 35 4.210 4.279 -0.069 1
1 353 . 10 1 1 A 35 35 ALA C C 35 178.918 177.820 1.098 1
1 354 . 10 1 1 A 35 35 ALA CA C 35 52.671 52.441 0.230 1
1 355 . 10 1 1 A 35 35 ALA CB C 35 18.988 19.279 -0.291 1
1 356 . 10 1 1 A 35 35 ALA N N 35 121.531 123.355 -1.824 1
1 357 . 10 1 1 A 36 36 THR H H 36 9.428 8.159 1.269 1
1 358 . 10 1 1 A 36 36 THR HA H 36 4.402 4.252 0.150 1
1 363 . 10 1 1 A 36 36 THR C C 36 174.739 174.463 0.276 1
1 364 . 10 1 1 A 36 36 THR CA C 36 62.692 63.950 -1.258 1
1 365 . 10 1 1 A 36 36 THR CB C 36 69.482 70.279 -0.797 1
1 367 . 10 1 1 A 36 36 THR N N 36 113.103 117.057 -3.954 1
1 368 . 10 1 1 A 37 37 HIS H H 37 7.857 7.029 0.828 1
1 369 . 10 1 1 A 37 37 HIS HA H 37 4.878 5.258 -0.380 1
1 374 . 10 1 1 A 37 37 HIS C C 37 171.103 172.310 -1.207 1
1 375 . 10 1 1 A 37 37 HIS CA C 37 55.867 53.632 2.235 1
1 376 . 10 1 1 A 37 37 HIS CB C 37 32.655 33.460 -0.805 1
1 379 . 10 1 1 A 37 37 HIS N N 37 118.486 114.642 3.844 1
1 380 . 10 1 1 A 38 38 TYR H H 38 9.217 9.217 0.000 1
1 381 . 10 1 1 A 38 38 TYR HA H 38 5.303 5.151 0.152 1
1 388 . 10 1 1 A 38 38 TYR C C 38 173.922 174.654 -0.732 1
1 389 . 10 1 1 A 38 38 TYR CA C 38 56.504 56.424 0.080 1
1 390 . 10 1 1 A 38 38 TYR CB C 38 41.823 42.020 -0.197 1
1 395 . 10 1 1 A 38 38 TYR N N 38 114.077 118.089 -4.012 1
1 396 . 10 1 1 A 39 39 LEU H H 39 9.052 9.237 -0.185 1
1 397 . 10 1 1 A 39 39 LEU HA H 39 5.061 4.932 0.129 1
1 407 . 10 1 1 A 39 39 LEU C C 39 175.455 174.630 0.825 1
1 408 . 10 1 1 A 39 39 LEU CA C 39 53.855 54.090 -0.235 1
1 409 . 10 1 1 A 39 39 LEU CB C 39 45.254 43.416 1.838 1
1 413 . 10 1 1 A 39 39 LEU N N 39 123.997 125.928 -1.931 1
1 414 . 10 1 1 A 40 40 VAL H H 40 9.520 9.747 -0.227 1
1 415 . 10 1 1 A 40 40 VAL HA H 40 4.988 4.739 0.249 1
1 423 . 10 1 1 A 40 40 VAL C C 40 174.578 174.970 -0.392 1
1 424 . 10 1 1 A 40 40 VAL CA C 40 60.575 61.260 -0.685 1
1 425 . 10 1 1 A 40 40 VAL CB C 40 33.284 32.589 0.695 1
1 428 . 10 1 1 A 40 40 VAL N N 40 129.678 129.169 0.509 1
1 429 . 10 1 1 A 41 41 ARG H H 41 9.096 8.929 0.167 1
1 430 . 10 1 1 A 41 41 ARG HA H 41 5.384 4.876 0.508 1
1 437 . 10 1 1 A 41 41 ARG C C 41 175.100 174.750 0.350 1
1 438 . 10 1 1 A 41 41 ARG CA C 41 54.297 55.611 -1.314 1
1 439 . 10 1 1 A 41 41 ARG CB C 41 33.003 31.113 1.890 1
1 442 . 10 1 1 A 41 41 ARG N N 41 126.332 126.923 -0.591 1
1 443 . 10 1 1 A 42 42 CYS H H 42 9.004 9.334 -0.330 1
1 444 . 10 1 1 A 42 42 CYS HA H 42 5.309 4.956 0.353 1
1 447 . 10 1 1 A 42 42 CYS C C 42 173.417 174.111 -0.694 1
1 448 . 10 1 1 A 42 42 CYS CA C 42 57.508 57.552 -0.044 1
1 449 . 10 1 1 A 42 42 CYS CB C 42 28.859 28.356 0.503 1
1 450 . 10 1 1 A 42 42 CYS N N 42 123.359 125.660 -2.301 1
1 451 . 10 1 1 A 43 43 SER H H 43 9.102 8.853 0.249 1
1 452 . 10 1 1 A 43 43 SER HA H 43 5.324 4.989 0.335 1
1 455 . 10 1 1 A 43 43 SER C C 43 171.429 171.578 -0.149 1
1 456 . 10 1 1 A 43 43 SER CA C 43 55.621 55.677 -0.056 1
1 457 . 10 1 1 A 43 43 SER CB C 43 64.856 65.367 -0.511 1
1 458 . 10 1 1 A 43 43 SER N N 43 125.444 123.227 2.217 1
1 459 . 10 1 1 A 44 44 PRO HA H 44 4.389 4.567 -0.178 1
1 466 . 10 1 1 A 44 44 PRO C C 44 176.559 177.096 -0.537 1
1 467 . 10 1 1 A 44 44 PRO CA C 44 63.027 63.175 -0.148 1
1 468 . 10 1 1 A 44 44 PRO CB C 44 31.935 32.854 -0.919 1
1 471 . 10 1 1 A 45 45 ALA H H 45 8.261 8.252 0.009 1
1 472 . 10 1 1 A 45 45 ALA HA H 45 4.157 4.088 0.069 1
1 476 . 10 1 1 A 45 45 ALA C C 45 177.706 177.785 -0.079 1
1 477 . 10 1 1 A 45 45 ALA CA C 45 53.284 54.683 -1.399 1
1 478 . 10 1 1 A 45 45 ALA CB C 45 18.978 19.176 -0.198 1
1 479 . 10 1 1 A 45 45 ALA N N 45 126.162 123.962 2.200 1
1 480 . 10 1 1 A 46 46 SER H H 46 8.275 7.834 0.441 1
1 481 . 10 1 1 A 46 46 SER HA H 46 4.779 4.516 0.263 1
1 484 . 10 1 1 A 46 46 SER C C 46 172.182 173.939 -1.757 1
1 485 . 10 1 1 A 46 46 SER CA C 46 55.091 56.971 -1.880 1
1 486 . 10 1 1 A 46 46 SER CB C 46 63.130 63.009 0.121 1
1 487 . 10 1 1 A 46 46 SER N N 46 113.009 114.206 -1.197 1
1 488 . 10 1 1 A 47 47 PRO HA H 47 4.336 4.601 -0.265 1
1 493 . 10 1 1 A 47 47 PRO C C 47 177.165 176.203 0.962 1
1 494 . 10 1 1 A 47 47 PRO CA C 47 63.268 63.811 -0.543 1
1 495 . 10 1 1 A 47 47 PRO CB C 47 32.528 31.571 0.957 1
1 498 . 10 1 1 A 48 48 LYS H H 48 9.089 7.676 1.413 1
1 499 . 10 1 1 A 48 48 LYS HA H 48 4.408 4.354 0.054 1
1 508 . 10 1 1 A 48 48 LYS C C 48 176.917 175.794 1.123 1
1 509 . 10 1 1 A 48 48 LYS CA C 48 55.893 56.517 -0.624 1
1 510 . 10 1 1 A 48 48 LYS CB C 48 32.997 32.381 0.616 1
1 514 . 10 1 1 A 48 48 LYS N N 48 122.579 118.412 4.167 1
1 515 . 10 1 1 A 49 49 GLY HA2 H 49 4.021 4.099 -0.078 1
1 516 . 10 1 1 A 49 49 GLY HA3 H 49 3.881 4.102 -0.221 1
1 517 . 10 1 1 A 49 49 GLY C C 49 174.552 174.435 0.117 1
1 518 . 10 1 1 A 49 49 GLY CA C 49 46.011 45.655 0.356 1
1 519 . 10 1 1 A 50 50 GLU H H 50 8.608 8.982 -0.374 1
1 520 . 10 1 1 A 50 50 GLU HA H 50 4.335 4.112 0.223 1
1 525 . 10 1 1 A 50 50 GLU C C 50 176.672 176.960 -0.288 1
1 526 . 10 1 1 A 50 50 GLU CA C 50 56.978 59.343 -2.365 1
1 527 . 10 1 1 A 50 50 GLU CB C 50 29.458 29.032 0.426 1
1 529 . 10 1 1 A 50 50 GLU N N 50 121.378 123.377 -1.999 1
1 530 . 10 1 1 A 51 51 GLU H H 51 8.287 7.582 0.705 1
1 531 . 10 1 1 A 51 51 GLU HA H 51 4.381 4.376 0.005 1
1 536 . 10 1 1 A 51 51 GLU C C 51 176.218 176.297 -0.079 1
1 537 . 10 1 1 A 51 51 GLU CA C 51 56.996 56.390 0.606 1
1 538 . 10 1 1 A 51 51 GLU CB C 51 31.066 30.130 0.936 1
1 540 . 10 1 1 A 51 51 GLU N N 51 120.863 120.346 0.517 1
1 541 . 10 1 1 A 52 52 GLU H H 52 8.445 8.382 0.063 1
1 542 . 10 1 1 A 52 52 GLU HA H 52 4.464 4.406 0.058 1
1 547 . 10 1 1 A 52 52 GLU C C 52 176.128 176.398 -0.270 1
1 548 . 10 1 1 A 52 52 GLU CA C 52 55.955 55.427 0.528 1
1 549 . 10 1 1 A 52 52 GLU CB C 52 31.691 30.651 1.040 1
1 551 . 10 1 1 A 52 52 GLU N N 52 121.103 119.729 1.374 1
1 552 . 10 1 1 A 53 53 GLU H H 53 8.441 8.618 -0.177 1
1 553 . 10 1 1 A 53 53 GLU HA H 53 4.609 4.425 0.184 1
1 558 . 10 1 1 A 53 53 GLU C C 53 175.816 175.627 0.189 1
1 559 . 10 1 1 A 53 53 GLU CA C 53 56.697 56.871 -0.174 1
1 560 . 10 1 1 A 53 53 GLU CB C 53 31.022 30.256 0.766 1
1 562 . 10 1 1 A 53 53 GLU N N 53 121.949 121.493 0.456 1
1 563 . 10 1 1 A 54 54 ARG H H 54 8.569 8.478 0.091 1
1 564 . 10 1 1 A 54 54 ARG HA H 54 4.768 5.153 -0.385 1
1 571 . 10 1 1 A 54 54 ARG C C 54 174.881 175.031 -0.150 1
1 572 . 10 1 1 A 54 54 ARG CA C 54 54.950 54.340 0.610 1
1 573 . 10 1 1 A 54 54 ARG CB C 54 33.374 33.078 0.296 1
1 576 . 10 1 1 A 54 54 ARG N N 54 123.714 123.014 0.700 1
1 577 . 10 1 1 A 55 55 GLU H H 55 8.650 9.104 -0.454 1
1 578 . 10 1 1 A 55 55 GLU HA H 55 5.493 5.352 0.141 1
1 583 . 10 1 1 A 55 55 GLU C C 55 175.566 174.947 0.619 1
1 584 . 10 1 1 A 55 55 GLU CA C 55 54.915 54.747 0.168 1
1 585 . 10 1 1 A 55 55 GLU CB C 55 33.250 33.449 -0.199 1
1 587 . 10 1 1 A 55 55 GLU N N 55 123.537 122.490 1.047 1
1 588 . 10 1 1 A 56 56 VAL H H 56 9.419 8.723 0.696 1
1 589 . 10 1 1 A 56 56 VAL HA H 56 4.524 4.890 -0.366 1
1 597 . 10 1 1 A 56 56 VAL C C 56 173.502 174.386 -0.884 1
1 598 . 10 1 1 A 56 56 VAL CA C 56 60.981 58.876 2.105 1
1 599 . 10 1 1 A 56 56 VAL CB C 56 36.117 36.011 0.106 1
1 602 . 10 1 1 A 56 56 VAL N N 56 123.343 118.329 5.014 1
1 603 . 10 1 1 A 57 57 GLN H H 57 8.767 8.727 0.040 1
1 604 . 10 1 1 A 57 57 GLN HA H 57 5.671 5.356 0.315 1
1 611 . 10 1 1 A 57 57 GLN C C 57 176.357 175.092 1.265 1
1 612 . 10 1 1 A 57 57 GLN CA C 57 54.735 54.187 0.548 1
1 613 . 10 1 1 A 57 57 GLN CB C 57 30.781 31.891 -1.110 1
1 615 . 10 1 1 A 57 57 GLN N N 57 125.639 120.888 4.751 1
1 617 . 10 1 1 A 58 58 VAL H H 58 9.217 8.748 0.469 1
1 618 . 10 1 1 A 58 58 VAL HA H 58 5.129 4.824 0.305 1
1 626 . 10 1 1 A 58 58 VAL C C 58 175.925 176.236 -0.311 1
1 627 . 10 1 1 A 58 58 VAL CA C 58 59.652 59.824 -0.172 1
1 628 . 10 1 1 A 58 58 VAL CB C 58 36.540 35.387 1.153 1
1 631 . 10 1 1 A 58 58 VAL N N 58 117.022 118.403 -1.381 1
1 632 . 10 1 1 A 59 59 GLY H H 59 9.008 8.932 0.076 1
1 633 . 10 1 1 A 59 59 GLY HA2 H 59 4.670 3.949 0.721 1
1 634 . 10 1 1 A 59 59 GLY HA3 H 59 3.914 4.010 -0.096 1
1 635 . 10 1 1 A 59 59 GLY C C 59 173.386 174.401 -1.015 1
1 636 . 10 1 1 A 59 59 GLY CA C 59 45.093 47.102 -2.009 1
1 637 . 10 1 1 A 59 59 GLY N N 59 109.174 111.245 -2.071 1
1 638 . 10 1 1 A 60 60 ARG H H 60 7.695 7.862 -0.167 1
1 639 . 10 1 1 A 60 60 ARG HA H 60 4.866 4.786 0.080 1
1 645 . 10 1 1 A 60 60 ARG C C 60 173.760 175.908 -2.148 1
1 646 . 10 1 1 A 60 60 ARG CA C 60 52.764 53.362 -0.598 1
1 647 . 10 1 1 A 60 60 ARG CB C 60 31.785 30.809 0.976 1
1 650 . 10 1 1 A 60 60 ARG N N 60 118.520 119.920 -1.400 1
1 651 . 10 1 1 A 61 61 PRO HA H 61 3.539 3.695 -0.156 1
1 658 . 10 1 1 A 61 61 PRO C C 61 173.175 173.968 -0.793 1
1 659 . 10 1 1 A 61 61 PRO CA C 61 62.265 62.854 -0.589 1
1 660 . 10 1 1 A 61 61 PRO CB C 61 27.546 30.713 -3.167 1
1 663 . 10 1 1 A 62 62 GLU H H 62 7.879 7.875 0.004 1
1 664 . 10 1 1 A 62 62 GLU HA H 62 4.071 4.652 -0.581 1
1 669 . 10 1 1 A 62 62 GLU C C 62 174.107 174.728 -0.621 1
1 670 . 10 1 1 A 62 62 GLU CA C 62 55.229 55.066 0.163 1
1 671 . 10 1 1 A 62 62 GLU CB C 62 32.838 30.970 1.868 1
1 673 . 10 1 1 A 62 62 GLU N N 62 118.173 114.946 3.227 1
1 674 . 10 1 1 A 63 63 VAL H H 63 8.930 8.642 0.288 1
1 675 . 10 1 1 A 63 63 VAL HA H 63 4.548 5.095 -0.547 1
1 683 . 10 1 1 A 63 63 VAL C C 63 170.325 173.584 -3.259 1
1 684 . 10 1 1 A 63 63 VAL CA C 63 60.770 59.462 1.308 1
1 685 . 10 1 1 A 63 63 VAL CB C 63 35.394 34.795 0.599 1
1 688 . 10 1 1 A 63 63 VAL N N 63 117.161 125.528 -8.367 1
1 689 . 10 1 1 A 64 64 LEU H H 64 8.332 8.759 -0.427 1
1 690 . 10 1 1 A 64 64 LEU HA H 64 5.122 5.031 0.091 1
1 700 . 10 1 1 A 64 64 LEU C C 64 176.243 175.057 1.186 1
1 701 . 10 1 1 A 64 64 LEU CA C 64 53.346 53.677 -0.331 1
1 702 . 10 1 1 A 64 64 LEU CB C 64 42.649 44.493 -1.844 1
1 706 . 10 1 1 A 64 64 LEU N N 64 130.510 128.747 1.763 1
1 707 . 10 1 1 A 65 65 LEU H H 65 9.261 9.394 -0.133 1
1 708 . 10 1 1 A 65 65 LEU HA H 65 4.443 4.590 -0.147 1
1 718 . 10 1 1 A 65 65 LEU C C 65 174.016 176.196 -2.180 1
1 719 . 10 1 1 A 65 65 LEU CA C 65 53.920 54.077 -0.157 1
1 720 . 10 1 1 A 65 65 LEU CB C 65 42.976 42.788 0.188 1
1 724 . 10 1 1 A 65 65 LEU N N 65 128.611 128.633 -0.022 1
1 725 . 10 1 1 A 66 66 ASP H H 66 8.105 8.511 -0.406 1
1 726 . 10 1 1 A 66 66 ASP HA H 66 5.207 5.026 0.181 1
1 729 . 10 1 1 A 66 66 ASP C C 66 176.161 175.775 0.386 1
1 730 . 10 1 1 A 66 66 ASP CA C 66 51.001 51.927 -0.926 1
1 731 . 10 1 1 A 66 66 ASP CB C 66 42.836 43.100 -0.264 1
1 732 . 10 1 1 A 66 66 ASP N N 66 121.799 123.326 -1.527 1
1 733 . 10 1 1 A 67 67 GLY H H 67 8.688 8.834 -0.146 1
1 734 . 10 1 1 A 67 67 GLY HA2 H 67 3.923 3.851 0.072 1
1 735 . 10 1 1 A 67 67 GLY HA3 H 67 3.808 3.859 -0.051 1
1 736 . 10 1 1 A 67 67 GLY C C 67 175.500 174.117 1.383 1
1 737 . 10 1 1 A 67 67 GLY CA C 67 46.591 46.949 -0.358 1
1 738 . 10 1 1 A 67 67 GLY N N 67 106.518 109.645 -3.127 1
1 739 . 10 1 1 A 68 68 LEU H H 68 8.125 7.111 1.014 1
1 740 . 10 1 1 A 68 68 LEU HA H 68 4.252 4.826 -0.574 1
1 750 . 10 1 1 A 68 68 LEU C C 68 174.914 175.301 -0.387 1
1 751 . 10 1 1 A 68 68 LEU CA C 68 53.469 53.095 0.374 1
1 752 . 10 1 1 A 68 68 LEU CB C 68 40.422 45.724 -5.302 1
1 756 . 10 1 1 A 68 68 LEU N N 68 119.345 119.838 -0.493 1
1 757 . 10 1 1 A 69 69 GLU H H 69 8.207 8.367 -0.160 1
1 758 . 10 1 1 A 69 69 GLU HA H 69 4.908 4.854 0.054 1
1 763 . 10 1 1 A 69 69 GLU C C 69 174.464 174.218 0.246 1
1 764 . 10 1 1 A 69 69 GLU CA C 69 53.081 53.121 -0.040 1
1 765 . 10 1 1 A 69 69 GLU CB C 69 31.538 30.690 0.848 1
1 767 . 10 1 1 A 69 69 GLU N N 69 119.486 121.328 -1.842 1
1 768 . 10 1 1 A 70 70 PRO HA H 70 4.866 4.341 0.525 1
1 775 . 10 1 1 A 70 70 PRO C C 70 178.285 177.511 0.774 1
1 776 . 10 1 1 A 70 70 PRO CA C 70 63.203 63.627 -0.424 1
1 777 . 10 1 1 A 70 70 PRO CB C 70 33.726 31.806 1.920 1
1 780 . 10 1 1 A 71 71 GLY H H 71 7.362 8.586 -1.224 1
1 781 . 10 1 1 A 71 71 GLY HA2 H 71 3.807 3.949 -0.142 1
1 782 . 10 1 1 A 71 71 GLY HA3 H 71 3.756 3.951 -0.195 1
1 783 . 10 1 1 A 71 71 GLY C C 71 174.664 173.851 0.813 1
1 784 . 10 1 1 A 71 71 GLY CA C 71 46.926 46.220 0.706 1
1 785 . 10 1 1 A 71 71 GLY N N 71 113.776 111.529 2.247 1
1 786 . 10 1 1 A 72 72 ARG H H 72 8.036 7.180 0.856 1
1 787 . 10 1 1 A 72 72 ARG HA H 72 4.597 4.756 -0.159 1
1 793 . 10 1 1 A 72 72 ARG C C 72 173.293 173.812 -0.519 1
1 794 . 10 1 1 A 72 72 ARG CA C 72 54.633 54.494 0.139 1
1 795 . 10 1 1 A 72 72 ARG CB C 72 33.704 33.315 0.389 1
1 798 . 10 1 1 A 72 72 ARG N N 72 119.611 119.503 0.108 1
1 799 . 10 1 1 A 73 73 ASP H H 73 7.785 8.523 -0.738 1
1 800 . 10 1 1 A 73 73 ASP HA H 73 5.276 5.457 -0.181 1
1 803 . 10 1 1 A 73 73 ASP C C 73 175.904 175.055 0.849 1
1 804 . 10 1 1 A 73 73 ASP CA C 73 53.568 52.962 0.606 1
1 805 . 10 1 1 A 73 73 ASP CB C 73 42.970 42.534 0.436 1
1 806 . 10 1 1 A 73 73 ASP N N 73 118.900 125.638 -6.738 1
1 807 . 10 1 1 A 74 74 TYR H H 74 9.516 8.953 0.563 1
1 808 . 10 1 1 A 74 74 TYR HA H 74 4.800 5.016 -0.216 1
1 815 . 10 1 1 A 74 74 TYR C C 74 174.631 175.495 -0.864 1
1 816 . 10 1 1 A 74 74 TYR CA C 74 58.548 56.538 2.010 1
1 817 . 10 1 1 A 74 74 TYR CB C 74 42.029 40.593 1.436 1
1 822 . 10 1 1 A 74 74 TYR N N 74 121.903 121.143 0.760 1
1 823 . 10 1 1 A 75 75 GLU H H 75 9.248 9.219 0.029 1
1 824 . 10 1 1 A 75 75 GLU HA H 75 4.756 4.488 0.268 1
1 829 . 10 1 1 A 75 75 GLU C C 75 175.524 175.429 0.095 1
1 830 . 10 1 1 A 75 75 GLU CA C 75 55.621 56.051 -0.430 1
1 831 . 10 1 1 A 75 75 GLU CB C 75 30.778 28.194 2.584 1
1 833 . 10 1 1 A 75 75 GLU N N 75 122.425 125.298 -2.873 1
1 834 . 10 1 1 A 76 76 VAL H H 76 8.884 8.343 0.541 1
1 835 . 10 1 1 A 76 76 VAL HA H 76 5.246 4.566 0.680 1
1 843 . 10 1 1 A 76 76 VAL C C 76 174.800 174.956 -0.156 1
1 844 . 10 1 1 A 76 76 VAL CA C 76 60.199 62.766 -2.567 1
1 845 . 10 1 1 A 76 76 VAL CB C 76 33.449 31.666 1.783 1
1 848 . 10 1 1 A 76 76 VAL N N 76 126.853 124.534 2.319 1
1 849 . 10 1 1 A 77 77 SER H H 77 9.234 8.745 0.489 1
1 850 . 10 1 1 A 77 77 SER HA H 77 5.398 5.127 0.271 1
1 853 . 10 1 1 A 77 77 SER C C 77 173.138 173.790 -0.652 1
1 854 . 10 1 1 A 77 77 SER CA C 77 56.032 57.112 -1.080 1
1 855 . 10 1 1 A 77 77 SER CB C 77 66.374 64.539 1.835 1
1 856 . 10 1 1 A 77 77 SER N N 77 120.852 123.352 -2.500 1
1 857 . 10 1 1 A 78 78 VAL H H 78 9.092 8.695 0.397 1
1 858 . 10 1 1 A 78 78 VAL HA H 78 4.756 5.002 -0.246 1
1 866 . 10 1 1 A 78 78 VAL C C 78 173.641 174.659 -1.018 1
1 867 . 10 1 1 A 78 78 VAL CA C 78 61.246 60.008 1.238 1
1 868 . 10 1 1 A 78 78 VAL CB C 78 34.467 34.319 0.148 1
1 871 . 10 1 1 A 78 78 VAL N N 78 122.453 125.817 -3.364 1
1 872 . 10 1 1 A 79 79 GLN H H 79 8.587 8.267 0.320 1
1 873 . 10 1 1 A 79 79 GLN HA H 79 4.438 4.565 -0.127 1
1 880 . 10 1 1 A 79 79 GLN C C 79 174.999 174.453 0.546 1
1 881 . 10 1 1 A 79 79 GLN CA C 79 54.227 55.193 -0.966 1
1 882 . 10 1 1 A 79 79 GLN CB C 79 33.587 32.465 1.122 1
1 884 . 10 1 1 A 79 79 GLN N N 79 125.619 125.785 -0.166 1
1 886 . 10 1 1 A 80 80 SER H H 80 8.623 8.485 0.138 1
1 887 . 10 1 1 A 80 80 SER HA H 80 4.756 4.676 0.080 1
1 890 . 10 1 1 A 80 80 SER C C 80 172.264 173.853 -1.589 1
1 891 . 10 1 1 A 80 80 SER CA C 80 58.177 57.661 0.516 1
1 892 . 10 1 1 A 80 80 SER CB C 80 63.920 63.644 0.276 1
1 893 . 10 1 1 A 80 80 SER N N 80 122.844 120.216 2.628 1
1 894 . 10 1 1 A 81 81 LEU H H 81 8.348 8.990 -0.642 1
1 895 . 10 1 1 A 81 81 LEU HA H 81 5.124 4.721 0.403 1
1 905 . 10 1 1 A 81 81 LEU C C 81 175.775 175.794 -0.019 1
1 906 . 10 1 1 A 81 81 LEU CA C 81 54.033 53.080 0.953 1
1 907 . 10 1 1 A 81 81 LEU CB C 81 44.690 42.638 2.052 1
1 911 . 10 1 1 A 81 81 LEU N N 81 123.191 125.725 -2.534 1
1 912 . 10 1 1 A 82 82 ARG H H 82 8.374 8.030 0.344 1
1 913 . 10 1 1 A 82 82 ARG HA H 82 4.616 4.477 0.139 1
1 919 . 10 1 1 A 82 82 ARG C C 82 176.864 175.614 1.250 1
1 920 . 10 1 1 A 82 82 ARG CA C 82 55.868 54.827 1.041 1
1 921 . 10 1 1 A 82 82 ARG CB C 82 32.322 31.189 1.133 1
1 924 . 10 1 1 A 82 82 ARG N N 82 121.029 125.254 -4.225 1
1 925 . 10 1 1 A 83 83 GLY H H 83 8.309 7.286 1.023 1
1 926 . 10 1 1 A 83 83 GLY HA2 H 83 4.031 4.093 -0.062 1
1 927 . 10 1 1 A 83 83 GLY HA3 H 83 3.888 4.118 -0.230 1
1 928 . 10 1 1 A 83 83 GLY C C 83 174.562 173.943 0.619 1
1 929 . 10 1 1 A 83 83 GLY CA C 83 45.963 44.669 1.294 1
1 930 . 10 1 1 A 83 83 GLY N N 83 109.937 108.249 1.688 1
1 931 . 10 1 1 A 84 84 PRO HA H 84 4.573 4.503 0.070 1
1 938 . 10 1 1 A 84 84 PRO C C 84 176.533 175.654 0.879 1
1 939 . 10 1 1 A 84 84 PRO CA C 84 63.485 64.039 -0.554 1
1 940 . 10 1 1 A 84 84 PRO CB C 84 32.409 31.989 0.420 1
1 943 . 10 1 1 A 85 85 GLU H H 85 7.799 7.581 0.218 1
1 944 . 10 1 1 A 85 85 GLU HA H 85 4.369 4.900 -0.531 1
1 949 . 10 1 1 A 85 85 GLU C C 85 174.722 175.654 -0.932 1
1 950 . 10 1 1 A 85 85 GLU CA C 85 55.899 54.789 1.110 1
1 951 . 10 1 1 A 85 85 GLU CB C 85 31.911 33.040 -1.129 1
1 953 . 10 1 1 A 85 85 GLU N N 85 122.093 112.962 9.131 1
1 954 . 10 1 1 A 86 86 GLY H H 86 8.329 8.859 -0.530 1
1 955 . 10 1 1 A 86 86 GLY HA2 H 86 5.298 4.286 1.012 1
1 956 . 10 1 1 A 86 86 GLY HA3 H 86 3.559 4.304 -0.745 1
1 957 . 10 1 1 A 86 86 GLY C C 86 174.355 173.518 0.837 1
1 958 . 10 1 1 A 86 86 GLY CA C 86 44.034 43.747 0.287 1
1 959 . 10 1 1 A 86 86 GLY N N 86 109.387 109.211 0.176 1
1 960 . 10 1 1 A 87 87 SER H H 87 8.807 8.762 0.045 1
1 961 . 10 1 1 A 87 87 SER HA H 87 4.670 4.565 0.105 1
1 964 . 10 1 1 A 87 87 SER C C 87 175.195 174.010 1.185 1
1 965 . 10 1 1 A 87 87 SER CA C 87 57.737 58.288 -0.551 1
1 966 . 10 1 1 A 87 87 SER CB C 87 67.829 65.122 2.707 1
1 967 . 10 1 1 A 87 87 SER N N 87 117.698 113.489 4.209 1
1 968 . 10 1 1 A 88 88 GLU H H 88 8.754 8.714 0.040 1
1 969 . 10 1 1 A 88 88 GLU HA H 88 4.357 4.366 -0.009 1
1 974 . 10 1 1 A 88 88 GLU C C 88 177.474 176.905 0.569 1
1 975 . 10 1 1 A 88 88 GLU CA C 88 57.525 56.511 1.014 1
1 976 . 10 1 1 A 88 88 GLU CB C 88 31.162 30.548 0.614 1
1 978 . 10 1 1 A 88 88 GLU N N 88 118.709 120.954 -2.245 1
1 979 . 10 1 1 A 89 89 ALA H H 89 8.855 8.339 0.516 1
1 980 . 10 1 1 A 89 89 ALA HA H 89 4.792 4.425 0.367 1
1 984 . 10 1 1 A 89 89 ALA C C 89 178.379 177.082 1.297 1
1 985 . 10 1 1 A 89 89 ALA CA C 89 51.264 52.253 -0.989 1
1 986 . 10 1 1 A 89 89 ALA CB C 89 20.040 19.273 0.767 1
1 987 . 10 1 1 A 89 89 ALA N N 89 127.301 124.646 2.655 1
1 988 . 10 1 1 A 90 90 ARG H H 90 8.549 8.778 -0.229 1
1 989 . 10 1 1 A 90 90 ARG HA H 90 4.658 4.935 -0.277 1
1 996 . 10 1 1 A 90 90 ARG C C 90 174.720 175.520 -0.800 1
1 997 . 10 1 1 A 90 90 ARG CA C 90 53.575 54.453 -0.878 1
1 998 . 10 1 1 A 90 90 ARG CB C 90 33.456 31.758 1.698 1
1 1001 . 10 1 1 A 90 90 ARG N N 90 121.289 123.661 -2.372 1
1 1002 . 10 1 1 A 91 91 GLY H H 91 8.396 9.104 -0.708 1
1 1003 . 10 1 1 A 91 91 GLY HA2 H 91 5.306 4.164 1.142 1
1 1004 . 10 1 1 A 91 91 GLY HA3 H 91 3.700 4.193 -0.493 1
1 1005 . 10 1 1 A 91 91 GLY C C 91 173.191 172.016 1.175 1
1 1006 . 10 1 1 A 91 91 GLY CA C 91 44.493 44.152 0.341 1
1 1007 . 10 1 1 A 91 91 GLY N N 91 108.579 111.816 -3.237 1
1 1008 . 10 1 1 A 92 92 ILE H H 92 8.891 8.357 0.534 1
1 1009 . 10 1 1 A 92 92 ILE HA H 92 4.499 4.916 -0.417 1
1 1019 . 10 1 1 A 92 92 ILE C C 92 171.877 174.046 -2.169 1
1 1020 . 10 1 1 A 92 92 ILE CA C 92 60.682 59.237 1.445 1
1 1021 . 10 1 1 A 92 92 ILE CB C 92 42.425 42.208 0.217 1
1 1025 . 10 1 1 A 92 92 ILE N N 92 118.313 121.585 -3.272 1
1 1026 . 10 1 1 A 93 93 ARG H H 93 7.980 8.504 -0.524 1
1 1027 . 10 1 1 A 93 93 ARG HA H 93 5.224 4.308 0.916 1
1 1034 . 10 1 1 A 93 93 ARG C C 93 175.072 175.176 -0.104 1
1 1035 . 10 1 1 A 93 93 ARG CA C 93 54.499 56.881 -2.382 1
1 1036 . 10 1 1 A 93 93 ARG CB C 93 31.767 30.653 1.114 1
1 1039 . 10 1 1 A 93 93 ARG N N 93 124.879 129.840 -4.961 1
1 1040 . 10 1 1 A 94 94 ALA H H 94 9.064 8.809 0.255 1
1 1041 . 10 1 1 A 94 94 ALA HA H 94 4.731 5.085 -0.354 1
1 1045 . 10 1 1 A 94 94 ALA C C 94 174.494 177.055 -2.561 1
1 1046 . 10 1 1 A 94 94 ALA CA C 94 50.577 50.799 -0.222 1
1 1047 . 10 1 1 A 94 94 ALA CB C 94 23.082 20.550 2.532 1
1 1048 . 10 1 1 A 94 94 ALA N N 94 126.095 129.775 -3.680 1
1 1049 . 10 1 1 A 95 95 ARG H H 95 8.263 9.062 -0.799 1
1 1050 . 10 1 1 A 95 95 ARG HA H 95 5.548 5.248 0.300 1
1 1058 . 10 1 1 A 95 95 ARG C C 95 176.901 175.162 1.739 1
1 1059 . 10 1 1 A 95 95 ARG CA C 95 53.787 54.175 -0.388 1
1 1060 . 10 1 1 A 95 95 ARG CB C 95 32.426 34.223 -1.797 1
1 1063 . 10 1 1 A 95 95 ARG N N 95 123.374 120.759 2.615 1
1 1065 . 10 1 1 A 96 96 THR H H 96 9.208 8.887 0.321 1
1 1066 . 10 1 1 A 96 96 THR HA H 96 4.461 5.064 -0.603 1
1 1071 . 10 1 1 A 96 96 THR CA C 96 58.248 58.285 -0.037 1
1 1072 . 10 1 1 A 96 96 THR CB C 96 68.466 71.070 -2.604 1
1 1074 . 10 1 1 A 96 96 THR N N 96 119.492 111.516 7.976 1
1 1075 . 10 1 1 A 97 97 PRO HA H 97 4.636 4.612 0.024 1
1 1082 . 10 1 1 A 97 97 PRO C C 97 175.725 175.910 -0.185 1
1 1083 . 10 1 1 A 97 97 PRO CA C 97 61.907 62.324 -0.417 1
1 1084 . 10 1 1 A 97 97 PRO CB C 97 32.590 33.427 -0.837 1
1 1087 . 10 1 1 A 98 98 THR H H 98 7.943 8.229 -0.286 1
1 1088 . 10 1 1 A 98 98 THR HA H 98 4.208 5.085 -0.877 1
1 1093 . 10 1 1 A 98 98 THR C C 98 175.058 174.758 0.300 1
1 1094 . 10 1 1 A 98 98 THR CA C 98 62.069 60.519 1.550 1
1 1095 . 10 1 1 A 98 98 THR CB C 98 69.719 70.481 -0.762 1
1 1097 . 10 1 1 A 98 98 THR N N 98 107.148 112.003 -4.855 1
1 1098 . 10 1 1 A 99 99 SER H H 99 8.163 8.910 -0.747 1
1 1099 . 10 1 1 A 99 99 SER HA H 99 4.524 4.212 0.312 1
1 1102 . 10 1 1 A 99 99 SER C C 99 174.319 175.895 -1.576 1
1 1103 . 10 1 1 A 99 99 SER CA C 99 58.107 61.474 -3.367 1
1 1104 . 10 1 1 A 99 99 SER CB C 99 64.492 63.253 1.239 1
1 1105 . 10 1 1 A 99 99 SER N N 99 115.114 119.538 -4.424 1
1 1106 . 10 1 1 A 100 100 GLY H H 100 8.336 7.807 0.529 1
1 1107 . 10 1 1 A 100 100 GLY HA2 H 100 4.222 4.064 0.158 1
1 1108 . 10 1 1 A 100 100 GLY HA3 H 100 4.222 4.065 0.157 1
1 1109 . 10 1 1 A 100 100 GLY C C 100 171.696 173.078 -1.382 1
1 1110 . 10 1 1 A 100 100 GLY CA C 100 44.617 44.983 -0.366 1
1 1111 . 10 1 1 A 100 100 GLY N N 100 110.678 109.106 1.572 1
1 1112 . 10 1 1 A 101 101 PRO HA H 101 4.506 4.751 -0.245 1
1 1118 . 10 1 1 A 101 101 PRO CA C 101 63.358 62.924 0.434 1
1 1119 . 10 1 1 A 101 101 PRO CB C 101 32.313 31.687 0.626 1
1 1 . 11 1 1 A 6 6 SER HA H 6 4.528 5.269 -0.741 1
1 3 . 11 1 1 A 6 6 SER CA C 6 58.373 56.764 1.609 1
1 4 . 11 1 1 A 6 6 SER CB C 6 63.978 66.134 -2.156 1
1 5 . 11 1 1 A 7 7 GLY H H 7 8.228 8.624 -0.396 1
1 6 . 11 1 1 A 7 7 GLY HA2 H 7 4.134 4.031 0.103 1
1 7 . 11 1 1 A 7 7 GLY HA3 H 7 4.134 4.032 0.102 1
1 8 . 11 1 1 A 7 7 GLY CA C 7 44.607 44.303 0.304 1
1 9 . 11 1 1 A 7 7 GLY N N 7 110.638 109.091 1.547 1
1 10 . 11 1 1 A 8 8 PRO HA H 8 4.419 4.642 -0.223 1
1 17 . 11 1 1 A 8 8 PRO C C 8 176.908 175.641 1.267 1
1 18 . 11 1 1 A 8 8 PRO CA C 8 62.851 62.890 -0.039 1
1 19 . 11 1 1 A 8 8 PRO CB C 8 32.243 31.684 0.559 1
1 22 . 11 1 1 A 9 9 LEU H H 9 8.462 8.591 -0.129 1
1 23 . 11 1 1 A 9 9 LEU HA H 9 4.494 4.958 -0.464 1
1 33 . 11 1 1 A 9 9 LEU C C 9 174.124 174.798 -0.674 1
1 34 . 11 1 1 A 9 9 LEU CA C 9 52.587 51.624 0.963 1
1 35 . 11 1 1 A 9 9 LEU CB C 9 43.150 43.092 0.058 1
1 39 . 11 1 1 A 9 9 LEU N N 9 126.015 123.615 2.400 1
1 40 . 11 1 1 A 10 10 PRO HA H 10 4.820 4.606 0.214 1
1 47 . 11 1 1 A 10 10 PRO CA C 10 61.368 62.417 -1.049 1
1 48 . 11 1 1 A 10 10 PRO CB C 10 31.391 31.697 -0.306 1
1 51 . 11 1 1 A 11 11 PRO HA H 11 4.949 4.613 0.336 1
1 58 . 11 1 1 A 11 11 PRO CA C 11 61.183 61.827 -0.644 1
1 59 . 11 1 1 A 11 11 PRO CB C 11 30.656 31.936 -1.280 1
1 62 . 11 1 1 A 12 12 PRO HA H 12 4.341 4.623 -0.282 1
1 69 . 11 1 1 A 12 12 PRO C C 12 174.849 176.902 -2.053 1
1 70 . 11 1 1 A 12 12 PRO CA C 12 63.062 62.621 0.441 1
1 71 . 11 1 1 A 12 12 PRO CB C 12 31.831 31.724 0.107 1
1 74 . 11 1 1 A 13 13 ARG H H 13 7.828 8.353 -0.525 1
1 75 . 11 1 1 A 13 13 ARG HA H 13 4.536 4.445 0.091 1
1 82 . 11 1 1 A 13 13 ARG C C 13 174.608 176.105 -1.497 1
1 83 . 11 1 1 A 13 13 ARG CA C 13 54.774 56.835 -2.061 1
1 84 . 11 1 1 A 13 13 ARG CB C 13 33.250 31.712 1.538 1
1 87 . 11 1 1 A 13 13 ARG N N 13 120.532 118.981 1.551 1
1 88 . 11 1 1 A 14 14 ALA H H 14 8.694 7.847 0.847 1
1 89 . 11 1 1 A 14 14 ALA HA H 14 3.986 4.378 -0.392 1
1 93 . 11 1 1 A 14 14 ALA C C 14 177.232 176.577 0.655 1
1 94 . 11 1 1 A 14 14 ALA CA C 14 52.461 51.706 0.755 1
1 95 . 11 1 1 A 14 14 ALA CB C 14 16.806 17.223 -0.417 1
1 96 . 11 1 1 A 14 14 ALA N N 14 121.921 121.119 0.802 1
1 97 . 11 1 1 A 15 15 LEU H H 15 8.097 8.475 -0.378 1
1 98 . 11 1 1 A 15 15 LEU HA H 15 4.670 4.687 -0.017 1
1 108 . 11 1 1 A 15 15 LEU C C 15 177.364 175.685 1.679 1
1 109 . 11 1 1 A 15 15 LEU CA C 15 57.543 54.731 2.812 1
1 110 . 11 1 1 A 15 15 LEU CB C 15 41.877 40.903 0.974 1
1 114 . 11 1 1 A 15 15 LEU N N 15 122.215 121.456 0.759 1
1 115 . 11 1 1 A 16 16 THR H H 16 9.520 8.985 0.535 1
1 116 . 11 1 1 A 16 16 THR HA H 16 4.369 4.801 -0.432 1
1 121 . 11 1 1 A 16 16 THR C C 16 172.453 173.829 -1.376 1
1 122 . 11 1 1 A 16 16 THR CA C 16 62.480 61.533 0.947 1
1 123 . 11 1 1 A 16 16 THR CB C 16 72.198 70.862 1.336 1
1 125 . 11 1 1 A 16 16 THR N N 16 122.214 120.820 1.394 1
1 126 . 11 1 1 A 17 17 LEU H H 17 8.847 8.697 0.150 1
1 127 . 11 1 1 A 17 17 LEU HA H 17 4.573 4.438 0.135 1
1 137 . 11 1 1 A 17 17 LEU C C 17 174.695 176.248 -1.553 1
1 138 . 11 1 1 A 17 17 LEU CA C 17 53.840 55.579 -1.739 1
1 139 . 11 1 1 A 17 17 LEU CB C 17 40.290 42.949 -2.659 1
1 143 . 11 1 1 A 17 17 LEU N N 17 127.415 128.013 -0.598 1
1 144 . 11 1 1 A 18 18 ALA H H 18 8.647 8.423 0.224 1
1 145 . 11 1 1 A 18 18 ALA HA H 18 4.106 4.229 -0.123 1
1 149 . 11 1 1 A 18 18 ALA C C 18 178.236 177.041 1.195 1
1 150 . 11 1 1 A 18 18 ALA CA C 18 53.926 54.029 -0.103 1
1 151 . 11 1 1 A 18 18 ALA CB C 18 18.876 19.000 -0.124 1
1 152 . 11 1 1 A 18 18 ALA N N 18 133.362 128.298 5.064 1
1 153 . 11 1 1 A 19 19 ALA H H 19 7.772 7.107 0.665 1
1 154 . 11 1 1 A 19 19 ALA HA H 19 4.561 4.659 -0.098 1
1 158 . 11 1 1 A 19 19 ALA C C 19 176.032 174.803 1.229 1
1 159 . 11 1 1 A 19 19 ALA CA C 19 53.011 51.790 1.221 1
1 160 . 11 1 1 A 19 19 ALA CB C 19 21.869 22.612 -0.743 1
1 161 . 11 1 1 A 19 19 ALA N N 19 115.654 116.499 -0.845 1
1 162 . 11 1 1 A 20 20 VAL H H 20 8.697 8.831 -0.134 1
1 163 . 11 1 1 A 20 20 VAL HA H 20 4.951 4.701 0.250 1
1 171 . 11 1 1 A 20 20 VAL C C 20 174.314 174.255 0.059 1
1 172 . 11 1 1 A 20 20 VAL CA C 20 61.352 60.654 0.698 1
1 173 . 11 1 1 A 20 20 VAL CB C 20 35.394 32.828 2.566 1
1 176 . 11 1 1 A 20 20 VAL N N 20 120.848 123.346 -2.498 1
1 177 . 11 1 1 A 21 21 THR H H 21 9.198 8.407 0.791 1
1 178 . 11 1 1 A 21 21 THR HA H 21 4.941 4.756 0.185 1
1 183 . 11 1 1 A 21 21 THR C C 21 174.416 174.625 -0.209 1
1 184 . 11 1 1 A 21 21 THR CA C 21 60.347 58.947 1.400 1
1 185 . 11 1 1 A 21 21 THR CB C 21 68.713 71.800 -3.087 1
1 187 . 11 1 1 A 21 21 THR N N 21 120.326 125.285 -4.959 1
1 188 . 11 1 1 A 22 22 PRO HA H 22 4.634 4.554 0.080 1
1 194 . 11 1 1 A 22 22 PRO C C 22 173.606 177.328 -3.722 1
1 195 . 11 1 1 A 22 22 PRO CA C 22 66.519 64.317 2.202 1
1 196 . 11 1 1 A 22 22 PRO CB C 22 32.078 31.731 0.347 1
1 199 . 11 1 1 A 23 23 ARG H H 23 6.621 8.388 -1.767 1
1 200 . 11 1 1 A 23 23 ARG HA H 23 4.591 4.522 0.069 1
1 207 . 11 1 1 A 23 23 ARG C C 23 176.554 175.464 1.090 1
1 208 . 11 1 1 A 23 23 ARG CA C 23 53.892 55.857 -1.965 1
1 209 . 11 1 1 A 23 23 ARG CB C 23 33.498 31.805 1.693 1
1 212 . 11 1 1 A 23 23 ARG N N 23 102.938 115.828 -12.890 1
1 213 . 11 1 1 A 24 24 THR H H 24 7.352 7.773 -0.421 1
1 214 . 11 1 1 A 24 24 THR HA H 24 5.593 5.258 0.335 1
1 219 . 11 1 1 A 24 24 THR C C 24 172.345 172.139 0.206 1
1 220 . 11 1 1 A 24 24 THR CA C 24 59.311 60.955 -1.644 1
1 221 . 11 1 1 A 24 24 THR CB C 24 73.311 72.034 1.277 1
1 223 . 11 1 1 A 24 24 THR N N 24 108.792 109.629 -0.837 1
1 224 . 11 1 1 A 25 25 VAL H H 25 8.437 8.499 -0.062 1
1 225 . 11 1 1 A 25 25 VAL HA H 25 4.512 4.786 -0.274 1
1 233 . 11 1 1 A 25 25 VAL C C 25 172.854 174.006 -1.152 1
1 234 . 11 1 1 A 25 25 VAL CA C 25 61.617 61.106 0.511 1
1 235 . 11 1 1 A 25 25 VAL CB C 25 36.742 34.546 2.196 1
1 238 . 11 1 1 A 25 25 VAL N N 25 117.023 121.049 -4.026 1
1 239 . 11 1 1 A 26 26 HIS H H 26 8.915 8.695 0.220 1
1 240 . 11 1 1 A 26 26 HIS HA H 26 5.765 5.647 0.118 1
1 245 . 11 1 1 A 26 26 HIS C C 26 173.976 173.022 0.954 1
1 246 . 11 1 1 A 26 26 HIS CA C 26 52.896 53.653 -0.757 1
1 247 . 11 1 1 A 26 26 HIS CB C 26 34.004 32.785 1.219 1
1 250 . 11 1 1 A 26 26 HIS N N 26 128.155 127.860 0.295 1
1 251 . 11 1 1 A 27 27 LEU H H 27 9.034 9.327 -0.293 1
1 252 . 11 1 1 A 27 27 LEU HA H 27 5.505 5.318 0.187 1
1 262 . 11 1 1 A 27 27 LEU C C 27 174.821 174.996 -0.175 1
1 263 . 11 1 1 A 27 27 LEU CA C 27 53.376 53.381 -0.005 1
1 264 . 11 1 1 A 27 27 LEU CB C 27 46.306 46.806 -0.500 1
1 268 . 11 1 1 A 27 27 LEU N N 27 128.569 130.434 -1.865 1
1 269 . 11 1 1 A 28 28 THR H H 28 8.844 8.714 0.130 1
1 270 . 11 1 1 A 28 28 THR HA H 28 4.485 4.853 -0.368 1
1 275 . 11 1 1 A 28 28 THR C C 28 172.773 173.440 -0.667 1
1 276 . 11 1 1 A 28 28 THR CA C 28 60.052 60.178 -0.126 1
1 277 . 11 1 1 A 28 28 THR CB C 28 71.704 71.319 0.385 1
1 279 . 11 1 1 A 28 28 THR N N 28 112.165 113.336 -1.171 1
1 280 . 11 1 1 A 29 29 TRP H H 29 7.395 7.816 -0.421 1
1 281 . 11 1 1 A 29 29 TRP HA H 29 4.915 5.485 -0.570 1
1 290 . 11 1 1 A 29 29 TRP C C 29 174.013 174.852 -0.839 1
1 291 . 11 1 1 A 29 29 TRP CA C 29 56.626 54.397 2.229 1
1 292 . 11 1 1 A 29 29 TRP CB C 29 29.487 32.154 -2.667 1
1 298 . 11 1 1 A 29 29 TRP N N 29 115.623 120.046 -4.423 1
1 300 . 11 1 1 A 30 30 GLN H H 30 8.759 8.503 0.256 1
1 301 . 11 1 1 A 30 30 GLN HA H 30 4.641 4.743 -0.102 1
1 308 . 11 1 1 A 30 30 GLN C C 30 175.072 174.456 0.616 1
1 309 . 11 1 1 A 30 30 GLN CA C 30 52.975 53.324 -0.349 1
1 310 . 11 1 1 A 30 30 GLN CB C 30 28.398 28.798 -0.400 1
1 312 . 11 1 1 A 30 30 GLN N N 30 117.497 119.876 -2.379 1
1 314 . 11 1 1 A 31 31 PRO HA H 31 4.487 4.464 0.023 1
1 320 . 11 1 1 A 31 31 PRO C C 31 177.034 176.503 0.531 1
1 321 . 11 1 1 A 31 31 PRO CA C 31 62.710 62.889 -0.179 1
1 322 . 11 1 1 A 31 31 PRO CB C 31 32.738 32.453 0.285 1
1 325 . 11 1 1 A 32 32 SER H H 32 8.259 8.742 -0.483 1
1 326 . 11 1 1 A 32 32 SER HA H 32 4.670 4.730 -0.060 1
1 329 . 11 1 1 A 32 32 SER C C 32 174.689 174.002 0.687 1
1 330 . 11 1 1 A 32 32 SER CA C 32 57.296 57.831 -0.535 1
1 331 . 11 1 1 A 32 32 SER CB C 32 64.748 63.858 0.890 1
1 332 . 11 1 1 A 32 32 SER N N 32 117.667 117.612 0.055 1
1 333 . 11 1 1 A 33 33 ALA H H 33 9.038 8.593 0.445 1
1 334 . 11 1 1 A 33 33 ALA HA H 33 4.126 4.403 -0.277 1
1 338 . 11 1 1 A 33 33 ALA C C 33 177.795 178.002 -0.207 1
1 339 . 11 1 1 A 33 33 ALA CA C 33 54.213 52.751 1.462 1
1 340 . 11 1 1 A 33 33 ALA CB C 33 17.948 18.371 -0.423 1
1 341 . 11 1 1 A 33 33 ALA N N 33 131.772 128.984 2.788 1
1 342 . 11 1 1 A 34 34 GLY H H 34 8.576 8.395 0.181 1
1 343 . 11 1 1 A 34 34 GLY HA2 H 34 4.171 4.051 0.120 1
1 344 . 11 1 1 A 34 34 GLY HA3 H 34 3.592 4.055 -0.463 1
1 345 . 11 1 1 A 34 34 GLY C C 34 174.182 174.457 -0.275 1
1 346 . 11 1 1 A 34 34 GLY CA C 34 44.987 45.342 -0.355 1
1 347 . 11 1 1 A 34 34 GLY N N 34 111.339 110.646 0.693 1
1 348 . 11 1 1 A 35 35 ALA H H 35 7.637 7.823 -0.186 1
1 349 . 11 1 1 A 35 35 ALA HA H 35 4.210 4.376 -0.166 1
1 353 . 11 1 1 A 35 35 ALA C C 35 178.918 178.393 0.525 1
1 354 . 11 1 1 A 35 35 ALA CA C 35 52.671 52.538 0.133 1
1 355 . 11 1 1 A 35 35 ALA CB C 35 18.988 19.410 -0.422 1
1 356 . 11 1 1 A 35 35 ALA N N 35 121.531 123.395 -1.864 1
1 357 . 11 1 1 A 36 36 THR H H 36 9.428 8.194 1.234 1
1 358 . 11 1 1 A 36 36 THR HA H 36 4.402 4.129 0.273 1
1 363 . 11 1 1 A 36 36 THR C C 36 174.739 174.303 0.436 1
1 364 . 11 1 1 A 36 36 THR CA C 36 62.692 63.909 -1.217 1
1 365 . 11 1 1 A 36 36 THR CB C 36 69.482 69.797 -0.315 1
1 367 . 11 1 1 A 36 36 THR N N 36 113.103 117.364 -4.261 1
1 368 . 11 1 1 A 37 37 HIS H H 37 7.857 6.774 1.083 1
1 369 . 11 1 1 A 37 37 HIS HA H 37 4.878 4.520 0.358 1
1 374 . 11 1 1 A 37 37 HIS C C 37 171.103 171.840 -0.737 1
1 375 . 11 1 1 A 37 37 HIS CA C 37 55.867 54.461 1.406 1
1 376 . 11 1 1 A 37 37 HIS CB C 37 32.655 31.069 1.586 1
1 379 . 11 1 1 A 37 37 HIS N N 37 118.486 114.047 4.439 1
1 380 . 11 1 1 A 38 38 TYR H H 38 9.217 8.871 0.346 1
1 381 . 11 1 1 A 38 38 TYR HA H 38 5.303 5.104 0.199 1
1 388 . 11 1 1 A 38 38 TYR C C 38 173.922 174.837 -0.915 1
1 389 . 11 1 1 A 38 38 TYR CA C 38 56.504 56.296 0.208 1
1 390 . 11 1 1 A 38 38 TYR CB C 38 41.823 41.394 0.429 1
1 395 . 11 1 1 A 38 38 TYR N N 38 114.077 118.217 -4.140 1
1 396 . 11 1 1 A 39 39 LEU H H 39 9.052 9.062 -0.010 1
1 397 . 11 1 1 A 39 39 LEU HA H 39 5.061 4.896 0.165 1
1 407 . 11 1 1 A 39 39 LEU C C 39 175.455 174.585 0.870 1
1 408 . 11 1 1 A 39 39 LEU CA C 39 53.855 54.138 -0.283 1
1 409 . 11 1 1 A 39 39 LEU CB C 39 45.254 43.548 1.706 1
1 413 . 11 1 1 A 39 39 LEU N N 39 123.997 126.576 -2.579 1
1 414 . 11 1 1 A 40 40 VAL H H 40 9.520 9.394 0.126 1
1 415 . 11 1 1 A 40 40 VAL HA H 40 4.988 4.677 0.311 1
1 423 . 11 1 1 A 40 40 VAL C C 40 174.578 174.197 0.381 1
1 424 . 11 1 1 A 40 40 VAL CA C 40 60.575 61.632 -1.057 1
1 425 . 11 1 1 A 40 40 VAL CB C 40 33.284 33.263 0.021 1
1 428 . 11 1 1 A 40 40 VAL N N 40 129.678 129.495 0.183 1
1 429 . 11 1 1 A 41 41 ARG H H 41 9.096 8.706 0.390 1
1 430 . 11 1 1 A 41 41 ARG HA H 41 5.384 5.049 0.335 1
1 437 . 11 1 1 A 41 41 ARG C C 41 175.100 174.571 0.529 1
1 438 . 11 1 1 A 41 41 ARG CA C 41 54.297 54.704 -0.407 1
1 439 . 11 1 1 A 41 41 ARG CB C 41 33.003 32.282 0.721 1
1 442 . 11 1 1 A 41 41 ARG N N 41 126.332 128.853 -2.521 1
1 443 . 11 1 1 A 42 42 CYS H H 42 9.004 9.546 -0.542 1
1 444 . 11 1 1 A 42 42 CYS HA H 42 5.309 4.898 0.411 1
1 447 . 11 1 1 A 42 42 CYS C C 42 173.417 174.083 -0.666 1
1 448 . 11 1 1 A 42 42 CYS CA C 42 57.508 58.030 -0.522 1
1 449 . 11 1 1 A 42 42 CYS CB C 42 28.859 28.656 0.203 1
1 450 . 11 1 1 A 42 42 CYS N N 42 123.359 127.984 -4.625 1
1 451 . 11 1 1 A 43 43 SER H H 43 9.102 8.485 0.617 1
1 452 . 11 1 1 A 43 43 SER HA H 43 5.324 5.178 0.146 1
1 455 . 11 1 1 A 43 43 SER C C 43 171.429 171.615 -0.186 1
1 456 . 11 1 1 A 43 43 SER CA C 43 55.621 55.343 0.278 1
1 457 . 11 1 1 A 43 43 SER CB C 43 64.856 65.300 -0.444 1
1 458 . 11 1 1 A 43 43 SER N N 43 125.444 120.435 5.009 1
1 459 . 11 1 1 A 44 44 PRO HA H 44 4.389 4.659 -0.270 1
1 466 . 11 1 1 A 44 44 PRO C C 44 176.559 177.302 -0.743 1
1 467 . 11 1 1 A 44 44 PRO CA C 44 63.027 62.843 0.184 1
1 468 . 11 1 1 A 44 44 PRO CB C 44 31.935 32.839 -0.904 1
1 471 . 11 1 1 A 45 45 ALA H H 45 8.261 8.159 0.102 1
1 472 . 11 1 1 A 45 45 ALA HA H 45 4.157 4.444 -0.287 1
1 476 . 11 1 1 A 45 45 ALA C C 45 177.706 177.931 -0.225 1
1 477 . 11 1 1 A 45 45 ALA CA C 45 53.284 54.650 -1.366 1
1 478 . 11 1 1 A 45 45 ALA CB C 45 18.978 19.310 -0.332 1
1 479 . 11 1 1 A 45 45 ALA N N 45 126.162 124.663 1.499 1
1 480 . 11 1 1 A 46 46 SER H H 46 8.275 7.810 0.465 1
1 481 . 11 1 1 A 46 46 SER HA H 46 4.779 4.652 0.127 1
1 484 . 11 1 1 A 46 46 SER C C 46 172.182 174.032 -1.850 1
1 485 . 11 1 1 A 46 46 SER CA C 46 55.091 55.421 -0.330 1
1 486 . 11 1 1 A 46 46 SER CB C 46 63.130 63.823 -0.693 1
1 487 . 11 1 1 A 46 46 SER N N 46 113.009 110.694 2.315 1
1 488 . 11 1 1 A 47 47 PRO HA H 47 4.336 4.558 -0.222 1
1 493 . 11 1 1 A 47 47 PRO C C 47 177.165 175.905 1.260 1
1 494 . 11 1 1 A 47 47 PRO CA C 47 63.268 63.659 -0.391 1
1 495 . 11 1 1 A 47 47 PRO CB C 47 32.528 31.635 0.893 1
1 498 . 11 1 1 A 48 48 LYS H H 48 9.089 7.564 1.525 1
1 499 . 11 1 1 A 48 48 LYS HA H 48 4.408 4.386 0.022 1
1 508 . 11 1 1 A 48 48 LYS C C 48 176.917 176.464 0.453 1
1 509 . 11 1 1 A 48 48 LYS CA C 48 55.893 55.987 -0.094 1
1 510 . 11 1 1 A 48 48 LYS CB C 48 32.997 33.481 -0.484 1
1 514 . 11 1 1 A 48 48 LYS N N 48 122.579 115.824 6.755 1
1 515 . 11 1 1 A 49 49 GLY HA2 H 49 4.021 3.909 0.112 1
1 516 . 11 1 1 A 49 49 GLY HA3 H 49 3.881 3.911 -0.030 1
1 517 . 11 1 1 A 49 49 GLY C C 49 174.552 174.597 -0.045 1
1 518 . 11 1 1 A 49 49 GLY CA C 49 46.011 46.298 -0.287 1
1 519 . 11 1 1 A 50 50 GLU H H 50 8.608 8.620 -0.012 1
1 520 . 11 1 1 A 50 50 GLU HA H 50 4.335 4.586 -0.251 1
1 525 . 11 1 1 A 50 50 GLU C C 50 176.672 176.380 0.292 1
1 526 . 11 1 1 A 50 50 GLU CA C 50 56.978 55.233 1.745 1
1 527 . 11 1 1 A 50 50 GLU CB C 50 29.458 28.997 0.461 1
1 529 . 11 1 1 A 50 50 GLU N N 50 121.378 125.275 -3.897 1
1 530 . 11 1 1 A 51 51 GLU H H 51 8.287 7.771 0.516 1
1 531 . 11 1 1 A 51 51 GLU HA H 51 4.381 4.291 0.090 1
1 536 . 11 1 1 A 51 51 GLU C C 51 176.218 175.793 0.425 1
1 537 . 11 1 1 A 51 51 GLU CA C 51 56.996 56.914 0.082 1
1 538 . 11 1 1 A 51 51 GLU CB C 51 31.066 29.863 1.203 1
1 540 . 11 1 1 A 51 51 GLU N N 51 120.863 119.706 1.157 1
1 541 . 11 1 1 A 52 52 GLU H H 52 8.445 8.613 -0.168 1
1 542 . 11 1 1 A 52 52 GLU HA H 52 4.464 4.778 -0.314 1
1 547 . 11 1 1 A 52 52 GLU C C 52 176.128 174.155 1.973 1
1 548 . 11 1 1 A 52 52 GLU CA C 52 55.955 55.397 0.558 1
1 549 . 11 1 1 A 52 52 GLU CB C 52 31.691 34.110 -2.419 1
1 551 . 11 1 1 A 52 52 GLU N N 52 121.103 124.100 -2.997 1
1 552 . 11 1 1 A 53 53 GLU H H 53 8.441 8.714 -0.273 1
1 553 . 11 1 1 A 53 53 GLU HA H 53 4.609 5.017 -0.408 1
1 558 . 11 1 1 A 53 53 GLU C C 53 175.816 174.828 0.988 1
1 559 . 11 1 1 A 53 53 GLU CA C 53 56.697 55.131 1.566 1
1 560 . 11 1 1 A 53 53 GLU CB C 53 31.022 31.700 -0.678 1
1 562 . 11 1 1 A 53 53 GLU N N 53 121.949 124.793 -2.844 1
1 563 . 11 1 1 A 54 54 ARG H H 54 8.569 9.042 -0.473 1
1 564 . 11 1 1 A 54 54 ARG HA H 54 4.768 4.962 -0.194 1
1 571 . 11 1 1 A 54 54 ARG C C 54 174.881 174.321 0.560 1
1 572 . 11 1 1 A 54 54 ARG CA C 54 54.950 54.656 0.294 1
1 573 . 11 1 1 A 54 54 ARG CB C 54 33.374 32.790 0.584 1
1 576 . 11 1 1 A 54 54 ARG N N 54 123.714 124.644 -0.930 1
1 577 . 11 1 1 A 55 55 GLU H H 55 8.650 9.111 -0.461 1
1 578 . 11 1 1 A 55 55 GLU HA H 55 5.493 5.005 0.488 1
1 583 . 11 1 1 A 55 55 GLU C C 55 175.566 176.130 -0.564 1
1 584 . 11 1 1 A 55 55 GLU CA C 55 54.915 55.631 -0.716 1
1 585 . 11 1 1 A 55 55 GLU CB C 55 33.250 31.450 1.800 1
1 587 . 11 1 1 A 55 55 GLU N N 55 123.537 128.872 -5.335 1
1 588 . 11 1 1 A 56 56 VAL H H 56 9.419 9.218 0.201 1
1 589 . 11 1 1 A 56 56 VAL HA H 56 4.524 4.953 -0.429 1
1 597 . 11 1 1 A 56 56 VAL C C 56 173.502 174.525 -1.023 1
1 598 . 11 1 1 A 56 56 VAL CA C 56 60.981 58.756 2.225 1
1 599 . 11 1 1 A 56 56 VAL CB C 56 36.117 36.045 0.072 1
1 602 . 11 1 1 A 56 56 VAL N N 56 123.343 119.875 3.468 1
1 603 . 11 1 1 A 57 57 GLN H H 57 8.767 8.773 -0.006 1
1 604 . 11 1 1 A 57 57 GLN HA H 57 5.671 5.184 0.487 1
1 611 . 11 1 1 A 57 57 GLN C C 57 176.357 174.850 1.507 1
1 612 . 11 1 1 A 57 57 GLN CA C 57 54.735 54.325 0.410 1
1 613 . 11 1 1 A 57 57 GLN CB C 57 30.781 31.225 -0.444 1
1 615 . 11 1 1 A 57 57 GLN N N 57 125.639 120.807 4.832 1
1 617 . 11 1 1 A 58 58 VAL H H 58 9.217 8.795 0.422 1
1 618 . 11 1 1 A 58 58 VAL HA H 58 5.129 4.847 0.282 1
1 626 . 11 1 1 A 58 58 VAL C C 58 175.925 176.923 -0.998 1
1 627 . 11 1 1 A 58 58 VAL CA C 58 59.652 60.615 -0.963 1
1 628 . 11 1 1 A 58 58 VAL CB C 58 36.540 34.355 2.185 1
1 631 . 11 1 1 A 58 58 VAL N N 58 117.022 120.786 -3.764 1
1 632 . 11 1 1 A 59 59 GLY H H 59 9.008 8.698 0.310 1
1 633 . 11 1 1 A 59 59 GLY HA2 H 59 4.670 3.890 0.780 1
1 634 . 11 1 1 A 59 59 GLY HA3 H 59 3.914 3.892 0.022 1
1 635 . 11 1 1 A 59 59 GLY C C 59 173.386 174.005 -0.619 1
1 636 . 11 1 1 A 59 59 GLY CA C 59 45.093 46.776 -1.683 1
1 637 . 11 1 1 A 59 59 GLY N N 59 109.174 111.485 -2.311 1
1 638 . 11 1 1 A 60 60 ARG H H 60 7.695 7.569 0.126 1
1 639 . 11 1 1 A 60 60 ARG HA H 60 4.866 5.071 -0.205 1
1 645 . 11 1 1 A 60 60 ARG C C 60 173.760 175.816 -2.056 1
1 646 . 11 1 1 A 60 60 ARG CA C 60 52.764 53.603 -0.839 1
1 647 . 11 1 1 A 60 60 ARG CB C 60 31.785 32.071 -0.286 1
1 650 . 11 1 1 A 60 60 ARG N N 60 118.520 117.984 0.536 1
1 651 . 11 1 1 A 61 61 PRO HA H 61 3.539 4.081 -0.542 1
1 658 . 11 1 1 A 61 61 PRO C C 61 173.175 173.729 -0.554 1
1 659 . 11 1 1 A 61 61 PRO CA C 61 62.265 63.094 -0.829 1
1 660 . 11 1 1 A 61 61 PRO CB C 61 27.546 30.812 -3.266 1
1 663 . 11 1 1 A 62 62 GLU H H 62 7.879 7.673 0.206 1
1 664 . 11 1 1 A 62 62 GLU HA H 62 4.071 4.764 -0.693 1
1 669 . 11 1 1 A 62 62 GLU C C 62 174.107 174.540 -0.433 1
1 670 . 11 1 1 A 62 62 GLU CA C 62 55.229 54.455 0.774 1
1 671 . 11 1 1 A 62 62 GLU CB C 62 32.838 32.278 0.560 1
1 673 . 11 1 1 A 62 62 GLU N N 62 118.173 113.956 4.217 1
1 674 . 11 1 1 A 63 63 VAL H H 63 8.930 8.574 0.356 1
1 675 . 11 1 1 A 63 63 VAL HA H 63 4.548 5.009 -0.461 1
1 683 . 11 1 1 A 63 63 VAL C C 63 170.325 173.131 -2.806 1
1 684 . 11 1 1 A 63 63 VAL CA C 63 60.770 59.333 1.437 1
1 685 . 11 1 1 A 63 63 VAL CB C 63 35.394 35.929 -0.535 1
1 688 . 11 1 1 A 63 63 VAL N N 63 117.161 121.966 -4.805 1
1 689 . 11 1 1 A 64 64 LEU H H 64 8.332 8.738 -0.406 1
1 690 . 11 1 1 A 64 64 LEU HA H 64 5.122 5.089 0.033 1
1 700 . 11 1 1 A 64 64 LEU C C 64 176.243 174.591 1.652 1
1 701 . 11 1 1 A 64 64 LEU CA C 64 53.346 53.641 -0.295 1
1 702 . 11 1 1 A 64 64 LEU CB C 64 42.649 45.028 -2.379 1
1 706 . 11 1 1 A 64 64 LEU N N 64 130.510 127.833 2.677 1
1 707 . 11 1 1 A 65 65 LEU H H 65 9.261 9.319 -0.058 1
1 708 . 11 1 1 A 65 65 LEU HA H 65 4.443 4.744 -0.301 1
1 718 . 11 1 1 A 65 65 LEU C C 65 174.016 176.178 -2.162 1
1 719 . 11 1 1 A 65 65 LEU CA C 65 53.920 54.069 -0.149 1
1 720 . 11 1 1 A 65 65 LEU CB C 65 42.976 42.017 0.959 1
1 724 . 11 1 1 A 65 65 LEU N N 65 128.611 128.848 -0.237 1
1 725 . 11 1 1 A 66 66 ASP H H 66 8.105 8.702 -0.597 1
1 726 . 11 1 1 A 66 66 ASP HA H 66 5.207 4.937 0.270 1
1 729 . 11 1 1 A 66 66 ASP C C 66 176.161 176.143 0.018 1
1 730 . 11 1 1 A 66 66 ASP CA C 66 51.001 52.976 -1.975 1
1 731 . 11 1 1 A 66 66 ASP CB C 66 42.836 42.123 0.713 1
1 732 . 11 1 1 A 66 66 ASP N N 66 121.799 125.043 -3.244 1
1 733 . 11 1 1 A 67 67 GLY H H 67 8.688 8.428 0.260 1
1 734 . 11 1 1 A 67 67 GLY HA2 H 67 3.923 3.878 0.045 1
1 735 . 11 1 1 A 67 67 GLY HA3 H 67 3.808 3.883 -0.075 1
1 736 . 11 1 1 A 67 67 GLY C C 67 175.500 174.328 1.172 1
1 737 . 11 1 1 A 67 67 GLY CA C 67 46.591 46.845 -0.254 1
1 738 . 11 1 1 A 67 67 GLY N N 67 106.518 110.397 -3.879 1
1 739 . 11 1 1 A 68 68 LEU H H 68 8.125 7.115 1.010 1
1 740 . 11 1 1 A 68 68 LEU HA H 68 4.252 4.917 -0.665 1
1 750 . 11 1 1 A 68 68 LEU C C 68 174.914 175.520 -0.606 1
1 751 . 11 1 1 A 68 68 LEU CA C 68 53.469 52.999 0.470 1
1 752 . 11 1 1 A 68 68 LEU CB C 68 40.422 44.857 -4.435 1
1 756 . 11 1 1 A 68 68 LEU N N 68 119.345 120.078 -0.733 1
1 757 . 11 1 1 A 69 69 GLU H H 69 8.207 8.815 -0.608 1
1 758 . 11 1 1 A 69 69 GLU HA H 69 4.908 4.867 0.041 1
1 763 . 11 1 1 A 69 69 GLU C C 69 174.464 174.302 0.162 1
1 764 . 11 1 1 A 69 69 GLU CA C 69 53.081 52.822 0.259 1
1 765 . 11 1 1 A 69 69 GLU CB C 69 31.538 31.319 0.219 1
1 767 . 11 1 1 A 69 69 GLU N N 69 119.486 120.245 -0.759 1
1 768 . 11 1 1 A 70 70 PRO HA H 70 4.866 4.352 0.514 1
1 775 . 11 1 1 A 70 70 PRO C C 70 178.285 177.556 0.729 1
1 776 . 11 1 1 A 70 70 PRO CA C 70 63.203 63.656 -0.453 1
1 777 . 11 1 1 A 70 70 PRO CB C 70 33.726 31.727 1.999 1
1 780 . 11 1 1 A 71 71 GLY H H 71 7.362 8.689 -1.327 1
1 781 . 11 1 1 A 71 71 GLY HA2 H 71 3.807 3.958 -0.151 1
1 782 . 11 1 1 A 71 71 GLY HA3 H 71 3.756 3.964 -0.208 1
1 783 . 11 1 1 A 71 71 GLY C C 71 174.664 173.731 0.933 1
1 784 . 11 1 1 A 71 71 GLY CA C 71 46.926 46.327 0.599 1
1 785 . 11 1 1 A 71 71 GLY N N 71 113.776 111.713 2.063 1
1 786 . 11 1 1 A 72 72 ARG H H 72 8.036 7.196 0.840 1
1 787 . 11 1 1 A 72 72 ARG HA H 72 4.597 4.836 -0.239 1
1 793 . 11 1 1 A 72 72 ARG C C 72 173.293 173.701 -0.408 1
1 794 . 11 1 1 A 72 72 ARG CA C 72 54.633 54.421 0.212 1
1 795 . 11 1 1 A 72 72 ARG CB C 72 33.704 33.354 0.350 1
1 798 . 11 1 1 A 72 72 ARG N N 72 119.611 119.507 0.104 1
1 799 . 11 1 1 A 73 73 ASP H H 73 7.785 8.425 -0.640 1
1 800 . 11 1 1 A 73 73 ASP HA H 73 5.276 5.304 -0.028 1
1 803 . 11 1 1 A 73 73 ASP C C 73 175.904 175.404 0.500 1
1 804 . 11 1 1 A 73 73 ASP CA C 73 53.568 53.110 0.458 1
1 805 . 11 1 1 A 73 73 ASP CB C 73 42.970 42.751 0.219 1
1 806 . 11 1 1 A 73 73 ASP N N 73 118.900 125.255 -6.355 1
1 807 . 11 1 1 A 74 74 TYR H H 74 9.516 8.780 0.736 1
1 808 . 11 1 1 A 74 74 TYR HA H 74 4.800 5.021 -0.221 1
1 815 . 11 1 1 A 74 74 TYR C C 74 174.631 174.934 -0.303 1
1 816 . 11 1 1 A 74 74 TYR CA C 74 58.548 56.253 2.295 1
1 817 . 11 1 1 A 74 74 TYR CB C 74 42.029 42.312 -0.283 1
1 822 . 11 1 1 A 74 74 TYR N N 74 121.903 121.185 0.718 1
1 823 . 11 1 1 A 75 75 GLU H H 75 9.248 9.376 -0.128 1
1 824 . 11 1 1 A 75 75 GLU HA H 75 4.756 4.649 0.107 1
1 829 . 11 1 1 A 75 75 GLU C C 75 175.524 175.430 0.094 1
1 830 . 11 1 1 A 75 75 GLU CA C 75 55.621 55.693 -0.072 1
1 831 . 11 1 1 A 75 75 GLU CB C 75 30.778 29.215 1.563 1
1 833 . 11 1 1 A 75 75 GLU N N 75 122.425 123.279 -0.854 1
1 834 . 11 1 1 A 76 76 VAL H H 76 8.884 8.647 0.237 1
1 835 . 11 1 1 A 76 76 VAL HA H 76 5.246 4.501 0.745 1
1 843 . 11 1 1 A 76 76 VAL C C 76 174.800 174.798 0.002 1
1 844 . 11 1 1 A 76 76 VAL CA C 76 60.199 62.234 -2.035 1
1 845 . 11 1 1 A 76 76 VAL CB C 76 33.449 31.475 1.974 1
1 848 . 11 1 1 A 76 76 VAL N N 76 126.853 125.723 1.130 1
1 849 . 11 1 1 A 77 77 SER H H 77 9.234 8.494 0.740 1
1 850 . 11 1 1 A 77 77 SER HA H 77 5.398 5.081 0.317 1
1 853 . 11 1 1 A 77 77 SER C C 77 173.138 173.637 -0.499 1
1 854 . 11 1 1 A 77 77 SER CA C 77 56.032 57.081 -1.049 1
1 855 . 11 1 1 A 77 77 SER CB C 77 66.374 64.608 1.766 1
1 856 . 11 1 1 A 77 77 SER N N 77 120.852 123.924 -3.072 1
1 857 . 11 1 1 A 78 78 VAL H H 78 9.092 8.735 0.357 1
1 858 . 11 1 1 A 78 78 VAL HA H 78 4.756 4.646 0.110 1
1 866 . 11 1 1 A 78 78 VAL C C 78 173.641 174.327 -0.686 1
1 867 . 11 1 1 A 78 78 VAL CA C 78 61.246 60.817 0.429 1
1 868 . 11 1 1 A 78 78 VAL CB C 78 34.467 33.509 0.958 1
1 871 . 11 1 1 A 78 78 VAL N N 78 122.453 125.572 -3.119 1
1 872 . 11 1 1 A 79 79 GLN H H 79 8.587 8.784 -0.197 1
1 873 . 11 1 1 A 79 79 GLN HA H 79 4.438 5.012 -0.574 1
1 880 . 11 1 1 A 79 79 GLN C C 79 174.999 174.860 0.139 1
1 881 . 11 1 1 A 79 79 GLN CA C 79 54.227 53.984 0.243 1
1 882 . 11 1 1 A 79 79 GLN CB C 79 33.587 32.345 1.242 1
1 884 . 11 1 1 A 79 79 GLN N N 79 125.619 127.815 -2.196 1
1 886 . 11 1 1 A 80 80 SER H H 80 8.623 8.776 -0.153 1
1 887 . 11 1 1 A 80 80 SER HA H 80 4.756 4.963 -0.207 1
1 890 . 11 1 1 A 80 80 SER C C 80 172.264 174.222 -1.958 1
1 891 . 11 1 1 A 80 80 SER CA C 80 58.177 59.500 -1.323 1
1 892 . 11 1 1 A 80 80 SER CB C 80 63.920 63.775 0.145 1
1 893 . 11 1 1 A 80 80 SER N N 80 122.844 124.325 -1.481 1
1 894 . 11 1 1 A 81 81 LEU H H 81 8.348 9.151 -0.803 1
1 895 . 11 1 1 A 81 81 LEU HA H 81 5.124 4.757 0.367 1
1 905 . 11 1 1 A 81 81 LEU C C 81 175.775 176.278 -0.503 1
1 906 . 11 1 1 A 81 81 LEU CA C 81 54.033 53.281 0.752 1
1 907 . 11 1 1 A 81 81 LEU CB C 81 44.690 43.813 0.877 1
1 911 . 11 1 1 A 81 81 LEU N N 81 123.191 126.698 -3.507 1
1 912 . 11 1 1 A 82 82 ARG H H 82 8.374 9.067 -0.693 1
1 913 . 11 1 1 A 82 82 ARG HA H 82 4.616 4.350 0.266 1
1 919 . 11 1 1 A 82 82 ARG C C 82 176.864 175.870 0.994 1
1 920 . 11 1 1 A 82 82 ARG CA C 82 55.868 56.786 -0.918 1
1 921 . 11 1 1 A 82 82 ARG CB C 82 32.322 32.953 -0.631 1
1 924 . 11 1 1 A 82 82 ARG N N 82 121.029 125.285 -4.256 1
1 925 . 11 1 1 A 83 83 GLY H H 83 8.309 7.405 0.904 1
1 926 . 11 1 1 A 83 83 GLY HA2 H 83 4.031 4.087 -0.056 1
1 927 . 11 1 1 A 83 83 GLY HA3 H 83 3.888 4.102 -0.214 1
1 928 . 11 1 1 A 83 83 GLY C C 83 174.562 173.880 0.682 1
1 929 . 11 1 1 A 83 83 GLY CA C 83 45.963 46.071 -0.108 1
1 930 . 11 1 1 A 83 83 GLY N N 83 109.937 106.477 3.460 1
1 931 . 11 1 1 A 84 84 PRO HA H 84 4.573 4.347 0.226 1
1 938 . 11 1 1 A 84 84 PRO C C 84 176.533 176.094 0.439 1
1 939 . 11 1 1 A 84 84 PRO CA C 84 63.485 64.813 -1.328 1
1 940 . 11 1 1 A 84 84 PRO CB C 84 32.409 31.978 0.431 1
1 943 . 11 1 1 A 85 85 GLU H H 85 7.799 7.480 0.319 1
1 944 . 11 1 1 A 85 85 GLU HA H 85 4.369 4.821 -0.452 1
1 949 . 11 1 1 A 85 85 GLU C C 85 174.722 175.981 -1.259 1
1 950 . 11 1 1 A 85 85 GLU CA C 85 55.899 54.886 1.013 1
1 951 . 11 1 1 A 85 85 GLU CB C 85 31.911 32.860 -0.949 1
1 953 . 11 1 1 A 85 85 GLU N N 85 122.093 112.226 9.867 1
1 954 . 11 1 1 A 86 86 GLY H H 86 8.329 8.591 -0.262 1
1 955 . 11 1 1 A 86 86 GLY HA2 H 86 5.298 4.120 1.178 1
1 956 . 11 1 1 A 86 86 GLY HA3 H 86 3.559 4.135 -0.576 1
1 957 . 11 1 1 A 86 86 GLY C C 86 174.355 173.052 1.303 1
1 958 . 11 1 1 A 86 86 GLY CA C 86 44.034 44.193 -0.159 1
1 959 . 11 1 1 A 86 86 GLY N N 86 109.387 108.827 0.560 1
1 960 . 11 1 1 A 87 87 SER H H 87 8.807 8.157 0.650 1
1 961 . 11 1 1 A 87 87 SER HA H 87 4.670 4.968 -0.298 1
1 964 . 11 1 1 A 87 87 SER C C 87 175.195 174.208 0.987 1
1 965 . 11 1 1 A 87 87 SER CA C 87 57.737 56.390 1.347 1
1 966 . 11 1 1 A 87 87 SER CB C 87 67.829 65.924 1.905 1
1 967 . 11 1 1 A 87 87 SER N N 87 117.698 114.327 3.371 1
1 968 . 11 1 1 A 88 88 GLU H H 88 8.754 8.176 0.578 1
1 969 . 11 1 1 A 88 88 GLU HA H 88 4.357 4.299 0.058 1
1 974 . 11 1 1 A 88 88 GLU C C 88 177.474 176.016 1.458 1
1 975 . 11 1 1 A 88 88 GLU CA C 88 57.525 56.422 1.103 1
1 976 . 11 1 1 A 88 88 GLU CB C 88 31.162 30.574 0.588 1
1 978 . 11 1 1 A 88 88 GLU N N 88 118.709 121.161 -2.452 1
1 979 . 11 1 1 A 89 89 ALA H H 89 8.855 8.474 0.381 1
1 980 . 11 1 1 A 89 89 ALA HA H 89 4.792 4.899 -0.107 1
1 984 . 11 1 1 A 89 89 ALA C C 89 178.379 176.604 1.775 1
1 985 . 11 1 1 A 89 89 ALA CA C 89 51.264 51.064 0.200 1
1 986 . 11 1 1 A 89 89 ALA CB C 89 20.040 20.218 -0.178 1
1 987 . 11 1 1 A 89 89 ALA N N 89 127.301 125.851 1.450 1
1 988 . 11 1 1 A 90 90 ARG H H 90 8.549 8.401 0.148 1
1 989 . 11 1 1 A 90 90 ARG HA H 90 4.658 4.971 -0.313 1
1 996 . 11 1 1 A 90 90 ARG C C 90 174.720 175.195 -0.475 1
1 997 . 11 1 1 A 90 90 ARG CA C 90 53.575 54.297 -0.722 1
1 998 . 11 1 1 A 90 90 ARG CB C 90 33.456 31.906 1.550 1
1 1001 . 11 1 1 A 90 90 ARG N N 90 121.289 123.214 -1.925 1
1 1002 . 11 1 1 A 91 91 GLY H H 91 8.396 8.949 -0.553 1
1 1003 . 11 1 1 A 91 91 GLY HA2 H 91 5.306 4.185 1.121 1
1 1004 . 11 1 1 A 91 91 GLY HA3 H 91 3.700 4.215 -0.515 1
1 1005 . 11 1 1 A 91 91 GLY C C 91 173.191 172.070 1.121 1
1 1006 . 11 1 1 A 91 91 GLY CA C 91 44.493 43.873 0.620 1
1 1007 . 11 1 1 A 91 91 GLY N N 91 108.579 112.156 -3.577 1
1 1008 . 11 1 1 A 92 92 ILE H H 92 8.891 8.205 0.686 1
1 1009 . 11 1 1 A 92 92 ILE HA H 92 4.499 4.964 -0.465 1
1 1019 . 11 1 1 A 92 92 ILE C C 92 171.877 174.336 -2.459 1
1 1020 . 11 1 1 A 92 92 ILE CA C 92 60.682 59.137 1.545 1
1 1021 . 11 1 1 A 92 92 ILE CB C 92 42.425 41.806 0.619 1
1 1025 . 11 1 1 A 92 92 ILE N N 92 118.313 121.452 -3.139 1
1 1026 . 11 1 1 A 93 93 ARG H H 93 7.980 8.553 -0.573 1
1 1027 . 11 1 1 A 93 93 ARG HA H 93 5.224 4.398 0.826 1
1 1034 . 11 1 1 A 93 93 ARG C C 93 175.072 174.877 0.195 1
1 1035 . 11 1 1 A 93 93 ARG CA C 93 54.499 55.815 -1.316 1
1 1036 . 11 1 1 A 93 93 ARG CB C 93 31.767 29.468 2.299 1
1 1039 . 11 1 1 A 93 93 ARG N N 93 124.879 129.598 -4.719 1
1 1040 . 11 1 1 A 94 94 ALA H H 94 9.064 8.185 0.879 1
1 1041 . 11 1 1 A 94 94 ALA HA H 94 4.731 4.457 0.274 1
1 1045 . 11 1 1 A 94 94 ALA C C 94 174.494 177.617 -3.123 1
1 1046 . 11 1 1 A 94 94 ALA CA C 94 50.577 53.007 -2.430 1
1 1047 . 11 1 1 A 94 94 ALA CB C 94 23.082 19.511 3.571 1
1 1048 . 11 1 1 A 94 94 ALA N N 94 126.095 129.430 -3.335 1
1 1049 . 11 1 1 A 95 95 ARG H H 95 8.263 9.006 -0.743 1
1 1050 . 11 1 1 A 95 95 ARG HA H 95 5.548 5.247 0.301 1
1 1058 . 11 1 1 A 95 95 ARG C C 95 176.901 174.964 1.937 1
1 1059 . 11 1 1 A 95 95 ARG CA C 95 53.787 54.397 -0.610 1
1 1060 . 11 1 1 A 95 95 ARG CB C 95 32.426 33.554 -1.128 1
1 1063 . 11 1 1 A 95 95 ARG N N 95 123.374 119.378 3.996 1
1 1065 . 11 1 1 A 96 96 THR H H 96 9.208 8.765 0.443 1
1 1066 . 11 1 1 A 96 96 THR HA H 96 4.461 5.063 -0.602 1
1 1071 . 11 1 1 A 96 96 THR CA C 96 58.248 58.259 -0.011 1
1 1072 . 11 1 1 A 96 96 THR CB C 96 68.466 71.101 -2.635 1
1 1074 . 11 1 1 A 96 96 THR N N 96 119.492 112.021 7.471 1
1 1075 . 11 1 1 A 97 97 PRO HA H 97 4.636 4.594 0.042 1
1 1082 . 11 1 1 A 97 97 PRO C C 97 175.725 176.001 -0.276 1
1 1083 . 11 1 1 A 97 97 PRO CA C 97 61.907 62.337 -0.430 1
1 1084 . 11 1 1 A 97 97 PRO CB C 97 32.590 33.317 -0.727 1
1 1087 . 11 1 1 A 98 98 THR H H 98 7.943 8.350 -0.407 1
1 1088 . 11 1 1 A 98 98 THR HA H 98 4.208 4.889 -0.681 1
1 1093 . 11 1 1 A 98 98 THR C C 98 175.058 173.617 1.441 1
1 1094 . 11 1 1 A 98 98 THR CA C 98 62.069 60.685 1.384 1
1 1095 . 11 1 1 A 98 98 THR CB C 98 69.719 70.385 -0.666 1
1 1097 . 11 1 1 A 98 98 THR N N 98 107.148 111.603 -4.455 1
1 1098 . 11 1 1 A 99 99 SER H H 99 8.163 8.682 -0.519 1
1 1099 . 11 1 1 A 99 99 SER HA H 99 4.524 4.242 0.282 1
1 1102 . 11 1 1 A 99 99 SER C C 99 174.319 174.773 -0.454 1
1 1103 . 11 1 1 A 99 99 SER CA C 99 58.107 59.694 -1.587 1
1 1104 . 11 1 1 A 99 99 SER CB C 99 64.492 62.693 1.799 1
1 1105 . 11 1 1 A 99 99 SER N N 99 115.114 119.857 -4.743 1
1 1106 . 11 1 1 A 100 100 GLY H H 100 8.336 8.730 -0.394 1
1 1107 . 11 1 1 A 100 100 GLY HA2 H 100 4.222 4.172 0.050 1
1 1108 . 11 1 1 A 100 100 GLY HA3 H 100 4.222 4.173 0.049 1
1 1109 . 11 1 1 A 100 100 GLY C C 100 171.696 173.946 -2.250 1
1 1110 . 11 1 1 A 100 100 GLY CA C 100 44.617 44.890 -0.273 1
1 1111 . 11 1 1 A 100 100 GLY N N 100 110.678 111.671 -0.993 1
1 1112 . 11 1 1 A 101 101 PRO HA H 101 4.506 4.569 -0.063 1
1 1118 . 11 1 1 A 101 101 PRO CA C 101 63.358 63.596 -0.238 1
1 1119 . 11 1 1 A 101 101 PRO CB C 101 32.313 32.180 0.133 1
1 1 . 12 1 1 A 6 6 SER HA H 6 4.528 4.942 -0.414 1
1 3 . 12 1 1 A 6 6 SER CA C 6 58.373 57.218 1.155 1
1 4 . 12 1 1 A 6 6 SER CB C 6 63.978 65.701 -1.723 1
1 5 . 12 1 1 A 7 7 GLY H H 7 8.228 8.505 -0.277 1
1 6 . 12 1 1 A 7 7 GLY HA2 H 7 4.134 4.188 -0.054 1
1 7 . 12 1 1 A 7 7 GLY HA3 H 7 4.134 4.190 -0.056 1
1 8 . 12 1 1 A 7 7 GLY CA C 7 44.607 44.797 -0.190 1
1 9 . 12 1 1 A 7 7 GLY N N 7 110.638 109.599 1.039 1
1 10 . 12 1 1 A 8 8 PRO HA H 8 4.419 4.717 -0.298 1
1 17 . 12 1 1 A 8 8 PRO C C 8 176.908 175.468 1.440 1
1 18 . 12 1 1 A 8 8 PRO CA C 8 62.851 62.888 -0.037 1
1 19 . 12 1 1 A 8 8 PRO CB C 8 32.243 32.043 0.200 1
1 22 . 12 1 1 A 9 9 LEU H H 9 8.462 8.547 -0.085 1
1 23 . 12 1 1 A 9 9 LEU HA H 9 4.494 4.945 -0.451 1
1 33 . 12 1 1 A 9 9 LEU C C 9 174.124 174.777 -0.653 1
1 34 . 12 1 1 A 9 9 LEU CA C 9 52.587 51.575 1.012 1
1 35 . 12 1 1 A 9 9 LEU CB C 9 43.150 43.337 -0.187 1
1 39 . 12 1 1 A 9 9 LEU N N 9 126.015 123.326 2.689 1
1 40 . 12 1 1 A 10 10 PRO HA H 10 4.820 4.560 0.260 1
1 47 . 12 1 1 A 10 10 PRO CA C 10 61.368 62.333 -0.965 1
1 48 . 12 1 1 A 10 10 PRO CB C 10 31.391 31.684 -0.293 1
1 51 . 12 1 1 A 11 11 PRO HA H 11 4.949 4.559 0.390 1
1 58 . 12 1 1 A 11 11 PRO CA C 11 61.183 61.785 -0.602 1
1 59 . 12 1 1 A 11 11 PRO CB C 11 30.656 31.885 -1.229 1
1 62 . 12 1 1 A 12 12 PRO HA H 12 4.341 4.579 -0.238 1
1 69 . 12 1 1 A 12 12 PRO C C 12 174.849 176.747 -1.898 1
1 70 . 12 1 1 A 12 12 PRO CA C 12 63.062 62.572 0.490 1
1 71 . 12 1 1 A 12 12 PRO CB C 12 31.831 31.669 0.162 1
1 74 . 12 1 1 A 13 13 ARG H H 13 7.828 8.795 -0.967 1
1 75 . 12 1 1 A 13 13 ARG HA H 13 4.536 4.479 0.057 1
1 82 . 12 1 1 A 13 13 ARG C C 13 174.608 176.645 -2.037 1
1 83 . 12 1 1 A 13 13 ARG CA C 13 54.774 56.839 -2.065 1
1 84 . 12 1 1 A 13 13 ARG CB C 13 33.250 32.489 0.761 1
1 87 . 12 1 1 A 13 13 ARG N N 13 120.532 123.265 -2.733 1
1 88 . 12 1 1 A 14 14 ALA H H 14 8.694 7.742 0.952 1
1 89 . 12 1 1 A 14 14 ALA HA H 14 3.986 4.369 -0.383 1
1 93 . 12 1 1 A 14 14 ALA C C 14 177.232 176.436 0.796 1
1 94 . 12 1 1 A 14 14 ALA CA C 14 52.461 51.784 0.677 1
1 95 . 12 1 1 A 14 14 ALA CB C 14 16.806 17.174 -0.368 1
1 96 . 12 1 1 A 14 14 ALA N N 14 121.921 120.887 1.034 1
1 97 . 12 1 1 A 15 15 LEU H H 15 8.097 8.546 -0.449 1
1 98 . 12 1 1 A 15 15 LEU HA H 15 4.670 4.877 -0.207 1
1 108 . 12 1 1 A 15 15 LEU C C 15 177.364 176.246 1.118 1
1 109 . 12 1 1 A 15 15 LEU CA C 15 57.543 54.231 3.312 1
1 110 . 12 1 1 A 15 15 LEU CB C 15 41.877 41.725 0.152 1
1 114 . 12 1 1 A 15 15 LEU N N 15 122.215 121.737 0.478 1
1 115 . 12 1 1 A 16 16 THR H H 16 9.520 8.873 0.647 1
1 116 . 12 1 1 A 16 16 THR HA H 16 4.369 4.857 -0.488 1
1 121 . 12 1 1 A 16 16 THR C C 16 172.453 172.586 -0.133 1
1 122 . 12 1 1 A 16 16 THR CA C 16 62.480 61.315 1.165 1
1 123 . 12 1 1 A 16 16 THR CB C 16 72.198 72.848 -0.650 1
1 125 . 12 1 1 A 16 16 THR N N 16 122.214 120.431 1.783 1
1 126 . 12 1 1 A 17 17 LEU H H 17 8.847 8.760 0.087 1
1 127 . 12 1 1 A 17 17 LEU HA H 17 4.573 4.513 0.060 1
1 137 . 12 1 1 A 17 17 LEU C C 17 174.695 176.494 -1.799 1
1 138 . 12 1 1 A 17 17 LEU CA C 17 53.840 54.418 -0.578 1
1 139 . 12 1 1 A 17 17 LEU CB C 17 40.290 41.959 -1.669 1
1 143 . 12 1 1 A 17 17 LEU N N 17 127.415 127.094 0.321 1
1 144 . 12 1 1 A 18 18 ALA H H 18 8.647 8.710 -0.063 1
1 145 . 12 1 1 A 18 18 ALA HA H 18 4.106 4.037 0.069 1
1 149 . 12 1 1 A 18 18 ALA C C 18 178.236 177.366 0.870 1
1 150 . 12 1 1 A 18 18 ALA CA C 18 53.926 54.137 -0.211 1
1 151 . 12 1 1 A 18 18 ALA CB C 18 18.876 19.113 -0.237 1
1 152 . 12 1 1 A 18 18 ALA N N 18 133.362 129.983 3.379 1
1 153 . 12 1 1 A 19 19 ALA H H 19 7.772 7.486 0.286 1
1 154 . 12 1 1 A 19 19 ALA HA H 19 4.561 4.636 -0.075 1
1 158 . 12 1 1 A 19 19 ALA C C 19 176.032 174.725 1.307 1
1 159 . 12 1 1 A 19 19 ALA CA C 19 53.011 51.830 1.181 1
1 160 . 12 1 1 A 19 19 ALA CB C 19 21.869 22.949 -1.080 1
1 161 . 12 1 1 A 19 19 ALA N N 19 115.654 116.673 -1.019 1
1 162 . 12 1 1 A 20 20 VAL H H 20 8.697 8.806 -0.109 1
1 163 . 12 1 1 A 20 20 VAL HA H 20 4.951 4.899 0.052 1
1 171 . 12 1 1 A 20 20 VAL C C 20 174.314 174.006 0.308 1
1 172 . 12 1 1 A 20 20 VAL CA C 20 61.352 60.171 1.181 1
1 173 . 12 1 1 A 20 20 VAL CB C 20 35.394 34.123 1.271 1
1 176 . 12 1 1 A 20 20 VAL N N 20 120.848 117.821 3.027 1
1 177 . 12 1 1 A 21 21 THR H H 21 9.198 8.433 0.765 1
1 178 . 12 1 1 A 21 21 THR HA H 21 4.941 4.789 0.152 1
1 183 . 12 1 1 A 21 21 THR C C 21 174.416 174.644 -0.228 1
1 184 . 12 1 1 A 21 21 THR CA C 21 60.347 58.925 1.422 1
1 185 . 12 1 1 A 21 21 THR CB C 21 68.713 71.831 -3.118 1
1 187 . 12 1 1 A 21 21 THR N N 21 120.326 124.794 -4.468 1
1 188 . 12 1 1 A 22 22 PRO HA H 22 4.634 4.558 0.076 1
1 194 . 12 1 1 A 22 22 PRO C C 22 173.606 176.764 -3.158 1
1 195 . 12 1 1 A 22 22 PRO CA C 22 66.519 64.282 2.237 1
1 196 . 12 1 1 A 22 22 PRO CB C 22 32.078 31.625 0.453 1
1 199 . 12 1 1 A 23 23 ARG H H 23 6.621 8.095 -1.474 1
1 200 . 12 1 1 A 23 23 ARG HA H 23 4.591 4.465 0.126 1
1 207 . 12 1 1 A 23 23 ARG C C 23 176.554 175.867 0.687 1
1 208 . 12 1 1 A 23 23 ARG CA C 23 53.892 56.414 -2.522 1
1 209 . 12 1 1 A 23 23 ARG CB C 23 33.498 33.210 0.288 1
1 212 . 12 1 1 A 23 23 ARG N N 23 102.938 116.894 -13.956 1
1 213 . 12 1 1 A 24 24 THR H H 24 7.352 8.062 -0.710 1
1 214 . 12 1 1 A 24 24 THR HA H 24 5.593 5.243 0.350 1
1 219 . 12 1 1 A 24 24 THR C C 24 172.345 172.563 -0.218 1
1 220 . 12 1 1 A 24 24 THR CA C 24 59.311 60.306 -0.995 1
1 221 . 12 1 1 A 24 24 THR CB C 24 73.311 72.334 0.977 1
1 223 . 12 1 1 A 24 24 THR N N 24 108.792 110.553 -1.761 1
1 224 . 12 1 1 A 25 25 VAL H H 25 8.437 8.665 -0.228 1
1 225 . 12 1 1 A 25 25 VAL HA H 25 4.512 4.956 -0.444 1
1 233 . 12 1 1 A 25 25 VAL C C 25 172.854 173.950 -1.096 1
1 234 . 12 1 1 A 25 25 VAL CA C 25 61.617 60.989 0.628 1
1 235 . 12 1 1 A 25 25 VAL CB C 25 36.742 34.549 2.193 1
1 238 . 12 1 1 A 25 25 VAL N N 25 117.023 121.031 -4.008 1
1 239 . 12 1 1 A 26 26 HIS H H 26 8.915 9.173 -0.258 1
1 240 . 12 1 1 A 26 26 HIS HA H 26 5.765 5.460 0.305 1
1 245 . 12 1 1 A 26 26 HIS C C 26 173.976 173.366 0.610 1
1 246 . 12 1 1 A 26 26 HIS CA C 26 52.896 53.686 -0.790 1
1 247 . 12 1 1 A 26 26 HIS CB C 26 34.004 32.955 1.049 1
1 250 . 12 1 1 A 26 26 HIS N N 26 128.155 127.633 0.522 1
1 251 . 12 1 1 A 27 27 LEU H H 27 9.034 9.446 -0.412 1
1 252 . 12 1 1 A 27 27 LEU HA H 27 5.505 5.271 0.234 1
1 262 . 12 1 1 A 27 27 LEU C C 27 174.821 174.702 0.119 1
1 263 . 12 1 1 A 27 27 LEU CA C 27 53.376 53.511 -0.135 1
1 264 . 12 1 1 A 27 27 LEU CB C 27 46.306 46.978 -0.672 1
1 268 . 12 1 1 A 27 27 LEU N N 27 128.569 129.954 -1.385 1
1 269 . 12 1 1 A 28 28 THR H H 28 8.844 8.310 0.534 1
1 270 . 12 1 1 A 28 28 THR HA H 28 4.485 4.840 -0.355 1
1 275 . 12 1 1 A 28 28 THR C C 28 172.773 173.296 -0.523 1
1 276 . 12 1 1 A 28 28 THR CA C 28 60.052 60.661 -0.609 1
1 277 . 12 1 1 A 28 28 THR CB C 28 71.704 71.475 0.229 1
1 279 . 12 1 1 A 28 28 THR N N 28 112.165 112.719 -0.554 1
1 280 . 12 1 1 A 29 29 TRP H H 29 7.395 7.938 -0.543 1
1 281 . 12 1 1 A 29 29 TRP HA H 29 4.915 5.712 -0.797 1
1 290 . 12 1 1 A 29 29 TRP C C 29 174.013 173.203 0.810 1
1 291 . 12 1 1 A 29 29 TRP CA C 29 56.626 54.897 1.729 1
1 292 . 12 1 1 A 29 29 TRP CB C 29 29.487 31.538 -2.051 1
1 298 . 12 1 1 A 29 29 TRP N N 29 115.623 119.808 -4.185 1
1 300 . 12 1 1 A 30 30 GLN H H 30 8.759 8.489 0.270 1
1 301 . 12 1 1 A 30 30 GLN HA H 30 4.641 4.839 -0.198 1
1 308 . 12 1 1 A 30 30 GLN C C 30 175.072 174.148 0.924 1
1 309 . 12 1 1 A 30 30 GLN CA C 30 52.975 52.989 -0.014 1
1 310 . 12 1 1 A 30 30 GLN CB C 30 28.398 29.103 -0.705 1
1 312 . 12 1 1 A 30 30 GLN N N 30 117.497 119.967 -2.470 1
1 314 . 12 1 1 A 31 31 PRO HA H 31 4.487 4.517 -0.030 1
1 320 . 12 1 1 A 31 31 PRO C C 31 177.034 175.440 1.594 1
1 321 . 12 1 1 A 31 31 PRO CA C 31 62.710 62.357 0.353 1
1 322 . 12 1 1 A 31 31 PRO CB C 31 32.738 32.775 -0.037 1
1 325 . 12 1 1 A 32 32 SER H H 32 8.259 8.581 -0.322 1
1 326 . 12 1 1 A 32 32 SER HA H 32 4.670 5.082 -0.412 1
1 329 . 12 1 1 A 32 32 SER C C 32 174.689 173.479 1.210 1
1 330 . 12 1 1 A 32 32 SER CA C 32 57.296 56.754 0.542 1
1 331 . 12 1 1 A 32 32 SER CB C 32 64.748 66.505 -1.757 1
1 332 . 12 1 1 A 32 32 SER N N 32 117.667 115.318 2.349 1
1 333 . 12 1 1 A 33 33 ALA H H 33 9.038 8.571 0.467 1
1 334 . 12 1 1 A 33 33 ALA HA H 33 4.126 4.176 -0.050 1
1 338 . 12 1 1 A 33 33 ALA C C 33 177.795 178.248 -0.453 1
1 339 . 12 1 1 A 33 33 ALA CA C 33 54.213 53.365 0.848 1
1 340 . 12 1 1 A 33 33 ALA CB C 33 17.948 18.734 -0.786 1
1 341 . 12 1 1 A 33 33 ALA N N 33 131.772 126.720 5.052 1
1 342 . 12 1 1 A 34 34 GLY H H 34 8.576 8.950 -0.374 1
1 343 . 12 1 1 A 34 34 GLY HA2 H 34 4.171 4.012 0.159 1
1 344 . 12 1 1 A 34 34 GLY HA3 H 34 3.592 4.013 -0.421 1
1 345 . 12 1 1 A 34 34 GLY C C 34 174.182 174.419 -0.237 1
1 346 . 12 1 1 A 34 34 GLY CA C 34 44.987 44.990 -0.003 1
1 347 . 12 1 1 A 34 34 GLY N N 34 111.339 111.577 -0.238 1
1 348 . 12 1 1 A 35 35 ALA H H 35 7.637 7.899 -0.262 1
1 349 . 12 1 1 A 35 35 ALA HA H 35 4.210 4.739 -0.529 1
1 353 . 12 1 1 A 35 35 ALA C C 35 178.918 178.442 0.476 1
1 354 . 12 1 1 A 35 35 ALA CA C 35 52.671 52.825 -0.154 1
1 355 . 12 1 1 A 35 35 ALA CB C 35 18.988 19.733 -0.745 1
1 356 . 12 1 1 A 35 35 ALA N N 35 121.531 123.816 -2.285 1
1 357 . 12 1 1 A 36 36 THR H H 36 9.428 8.956 0.472 1
1 358 . 12 1 1 A 36 36 THR HA H 36 4.402 4.424 -0.022 1
1 363 . 12 1 1 A 36 36 THR C C 36 174.739 174.366 0.373 1
1 364 . 12 1 1 A 36 36 THR CA C 36 62.692 63.279 -0.587 1
1 365 . 12 1 1 A 36 36 THR CB C 36 69.482 69.767 -0.285 1
1 367 . 12 1 1 A 36 36 THR N N 36 113.103 118.542 -5.439 1
1 368 . 12 1 1 A 37 37 HIS H H 37 7.857 7.270 0.587 1
1 369 . 12 1 1 A 37 37 HIS HA H 37 4.878 4.494 0.384 1
1 374 . 12 1 1 A 37 37 HIS C C 37 171.103 172.034 -0.931 1
1 375 . 12 1 1 A 37 37 HIS CA C 37 55.867 54.398 1.469 1
1 376 . 12 1 1 A 37 37 HIS CB C 37 32.655 31.223 1.432 1
1 379 . 12 1 1 A 37 37 HIS N N 37 118.486 116.644 1.842 1
1 380 . 12 1 1 A 38 38 TYR H H 38 9.217 8.748 0.469 1
1 381 . 12 1 1 A 38 38 TYR HA H 38 5.303 5.303 0.000 1
1 388 . 12 1 1 A 38 38 TYR C C 38 173.922 174.285 -0.363 1
1 389 . 12 1 1 A 38 38 TYR CA C 38 56.504 56.138 0.366 1
1 390 . 12 1 1 A 38 38 TYR CB C 38 41.823 41.901 -0.078 1
1 395 . 12 1 1 A 38 38 TYR N N 38 114.077 118.330 -4.253 1
1 396 . 12 1 1 A 39 39 LEU H H 39 9.052 8.564 0.488 1
1 397 . 12 1 1 A 39 39 LEU HA H 39 5.061 4.915 0.146 1
1 407 . 12 1 1 A 39 39 LEU C C 39 175.455 174.705 0.750 1
1 408 . 12 1 1 A 39 39 LEU CA C 39 53.855 54.066 -0.211 1
1 409 . 12 1 1 A 39 39 LEU CB C 39 45.254 44.450 0.804 1
1 413 . 12 1 1 A 39 39 LEU N N 39 123.997 126.131 -2.134 1
1 414 . 12 1 1 A 40 40 VAL H H 40 9.520 9.201 0.319 1
1 415 . 12 1 1 A 40 40 VAL HA H 40 4.988 5.218 -0.230 1
1 423 . 12 1 1 A 40 40 VAL C C 40 174.578 174.893 -0.315 1
1 424 . 12 1 1 A 40 40 VAL CA C 40 60.575 60.827 -0.252 1
1 425 . 12 1 1 A 40 40 VAL CB C 40 33.284 34.687 -1.403 1
1 428 . 12 1 1 A 40 40 VAL N N 40 129.678 127.965 1.713 1
1 429 . 12 1 1 A 41 41 ARG H H 41 9.096 8.694 0.402 1
1 430 . 12 1 1 A 41 41 ARG HA H 41 5.384 5.380 0.004 1
1 437 . 12 1 1 A 41 41 ARG C C 41 175.100 174.170 0.930 1
1 438 . 12 1 1 A 41 41 ARG CA C 41 54.297 53.840 0.457 1
1 439 . 12 1 1 A 41 41 ARG CB C 41 33.003 32.964 0.039 1
1 442 . 12 1 1 A 41 41 ARG N N 41 126.332 125.689 0.643 1
1 443 . 12 1 1 A 42 42 CYS H H 42 9.004 9.187 -0.183 1
1 444 . 12 1 1 A 42 42 CYS HA H 42 5.309 5.216 0.093 1
1 447 . 12 1 1 A 42 42 CYS C C 42 173.417 173.848 -0.431 1
1 448 . 12 1 1 A 42 42 CYS CA C 42 57.508 57.052 0.456 1
1 449 . 12 1 1 A 42 42 CYS CB C 42 28.859 29.800 -0.941 1
1 450 . 12 1 1 A 42 42 CYS N N 42 123.359 125.502 -2.143 1
1 451 . 12 1 1 A 43 43 SER H H 43 9.102 8.725 0.377 1
1 452 . 12 1 1 A 43 43 SER HA H 43 5.324 4.973 0.351 1
1 455 . 12 1 1 A 43 43 SER C C 43 171.429 171.553 -0.124 1
1 456 . 12 1 1 A 43 43 SER CA C 43 55.621 55.896 -0.275 1
1 457 . 12 1 1 A 43 43 SER CB C 43 64.856 65.987 -1.131 1
1 458 . 12 1 1 A 43 43 SER N N 43 125.444 122.127 3.317 1
1 459 . 12 1 1 A 44 44 PRO HA H 44 4.389 4.581 -0.192 1
1 466 . 12 1 1 A 44 44 PRO C C 44 176.559 177.130 -0.571 1
1 467 . 12 1 1 A 44 44 PRO CA C 44 63.027 62.870 0.157 1
1 468 . 12 1 1 A 44 44 PRO CB C 44 31.935 32.818 -0.883 1
1 471 . 12 1 1 A 45 45 ALA H H 45 8.261 8.001 0.260 1
1 472 . 12 1 1 A 45 45 ALA HA H 45 4.157 4.123 0.034 1
1 476 . 12 1 1 A 45 45 ALA C C 45 177.706 176.794 0.912 1
1 477 . 12 1 1 A 45 45 ALA CA C 45 53.284 53.850 -0.566 1
1 478 . 12 1 1 A 45 45 ALA CB C 45 18.978 19.129 -0.151 1
1 479 . 12 1 1 A 45 45 ALA N N 45 126.162 123.756 2.406 1
1 480 . 12 1 1 A 46 46 SER H H 46 8.275 7.648 0.627 1
1 481 . 12 1 1 A 46 46 SER HA H 46 4.779 4.731 0.048 1
1 484 . 12 1 1 A 46 46 SER C C 46 172.182 173.880 -1.698 1
1 485 . 12 1 1 A 46 46 SER CA C 46 55.091 54.779 0.312 1
1 486 . 12 1 1 A 46 46 SER CB C 46 63.130 64.462 -1.332 1
1 487 . 12 1 1 A 46 46 SER N N 46 113.009 115.111 -2.102 1
1 488 . 12 1 1 A 47 47 PRO HA H 47 4.336 4.568 -0.232 1
1 493 . 12 1 1 A 47 47 PRO C C 47 177.165 176.296 0.869 1
1 494 . 12 1 1 A 47 47 PRO CA C 47 63.268 63.760 -0.492 1
1 495 . 12 1 1 A 47 47 PRO CB C 47 32.528 31.605 0.923 1
1 498 . 12 1 1 A 48 48 LYS H H 48 9.089 7.696 1.393 1
1 499 . 12 1 1 A 48 48 LYS HA H 48 4.408 4.113 0.295 1
1 508 . 12 1 1 A 48 48 LYS C C 48 176.917 176.874 0.043 1
1 509 . 12 1 1 A 48 48 LYS CA C 48 55.893 57.941 -2.048 1
1 510 . 12 1 1 A 48 48 LYS CB C 48 32.997 31.856 1.141 1
1 514 . 12 1 1 A 48 48 LYS N N 48 122.579 119.391 3.188 1
1 515 . 12 1 1 A 49 49 GLY HA2 H 49 4.021 4.141 -0.120 1
1 516 . 12 1 1 A 49 49 GLY HA3 H 49 3.881 4.142 -0.261 1
1 517 . 12 1 1 A 49 49 GLY C C 49 174.552 172.865 1.687 1
1 518 . 12 1 1 A 49 49 GLY CA C 49 46.011 44.178 1.833 1
1 519 . 12 1 1 A 50 50 GLU H H 50 8.608 8.481 0.127 1
1 520 . 12 1 1 A 50 50 GLU HA H 50 4.335 4.936 -0.601 1
1 525 . 12 1 1 A 50 50 GLU C C 50 176.672 175.550 1.122 1
1 526 . 12 1 1 A 50 50 GLU CA C 50 56.978 55.499 1.479 1
1 527 . 12 1 1 A 50 50 GLU CB C 50 29.458 30.267 -0.809 1
1 529 . 12 1 1 A 50 50 GLU N N 50 121.378 119.165 2.213 1
1 530 . 12 1 1 A 51 51 GLU H H 51 8.287 8.740 -0.453 1
1 531 . 12 1 1 A 51 51 GLU HA H 51 4.381 4.797 -0.416 1
1 536 . 12 1 1 A 51 51 GLU C C 51 176.218 174.570 1.648 1
1 537 . 12 1 1 A 51 51 GLU CA C 51 56.996 54.754 2.242 1
1 538 . 12 1 1 A 51 51 GLU CB C 51 31.066 32.515 -1.449 1
1 540 . 12 1 1 A 51 51 GLU N N 51 120.863 121.879 -1.016 1
1 541 . 12 1 1 A 52 52 GLU H H 52 8.445 8.740 -0.295 1
1 542 . 12 1 1 A 52 52 GLU HA H 52 4.464 4.824 -0.360 1
1 547 . 12 1 1 A 52 52 GLU C C 52 176.128 176.230 -0.102 1
1 548 . 12 1 1 A 52 52 GLU CA C 52 55.955 55.237 0.718 1
1 549 . 12 1 1 A 52 52 GLU CB C 52 31.691 31.860 -0.169 1
1 551 . 12 1 1 A 52 52 GLU N N 52 121.103 122.352 -1.249 1
1 552 . 12 1 1 A 53 53 GLU H H 53 8.441 8.574 -0.133 1
1 553 . 12 1 1 A 53 53 GLU HA H 53 4.609 4.677 -0.068 1
1 558 . 12 1 1 A 53 53 GLU C C 53 175.816 175.965 -0.149 1
1 559 . 12 1 1 A 53 53 GLU CA C 53 56.697 56.398 0.299 1
1 560 . 12 1 1 A 53 53 GLU CB C 53 31.022 30.587 0.435 1
1 562 . 12 1 1 A 53 53 GLU N N 53 121.949 124.135 -2.186 1
1 563 . 12 1 1 A 54 54 ARG H H 54 8.569 8.508 0.061 1
1 564 . 12 1 1 A 54 54 ARG HA H 54 4.768 4.650 0.118 1
1 571 . 12 1 1 A 54 54 ARG C C 54 174.881 174.992 -0.111 1
1 572 . 12 1 1 A 54 54 ARG CA C 54 54.950 56.152 -1.202 1
1 573 . 12 1 1 A 54 54 ARG CB C 54 33.374 31.137 2.237 1
1 576 . 12 1 1 A 54 54 ARG N N 54 123.714 125.017 -1.303 1
1 577 . 12 1 1 A 55 55 GLU H H 55 8.650 8.847 -0.197 1
1 578 . 12 1 1 A 55 55 GLU HA H 55 5.493 5.234 0.259 1
1 583 . 12 1 1 A 55 55 GLU C C 55 175.566 175.186 0.380 1
1 584 . 12 1 1 A 55 55 GLU CA C 55 54.915 54.915 0.000 1
1 585 . 12 1 1 A 55 55 GLU CB C 55 33.250 33.149 0.101 1
1 587 . 12 1 1 A 55 55 GLU N N 55 123.537 127.189 -3.652 1
1 588 . 12 1 1 A 56 56 VAL H H 56 9.419 9.018 0.401 1
1 589 . 12 1 1 A 56 56 VAL HA H 56 4.524 4.868 -0.344 1
1 597 . 12 1 1 A 56 56 VAL C C 56 173.502 174.217 -0.715 1
1 598 . 12 1 1 A 56 56 VAL CA C 56 60.981 59.156 1.825 1
1 599 . 12 1 1 A 56 56 VAL CB C 56 36.117 36.250 -0.133 1
1 602 . 12 1 1 A 56 56 VAL N N 56 123.343 119.102 4.241 1
1 603 . 12 1 1 A 57 57 GLN H H 57 8.767 8.686 0.081 1
1 604 . 12 1 1 A 57 57 GLN HA H 57 5.671 5.143 0.528 1
1 611 . 12 1 1 A 57 57 GLN C C 57 176.357 175.066 1.291 1
1 612 . 12 1 1 A 57 57 GLN CA C 57 54.735 53.930 0.805 1
1 613 . 12 1 1 A 57 57 GLN CB C 57 30.781 31.643 -0.862 1
1 615 . 12 1 1 A 57 57 GLN N N 57 125.639 121.086 4.553 1
1 617 . 12 1 1 A 58 58 VAL H H 58 9.217 8.793 0.424 1
1 618 . 12 1 1 A 58 58 VAL HA H 58 5.129 4.839 0.290 1
1 626 . 12 1 1 A 58 58 VAL C C 58 175.925 176.715 -0.790 1
1 627 . 12 1 1 A 58 58 VAL CA C 58 59.652 59.955 -0.303 1
1 628 . 12 1 1 A 58 58 VAL CB C 58 36.540 34.980 1.560 1
1 631 . 12 1 1 A 58 58 VAL N N 58 117.022 117.858 -0.836 1
1 632 . 12 1 1 A 59 59 GLY H H 59 9.008 8.775 0.233 1
1 633 . 12 1 1 A 59 59 GLY HA2 H 59 4.670 3.719 0.951 1
1 634 . 12 1 1 A 59 59 GLY HA3 H 59 3.914 3.805 0.109 1
1 635 . 12 1 1 A 59 59 GLY C C 59 173.386 173.961 -0.575 1
1 636 . 12 1 1 A 59 59 GLY CA C 59 45.093 45.727 -0.634 1
1 637 . 12 1 1 A 59 59 GLY N N 59 109.174 111.154 -1.980 1
1 638 . 12 1 1 A 60 60 ARG H H 60 7.695 7.582 0.113 1
1 639 . 12 1 1 A 60 60 ARG HA H 60 4.866 5.113 -0.247 1
1 645 . 12 1 1 A 60 60 ARG C C 60 173.760 175.773 -2.013 1
1 646 . 12 1 1 A 60 60 ARG CA C 60 52.764 53.609 -0.845 1
1 647 . 12 1 1 A 60 60 ARG CB C 60 31.785 32.474 -0.689 1
1 650 . 12 1 1 A 60 60 ARG N N 60 118.520 117.915 0.605 1
1 651 . 12 1 1 A 61 61 PRO HA H 61 3.539 4.316 -0.777 1
1 658 . 12 1 1 A 61 61 PRO C C 61 173.175 173.878 -0.703 1
1 659 . 12 1 1 A 61 61 PRO CA C 61 62.265 63.234 -0.969 1
1 660 . 12 1 1 A 61 61 PRO CB C 61 27.546 31.056 -3.510 1
1 663 . 12 1 1 A 62 62 GLU H H 62 7.879 7.564 0.315 1
1 664 . 12 1 1 A 62 62 GLU HA H 62 4.071 4.425 -0.354 1
1 669 . 12 1 1 A 62 62 GLU C C 62 174.107 174.607 -0.500 1
1 670 . 12 1 1 A 62 62 GLU CA C 62 55.229 54.459 0.770 1
1 671 . 12 1 1 A 62 62 GLU CB C 62 32.838 32.546 0.292 1
1 673 . 12 1 1 A 62 62 GLU N N 62 118.173 113.859 4.314 1
1 674 . 12 1 1 A 63 63 VAL H H 63 8.930 8.244 0.686 1
1 675 . 12 1 1 A 63 63 VAL HA H 63 4.548 4.921 -0.373 1
1 683 . 12 1 1 A 63 63 VAL C C 63 170.325 173.142 -2.817 1
1 684 . 12 1 1 A 63 63 VAL CA C 63 60.770 59.492 1.278 1
1 685 . 12 1 1 A 63 63 VAL CB C 63 35.394 35.952 -0.558 1
1 688 . 12 1 1 A 63 63 VAL N N 63 117.161 120.635 -3.474 1
1 689 . 12 1 1 A 64 64 LEU H H 64 8.332 8.836 -0.504 1
1 690 . 12 1 1 A 64 64 LEU HA H 64 5.122 5.152 -0.030 1
1 700 . 12 1 1 A 64 64 LEU C C 64 176.243 174.578 1.665 1
1 701 . 12 1 1 A 64 64 LEU CA C 64 53.346 53.776 -0.430 1
1 702 . 12 1 1 A 64 64 LEU CB C 64 42.649 44.928 -2.279 1
1 706 . 12 1 1 A 64 64 LEU N N 64 130.510 128.249 2.261 1
1 707 . 12 1 1 A 65 65 LEU H H 65 9.261 9.226 0.035 1
1 708 . 12 1 1 A 65 65 LEU HA H 65 4.443 4.785 -0.342 1
1 718 . 12 1 1 A 65 65 LEU C C 65 174.016 175.859 -1.843 1
1 719 . 12 1 1 A 65 65 LEU CA C 65 53.920 54.090 -0.170 1
1 720 . 12 1 1 A 65 65 LEU CB C 65 42.976 41.508 1.468 1
1 724 . 12 1 1 A 65 65 LEU N N 65 128.611 128.918 -0.307 1
1 725 . 12 1 1 A 66 66 ASP H H 66 8.105 8.654 -0.549 1
1 726 . 12 1 1 A 66 66 ASP HA H 66 5.207 4.881 0.326 1
1 729 . 12 1 1 A 66 66 ASP C C 66 176.161 176.522 -0.361 1
1 730 . 12 1 1 A 66 66 ASP CA C 66 51.001 54.426 -3.425 1
1 731 . 12 1 1 A 66 66 ASP CB C 66 42.836 41.295 1.541 1
1 732 . 12 1 1 A 66 66 ASP N N 66 121.799 125.429 -3.630 1
1 733 . 12 1 1 A 67 67 GLY H H 67 8.688 8.770 -0.082 1
1 734 . 12 1 1 A 67 67 GLY HA2 H 67 3.923 3.953 -0.030 1
1 735 . 12 1 1 A 67 67 GLY HA3 H 67 3.808 3.960 -0.152 1
1 736 . 12 1 1 A 67 67 GLY C C 67 175.500 174.230 1.270 1
1 737 . 12 1 1 A 67 67 GLY CA C 67 46.591 46.660 -0.069 1
1 738 . 12 1 1 A 67 67 GLY N N 67 106.518 111.108 -4.590 1
1 739 . 12 1 1 A 68 68 LEU H H 68 8.125 7.860 0.265 1
1 740 . 12 1 1 A 68 68 LEU HA H 68 4.252 4.921 -0.669 1
1 750 . 12 1 1 A 68 68 LEU C C 68 174.914 175.360 -0.446 1
1 751 . 12 1 1 A 68 68 LEU CA C 68 53.469 53.090 0.379 1
1 752 . 12 1 1 A 68 68 LEU CB C 68 40.422 45.713 -5.291 1
1 756 . 12 1 1 A 68 68 LEU N N 68 119.345 120.166 -0.821 1
1 757 . 12 1 1 A 69 69 GLU H H 69 8.207 8.102 0.105 1
1 758 . 12 1 1 A 69 69 GLU HA H 69 4.908 4.846 0.062 1
1 763 . 12 1 1 A 69 69 GLU C C 69 174.464 174.442 0.022 1
1 764 . 12 1 1 A 69 69 GLU CA C 69 53.081 53.536 -0.455 1
1 765 . 12 1 1 A 69 69 GLU CB C 69 31.538 30.107 1.431 1
1 767 . 12 1 1 A 69 69 GLU N N 69 119.486 121.246 -1.760 1
1 768 . 12 1 1 A 70 70 PRO HA H 70 4.866 4.341 0.525 1
1 775 . 12 1 1 A 70 70 PRO C C 70 178.285 177.666 0.619 1
1 776 . 12 1 1 A 70 70 PRO CA C 70 63.203 63.759 -0.556 1
1 777 . 12 1 1 A 70 70 PRO CB C 70 33.726 31.276 2.450 1
1 780 . 12 1 1 A 71 71 GLY H H 71 7.362 8.624 -1.262 1
1 781 . 12 1 1 A 71 71 GLY HA2 H 71 3.807 3.971 -0.164 1
1 782 . 12 1 1 A 71 71 GLY HA3 H 71 3.756 3.976 -0.220 1
1 783 . 12 1 1 A 71 71 GLY C C 71 174.664 173.730 0.934 1
1 784 . 12 1 1 A 71 71 GLY CA C 71 46.926 46.464 0.462 1
1 785 . 12 1 1 A 71 71 GLY N N 71 113.776 112.225 1.551 1
1 786 . 12 1 1 A 72 72 ARG H H 72 8.036 7.396 0.640 1
1 787 . 12 1 1 A 72 72 ARG HA H 72 4.597 4.821 -0.224 1
1 793 . 12 1 1 A 72 72 ARG C C 72 173.293 173.816 -0.523 1
1 794 . 12 1 1 A 72 72 ARG CA C 72 54.633 54.420 0.213 1
1 795 . 12 1 1 A 72 72 ARG CB C 72 33.704 33.577 0.127 1
1 798 . 12 1 1 A 72 72 ARG N N 72 119.611 119.512 0.099 1
1 799 . 12 1 1 A 73 73 ASP H H 73 7.785 8.450 -0.665 1
1 800 . 12 1 1 A 73 73 ASP HA H 73 5.276 5.288 -0.012 1
1 803 . 12 1 1 A 73 73 ASP C C 73 175.904 175.005 0.899 1
1 804 . 12 1 1 A 73 73 ASP CA C 73 53.568 52.867 0.701 1
1 805 . 12 1 1 A 73 73 ASP CB C 73 42.970 43.121 -0.151 1
1 806 . 12 1 1 A 73 73 ASP N N 73 118.900 125.071 -6.171 1
1 807 . 12 1 1 A 74 74 TYR H H 74 9.516 8.963 0.553 1
1 808 . 12 1 1 A 74 74 TYR HA H 74 4.800 5.136 -0.336 1
1 815 . 12 1 1 A 74 74 TYR C C 74 174.631 174.952 -0.321 1
1 816 . 12 1 1 A 74 74 TYR CA C 74 58.548 56.476 2.072 1
1 817 . 12 1 1 A 74 74 TYR CB C 74 42.029 43.612 -1.583 1
1 822 . 12 1 1 A 74 74 TYR N N 74 121.903 120.417 1.486 1
1 823 . 12 1 1 A 75 75 GLU H H 75 9.248 8.939 0.309 1
1 824 . 12 1 1 A 75 75 GLU HA H 75 4.756 4.887 -0.131 1
1 829 . 12 1 1 A 75 75 GLU C C 75 175.524 175.336 0.188 1
1 830 . 12 1 1 A 75 75 GLU CA C 75 55.621 55.300 0.321 1
1 831 . 12 1 1 A 75 75 GLU CB C 75 30.778 30.487 0.291 1
1 833 . 12 1 1 A 75 75 GLU N N 75 122.425 122.177 0.248 1
1 834 . 12 1 1 A 76 76 VAL H H 76 8.884 8.732 0.152 1
1 835 . 12 1 1 A 76 76 VAL HA H 76 5.246 4.602 0.644 1
1 843 . 12 1 1 A 76 76 VAL C C 76 174.800 175.424 -0.624 1
1 844 . 12 1 1 A 76 76 VAL CA C 76 60.199 62.314 -2.115 1
1 845 . 12 1 1 A 76 76 VAL CB C 76 33.449 31.603 1.846 1
1 848 . 12 1 1 A 76 76 VAL N N 76 126.853 125.031 1.822 1
1 849 . 12 1 1 A 77 77 SER H H 77 9.234 8.671 0.563 1
1 850 . 12 1 1 A 77 77 SER HA H 77 5.398 5.440 -0.042 1
1 853 . 12 1 1 A 77 77 SER C C 77 173.138 173.611 -0.473 1
1 854 . 12 1 1 A 77 77 SER CA C 77 56.032 56.536 -0.504 1
1 855 . 12 1 1 A 77 77 SER CB C 77 66.374 64.799 1.575 1
1 856 . 12 1 1 A 77 77 SER N N 77 120.852 121.668 -0.816 1
1 857 . 12 1 1 A 78 78 VAL H H 78 9.092 8.822 0.270 1
1 858 . 12 1 1 A 78 78 VAL HA H 78 4.756 4.814 -0.058 1
1 866 . 12 1 1 A 78 78 VAL C C 78 173.641 174.755 -1.114 1
1 867 . 12 1 1 A 78 78 VAL CA C 78 61.246 60.443 0.803 1
1 868 . 12 1 1 A 78 78 VAL CB C 78 34.467 33.328 1.139 1
1 871 . 12 1 1 A 78 78 VAL N N 78 122.453 125.219 -2.766 1
1 872 . 12 1 1 A 79 79 GLN H H 79 8.587 8.110 0.477 1
1 873 . 12 1 1 A 79 79 GLN HA H 79 4.438 4.610 -0.172 1
1 880 . 12 1 1 A 79 79 GLN C C 79 174.999 173.889 1.110 1
1 881 . 12 1 1 A 79 79 GLN CA C 79 54.227 54.585 -0.358 1
1 882 . 12 1 1 A 79 79 GLN CB C 79 33.587 32.595 0.992 1
1 884 . 12 1 1 A 79 79 GLN N N 79 125.619 125.155 0.464 1
1 886 . 12 1 1 A 80 80 SER H H 80 8.623 8.838 -0.215 1
1 887 . 12 1 1 A 80 80 SER HA H 80 4.756 4.896 -0.140 1
1 890 . 12 1 1 A 80 80 SER C C 80 172.264 173.662 -1.398 1
1 891 . 12 1 1 A 80 80 SER CA C 80 58.177 58.158 0.019 1
1 892 . 12 1 1 A 80 80 SER CB C 80 63.920 62.720 1.200 1
1 893 . 12 1 1 A 80 80 SER N N 80 122.844 124.479 -1.635 1
1 894 . 12 1 1 A 81 81 LEU H H 81 8.348 8.645 -0.297 1
1 895 . 12 1 1 A 81 81 LEU HA H 81 5.124 4.520 0.604 1
1 905 . 12 1 1 A 81 81 LEU C C 81 175.775 176.557 -0.782 1
1 906 . 12 1 1 A 81 81 LEU CA C 81 54.033 54.035 -0.002 1
1 907 . 12 1 1 A 81 81 LEU CB C 81 44.690 42.142 2.548 1
1 911 . 12 1 1 A 81 81 LEU N N 81 123.191 127.132 -3.941 1
1 912 . 12 1 1 A 82 82 ARG H H 82 8.374 9.152 -0.778 1
1 913 . 12 1 1 A 82 82 ARG HA H 82 4.616 4.612 0.004 1
1 919 . 12 1 1 A 82 82 ARG C C 82 176.864 176.140 0.724 1
1 920 . 12 1 1 A 82 82 ARG CA C 82 55.868 56.763 -0.895 1
1 921 . 12 1 1 A 82 82 ARG CB C 82 32.322 32.857 -0.535 1
1 924 . 12 1 1 A 82 82 ARG N N 82 121.029 124.193 -3.164 1
1 925 . 12 1 1 A 83 83 GLY H H 83 8.309 7.531 0.778 1
1 926 . 12 1 1 A 83 83 GLY HA2 H 83 4.031 4.109 -0.078 1
1 927 . 12 1 1 A 83 83 GLY HA3 H 83 3.888 4.115 -0.227 1
1 928 . 12 1 1 A 83 83 GLY C C 83 174.562 174.109 0.453 1
1 929 . 12 1 1 A 83 83 GLY CA C 83 45.963 46.100 -0.137 1
1 930 . 12 1 1 A 83 83 GLY N N 83 109.937 107.125 2.812 1
1 931 . 12 1 1 A 84 84 PRO HA H 84 4.573 4.355 0.218 1
1 938 . 12 1 1 A 84 84 PRO C C 84 176.533 176.138 0.395 1
1 939 . 12 1 1 A 84 84 PRO CA C 84 63.485 64.841 -1.356 1
1 940 . 12 1 1 A 84 84 PRO CB C 84 32.409 31.965 0.444 1
1 943 . 12 1 1 A 85 85 GLU H H 85 7.799 7.655 0.144 1
1 944 . 12 1 1 A 85 85 GLU HA H 85 4.369 4.796 -0.427 1
1 949 . 12 1 1 A 85 85 GLU C C 85 174.722 175.984 -1.262 1
1 950 . 12 1 1 A 85 85 GLU CA C 85 55.899 54.904 0.995 1
1 951 . 12 1 1 A 85 85 GLU CB C 85 31.911 33.014 -1.103 1
1 953 . 12 1 1 A 85 85 GLU N N 85 122.093 112.472 9.621 1
1 954 . 12 1 1 A 86 86 GLY H H 86 8.329 8.701 -0.372 1
1 955 . 12 1 1 A 86 86 GLY HA2 H 86 5.298 4.184 1.114 1
1 956 . 12 1 1 A 86 86 GLY HA3 H 86 3.559 4.187 -0.628 1
1 957 . 12 1 1 A 86 86 GLY C C 86 174.355 172.931 1.424 1
1 958 . 12 1 1 A 86 86 GLY CA C 86 44.034 43.903 0.131 1
1 959 . 12 1 1 A 86 86 GLY N N 86 109.387 109.181 0.206 1
1 960 . 12 1 1 A 87 87 SER H H 87 8.807 8.220 0.587 1
1 961 . 12 1 1 A 87 87 SER HA H 87 4.670 4.933 -0.263 1
1 964 . 12 1 1 A 87 87 SER C C 87 175.195 174.208 0.987 1
1 965 . 12 1 1 A 87 87 SER CA C 87 57.737 56.358 1.379 1
1 966 . 12 1 1 A 87 87 SER CB C 87 67.829 66.000 1.829 1
1 967 . 12 1 1 A 87 87 SER N N 87 117.698 113.463 4.235 1
1 968 . 12 1 1 A 88 88 GLU H H 88 8.754 8.189 0.565 1
1 969 . 12 1 1 A 88 88 GLU HA H 88 4.357 4.274 0.083 1
1 974 . 12 1 1 A 88 88 GLU C C 88 177.474 176.032 1.442 1
1 975 . 12 1 1 A 88 88 GLU CA C 88 57.525 56.418 1.107 1
1 976 . 12 1 1 A 88 88 GLU CB C 88 31.162 30.556 0.606 1
1 978 . 12 1 1 A 88 88 GLU N N 88 118.709 121.034 -2.325 1
1 979 . 12 1 1 A 89 89 ALA H H 89 8.855 8.492 0.363 1
1 980 . 12 1 1 A 89 89 ALA HA H 89 4.792 4.897 -0.105 1
1 984 . 12 1 1 A 89 89 ALA C C 89 178.379 176.456 1.923 1
1 985 . 12 1 1 A 89 89 ALA CA C 89 51.264 50.863 0.401 1
1 986 . 12 1 1 A 89 89 ALA CB C 89 20.040 20.249 -0.209 1
1 987 . 12 1 1 A 89 89 ALA N N 89 127.301 125.699 1.602 1
1 988 . 12 1 1 A 90 90 ARG H H 90 8.549 8.724 -0.175 1
1 989 . 12 1 1 A 90 90 ARG HA H 90 4.658 4.953 -0.295 1
1 996 . 12 1 1 A 90 90 ARG C C 90 174.720 175.322 -0.602 1
1 997 . 12 1 1 A 90 90 ARG CA C 90 53.575 54.248 -0.673 1
1 998 . 12 1 1 A 90 90 ARG CB C 90 33.456 31.959 1.497 1
1 1001 . 12 1 1 A 90 90 ARG N N 90 121.289 123.130 -1.841 1
1 1002 . 12 1 1 A 91 91 GLY H H 91 8.396 8.913 -0.517 1
1 1003 . 12 1 1 A 91 91 GLY HA2 H 91 5.306 4.180 1.126 1
1 1004 . 12 1 1 A 91 91 GLY HA3 H 91 3.700 4.217 -0.517 1
1 1005 . 12 1 1 A 91 91 GLY C C 91 173.191 171.990 1.201 1
1 1006 . 12 1 1 A 91 91 GLY CA C 91 44.493 43.804 0.689 1
1 1007 . 12 1 1 A 91 91 GLY N N 91 108.579 112.122 -3.543 1
1 1008 . 12 1 1 A 92 92 ILE H H 92 8.891 8.481 0.410 1
1 1009 . 12 1 1 A 92 92 ILE HA H 92 4.499 4.958 -0.459 1
1 1019 . 12 1 1 A 92 92 ILE C C 92 171.877 174.164 -2.287 1
1 1020 . 12 1 1 A 92 92 ILE CA C 92 60.682 59.188 1.494 1
1 1021 . 12 1 1 A 92 92 ILE CB C 92 42.425 42.157 0.268 1
1 1025 . 12 1 1 A 92 92 ILE N N 92 118.313 121.796 -3.483 1
1 1026 . 12 1 1 A 93 93 ARG H H 93 7.980 8.515 -0.535 1
1 1027 . 12 1 1 A 93 93 ARG HA H 93 5.224 4.552 0.672 1
1 1034 . 12 1 1 A 93 93 ARG C C 93 175.072 175.374 -0.302 1
1 1035 . 12 1 1 A 93 93 ARG CA C 93 54.499 55.979 -1.480 1
1 1036 . 12 1 1 A 93 93 ARG CB C 93 31.767 30.837 0.930 1
1 1039 . 12 1 1 A 93 93 ARG N N 93 124.879 130.274 -5.395 1
1 1040 . 12 1 1 A 94 94 ALA H H 94 9.064 8.334 0.730 1
1 1041 . 12 1 1 A 94 94 ALA HA H 94 4.731 4.595 0.136 1
1 1045 . 12 1 1 A 94 94 ALA C C 94 174.494 176.891 -2.397 1
1 1046 . 12 1 1 A 94 94 ALA CA C 94 50.577 52.275 -1.698 1
1 1047 . 12 1 1 A 94 94 ALA CB C 94 23.082 20.168 2.914 1
1 1048 . 12 1 1 A 94 94 ALA N N 94 126.095 129.617 -3.522 1
1 1049 . 12 1 1 A 95 95 ARG H H 95 8.263 9.009 -0.746 1
1 1050 . 12 1 1 A 95 95 ARG HA H 95 5.548 5.216 0.332 1
1 1058 . 12 1 1 A 95 95 ARG C C 95 176.901 174.503 2.398 1
1 1059 . 12 1 1 A 95 95 ARG CA C 95 53.787 54.302 -0.515 1
1 1060 . 12 1 1 A 95 95 ARG CB C 95 32.426 35.005 -2.579 1
1 1063 . 12 1 1 A 95 95 ARG N N 95 123.374 116.819 6.555 1
1 1065 . 12 1 1 A 96 96 THR H H 96 9.208 8.799 0.409 1
1 1066 . 12 1 1 A 96 96 THR HA H 96 4.461 4.940 -0.479 1
1 1071 . 12 1 1 A 96 96 THR CA C 96 58.248 58.575 -0.327 1
1 1072 . 12 1 1 A 96 96 THR CB C 96 68.466 70.882 -2.416 1
1 1074 . 12 1 1 A 96 96 THR N N 96 119.492 111.348 8.144 1
1 1075 . 12 1 1 A 97 97 PRO HA H 97 4.636 4.642 -0.006 1
1 1082 . 12 1 1 A 97 97 PRO C C 97 175.725 175.531 0.194 1
1 1083 . 12 1 1 A 97 97 PRO CA C 97 61.907 62.329 -0.422 1
1 1084 . 12 1 1 A 97 97 PRO CB C 97 32.590 33.459 -0.869 1
1 1087 . 12 1 1 A 98 98 THR H H 98 7.943 8.296 -0.353 1
1 1088 . 12 1 1 A 98 98 THR HA H 98 4.208 5.070 -0.862 1
1 1093 . 12 1 1 A 98 98 THR C C 98 175.058 173.340 1.718 1
1 1094 . 12 1 1 A 98 98 THR CA C 98 62.069 60.150 1.919 1
1 1095 . 12 1 1 A 98 98 THR CB C 98 69.719 69.768 -0.049 1
1 1097 . 12 1 1 A 98 98 THR N N 98 107.148 110.094 -2.946 1
1 1098 . 12 1 1 A 99 99 SER H H 99 8.163 8.637 -0.474 1
1 1099 . 12 1 1 A 99 99 SER HA H 99 4.524 4.093 0.431 1
1 1102 . 12 1 1 A 99 99 SER C C 99 174.319 175.554 -1.235 1
1 1103 . 12 1 1 A 99 99 SER CA C 99 58.107 60.670 -2.563 1
1 1104 . 12 1 1 A 99 99 SER CB C 99 64.492 62.863 1.629 1
1 1105 . 12 1 1 A 99 99 SER N N 99 115.114 123.392 -8.278 1
1 1106 . 12 1 1 A 100 100 GLY H H 100 8.336 8.863 -0.527 1
1 1107 . 12 1 1 A 100 100 GLY HA2 H 100 4.222 4.040 0.182 1
1 1108 . 12 1 1 A 100 100 GLY HA3 H 100 4.222 4.041 0.181 1
1 1109 . 12 1 1 A 100 100 GLY C C 100 171.696 174.545 -2.849 1
1 1110 . 12 1 1 A 100 100 GLY CA C 100 44.617 46.249 -1.632 1
1 1111 . 12 1 1 A 100 100 GLY N N 100 110.678 114.069 -3.391 1
1 1112 . 12 1 1 A 101 101 PRO HA H 101 4.506 4.599 -0.093 1
1 1118 . 12 1 1 A 101 101 PRO CA C 101 63.358 62.624 0.734 1
1 1119 . 12 1 1 A 101 101 PRO CB C 101 32.313 32.869 -0.556 1
1 1 . 13 1 1 A 6 6 SER HA H 6 4.528 5.026 -0.498 1
1 3 . 13 1 1 A 6 6 SER CA C 6 58.373 57.296 1.077 1
1 4 . 13 1 1 A 6 6 SER CB C 6 63.978 64.461 -0.483 1
1 5 . 13 1 1 A 7 7 GLY H H 7 8.228 9.123 -0.895 1
1 6 . 13 1 1 A 7 7 GLY HA2 H 7 4.134 4.227 -0.093 1
1 7 . 13 1 1 A 7 7 GLY HA3 H 7 4.134 4.228 -0.094 1
1 8 . 13 1 1 A 7 7 GLY CA C 7 44.607 43.697 0.910 1
1 9 . 13 1 1 A 7 7 GLY N N 7 110.638 114.407 -3.769 1
1 10 . 13 1 1 A 8 8 PRO HA H 8 4.419 4.721 -0.302 1
1 17 . 13 1 1 A 8 8 PRO C C 8 176.908 175.330 1.578 1
1 18 . 13 1 1 A 8 8 PRO CA C 8 62.851 62.790 0.061 1
1 19 . 13 1 1 A 8 8 PRO CB C 8 32.243 31.173 1.070 1
1 22 . 13 1 1 A 9 9 LEU H H 9 8.462 8.767 -0.305 1
1 23 . 13 1 1 A 9 9 LEU HA H 9 4.494 4.742 -0.248 1
1 33 . 13 1 1 A 9 9 LEU C C 9 174.124 174.363 -0.239 1
1 34 . 13 1 1 A 9 9 LEU CA C 9 52.587 51.764 0.823 1
1 35 . 13 1 1 A 9 9 LEU CB C 9 43.150 44.227 -1.077 1
1 39 . 13 1 1 A 9 9 LEU N N 9 126.015 124.679 1.336 1
1 40 . 13 1 1 A 10 10 PRO HA H 10 4.820 4.617 0.203 1
1 47 . 13 1 1 A 10 10 PRO CA C 10 61.368 62.519 -1.151 1
1 48 . 13 1 1 A 10 10 PRO CB C 10 31.391 31.674 -0.283 1
1 51 . 13 1 1 A 11 11 PRO HA H 11 4.949 4.571 0.378 1
1 58 . 13 1 1 A 11 11 PRO CA C 11 61.183 61.795 -0.612 1
1 59 . 13 1 1 A 11 11 PRO CB C 11 30.656 31.905 -1.249 1
1 62 . 13 1 1 A 12 12 PRO HA H 12 4.341 4.581 -0.240 1
1 69 . 13 1 1 A 12 12 PRO C C 12 174.849 176.872 -2.023 1
1 70 . 13 1 1 A 12 12 PRO CA C 12 63.062 62.643 0.419 1
1 71 . 13 1 1 A 12 12 PRO CB C 12 31.831 31.522 0.309 1
1 74 . 13 1 1 A 13 13 ARG H H 13 7.828 8.989 -1.161 1
1 75 . 13 1 1 A 13 13 ARG HA H 13 4.536 4.441 0.095 1
1 82 . 13 1 1 A 13 13 ARG C C 13 174.608 177.504 -2.896 1
1 83 . 13 1 1 A 13 13 ARG CA C 13 54.774 57.147 -2.373 1
1 84 . 13 1 1 A 13 13 ARG CB C 13 33.250 31.749 1.501 1
1 87 . 13 1 1 A 13 13 ARG N N 13 120.532 124.074 -3.542 1
1 88 . 13 1 1 A 14 14 ALA H H 14 8.694 7.608 1.086 1
1 89 . 13 1 1 A 14 14 ALA HA H 14 3.986 4.355 -0.369 1
1 93 . 13 1 1 A 14 14 ALA C C 14 177.232 176.932 0.300 1
1 94 . 13 1 1 A 14 14 ALA CA C 14 52.461 52.457 0.004 1
1 95 . 13 1 1 A 14 14 ALA CB C 14 16.806 18.804 -1.998 1
1 96 . 13 1 1 A 14 14 ALA N N 14 121.921 119.792 2.129 1
1 97 . 13 1 1 A 15 15 LEU H H 15 8.097 7.346 0.751 1
1 98 . 13 1 1 A 15 15 LEU HA H 15 4.670 4.547 0.123 1
1 108 . 13 1 1 A 15 15 LEU C C 15 177.364 176.049 1.315 1
1 109 . 13 1 1 A 15 15 LEU CA C 15 57.543 54.605 2.938 1
1 110 . 13 1 1 A 15 15 LEU CB C 15 41.877 40.791 1.086 1
1 114 . 13 1 1 A 15 15 LEU N N 15 122.215 121.393 0.822 1
1 115 . 13 1 1 A 16 16 THR H H 16 9.520 8.443 1.077 1
1 116 . 13 1 1 A 16 16 THR HA H 16 4.369 4.702 -0.333 1
1 121 . 13 1 1 A 16 16 THR C C 16 172.453 173.239 -0.786 1
1 122 . 13 1 1 A 16 16 THR CA C 16 62.480 61.391 1.089 1
1 123 . 13 1 1 A 16 16 THR CB C 16 72.198 72.774 -0.576 1
1 125 . 13 1 1 A 16 16 THR N N 16 122.214 120.119 2.095 1
1 126 . 13 1 1 A 17 17 LEU H H 17 8.847 8.605 0.242 1
1 127 . 13 1 1 A 17 17 LEU HA H 17 4.573 4.356 0.217 1
1 137 . 13 1 1 A 17 17 LEU C C 17 174.695 176.805 -2.110 1
1 138 . 13 1 1 A 17 17 LEU CA C 17 53.840 55.345 -1.505 1
1 139 . 13 1 1 A 17 17 LEU CB C 17 40.290 42.644 -2.354 1
1 143 . 13 1 1 A 17 17 LEU N N 17 127.415 127.777 -0.362 1
1 144 . 13 1 1 A 18 18 ALA H H 18 8.647 8.719 -0.072 1
1 145 . 13 1 1 A 18 18 ALA HA H 18 4.106 4.059 0.047 1
1 149 . 13 1 1 A 18 18 ALA C C 18 178.236 177.522 0.714 1
1 150 . 13 1 1 A 18 18 ALA CA C 18 53.926 54.479 -0.553 1
1 151 . 13 1 1 A 18 18 ALA CB C 18 18.876 19.085 -0.209 1
1 152 . 13 1 1 A 18 18 ALA N N 18 133.362 130.772 2.590 1
1 153 . 13 1 1 A 19 19 ALA H H 19 7.772 7.141 0.631 1
1 154 . 13 1 1 A 19 19 ALA HA H 19 4.561 4.687 -0.126 1
1 158 . 13 1 1 A 19 19 ALA C C 19 176.032 174.972 1.060 1
1 159 . 13 1 1 A 19 19 ALA CA C 19 53.011 51.656 1.355 1
1 160 . 13 1 1 A 19 19 ALA CB C 19 21.869 22.407 -0.538 1
1 161 . 13 1 1 A 19 19 ALA N N 19 115.654 116.728 -1.074 1
1 162 . 13 1 1 A 20 20 VAL H H 20 8.697 8.885 -0.188 1
1 163 . 13 1 1 A 20 20 VAL HA H 20 4.951 4.693 0.258 1
1 171 . 13 1 1 A 20 20 VAL C C 20 174.314 174.315 -0.001 1
1 172 . 13 1 1 A 20 20 VAL CA C 20 61.352 60.739 0.613 1
1 173 . 13 1 1 A 20 20 VAL CB C 20 35.394 32.892 2.502 1
1 176 . 13 1 1 A 20 20 VAL N N 20 120.848 123.873 -3.025 1
1 177 . 13 1 1 A 21 21 THR H H 21 9.198 8.432 0.766 1
1 178 . 13 1 1 A 21 21 THR HA H 21 4.941 4.776 0.165 1
1 183 . 13 1 1 A 21 21 THR C C 21 174.416 174.637 -0.221 1
1 184 . 13 1 1 A 21 21 THR CA C 21 60.347 58.932 1.415 1
1 185 . 13 1 1 A 21 21 THR CB C 21 68.713 71.809 -3.096 1
1 187 . 13 1 1 A 21 21 THR N N 21 120.326 125.488 -5.162 1
1 188 . 13 1 1 A 22 22 PRO HA H 22 4.634 4.551 0.083 1
1 194 . 13 1 1 A 22 22 PRO C C 22 173.606 176.544 -2.938 1
1 195 . 13 1 1 A 22 22 PRO CA C 22 66.519 64.258 2.261 1
1 196 . 13 1 1 A 22 22 PRO CB C 22 32.078 31.653 0.425 1
1 199 . 13 1 1 A 23 23 ARG H H 23 6.621 8.013 -1.392 1
1 200 . 13 1 1 A 23 23 ARG HA H 23 4.591 4.456 0.135 1
1 207 . 13 1 1 A 23 23 ARG C C 23 176.554 175.729 0.825 1
1 208 . 13 1 1 A 23 23 ARG CA C 23 53.892 56.413 -2.521 1
1 209 . 13 1 1 A 23 23 ARG CB C 23 33.498 33.185 0.313 1
1 212 . 13 1 1 A 23 23 ARG N N 23 102.938 117.031 -14.093 1
1 213 . 13 1 1 A 24 24 THR H H 24 7.352 8.100 -0.748 1
1 214 . 13 1 1 A 24 24 THR HA H 24 5.593 5.261 0.332 1
1 219 . 13 1 1 A 24 24 THR C C 24 172.345 172.245 0.100 1
1 220 . 13 1 1 A 24 24 THR CA C 24 59.311 60.550 -1.239 1
1 221 . 13 1 1 A 24 24 THR CB C 24 73.311 72.241 1.070 1
1 223 . 13 1 1 A 24 24 THR N N 24 108.792 110.143 -1.351 1
1 224 . 13 1 1 A 25 25 VAL H H 25 8.437 8.701 -0.264 1
1 225 . 13 1 1 A 25 25 VAL HA H 25 4.512 5.011 -0.499 1
1 233 . 13 1 1 A 25 25 VAL C C 25 172.854 174.357 -1.503 1
1 234 . 13 1 1 A 25 25 VAL CA C 25 61.617 60.859 0.758 1
1 235 . 13 1 1 A 25 25 VAL CB C 25 36.742 34.370 2.372 1
1 238 . 13 1 1 A 25 25 VAL N N 25 117.023 121.071 -4.048 1
1 239 . 13 1 1 A 26 26 HIS H H 26 8.915 8.507 0.408 1
1 240 . 13 1 1 A 26 26 HIS HA H 26 5.765 5.457 0.308 1
1 245 . 13 1 1 A 26 26 HIS C C 26 173.976 173.264 0.712 1
1 246 . 13 1 1 A 26 26 HIS CA C 26 52.896 53.856 -0.960 1
1 247 . 13 1 1 A 26 26 HIS CB C 26 34.004 32.719 1.285 1
1 250 . 13 1 1 A 26 26 HIS N N 26 128.155 127.469 0.686 1
1 251 . 13 1 1 A 27 27 LEU H H 27 9.034 8.922 0.112 1
1 252 . 13 1 1 A 27 27 LEU HA H 27 5.505 5.010 0.495 1
1 262 . 13 1 1 A 27 27 LEU C C 27 174.821 174.693 0.128 1
1 263 . 13 1 1 A 27 27 LEU CA C 27 53.376 53.738 -0.362 1
1 264 . 13 1 1 A 27 27 LEU CB C 27 46.306 46.660 -0.354 1
1 268 . 13 1 1 A 27 27 LEU N N 27 128.569 128.305 0.264 1
1 269 . 13 1 1 A 28 28 THR H H 28 8.844 8.117 0.727 1
1 270 . 13 1 1 A 28 28 THR HA H 28 4.485 4.832 -0.347 1
1 275 . 13 1 1 A 28 28 THR C C 28 172.773 173.149 -0.376 1
1 276 . 13 1 1 A 28 28 THR CA C 28 60.052 60.082 -0.030 1
1 277 . 13 1 1 A 28 28 THR CB C 28 71.704 71.615 0.089 1
1 279 . 13 1 1 A 28 28 THR N N 28 112.165 112.828 -0.663 1
1 280 . 13 1 1 A 29 29 TRP H H 29 7.395 7.892 -0.497 1
1 281 . 13 1 1 A 29 29 TRP HA H 29 4.915 5.657 -0.742 1
1 290 . 13 1 1 A 29 29 TRP C C 29 174.013 173.229 0.784 1
1 291 . 13 1 1 A 29 29 TRP CA C 29 56.626 55.096 1.530 1
1 292 . 13 1 1 A 29 29 TRP CB C 29 29.487 31.405 -1.918 1
1 298 . 13 1 1 A 29 29 TRP N N 29 115.623 119.423 -3.800 1
1 300 . 13 1 1 A 30 30 GLN H H 30 8.759 8.434 0.325 1
1 301 . 13 1 1 A 30 30 GLN HA H 30 4.641 4.824 -0.183 1
1 308 . 13 1 1 A 30 30 GLN C C 30 175.072 173.829 1.243 1
1 309 . 13 1 1 A 30 30 GLN CA C 30 52.975 53.242 -0.267 1
1 310 . 13 1 1 A 30 30 GLN CB C 30 28.398 28.815 -0.417 1
1 312 . 13 1 1 A 30 30 GLN N N 30 117.497 119.972 -2.475 1
1 314 . 13 1 1 A 31 31 PRO HA H 31 4.487 4.496 -0.009 1
1 320 . 13 1 1 A 31 31 PRO C C 31 177.034 175.936 1.098 1
1 321 . 13 1 1 A 31 31 PRO CA C 31 62.710 62.649 0.061 1
1 322 . 13 1 1 A 31 31 PRO CB C 31 32.738 32.273 0.465 1
1 325 . 13 1 1 A 32 32 SER H H 32 8.259 8.758 -0.499 1
1 326 . 13 1 1 A 32 32 SER HA H 32 4.670 4.779 -0.109 1
1 329 . 13 1 1 A 32 32 SER C C 32 174.689 174.327 0.362 1
1 330 . 13 1 1 A 32 32 SER CA C 32 57.296 57.736 -0.440 1
1 331 . 13 1 1 A 32 32 SER CB C 32 64.748 64.604 0.144 1
1 332 . 13 1 1 A 32 32 SER N N 32 117.667 116.725 0.942 1
1 333 . 13 1 1 A 33 33 ALA H H 33 9.038 8.549 0.489 1
1 334 . 13 1 1 A 33 33 ALA HA H 33 4.126 4.502 -0.376 1
1 338 . 13 1 1 A 33 33 ALA C C 33 177.795 177.650 0.145 1
1 339 . 13 1 1 A 33 33 ALA CA C 33 54.213 51.495 2.718 1
1 340 . 13 1 1 A 33 33 ALA CB C 33 17.948 17.521 0.427 1
1 341 . 13 1 1 A 33 33 ALA N N 33 131.772 127.121 4.651 1
1 342 . 13 1 1 A 34 34 GLY H H 34 8.576 8.111 0.465 1
1 343 . 13 1 1 A 34 34 GLY HA2 H 34 4.171 4.022 0.149 1
1 344 . 13 1 1 A 34 34 GLY HA3 H 34 3.592 4.024 -0.432 1
1 345 . 13 1 1 A 34 34 GLY C C 34 174.182 174.517 -0.335 1
1 346 . 13 1 1 A 34 34 GLY CA C 34 44.987 45.377 -0.390 1
1 347 . 13 1 1 A 34 34 GLY N N 34 111.339 106.940 4.399 1
1 348 . 13 1 1 A 35 35 ALA H H 35 7.637 7.847 -0.210 1
1 349 . 13 1 1 A 35 35 ALA HA H 35 4.210 4.159 0.051 1
1 353 . 13 1 1 A 35 35 ALA C C 35 178.918 178.331 0.587 1
1 354 . 13 1 1 A 35 35 ALA CA C 35 52.671 52.630 0.041 1
1 355 . 13 1 1 A 35 35 ALA CB C 35 18.988 18.981 0.007 1
1 356 . 13 1 1 A 35 35 ALA N N 35 121.531 123.540 -2.009 1
1 357 . 13 1 1 A 36 36 THR H H 36 9.428 8.515 0.913 1
1 358 . 13 1 1 A 36 36 THR HA H 36 4.402 4.169 0.233 1
1 363 . 13 1 1 A 36 36 THR C C 36 174.739 174.306 0.433 1
1 364 . 13 1 1 A 36 36 THR CA C 36 62.692 63.515 -0.823 1
1 365 . 13 1 1 A 36 36 THR CB C 36 69.482 69.401 0.081 1
1 367 . 13 1 1 A 36 36 THR N N 36 113.103 119.740 -6.637 1
1 368 . 13 1 1 A 37 37 HIS H H 37 7.857 6.805 1.052 1
1 369 . 13 1 1 A 37 37 HIS HA H 37 4.878 4.468 0.410 1
1 374 . 13 1 1 A 37 37 HIS C C 37 171.103 172.085 -0.982 1
1 375 . 13 1 1 A 37 37 HIS CA C 37 55.867 54.386 1.481 1
1 376 . 13 1 1 A 37 37 HIS CB C 37 32.655 31.155 1.500 1
1 379 . 13 1 1 A 37 37 HIS N N 37 118.486 115.368 3.118 1
1 380 . 13 1 1 A 38 38 TYR H H 38 9.217 8.284 0.933 1
1 381 . 13 1 1 A 38 38 TYR HA H 38 5.303 5.069 0.234 1
1 388 . 13 1 1 A 38 38 TYR C C 38 173.922 174.343 -0.421 1
1 389 . 13 1 1 A 38 38 TYR CA C 38 56.504 56.474 0.030 1
1 390 . 13 1 1 A 38 38 TYR CB C 38 41.823 42.056 -0.233 1
1 395 . 13 1 1 A 38 38 TYR N N 38 114.077 118.377 -4.300 1
1 396 . 13 1 1 A 39 39 LEU H H 39 9.052 9.296 -0.244 1
1 397 . 13 1 1 A 39 39 LEU HA H 39 5.061 5.017 0.044 1
1 407 . 13 1 1 A 39 39 LEU C C 39 175.455 174.678 0.777 1
1 408 . 13 1 1 A 39 39 LEU CA C 39 53.855 54.010 -0.155 1
1 409 . 13 1 1 A 39 39 LEU CB C 39 45.254 43.789 1.465 1
1 413 . 13 1 1 A 39 39 LEU N N 39 123.997 125.421 -1.424 1
1 414 . 13 1 1 A 40 40 VAL H H 40 9.520 9.558 -0.038 1
1 415 . 13 1 1 A 40 40 VAL HA H 40 4.988 4.668 0.320 1
1 423 . 13 1 1 A 40 40 VAL C C 40 174.578 174.871 -0.293 1
1 424 . 13 1 1 A 40 40 VAL CA C 40 60.575 61.817 -1.242 1
1 425 . 13 1 1 A 40 40 VAL CB C 40 33.284 33.230 0.054 1
1 428 . 13 1 1 A 40 40 VAL N N 40 129.678 129.164 0.514 1
1 429 . 13 1 1 A 41 41 ARG H H 41 9.096 9.043 0.053 1
1 430 . 13 1 1 A 41 41 ARG HA H 41 5.384 5.232 0.152 1
1 437 . 13 1 1 A 41 41 ARG C C 41 175.100 175.236 -0.136 1
1 438 . 13 1 1 A 41 41 ARG CA C 41 54.297 54.517 -0.220 1
1 439 . 13 1 1 A 41 41 ARG CB C 41 33.003 31.753 1.250 1
1 442 . 13 1 1 A 41 41 ARG N N 41 126.332 126.935 -0.603 1
1 443 . 13 1 1 A 42 42 CYS H H 42 9.004 9.425 -0.421 1
1 444 . 13 1 1 A 42 42 CYS HA H 42 5.309 5.266 0.043 1
1 447 . 13 1 1 A 42 42 CYS C C 42 173.417 173.954 -0.537 1
1 448 . 13 1 1 A 42 42 CYS CA C 42 57.508 57.530 -0.022 1
1 449 . 13 1 1 A 42 42 CYS CB C 42 28.859 29.184 -0.325 1
1 450 . 13 1 1 A 42 42 CYS N N 42 123.359 124.021 -0.662 1
1 451 . 13 1 1 A 43 43 SER H H 43 9.102 8.706 0.396 1
1 452 . 13 1 1 A 43 43 SER HA H 43 5.324 5.004 0.320 1
1 455 . 13 1 1 A 43 43 SER C C 43 171.429 171.807 -0.378 1
1 456 . 13 1 1 A 43 43 SER CA C 43 55.621 55.654 -0.033 1
1 457 . 13 1 1 A 43 43 SER CB C 43 64.856 66.217 -1.361 1
1 458 . 13 1 1 A 43 43 SER N N 43 125.444 119.328 6.116 1
1 459 . 13 1 1 A 44 44 PRO HA H 44 4.389 4.551 -0.162 1
1 466 . 13 1 1 A 44 44 PRO C C 44 176.559 177.154 -0.595 1
1 467 . 13 1 1 A 44 44 PRO CA C 44 63.027 62.976 0.051 1
1 468 . 13 1 1 A 44 44 PRO CB C 44 31.935 32.828 -0.893 1
1 471 . 13 1 1 A 45 45 ALA H H 45 8.261 8.390 -0.129 1
1 472 . 13 1 1 A 45 45 ALA HA H 45 4.157 4.134 0.023 1
1 476 . 13 1 1 A 45 45 ALA C C 45 177.706 176.910 0.796 1
1 477 . 13 1 1 A 45 45 ALA CA C 45 53.284 53.877 -0.593 1
1 478 . 13 1 1 A 45 45 ALA CB C 45 18.978 19.039 -0.061 1
1 479 . 13 1 1 A 45 45 ALA N N 45 126.162 124.212 1.950 1
1 480 . 13 1 1 A 46 46 SER H H 46 8.275 7.593 0.682 1
1 481 . 13 1 1 A 46 46 SER HA H 46 4.779 4.723 0.056 1
1 484 . 13 1 1 A 46 46 SER C C 46 172.182 174.139 -1.957 1
1 485 . 13 1 1 A 46 46 SER CA C 46 55.091 55.319 -0.228 1
1 486 . 13 1 1 A 46 46 SER CB C 46 63.130 64.342 -1.212 1
1 487 . 13 1 1 A 46 46 SER N N 46 113.009 115.319 -2.310 1
1 488 . 13 1 1 A 47 47 PRO HA H 47 4.336 4.556 -0.220 1
1 493 . 13 1 1 A 47 47 PRO C C 47 177.165 176.142 1.023 1
1 494 . 13 1 1 A 47 47 PRO CA C 47 63.268 63.781 -0.513 1
1 495 . 13 1 1 A 47 47 PRO CB C 47 32.528 31.561 0.967 1
1 498 . 13 1 1 A 48 48 LYS H H 48 9.089 7.453 1.636 1
1 499 . 13 1 1 A 48 48 LYS HA H 48 4.408 3.952 0.456 1
1 508 . 13 1 1 A 48 48 LYS C C 48 176.917 177.107 -0.190 1
1 509 . 13 1 1 A 48 48 LYS CA C 48 55.893 58.370 -2.477 1
1 510 . 13 1 1 A 48 48 LYS CB C 48 32.997 32.007 0.990 1
1 514 . 13 1 1 A 48 48 LYS N N 48 122.579 120.096 2.483 1
1 515 . 13 1 1 A 49 49 GLY HA2 H 49 4.021 3.972 0.049 1
1 516 . 13 1 1 A 49 49 GLY HA3 H 49 3.881 3.973 -0.092 1
1 517 . 13 1 1 A 49 49 GLY C C 49 174.552 174.843 -0.291 1
1 518 . 13 1 1 A 49 49 GLY CA C 49 46.011 45.196 0.815 1
1 519 . 13 1 1 A 50 50 GLU H H 50 8.608 7.889 0.719 1
1 520 . 13 1 1 A 50 50 GLU HA H 50 4.335 3.984 0.351 1
1 525 . 13 1 1 A 50 50 GLU C C 50 176.672 175.328 1.344 1
1 526 . 13 1 1 A 50 50 GLU CA C 50 56.978 57.561 -0.583 1
1 527 . 13 1 1 A 50 50 GLU CB C 50 29.458 28.419 1.039 1
1 529 . 13 1 1 A 50 50 GLU N N 50 121.378 119.848 1.530 1
1 530 . 13 1 1 A 51 51 GLU H H 51 8.287 8.074 0.213 1
1 531 . 13 1 1 A 51 51 GLU HA H 51 4.381 4.394 -0.013 1
1 536 . 13 1 1 A 51 51 GLU C C 51 176.218 176.081 0.137 1
1 537 . 13 1 1 A 51 51 GLU CA C 51 56.996 56.309 0.687 1
1 538 . 13 1 1 A 51 51 GLU CB C 51 31.066 31.082 -0.016 1
1 540 . 13 1 1 A 51 51 GLU N N 51 120.863 119.552 1.311 1
1 541 . 13 1 1 A 52 52 GLU H H 52 8.445 8.368 0.077 1
1 542 . 13 1 1 A 52 52 GLU HA H 52 4.464 4.433 0.031 1
1 547 . 13 1 1 A 52 52 GLU C C 52 176.128 176.372 -0.244 1
1 548 . 13 1 1 A 52 52 GLU CA C 52 55.955 56.387 -0.432 1
1 549 . 13 1 1 A 52 52 GLU CB C 52 31.691 30.445 1.246 1
1 551 . 13 1 1 A 52 52 GLU N N 52 121.103 122.180 -1.077 1
1 552 . 13 1 1 A 53 53 GLU H H 53 8.441 8.644 -0.203 1
1 553 . 13 1 1 A 53 53 GLU HA H 53 4.609 4.588 0.021 1
1 558 . 13 1 1 A 53 53 GLU C C 53 175.816 176.553 -0.737 1
1 559 . 13 1 1 A 53 53 GLU CA C 53 56.697 56.252 0.445 1
1 560 . 13 1 1 A 53 53 GLU CB C 53 31.022 30.553 0.469 1
1 562 . 13 1 1 A 53 53 GLU N N 53 121.949 126.746 -4.797 1
1 563 . 13 1 1 A 54 54 ARG H H 54 8.569 8.663 -0.094 1
1 564 . 13 1 1 A 54 54 ARG HA H 54 4.768 4.648 0.120 1
1 571 . 13 1 1 A 54 54 ARG C C 54 174.881 175.008 -0.127 1
1 572 . 13 1 1 A 54 54 ARG CA C 54 54.950 56.286 -1.336 1
1 573 . 13 1 1 A 54 54 ARG CB C 54 33.374 31.174 2.200 1
1 576 . 13 1 1 A 54 54 ARG N N 54 123.714 127.566 -3.852 1
1 577 . 13 1 1 A 55 55 GLU H H 55 8.650 8.866 -0.216 1
1 578 . 13 1 1 A 55 55 GLU HA H 55 5.493 5.181 0.312 1
1 583 . 13 1 1 A 55 55 GLU C C 55 175.566 175.318 0.248 1
1 584 . 13 1 1 A 55 55 GLU CA C 55 54.915 54.831 0.084 1
1 585 . 13 1 1 A 55 55 GLU CB C 55 33.250 32.941 0.309 1
1 587 . 13 1 1 A 55 55 GLU N N 55 123.537 127.810 -4.273 1
1 588 . 13 1 1 A 56 56 VAL H H 56 9.419 9.114 0.305 1
1 589 . 13 1 1 A 56 56 VAL HA H 56 4.524 4.933 -0.409 1
1 597 . 13 1 1 A 56 56 VAL C C 56 173.502 173.929 -0.427 1
1 598 . 13 1 1 A 56 56 VAL CA C 56 60.981 58.919 2.062 1
1 599 . 13 1 1 A 56 56 VAL CB C 56 36.117 35.849 0.268 1
1 602 . 13 1 1 A 56 56 VAL N N 56 123.343 120.019 3.324 1
1 603 . 13 1 1 A 57 57 GLN H H 57 8.767 8.853 -0.086 1
1 604 . 13 1 1 A 57 57 GLN HA H 57 5.671 5.238 0.433 1
1 611 . 13 1 1 A 57 57 GLN C C 57 176.357 175.233 1.124 1
1 612 . 13 1 1 A 57 57 GLN CA C 57 54.735 54.194 0.541 1
1 613 . 13 1 1 A 57 57 GLN CB C 57 30.781 31.957 -1.176 1
1 615 . 13 1 1 A 57 57 GLN N N 57 125.639 121.420 4.219 1
1 617 . 13 1 1 A 58 58 VAL H H 58 9.217 8.629 0.588 1
1 618 . 13 1 1 A 58 58 VAL HA H 58 5.129 4.841 0.288 1
1 626 . 13 1 1 A 58 58 VAL C C 58 175.925 176.862 -0.937 1
1 627 . 13 1 1 A 58 58 VAL CA C 58 59.652 60.018 -0.366 1
1 628 . 13 1 1 A 58 58 VAL CB C 58 36.540 35.183 1.357 1
1 631 . 13 1 1 A 58 58 VAL N N 58 117.022 117.479 -0.457 1
1 632 . 13 1 1 A 59 59 GLY H H 59 9.008 8.816 0.192 1
1 633 . 13 1 1 A 59 59 GLY HA2 H 59 4.670 3.807 0.863 1
1 634 . 13 1 1 A 59 59 GLY HA3 H 59 3.914 3.844 0.070 1
1 635 . 13 1 1 A 59 59 GLY C C 59 173.386 173.973 -0.587 1
1 636 . 13 1 1 A 59 59 GLY CA C 59 45.093 46.048 -0.955 1
1 637 . 13 1 1 A 59 59 GLY N N 59 109.174 111.175 -2.001 1
1 638 . 13 1 1 A 60 60 ARG H H 60 7.695 7.575 0.120 1
1 639 . 13 1 1 A 60 60 ARG HA H 60 4.866 5.022 -0.156 1
1 645 . 13 1 1 A 60 60 ARG C C 60 173.760 175.816 -2.056 1
1 646 . 13 1 1 A 60 60 ARG CA C 60 52.764 53.581 -0.817 1
1 647 . 13 1 1 A 60 60 ARG CB C 60 31.785 32.460 -0.675 1
1 650 . 13 1 1 A 60 60 ARG N N 60 118.520 118.140 0.380 1
1 651 . 13 1 1 A 61 61 PRO HA H 61 3.539 4.200 -0.661 1
1 658 . 13 1 1 A 61 61 PRO C C 61 173.175 173.854 -0.679 1
1 659 . 13 1 1 A 61 61 PRO CA C 61 62.265 63.219 -0.954 1
1 660 . 13 1 1 A 61 61 PRO CB C 61 27.546 30.932 -3.386 1
1 663 . 13 1 1 A 62 62 GLU H H 62 7.879 7.750 0.129 1
1 664 . 13 1 1 A 62 62 GLU HA H 62 4.071 4.608 -0.537 1
1 669 . 13 1 1 A 62 62 GLU C C 62 174.107 174.643 -0.536 1
1 670 . 13 1 1 A 62 62 GLU CA C 62 55.229 54.435 0.794 1
1 671 . 13 1 1 A 62 62 GLU CB C 62 32.838 32.020 0.818 1
1 673 . 13 1 1 A 62 62 GLU N N 62 118.173 114.010 4.163 1
1 674 . 13 1 1 A 63 63 VAL H H 63 8.930 8.570 0.360 1
1 675 . 13 1 1 A 63 63 VAL HA H 63 4.548 5.113 -0.565 1
1 683 . 13 1 1 A 63 63 VAL C C 63 170.325 173.539 -3.214 1
1 684 . 13 1 1 A 63 63 VAL CA C 63 60.770 59.401 1.369 1
1 685 . 13 1 1 A 63 63 VAL CB C 63 35.394 34.733 0.661 1
1 688 . 13 1 1 A 63 63 VAL N N 63 117.161 124.868 -7.707 1
1 689 . 13 1 1 A 64 64 LEU H H 64 8.332 8.985 -0.653 1
1 690 . 13 1 1 A 64 64 LEU HA H 64 5.122 5.447 -0.325 1
1 700 . 13 1 1 A 64 64 LEU C C 64 176.243 174.427 1.816 1
1 701 . 13 1 1 A 64 64 LEU CA C 64 53.346 53.562 -0.216 1
1 702 . 13 1 1 A 64 64 LEU CB C 64 42.649 45.315 -2.666 1
1 706 . 13 1 1 A 64 64 LEU N N 64 130.510 129.493 1.017 1
1 707 . 13 1 1 A 65 65 LEU H H 65 9.261 9.511 -0.250 1
1 708 . 13 1 1 A 65 65 LEU HA H 65 4.443 4.877 -0.434 1
1 718 . 13 1 1 A 65 65 LEU C C 65 174.016 175.633 -1.617 1
1 719 . 13 1 1 A 65 65 LEU CA C 65 53.920 54.008 -0.088 1
1 720 . 13 1 1 A 65 65 LEU CB C 65 42.976 42.076 0.900 1
1 724 . 13 1 1 A 65 65 LEU N N 65 128.611 128.836 -0.225 1
1 725 . 13 1 1 A 66 66 ASP H H 66 8.105 8.683 -0.578 1
1 726 . 13 1 1 A 66 66 ASP HA H 66 5.207 5.118 0.089 1
1 729 . 13 1 1 A 66 66 ASP C C 66 176.161 176.661 -0.500 1
1 730 . 13 1 1 A 66 66 ASP CA C 66 51.001 53.909 -2.908 1
1 731 . 13 1 1 A 66 66 ASP CB C 66 42.836 41.923 0.913 1
1 732 . 13 1 1 A 66 66 ASP N N 66 121.799 125.095 -3.296 1
1 733 . 13 1 1 A 67 67 GLY H H 67 8.688 8.541 0.147 1
1 734 . 13 1 1 A 67 67 GLY HA2 H 67 3.923 3.955 -0.032 1
1 735 . 13 1 1 A 67 67 GLY HA3 H 67 3.808 3.960 -0.152 1
1 736 . 13 1 1 A 67 67 GLY C C 67 175.500 174.213 1.287 1
1 737 . 13 1 1 A 67 67 GLY CA C 67 46.591 46.645 -0.054 1
1 738 . 13 1 1 A 67 67 GLY N N 67 106.518 111.206 -4.688 1
1 739 . 13 1 1 A 68 68 LEU H H 68 8.125 7.960 0.165 1
1 740 . 13 1 1 A 68 68 LEU HA H 68 4.252 4.895 -0.643 1
1 750 . 13 1 1 A 68 68 LEU C C 68 174.914 175.471 -0.557 1
1 751 . 13 1 1 A 68 68 LEU CA C 68 53.469 53.102 0.367 1
1 752 . 13 1 1 A 68 68 LEU CB C 68 40.422 45.173 -4.751 1
1 756 . 13 1 1 A 68 68 LEU N N 68 119.345 119.792 -0.447 1
1 757 . 13 1 1 A 69 69 GLU H H 69 8.207 8.243 -0.036 1
1 758 . 13 1 1 A 69 69 GLU HA H 69 4.908 4.839 0.069 1
1 763 . 13 1 1 A 69 69 GLU C C 69 174.464 174.198 0.266 1
1 764 . 13 1 1 A 69 69 GLU CA C 69 53.081 53.156 -0.075 1
1 765 . 13 1 1 A 69 69 GLU CB C 69 31.538 30.776 0.762 1
1 767 . 13 1 1 A 69 69 GLU N N 69 119.486 120.985 -1.499 1
1 768 . 13 1 1 A 70 70 PRO HA H 70 4.866 4.336 0.530 1
1 775 . 13 1 1 A 70 70 PRO C C 70 178.285 177.481 0.804 1
1 776 . 13 1 1 A 70 70 PRO CA C 70 63.203 63.622 -0.419 1
1 777 . 13 1 1 A 70 70 PRO CB C 70 33.726 31.810 1.916 1
1 780 . 13 1 1 A 71 71 GLY H H 71 7.362 8.876 -1.514 1
1 781 . 13 1 1 A 71 71 GLY HA2 H 71 3.807 3.941 -0.134 1
1 782 . 13 1 1 A 71 71 GLY HA3 H 71 3.756 3.944 -0.188 1
1 783 . 13 1 1 A 71 71 GLY C C 71 174.664 173.857 0.807 1
1 784 . 13 1 1 A 71 71 GLY CA C 71 46.926 46.348 0.578 1
1 785 . 13 1 1 A 71 71 GLY N N 71 113.776 111.522 2.254 1
1 786 . 13 1 1 A 72 72 ARG H H 72 8.036 7.633 0.403 1
1 787 . 13 1 1 A 72 72 ARG HA H 72 4.597 4.769 -0.172 1
1 793 . 13 1 1 A 72 72 ARG C C 72 173.293 173.713 -0.420 1
1 794 . 13 1 1 A 72 72 ARG CA C 72 54.633 54.501 0.132 1
1 795 . 13 1 1 A 72 72 ARG CB C 72 33.704 33.177 0.527 1
1 798 . 13 1 1 A 72 72 ARG N N 72 119.611 119.468 0.143 1
1 799 . 13 1 1 A 73 73 ASP H H 73 7.785 8.661 -0.876 1
1 800 . 13 1 1 A 73 73 ASP HA H 73 5.276 5.023 0.253 1
1 803 . 13 1 1 A 73 73 ASP C C 73 175.904 174.607 1.297 1
1 804 . 13 1 1 A 73 73 ASP CA C 73 53.568 53.108 0.460 1
1 805 . 13 1 1 A 73 73 ASP CB C 73 42.970 42.474 0.496 1
1 806 . 13 1 1 A 73 73 ASP N N 73 118.900 126.460 -7.560 1
1 807 . 13 1 1 A 74 74 TYR H H 74 9.516 9.046 0.470 1
1 808 . 13 1 1 A 74 74 TYR HA H 74 4.800 5.263 -0.463 1
1 815 . 13 1 1 A 74 74 TYR C C 74 174.631 175.200 -0.569 1
1 816 . 13 1 1 A 74 74 TYR CA C 74 58.548 56.606 1.942 1
1 817 . 13 1 1 A 74 74 TYR CB C 74 42.029 42.916 -0.887 1
1 822 . 13 1 1 A 74 74 TYR N N 74 121.903 125.386 -3.483 1
1 823 . 13 1 1 A 75 75 GLU H H 75 9.248 9.214 0.034 1
1 824 . 13 1 1 A 75 75 GLU HA H 75 4.756 5.050 -0.294 1
1 829 . 13 1 1 A 75 75 GLU C C 75 175.524 175.548 -0.024 1
1 830 . 13 1 1 A 75 75 GLU CA C 75 55.621 55.402 0.219 1
1 831 . 13 1 1 A 75 75 GLU CB C 75 30.778 31.341 -0.563 1
1 833 . 13 1 1 A 75 75 GLU N N 75 122.425 121.010 1.415 1
1 834 . 13 1 1 A 76 76 VAL H H 76 8.884 9.113 -0.229 1
1 835 . 13 1 1 A 76 76 VAL HA H 76 5.246 5.083 0.163 1
1 843 . 13 1 1 A 76 76 VAL C C 76 174.800 174.899 -0.099 1
1 844 . 13 1 1 A 76 76 VAL CA C 76 60.199 61.203 -1.004 1
1 845 . 13 1 1 A 76 76 VAL CB C 76 33.449 33.108 0.341 1
1 848 . 13 1 1 A 76 76 VAL N N 76 126.853 126.567 0.286 1
1 849 . 13 1 1 A 77 77 SER H H 77 9.234 8.784 0.450 1
1 850 . 13 1 1 A 77 77 SER HA H 77 5.398 5.382 0.016 1
1 853 . 13 1 1 A 77 77 SER C C 77 173.138 173.412 -0.274 1
1 854 . 13 1 1 A 77 77 SER CA C 77 56.032 56.538 -0.506 1
1 855 . 13 1 1 A 77 77 SER CB C 77 66.374 64.560 1.814 1
1 856 . 13 1 1 A 77 77 SER N N 77 120.852 121.903 -1.051 1
1 857 . 13 1 1 A 78 78 VAL H H 78 9.092 8.900 0.192 1
1 858 . 13 1 1 A 78 78 VAL HA H 78 4.756 4.878 -0.122 1
1 866 . 13 1 1 A 78 78 VAL C C 78 173.641 174.581 -0.940 1
1 867 . 13 1 1 A 78 78 VAL CA C 78 61.246 61.008 0.238 1
1 868 . 13 1 1 A 78 78 VAL CB C 78 34.467 32.608 1.859 1
1 871 . 13 1 1 A 78 78 VAL N N 78 122.453 126.189 -3.736 1
1 872 . 13 1 1 A 79 79 GLN H H 79 8.587 8.735 -0.148 1
1 873 . 13 1 1 A 79 79 GLN HA H 79 4.438 4.715 -0.277 1
1 880 . 13 1 1 A 79 79 GLN C C 79 174.999 174.762 0.237 1
1 881 . 13 1 1 A 79 79 GLN CA C 79 54.227 54.136 0.091 1
1 882 . 13 1 1 A 79 79 GLN CB C 79 33.587 32.379 1.208 1
1 884 . 13 1 1 A 79 79 GLN N N 79 125.619 126.830 -1.211 1
1 886 . 13 1 1 A 80 80 SER H H 80 8.623 8.678 -0.055 1
1 887 . 13 1 1 A 80 80 SER HA H 80 4.756 4.795 -0.039 1
1 890 . 13 1 1 A 80 80 SER C C 80 172.264 174.254 -1.990 1
1 891 . 13 1 1 A 80 80 SER CA C 80 58.177 60.003 -1.826 1
1 892 . 13 1 1 A 80 80 SER CB C 80 63.920 63.517 0.403 1
1 893 . 13 1 1 A 80 80 SER N N 80 122.844 124.068 -1.224 1
1 894 . 13 1 1 A 81 81 LEU H H 81 8.348 9.002 -0.654 1
1 895 . 13 1 1 A 81 81 LEU HA H 81 5.124 4.731 0.393 1
1 905 . 13 1 1 A 81 81 LEU C C 81 175.775 175.783 -0.008 1
1 906 . 13 1 1 A 81 81 LEU CA C 81 54.033 53.335 0.698 1
1 907 . 13 1 1 A 81 81 LEU CB C 81 44.690 42.420 2.270 1
1 911 . 13 1 1 A 81 81 LEU N N 81 123.191 127.545 -4.354 1
1 912 . 13 1 1 A 82 82 ARG H H 82 8.374 8.609 -0.235 1
1 913 . 13 1 1 A 82 82 ARG HA H 82 4.616 4.504 0.112 1
1 919 . 13 1 1 A 82 82 ARG C C 82 176.864 175.437 1.427 1
1 920 . 13 1 1 A 82 82 ARG CA C 82 55.868 54.720 1.148 1
1 921 . 13 1 1 A 82 82 ARG CB C 82 32.322 31.097 1.225 1
1 924 . 13 1 1 A 82 82 ARG N N 82 121.029 126.276 -5.247 1
1 925 . 13 1 1 A 83 83 GLY H H 83 8.309 7.367 0.942 1
1 926 . 13 1 1 A 83 83 GLY HA2 H 83 4.031 4.104 -0.073 1
1 927 . 13 1 1 A 83 83 GLY HA3 H 83 3.888 4.128 -0.240 1
1 928 . 13 1 1 A 83 83 GLY C C 83 174.562 173.855 0.707 1
1 929 . 13 1 1 A 83 83 GLY CA C 83 45.963 44.533 1.430 1
1 930 . 13 1 1 A 83 83 GLY N N 83 109.937 109.669 0.268 1
1 931 . 13 1 1 A 84 84 PRO HA H 84 4.573 4.524 0.049 1
1 938 . 13 1 1 A 84 84 PRO C C 84 176.533 175.465 1.068 1
1 939 . 13 1 1 A 84 84 PRO CA C 84 63.485 63.944 -0.459 1
1 940 . 13 1 1 A 84 84 PRO CB C 84 32.409 31.917 0.492 1
1 943 . 13 1 1 A 85 85 GLU H H 85 7.799 7.648 0.151 1
1 944 . 13 1 1 A 85 85 GLU HA H 85 4.369 4.925 -0.556 1
1 949 . 13 1 1 A 85 85 GLU C C 85 174.722 175.211 -0.489 1
1 950 . 13 1 1 A 85 85 GLU CA C 85 55.899 54.865 1.034 1
1 951 . 13 1 1 A 85 85 GLU CB C 85 31.911 33.010 -1.099 1
1 953 . 13 1 1 A 85 85 GLU N N 85 122.093 113.260 8.833 1
1 954 . 13 1 1 A 86 86 GLY H H 86 8.329 8.837 -0.508 1
1 955 . 13 1 1 A 86 86 GLY HA2 H 86 5.298 4.332 0.966 1
1 956 . 13 1 1 A 86 86 GLY HA3 H 86 3.559 4.340 -0.781 1
1 957 . 13 1 1 A 86 86 GLY C C 86 174.355 173.778 0.577 1
1 958 . 13 1 1 A 86 86 GLY CA C 86 44.034 43.722 0.312 1
1 959 . 13 1 1 A 86 86 GLY N N 86 109.387 108.993 0.394 1
1 960 . 13 1 1 A 87 87 SER H H 87 8.807 8.870 -0.063 1
1 961 . 13 1 1 A 87 87 SER HA H 87 4.670 4.542 0.128 1
1 964 . 13 1 1 A 87 87 SER C C 87 175.195 174.079 1.116 1
1 965 . 13 1 1 A 87 87 SER CA C 87 57.737 58.266 -0.529 1
1 966 . 13 1 1 A 87 87 SER CB C 87 67.829 65.195 2.634 1
1 967 . 13 1 1 A 87 87 SER N N 87 117.698 113.680 4.018 1
1 968 . 13 1 1 A 88 88 GLU H H 88 8.754 8.713 0.041 1
1 969 . 13 1 1 A 88 88 GLU HA H 88 4.357 4.285 0.072 1
1 974 . 13 1 1 A 88 88 GLU C C 88 177.474 176.597 0.877 1
1 975 . 13 1 1 A 88 88 GLU CA C 88 57.525 56.951 0.574 1
1 976 . 13 1 1 A 88 88 GLU CB C 88 31.162 30.220 0.942 1
1 978 . 13 1 1 A 88 88 GLU N N 88 118.709 120.564 -1.855 1
1 979 . 13 1 1 A 89 89 ALA H H 89 8.855 8.441 0.414 1
1 980 . 13 1 1 A 89 89 ALA HA H 89 4.792 4.579 0.213 1
1 984 . 13 1 1 A 89 89 ALA C C 89 178.379 176.118 2.261 1
1 985 . 13 1 1 A 89 89 ALA CA C 89 51.264 51.506 -0.242 1
1 986 . 13 1 1 A 89 89 ALA CB C 89 20.040 19.578 0.462 1
1 987 . 13 1 1 A 89 89 ALA N N 89 127.301 125.293 2.008 1
1 988 . 13 1 1 A 90 90 ARG H H 90 8.549 8.712 -0.163 1
1 989 . 13 1 1 A 90 90 ARG HA H 90 4.658 4.851 -0.193 1
1 996 . 13 1 1 A 90 90 ARG C C 90 174.720 175.622 -0.902 1
1 997 . 13 1 1 A 90 90 ARG CA C 90 53.575 54.576 -1.001 1
1 998 . 13 1 1 A 90 90 ARG CB C 90 33.456 31.693 1.763 1
1 1001 . 13 1 1 A 90 90 ARG N N 90 121.289 124.545 -3.256 1
1 1002 . 13 1 1 A 91 91 GLY H H 91 8.396 9.001 -0.605 1
1 1003 . 13 1 1 A 91 91 GLY HA2 H 91 5.306 4.171 1.135 1
1 1004 . 13 1 1 A 91 91 GLY HA3 H 91 3.700 4.206 -0.506 1
1 1005 . 13 1 1 A 91 91 GLY C C 91 173.191 171.961 1.230 1
1 1006 . 13 1 1 A 91 91 GLY CA C 91 44.493 43.764 0.729 1
1 1007 . 13 1 1 A 91 91 GLY N N 91 108.579 112.316 -3.737 1
1 1008 . 13 1 1 A 92 92 ILE H H 92 8.891 8.342 0.549 1
1 1009 . 13 1 1 A 92 92 ILE HA H 92 4.499 4.990 -0.491 1
1 1019 . 13 1 1 A 92 92 ILE C C 92 171.877 174.283 -2.406 1
1 1020 . 13 1 1 A 92 92 ILE CA C 92 60.682 59.325 1.357 1
1 1021 . 13 1 1 A 92 92 ILE CB C 92 42.425 41.797 0.628 1
1 1025 . 13 1 1 A 92 92 ILE N N 92 118.313 122.685 -4.372 1
1 1026 . 13 1 1 A 93 93 ARG H H 93 7.980 8.492 -0.512 1
1 1027 . 13 1 1 A 93 93 ARG HA H 93 5.224 4.542 0.682 1
1 1034 . 13 1 1 A 93 93 ARG C C 93 175.072 175.593 -0.521 1
1 1035 . 13 1 1 A 93 93 ARG CA C 93 54.499 56.071 -1.572 1
1 1036 . 13 1 1 A 93 93 ARG CB C 93 31.767 30.832 0.935 1
1 1039 . 13 1 1 A 93 93 ARG N N 93 124.879 130.231 -5.352 1
1 1040 . 13 1 1 A 94 94 ALA H H 94 9.064 8.413 0.651 1
1 1041 . 13 1 1 A 94 94 ALA HA H 94 4.731 5.278 -0.547 1
1 1045 . 13 1 1 A 94 94 ALA C C 94 174.494 176.338 -1.844 1
1 1046 . 13 1 1 A 94 94 ALA CA C 94 50.577 50.677 -0.100 1
1 1047 . 13 1 1 A 94 94 ALA CB C 94 23.082 21.923 1.159 1
1 1048 . 13 1 1 A 94 94 ALA N N 94 126.095 129.651 -3.556 1
1 1049 . 13 1 1 A 95 95 ARG H H 95 8.263 9.105 -0.842 1
1 1050 . 13 1 1 A 95 95 ARG HA H 95 5.548 5.212 0.336 1
1 1058 . 13 1 1 A 95 95 ARG C C 95 176.901 174.523 2.378 1
1 1059 . 13 1 1 A 95 95 ARG CA C 95 53.787 54.180 -0.393 1
1 1060 . 13 1 1 A 95 95 ARG CB C 95 32.426 34.902 -2.476 1
1 1063 . 13 1 1 A 95 95 ARG N N 95 123.374 116.710 6.664 1
1 1065 . 13 1 1 A 96 96 THR H H 96 9.208 8.761 0.447 1
1 1066 . 13 1 1 A 96 96 THR HA H 96 4.461 5.066 -0.605 1
1 1071 . 13 1 1 A 96 96 THR CA C 96 58.248 58.546 -0.298 1
1 1072 . 13 1 1 A 96 96 THR CB C 96 68.466 71.472 -3.006 1
1 1074 . 13 1 1 A 96 96 THR N N 96 119.492 111.305 8.187 1
1 1075 . 13 1 1 A 97 97 PRO HA H 97 4.636 4.647 -0.011 1
1 1082 . 13 1 1 A 97 97 PRO C C 97 175.725 176.008 -0.283 1
1 1083 . 13 1 1 A 97 97 PRO CA C 97 61.907 62.340 -0.433 1
1 1084 . 13 1 1 A 97 97 PRO CB C 97 32.590 33.424 -0.834 1
1 1087 . 13 1 1 A 98 98 THR H H 98 7.943 8.310 -0.367 1
1 1088 . 13 1 1 A 98 98 THR HA H 98 4.208 5.093 -0.885 1
1 1093 . 13 1 1 A 98 98 THR C C 98 175.058 173.192 1.866 1
1 1094 . 13 1 1 A 98 98 THR CA C 98 62.069 60.433 1.636 1
1 1095 . 13 1 1 A 98 98 THR CB C 98 69.719 70.764 -1.045 1
1 1097 . 13 1 1 A 98 98 THR N N 98 107.148 111.262 -4.114 1
1 1098 . 13 1 1 A 99 99 SER H H 99 8.163 8.892 -0.729 1
1 1099 . 13 1 1 A 99 99 SER HA H 99 4.524 4.494 0.030 1
1 1102 . 13 1 1 A 99 99 SER C C 99 174.319 173.530 0.789 1
1 1103 . 13 1 1 A 99 99 SER CA C 99 58.107 58.004 0.103 1
1 1104 . 13 1 1 A 99 99 SER CB C 99 64.492 63.359 1.133 1
1 1105 . 13 1 1 A 99 99 SER N N 99 115.114 122.989 -7.875 1
1 1106 . 13 1 1 A 100 100 GLY H H 100 8.336 8.934 -0.598 1
1 1107 . 13 1 1 A 100 100 GLY HA2 H 100 4.222 4.187 0.035 1
1 1108 . 13 1 1 A 100 100 GLY HA3 H 100 4.222 4.187 0.035 1
1 1109 . 13 1 1 A 100 100 GLY C C 100 171.696 174.114 -2.418 1
1 1110 . 13 1 1 A 100 100 GLY CA C 100 44.617 46.549 -1.932 1
1 1111 . 13 1 1 A 100 100 GLY N N 100 110.678 115.242 -4.564 1
1 1112 . 13 1 1 A 101 101 PRO HA H 101 4.506 4.351 0.155 1
1 1118 . 13 1 1 A 101 101 PRO CA C 101 63.358 64.993 -1.635 1
1 1119 . 13 1 1 A 101 101 PRO CB C 101 32.313 31.855 0.458 1
1 1 . 14 1 1 A 6 6 SER HA H 6 4.528 5.329 -0.801 1
1 3 . 14 1 1 A 6 6 SER CA C 6 58.373 57.192 1.181 1
1 4 . 14 1 1 A 6 6 SER CB C 6 63.978 64.995 -1.017 1
1 5 . 14 1 1 A 7 7 GLY H H 7 8.228 8.877 -0.649 1
1 6 . 14 1 1 A 7 7 GLY HA2 H 7 4.134 4.453 -0.319 1
1 7 . 14 1 1 A 7 7 GLY HA3 H 7 4.134 4.454 -0.320 1
1 8 . 14 1 1 A 7 7 GLY CA C 7 44.607 45.844 -1.237 1
1 9 . 14 1 1 A 7 7 GLY N N 7 110.638 113.518 -2.880 1
1 10 . 14 1 1 A 8 8 PRO HA H 8 4.419 4.639 -0.220 1
1 17 . 14 1 1 A 8 8 PRO C C 8 176.908 175.498 1.410 1
1 18 . 14 1 1 A 8 8 PRO CA C 8 62.851 62.917 -0.066 1
1 19 . 14 1 1 A 8 8 PRO CB C 8 32.243 31.765 0.478 1
1 22 . 14 1 1 A 9 9 LEU H H 9 8.462 8.601 -0.139 1
1 23 . 14 1 1 A 9 9 LEU HA H 9 4.494 4.948 -0.454 1
1 33 . 14 1 1 A 9 9 LEU C C 9 174.124 174.660 -0.536 1
1 34 . 14 1 1 A 9 9 LEU CA C 9 52.587 51.566 1.021 1
1 35 . 14 1 1 A 9 9 LEU CB C 9 43.150 43.685 -0.535 1
1 39 . 14 1 1 A 9 9 LEU N N 9 126.015 123.791 2.224 1
1 40 . 14 1 1 A 10 10 PRO HA H 10 4.820 4.608 0.212 1
1 47 . 14 1 1 A 10 10 PRO CA C 10 61.368 62.559 -1.191 1
1 48 . 14 1 1 A 10 10 PRO CB C 10 31.391 31.697 -0.306 1
1 51 . 14 1 1 A 11 11 PRO HA H 11 4.949 4.901 0.048 1
1 58 . 14 1 1 A 11 11 PRO CA C 11 61.183 61.795 -0.612 1
1 59 . 14 1 1 A 11 11 PRO CB C 11 30.656 31.934 -1.278 1
1 62 . 14 1 1 A 12 12 PRO HA H 12 4.341 4.649 -0.308 1
1 69 . 14 1 1 A 12 12 PRO C C 12 174.849 176.807 -1.958 1
1 70 . 14 1 1 A 12 12 PRO CA C 12 63.062 62.761 0.301 1
1 71 . 14 1 1 A 12 12 PRO CB C 12 31.831 31.605 0.226 1
1 74 . 14 1 1 A 13 13 ARG H H 13 7.828 8.902 -1.074 1
1 75 . 14 1 1 A 13 13 ARG HA H 13 4.536 4.491 0.045 1
1 82 . 14 1 1 A 13 13 ARG C C 13 174.608 176.909 -2.301 1
1 83 . 14 1 1 A 13 13 ARG CA C 13 54.774 57.135 -2.361 1
1 84 . 14 1 1 A 13 13 ARG CB C 13 33.250 32.201 1.049 1
1 87 . 14 1 1 A 13 13 ARG N N 13 120.532 123.770 -3.238 1
1 88 . 14 1 1 A 14 14 ALA H H 14 8.694 7.636 1.058 1
1 89 . 14 1 1 A 14 14 ALA HA H 14 3.986 4.372 -0.386 1
1 93 . 14 1 1 A 14 14 ALA C C 14 177.232 176.764 0.468 1
1 94 . 14 1 1 A 14 14 ALA CA C 14 52.461 52.126 0.335 1
1 95 . 14 1 1 A 14 14 ALA CB C 14 16.806 17.364 -0.558 1
1 96 . 14 1 1 A 14 14 ALA N N 14 121.921 119.942 1.979 1
1 97 . 14 1 1 A 15 15 LEU H H 15 8.097 8.145 -0.048 1
1 98 . 14 1 1 A 15 15 LEU HA H 15 4.670 4.416 0.254 1
1 108 . 14 1 1 A 15 15 LEU C C 15 177.364 176.099 1.265 1
1 109 . 14 1 1 A 15 15 LEU CA C 15 57.543 55.276 2.267 1
1 110 . 14 1 1 A 15 15 LEU CB C 15 41.877 41.618 0.259 1
1 114 . 14 1 1 A 15 15 LEU N N 15 122.215 120.696 1.519 1
1 115 . 14 1 1 A 16 16 THR H H 16 9.520 8.995 0.525 1
1 116 . 14 1 1 A 16 16 THR HA H 16 4.369 4.912 -0.543 1
1 121 . 14 1 1 A 16 16 THR C C 16 172.453 172.876 -0.423 1
1 122 . 14 1 1 A 16 16 THR CA C 16 62.480 61.364 1.116 1
1 123 . 14 1 1 A 16 16 THR CB C 16 72.198 71.965 0.233 1
1 125 . 14 1 1 A 16 16 THR N N 16 122.214 120.809 1.405 1
1 126 . 14 1 1 A 17 17 LEU H H 17 8.847 8.809 0.038 1
1 127 . 14 1 1 A 17 17 LEU HA H 17 4.573 4.569 0.004 1
1 137 . 14 1 1 A 17 17 LEU C C 17 174.695 176.070 -1.375 1
1 138 . 14 1 1 A 17 17 LEU CA C 17 53.840 54.800 -0.960 1
1 139 . 14 1 1 A 17 17 LEU CB C 17 40.290 42.240 -1.950 1
1 143 . 14 1 1 A 17 17 LEU N N 17 127.415 127.637 -0.222 1
1 144 . 14 1 1 A 18 18 ALA H H 18 8.647 8.335 0.312 1
1 145 . 14 1 1 A 18 18 ALA HA H 18 4.106 4.197 -0.091 1
1 149 . 14 1 1 A 18 18 ALA C C 18 178.236 177.349 0.887 1
1 150 . 14 1 1 A 18 18 ALA CA C 18 53.926 53.987 -0.061 1
1 151 . 14 1 1 A 18 18 ALA CB C 18 18.876 19.206 -0.330 1
1 152 . 14 1 1 A 18 18 ALA N N 18 133.362 129.595 3.767 1
1 153 . 14 1 1 A 19 19 ALA H H 19 7.772 7.068 0.704 1
1 154 . 14 1 1 A 19 19 ALA HA H 19 4.561 4.654 -0.093 1
1 158 . 14 1 1 A 19 19 ALA C C 19 176.032 174.532 1.500 1
1 159 . 14 1 1 A 19 19 ALA CA C 19 53.011 51.542 1.469 1
1 160 . 14 1 1 A 19 19 ALA CB C 19 21.869 22.813 -0.944 1
1 161 . 14 1 1 A 19 19 ALA N N 19 115.654 116.605 -0.951 1
1 162 . 14 1 1 A 20 20 VAL H H 20 8.697 8.847 -0.150 1
1 163 . 14 1 1 A 20 20 VAL HA H 20 4.951 4.864 0.087 1
1 171 . 14 1 1 A 20 20 VAL C C 20 174.314 174.127 0.187 1
1 172 . 14 1 1 A 20 20 VAL CA C 20 61.352 60.445 0.907 1
1 173 . 14 1 1 A 20 20 VAL CB C 20 35.394 33.740 1.654 1
1 176 . 14 1 1 A 20 20 VAL N N 20 120.848 121.985 -1.137 1
1 177 . 14 1 1 A 21 21 THR H H 21 9.198 8.463 0.735 1
1 178 . 14 1 1 A 21 21 THR HA H 21 4.941 4.744 0.197 1
1 183 . 14 1 1 A 21 21 THR C C 21 174.416 174.650 -0.234 1
1 184 . 14 1 1 A 21 21 THR CA C 21 60.347 58.944 1.403 1
1 185 . 14 1 1 A 21 21 THR CB C 21 68.713 71.769 -3.056 1
1 187 . 14 1 1 A 21 21 THR N N 21 120.326 125.334 -5.008 1
1 188 . 14 1 1 A 22 22 PRO HA H 22 4.634 4.574 0.060 1
1 194 . 14 1 1 A 22 22 PRO C C 22 173.606 177.105 -3.499 1
1 195 . 14 1 1 A 22 22 PRO CA C 22 66.519 64.255 2.264 1
1 196 . 14 1 1 A 22 22 PRO CB C 22 32.078 31.639 0.439 1
1 199 . 14 1 1 A 23 23 ARG H H 23 6.621 8.400 -1.779 1
1 200 . 14 1 1 A 23 23 ARG HA H 23 4.591 4.584 0.007 1
1 207 . 14 1 1 A 23 23 ARG C C 23 176.554 175.676 0.878 1
1 208 . 14 1 1 A 23 23 ARG CA C 23 53.892 56.091 -2.199 1
1 209 . 14 1 1 A 23 23 ARG CB C 23 33.498 32.383 1.115 1
1 212 . 14 1 1 A 23 23 ARG N N 23 102.938 115.977 -13.039 1
1 213 . 14 1 1 A 24 24 THR H H 24 7.352 7.955 -0.603 1
1 214 . 14 1 1 A 24 24 THR HA H 24 5.593 5.237 0.356 1
1 219 . 14 1 1 A 24 24 THR C C 24 172.345 172.369 -0.024 1
1 220 . 14 1 1 A 24 24 THR CA C 24 59.311 60.484 -1.173 1
1 221 . 14 1 1 A 24 24 THR CB C 24 73.311 71.796 1.515 1
1 223 . 14 1 1 A 24 24 THR N N 24 108.792 110.308 -1.516 1
1 224 . 14 1 1 A 25 25 VAL H H 25 8.437 8.523 -0.086 1
1 225 . 14 1 1 A 25 25 VAL HA H 25 4.512 4.889 -0.377 1
1 233 . 14 1 1 A 25 25 VAL C C 25 172.854 173.979 -1.125 1
1 234 . 14 1 1 A 25 25 VAL CA C 25 61.617 61.039 0.578 1
1 235 . 14 1 1 A 25 25 VAL CB C 25 36.742 34.033 2.709 1
1 238 . 14 1 1 A 25 25 VAL N N 25 117.023 121.907 -4.884 1
1 239 . 14 1 1 A 26 26 HIS H H 26 8.915 8.710 0.205 1
1 240 . 14 1 1 A 26 26 HIS HA H 26 5.765 5.519 0.246 1
1 245 . 14 1 1 A 26 26 HIS C C 26 173.976 173.271 0.705 1
1 246 . 14 1 1 A 26 26 HIS CA C 26 52.896 53.656 -0.760 1
1 247 . 14 1 1 A 26 26 HIS CB C 26 34.004 32.511 1.493 1
1 250 . 14 1 1 A 26 26 HIS N N 26 128.155 127.764 0.391 1
1 251 . 14 1 1 A 27 27 LEU H H 27 9.034 9.423 -0.389 1
1 252 . 14 1 1 A 27 27 LEU HA H 27 5.505 5.279 0.226 1
1 262 . 14 1 1 A 27 27 LEU C C 27 174.821 174.855 -0.034 1
1 263 . 14 1 1 A 27 27 LEU CA C 27 53.376 53.355 0.021 1
1 264 . 14 1 1 A 27 27 LEU CB C 27 46.306 46.712 -0.406 1
1 268 . 14 1 1 A 27 27 LEU N N 27 128.569 130.468 -1.899 1
1 269 . 14 1 1 A 28 28 THR H H 28 8.844 8.421 0.423 1
1 270 . 14 1 1 A 28 28 THR HA H 28 4.485 4.816 -0.331 1
1 275 . 14 1 1 A 28 28 THR C C 28 172.773 173.358 -0.585 1
1 276 . 14 1 1 A 28 28 THR CA C 28 60.052 60.569 -0.517 1
1 277 . 14 1 1 A 28 28 THR CB C 28 71.704 71.341 0.363 1
1 279 . 14 1 1 A 28 28 THR N N 28 112.165 113.038 -0.873 1
1 280 . 14 1 1 A 29 29 TRP H H 29 7.395 7.830 -0.435 1
1 281 . 14 1 1 A 29 29 TRP HA H 29 4.915 5.489 -0.574 1
1 290 . 14 1 1 A 29 29 TRP C C 29 174.013 174.508 -0.495 1
1 291 . 14 1 1 A 29 29 TRP CA C 29 56.626 54.462 2.164 1
1 292 . 14 1 1 A 29 29 TRP CB C 29 29.487 32.144 -2.657 1
1 298 . 14 1 1 A 29 29 TRP N N 29 115.623 120.013 -4.390 1
1 300 . 14 1 1 A 30 30 GLN H H 30 8.759 8.596 0.163 1
1 301 . 14 1 1 A 30 30 GLN HA H 30 4.641 4.804 -0.163 1
1 308 . 14 1 1 A 30 30 GLN C C 30 175.072 174.303 0.769 1
1 309 . 14 1 1 A 30 30 GLN CA C 30 52.975 53.103 -0.128 1
1 310 . 14 1 1 A 30 30 GLN CB C 30 28.398 28.941 -0.543 1
1 312 . 14 1 1 A 30 30 GLN N N 30 117.497 119.917 -2.420 1
1 314 . 14 1 1 A 31 31 PRO HA H 31 4.487 4.546 -0.059 1
1 320 . 14 1 1 A 31 31 PRO C C 31 177.034 176.728 0.306 1
1 321 . 14 1 1 A 31 31 PRO CA C 31 62.710 63.008 -0.298 1
1 322 . 14 1 1 A 31 31 PRO CB C 31 32.738 32.436 0.302 1
1 325 . 14 1 1 A 32 32 SER H H 32 8.259 8.763 -0.504 1
1 326 . 14 1 1 A 32 32 SER HA H 32 4.670 4.717 -0.047 1
1 329 . 14 1 1 A 32 32 SER C C 32 174.689 174.365 0.324 1
1 330 . 14 1 1 A 32 32 SER CA C 32 57.296 58.285 -0.989 1
1 331 . 14 1 1 A 32 32 SER CB C 32 64.748 63.967 0.781 1
1 332 . 14 1 1 A 32 32 SER N N 32 117.667 117.481 0.186 1
1 333 . 14 1 1 A 33 33 ALA H H 33 9.038 8.469 0.569 1
1 334 . 14 1 1 A 33 33 ALA HA H 33 4.126 4.539 -0.413 1
1 338 . 14 1 1 A 33 33 ALA C C 33 177.795 177.540 0.255 1
1 339 . 14 1 1 A 33 33 ALA CA C 33 54.213 51.125 3.088 1
1 340 . 14 1 1 A 33 33 ALA CB C 33 17.948 17.735 0.213 1
1 341 . 14 1 1 A 33 33 ALA N N 33 131.772 126.139 5.633 1
1 342 . 14 1 1 A 34 34 GLY H H 34 8.576 7.830 0.746 1
1 343 . 14 1 1 A 34 34 GLY HA2 H 34 4.171 4.033 0.138 1
1 344 . 14 1 1 A 34 34 GLY HA3 H 34 3.592 4.033 -0.441 1
1 345 . 14 1 1 A 34 34 GLY C C 34 174.182 174.616 -0.434 1
1 346 . 14 1 1 A 34 34 GLY CA C 34 44.987 45.447 -0.460 1
1 347 . 14 1 1 A 34 34 GLY N N 34 111.339 106.444 4.895 1
1 348 . 14 1 1 A 35 35 ALA H H 35 7.637 7.771 -0.134 1
1 349 . 14 1 1 A 35 35 ALA HA H 35 4.210 4.108 0.102 1
1 353 . 14 1 1 A 35 35 ALA C C 35 178.918 177.994 0.924 1
1 354 . 14 1 1 A 35 35 ALA CA C 35 52.671 52.598 0.073 1
1 355 . 14 1 1 A 35 35 ALA CB C 35 18.988 19.223 -0.235 1
1 356 . 14 1 1 A 35 35 ALA N N 35 121.531 123.327 -1.796 1
1 357 . 14 1 1 A 36 36 THR H H 36 9.428 8.529 0.899 1
1 358 . 14 1 1 A 36 36 THR HA H 36 4.402 4.188 0.214 1
1 363 . 14 1 1 A 36 36 THR C C 36 174.739 174.456 0.283 1
1 364 . 14 1 1 A 36 36 THR CA C 36 62.692 63.645 -0.953 1
1 365 . 14 1 1 A 36 36 THR CB C 36 69.482 69.957 -0.475 1
1 367 . 14 1 1 A 36 36 THR N N 36 113.103 118.044 -4.941 1
1 368 . 14 1 1 A 37 37 HIS H H 37 7.857 7.310 0.547 1
1 369 . 14 1 1 A 37 37 HIS HA H 37 4.878 4.779 0.099 1
1 374 . 14 1 1 A 37 37 HIS C C 37 171.103 172.086 -0.983 1
1 375 . 14 1 1 A 37 37 HIS CA C 37 55.867 54.188 1.679 1
1 376 . 14 1 1 A 37 37 HIS CB C 37 32.655 32.285 0.370 1
1 379 . 14 1 1 A 37 37 HIS N N 37 118.486 114.446 4.040 1
1 380 . 14 1 1 A 38 38 TYR H H 38 9.217 8.850 0.367 1
1 381 . 14 1 1 A 38 38 TYR HA H 38 5.303 5.188 0.115 1
1 388 . 14 1 1 A 38 38 TYR C C 38 173.922 174.781 -0.859 1
1 389 . 14 1 1 A 38 38 TYR CA C 38 56.504 56.518 -0.014 1
1 390 . 14 1 1 A 38 38 TYR CB C 38 41.823 41.763 0.060 1
1 395 . 14 1 1 A 38 38 TYR N N 38 114.077 119.131 -5.054 1
1 396 . 14 1 1 A 39 39 LEU H H 39 9.052 9.048 0.004 1
1 397 . 14 1 1 A 39 39 LEU HA H 39 5.061 5.032 0.029 1
1 407 . 14 1 1 A 39 39 LEU C C 39 175.455 174.378 1.077 1
1 408 . 14 1 1 A 39 39 LEU CA C 39 53.855 53.971 -0.116 1
1 409 . 14 1 1 A 39 39 LEU CB C 39 45.254 43.956 1.298 1
1 413 . 14 1 1 A 39 39 LEU N N 39 123.997 125.590 -1.593 1
1 414 . 14 1 1 A 40 40 VAL H H 40 9.520 9.587 -0.067 1
1 415 . 14 1 1 A 40 40 VAL HA H 40 4.988 4.507 0.481 1
1 423 . 14 1 1 A 40 40 VAL C C 40 174.578 174.152 0.426 1
1 424 . 14 1 1 A 40 40 VAL CA C 40 60.575 61.200 -0.625 1
1 425 . 14 1 1 A 40 40 VAL CB C 40 33.284 32.231 1.053 1
1 428 . 14 1 1 A 40 40 VAL N N 40 129.678 129.045 0.633 1
1 429 . 14 1 1 A 41 41 ARG H H 41 9.096 9.065 0.031 1
1 430 . 14 1 1 A 41 41 ARG HA H 41 5.384 4.956 0.428 1
1 437 . 14 1 1 A 41 41 ARG C C 41 175.100 174.786 0.314 1
1 438 . 14 1 1 A 41 41 ARG CA C 41 54.297 54.766 -0.469 1
1 439 . 14 1 1 A 41 41 ARG CB C 41 33.003 31.476 1.527 1
1 442 . 14 1 1 A 41 41 ARG N N 41 126.332 128.901 -2.569 1
1 443 . 14 1 1 A 42 42 CYS H H 42 9.004 9.391 -0.387 1
1 444 . 14 1 1 A 42 42 CYS HA H 42 5.309 4.945 0.364 1
1 447 . 14 1 1 A 42 42 CYS C C 42 173.417 174.047 -0.630 1
1 448 . 14 1 1 A 42 42 CYS CA C 42 57.508 57.638 -0.130 1
1 449 . 14 1 1 A 42 42 CYS CB C 42 28.859 28.385 0.474 1
1 450 . 14 1 1 A 42 42 CYS N N 42 123.359 127.789 -4.430 1
1 451 . 14 1 1 A 43 43 SER H H 43 9.102 8.879 0.223 1
1 452 . 14 1 1 A 43 43 SER HA H 43 5.324 4.993 0.331 1
1 455 . 14 1 1 A 43 43 SER C C 43 171.429 171.648 -0.219 1
1 456 . 14 1 1 A 43 43 SER CA C 43 55.621 55.667 -0.046 1
1 457 . 14 1 1 A 43 43 SER CB C 43 64.856 65.750 -0.894 1
1 458 . 14 1 1 A 43 43 SER N N 43 125.444 123.237 2.207 1
1 459 . 14 1 1 A 44 44 PRO HA H 44 4.389 4.622 -0.233 1
1 466 . 14 1 1 A 44 44 PRO C C 44 176.559 177.229 -0.670 1
1 467 . 14 1 1 A 44 44 PRO CA C 44 63.027 63.194 -0.167 1
1 468 . 14 1 1 A 44 44 PRO CB C 44 31.935 32.837 -0.902 1
1 471 . 14 1 1 A 45 45 ALA H H 45 8.261 7.981 0.280 1
1 472 . 14 1 1 A 45 45 ALA HA H 45 4.157 4.478 -0.321 1
1 476 . 14 1 1 A 45 45 ALA C C 45 177.706 177.326 0.380 1
1 477 . 14 1 1 A 45 45 ALA CA C 45 53.284 54.792 -1.508 1
1 478 . 14 1 1 A 45 45 ALA CB C 45 18.978 19.510 -0.532 1
1 479 . 14 1 1 A 45 45 ALA N N 45 126.162 123.899 2.263 1
1 480 . 14 1 1 A 46 46 SER H H 46 8.275 7.652 0.623 1
1 481 . 14 1 1 A 46 46 SER HA H 46 4.779 4.708 0.071 1
1 484 . 14 1 1 A 46 46 SER C C 46 172.182 174.278 -2.096 1
1 485 . 14 1 1 A 46 46 SER CA C 46 55.091 55.274 -0.183 1
1 486 . 14 1 1 A 46 46 SER CB C 46 63.130 64.212 -1.082 1
1 487 . 14 1 1 A 46 46 SER N N 46 113.009 113.437 -0.428 1
1 488 . 14 1 1 A 47 47 PRO HA H 47 4.336 4.535 -0.199 1
1 493 . 14 1 1 A 47 47 PRO C C 47 177.165 176.297 0.868 1
1 494 . 14 1 1 A 47 47 PRO CA C 47 63.268 63.698 -0.430 1
1 495 . 14 1 1 A 47 47 PRO CB C 47 32.528 31.924 0.604 1
1 498 . 14 1 1 A 48 48 LYS H H 48 9.089 7.906 1.183 1
1 499 . 14 1 1 A 48 48 LYS HA H 48 4.408 4.171 0.237 1
1 508 . 14 1 1 A 48 48 LYS C C 48 176.917 176.679 0.238 1
1 509 . 14 1 1 A 48 48 LYS CA C 48 55.893 56.361 -0.468 1
1 510 . 14 1 1 A 48 48 LYS CB C 48 32.997 31.042 1.955 1
1 514 . 14 1 1 A 48 48 LYS N N 48 122.579 119.531 3.048 1
1 515 . 14 1 1 A 49 49 GLY HA2 H 49 4.021 4.210 -0.189 1
1 516 . 14 1 1 A 49 49 GLY HA3 H 49 3.881 4.212 -0.331 1
1 517 . 14 1 1 A 49 49 GLY C C 49 174.552 172.248 2.304 1
1 518 . 14 1 1 A 49 49 GLY CA C 49 46.011 45.521 0.490 1
1 519 . 14 1 1 A 50 50 GLU H H 50 8.608 8.671 -0.063 1
1 520 . 14 1 1 A 50 50 GLU HA H 50 4.335 4.793 -0.458 1
1 525 . 14 1 1 A 50 50 GLU C C 50 176.672 176.381 0.291 1
1 526 . 14 1 1 A 50 50 GLU CA C 50 56.978 54.872 2.106 1
1 527 . 14 1 1 A 50 50 GLU CB C 50 29.458 30.650 -1.192 1
1 529 . 14 1 1 A 50 50 GLU N N 50 121.378 120.628 0.750 1
1 530 . 14 1 1 A 51 51 GLU H H 51 8.287 8.273 0.014 1
1 531 . 14 1 1 A 51 51 GLU HA H 51 4.381 4.003 0.378 1
1 536 . 14 1 1 A 51 51 GLU C C 51 176.218 175.526 0.692 1
1 537 . 14 1 1 A 51 51 GLU CA C 51 56.996 57.276 -0.280 1
1 538 . 14 1 1 A 51 51 GLU CB C 51 31.066 27.441 3.625 1
1 540 . 14 1 1 A 51 51 GLU N N 51 120.863 118.200 2.663 1
1 541 . 14 1 1 A 52 52 GLU H H 52 8.445 8.201 0.244 1
1 542 . 14 1 1 A 52 52 GLU HA H 52 4.464 4.441 0.023 1
1 547 . 14 1 1 A 52 52 GLU C C 52 176.128 174.839 1.289 1
1 548 . 14 1 1 A 52 52 GLU CA C 52 55.955 55.439 0.516 1
1 549 . 14 1 1 A 52 52 GLU CB C 52 31.691 28.815 2.876 1
1 551 . 14 1 1 A 52 52 GLU N N 52 121.103 120.198 0.905 1
1 552 . 14 1 1 A 53 53 GLU H H 53 8.441 8.339 0.102 1
1 553 . 14 1 1 A 53 53 GLU HA H 53 4.609 5.231 -0.622 1
1 558 . 14 1 1 A 53 53 GLU C C 53 175.816 174.998 0.818 1
1 559 . 14 1 1 A 53 53 GLU CA C 53 56.697 54.951 1.746 1
1 560 . 14 1 1 A 53 53 GLU CB C 53 31.022 33.480 -2.458 1
1 562 . 14 1 1 A 53 53 GLU N N 53 121.949 123.157 -1.208 1
1 563 . 14 1 1 A 54 54 ARG H H 54 8.569 9.369 -0.800 1
1 564 . 14 1 1 A 54 54 ARG HA H 54 4.768 5.265 -0.497 1
1 571 . 14 1 1 A 54 54 ARG C C 54 174.881 174.367 0.514 1
1 572 . 14 1 1 A 54 54 ARG CA C 54 54.950 54.051 0.899 1
1 573 . 14 1 1 A 54 54 ARG CB C 54 33.374 34.048 -0.674 1
1 576 . 14 1 1 A 54 54 ARG N N 54 123.714 123.590 0.124 1
1 577 . 14 1 1 A 55 55 GLU H H 55 8.650 9.040 -0.390 1
1 578 . 14 1 1 A 55 55 GLU HA H 55 5.493 5.396 0.097 1
1 583 . 14 1 1 A 55 55 GLU C C 55 175.566 174.946 0.620 1
1 584 . 14 1 1 A 55 55 GLU CA C 55 54.915 54.803 0.112 1
1 585 . 14 1 1 A 55 55 GLU CB C 55 33.250 33.474 -0.224 1
1 587 . 14 1 1 A 55 55 GLU N N 55 123.537 121.625 1.912 1
1 588 . 14 1 1 A 56 56 VAL H H 56 9.419 8.751 0.668 1
1 589 . 14 1 1 A 56 56 VAL HA H 56 4.524 4.922 -0.398 1
1 597 . 14 1 1 A 56 56 VAL C C 56 173.502 174.591 -1.089 1
1 598 . 14 1 1 A 56 56 VAL CA C 56 60.981 58.897 2.084 1
1 599 . 14 1 1 A 56 56 VAL CB C 56 36.117 36.244 -0.127 1
1 602 . 14 1 1 A 56 56 VAL N N 56 123.343 118.593 4.750 1
1 603 . 14 1 1 A 57 57 GLN H H 57 8.767 8.766 0.001 1
1 604 . 14 1 1 A 57 57 GLN HA H 57 5.671 5.193 0.478 1
1 611 . 14 1 1 A 57 57 GLN C C 57 176.357 174.939 1.418 1
1 612 . 14 1 1 A 57 57 GLN CA C 57 54.735 54.143 0.592 1
1 613 . 14 1 1 A 57 57 GLN CB C 57 30.781 31.536 -0.755 1
1 615 . 14 1 1 A 57 57 GLN N N 57 125.639 120.457 5.182 1
1 617 . 14 1 1 A 58 58 VAL H H 58 9.217 8.856 0.361 1
1 618 . 14 1 1 A 58 58 VAL HA H 58 5.129 4.966 0.163 1
1 626 . 14 1 1 A 58 58 VAL C C 58 175.925 176.250 -0.325 1
1 627 . 14 1 1 A 58 58 VAL CA C 58 59.652 59.759 -0.107 1
1 628 . 14 1 1 A 58 58 VAL CB C 58 36.540 34.945 1.595 1
1 631 . 14 1 1 A 58 58 VAL N N 58 117.022 117.587 -0.565 1
1 632 . 14 1 1 A 59 59 GLY H H 59 9.008 8.961 0.047 1
1 633 . 14 1 1 A 59 59 GLY HA2 H 59 4.670 3.820 0.850 1
1 634 . 14 1 1 A 59 59 GLY HA3 H 59 3.914 3.854 0.060 1
1 635 . 14 1 1 A 59 59 GLY C C 59 173.386 174.401 -1.015 1
1 636 . 14 1 1 A 59 59 GLY CA C 59 45.093 46.339 -1.246 1
1 637 . 14 1 1 A 59 59 GLY N N 59 109.174 110.613 -1.439 1
1 638 . 14 1 1 A 60 60 ARG H H 60 7.695 7.748 -0.053 1
1 639 . 14 1 1 A 60 60 ARG HA H 60 4.866 4.928 -0.062 1
1 645 . 14 1 1 A 60 60 ARG C C 60 173.760 175.819 -2.059 1
1 646 . 14 1 1 A 60 60 ARG CA C 60 52.764 54.426 -1.662 1
1 647 . 14 1 1 A 60 60 ARG CB C 60 31.785 32.363 -0.578 1
1 650 . 14 1 1 A 60 60 ARG N N 60 118.520 117.052 1.468 1
1 651 . 14 1 1 A 61 61 PRO HA H 61 3.539 3.720 -0.181 1
1 658 . 14 1 1 A 61 61 PRO C C 61 173.175 173.866 -0.691 1
1 659 . 14 1 1 A 61 61 PRO CA C 61 62.265 62.849 -0.584 1
1 660 . 14 1 1 A 61 61 PRO CB C 61 27.546 30.863 -3.317 1
1 663 . 14 1 1 A 62 62 GLU H H 62 7.879 7.628 0.251 1
1 664 . 14 1 1 A 62 62 GLU HA H 62 4.071 4.629 -0.558 1
1 669 . 14 1 1 A 62 62 GLU C C 62 174.107 174.750 -0.643 1
1 670 . 14 1 1 A 62 62 GLU CA C 62 55.229 54.742 0.487 1
1 671 . 14 1 1 A 62 62 GLU CB C 62 32.838 32.306 0.532 1
1 673 . 14 1 1 A 62 62 GLU N N 62 118.173 113.810 4.363 1
1 674 . 14 1 1 A 63 63 VAL H H 63 8.930 8.468 0.462 1
1 675 . 14 1 1 A 63 63 VAL HA H 63 4.548 4.932 -0.384 1
1 683 . 14 1 1 A 63 63 VAL C C 63 170.325 173.142 -2.817 1
1 684 . 14 1 1 A 63 63 VAL CA C 63 60.770 59.401 1.369 1
1 685 . 14 1 1 A 63 63 VAL CB C 63 35.394 35.954 -0.560 1
1 688 . 14 1 1 A 63 63 VAL N N 63 117.161 121.201 -4.040 1
1 689 . 14 1 1 A 64 64 LEU H H 64 8.332 8.648 -0.316 1
1 690 . 14 1 1 A 64 64 LEU HA H 64 5.122 5.165 -0.043 1
1 700 . 14 1 1 A 64 64 LEU C C 64 176.243 174.778 1.465 1
1 701 . 14 1 1 A 64 64 LEU CA C 64 53.346 53.972 -0.626 1
1 702 . 14 1 1 A 64 64 LEU CB C 64 42.649 45.240 -2.591 1
1 706 . 14 1 1 A 64 64 LEU N N 64 130.510 128.074 2.436 1
1 707 . 14 1 1 A 65 65 LEU H H 65 9.261 9.019 0.242 1
1 708 . 14 1 1 A 65 65 LEU HA H 65 4.443 4.718 -0.275 1
1 718 . 14 1 1 A 65 65 LEU C C 65 174.016 176.136 -2.120 1
1 719 . 14 1 1 A 65 65 LEU CA C 65 53.920 54.029 -0.109 1
1 720 . 14 1 1 A 65 65 LEU CB C 65 42.976 43.562 -0.586 1
1 724 . 14 1 1 A 65 65 LEU N N 65 128.611 128.213 0.398 1
1 725 . 14 1 1 A 66 66 ASP H H 66 8.105 8.572 -0.467 1
1 726 . 14 1 1 A 66 66 ASP HA H 66 5.207 5.167 0.040 1
1 729 . 14 1 1 A 66 66 ASP C C 66 176.161 176.053 0.108 1
1 730 . 14 1 1 A 66 66 ASP CA C 66 51.001 52.316 -1.315 1
1 731 . 14 1 1 A 66 66 ASP CB C 66 42.836 43.424 -0.588 1
1 732 . 14 1 1 A 66 66 ASP N N 66 121.799 123.431 -1.632 1
1 733 . 14 1 1 A 67 67 GLY H H 67 8.688 8.827 -0.139 1
1 734 . 14 1 1 A 67 67 GLY HA2 H 67 3.923 3.881 0.042 1
1 735 . 14 1 1 A 67 67 GLY HA3 H 67 3.808 3.887 -0.079 1
1 736 . 14 1 1 A 67 67 GLY C C 67 175.500 174.448 1.052 1
1 737 . 14 1 1 A 67 67 GLY CA C 67 46.591 46.734 -0.143 1
1 738 . 14 1 1 A 67 67 GLY N N 67 106.518 110.809 -4.291 1
1 739 . 14 1 1 A 68 68 LEU H H 68 8.125 7.386 0.739 1
1 740 . 14 1 1 A 68 68 LEU HA H 68 4.252 4.819 -0.567 1
1 750 . 14 1 1 A 68 68 LEU C C 68 174.914 175.850 -0.936 1
1 751 . 14 1 1 A 68 68 LEU CA C 68 53.469 53.123 0.346 1
1 752 . 14 1 1 A 68 68 LEU CB C 68 40.422 43.945 -3.523 1
1 756 . 14 1 1 A 68 68 LEU N N 68 119.345 120.384 -1.039 1
1 757 . 14 1 1 A 69 69 GLU H H 69 8.207 8.247 -0.040 1
1 758 . 14 1 1 A 69 69 GLU HA H 69 4.908 4.840 0.068 1
1 763 . 14 1 1 A 69 69 GLU C C 69 174.464 174.492 -0.028 1
1 764 . 14 1 1 A 69 69 GLU CA C 69 53.081 53.685 -0.604 1
1 765 . 14 1 1 A 69 69 GLU CB C 69 31.538 29.997 1.541 1
1 767 . 14 1 1 A 69 69 GLU N N 69 119.486 121.624 -2.138 1
1 768 . 14 1 1 A 70 70 PRO HA H 70 4.866 4.332 0.534 1
1 775 . 14 1 1 A 70 70 PRO C C 70 178.285 177.397 0.888 1
1 776 . 14 1 1 A 70 70 PRO CA C 70 63.203 63.598 -0.395 1
1 777 . 14 1 1 A 70 70 PRO CB C 70 33.726 31.923 1.803 1
1 780 . 14 1 1 A 71 71 GLY H H 71 7.362 8.859 -1.497 1
1 781 . 14 1 1 A 71 71 GLY HA2 H 71 3.807 3.925 -0.118 1
1 782 . 14 1 1 A 71 71 GLY HA3 H 71 3.756 3.927 -0.171 1
1 783 . 14 1 1 A 71 71 GLY C C 71 174.664 173.736 0.928 1
1 784 . 14 1 1 A 71 71 GLY CA C 71 46.926 46.412 0.514 1
1 785 . 14 1 1 A 71 71 GLY N N 71 113.776 111.596 2.180 1
1 786 . 14 1 1 A 72 72 ARG H H 72 8.036 7.332 0.704 1
1 787 . 14 1 1 A 72 72 ARG HA H 72 4.597 4.797 -0.200 1
1 793 . 14 1 1 A 72 72 ARG C C 72 173.293 174.272 -0.979 1
1 794 . 14 1 1 A 72 72 ARG CA C 72 54.633 54.192 0.441 1
1 795 . 14 1 1 A 72 72 ARG CB C 72 33.704 33.518 0.186 1
1 798 . 14 1 1 A 72 72 ARG N N 72 119.611 119.571 0.040 1
1 799 . 14 1 1 A 73 73 ASP H H 73 7.785 8.642 -0.857 1
1 800 . 14 1 1 A 73 73 ASP HA H 73 5.276 5.425 -0.149 1
1 803 . 14 1 1 A 73 73 ASP C C 73 175.904 174.847 1.057 1
1 804 . 14 1 1 A 73 73 ASP CA C 73 53.568 52.665 0.903 1
1 805 . 14 1 1 A 73 73 ASP CB C 73 42.970 42.507 0.463 1
1 806 . 14 1 1 A 73 73 ASP N N 73 118.900 122.667 -3.767 1
1 807 . 14 1 1 A 74 74 TYR H H 74 9.516 8.790 0.726 1
1 808 . 14 1 1 A 74 74 TYR HA H 74 4.800 5.149 -0.349 1
1 815 . 14 1 1 A 74 74 TYR C C 74 174.631 174.948 -0.317 1
1 816 . 14 1 1 A 74 74 TYR CA C 74 58.548 56.474 2.074 1
1 817 . 14 1 1 A 74 74 TYR CB C 74 42.029 43.626 -1.597 1
1 822 . 14 1 1 A 74 74 TYR N N 74 121.903 121.120 0.783 1
1 823 . 14 1 1 A 75 75 GLU H H 75 9.248 9.093 0.155 1
1 824 . 14 1 1 A 75 75 GLU HA H 75 4.756 4.996 -0.240 1
1 829 . 14 1 1 A 75 75 GLU C C 75 175.524 175.272 0.252 1
1 830 . 14 1 1 A 75 75 GLU CA C 75 55.621 55.362 0.259 1
1 831 . 14 1 1 A 75 75 GLU CB C 75 30.778 30.665 0.113 1
1 833 . 14 1 1 A 75 75 GLU N N 75 122.425 122.083 0.342 1
1 834 . 14 1 1 A 76 76 VAL H H 76 8.884 8.631 0.253 1
1 835 . 14 1 1 A 76 76 VAL HA H 76 5.246 4.578 0.668 1
1 843 . 14 1 1 A 76 76 VAL C C 76 174.800 175.428 -0.628 1
1 844 . 14 1 1 A 76 76 VAL CA C 76 60.199 62.780 -2.581 1
1 845 . 14 1 1 A 76 76 VAL CB C 76 33.449 31.649 1.800 1
1 848 . 14 1 1 A 76 76 VAL N N 76 126.853 124.897 1.956 1
1 849 . 14 1 1 A 77 77 SER H H 77 9.234 8.716 0.518 1
1 850 . 14 1 1 A 77 77 SER HA H 77 5.398 5.050 0.348 1
1 853 . 14 1 1 A 77 77 SER C C 77 173.138 174.017 -0.879 1
1 854 . 14 1 1 A 77 77 SER CA C 77 56.032 57.739 -1.707 1
1 855 . 14 1 1 A 77 77 SER CB C 77 66.374 64.126 2.248 1
1 856 . 14 1 1 A 77 77 SER N N 77 120.852 125.417 -4.565 1
1 857 . 14 1 1 A 78 78 VAL H H 78 9.092 8.949 0.143 1
1 858 . 14 1 1 A 78 78 VAL HA H 78 4.756 4.726 0.030 1
1 866 . 14 1 1 A 78 78 VAL C C 78 173.641 174.060 -0.419 1
1 867 . 14 1 1 A 78 78 VAL CA C 78 61.246 60.994 0.252 1
1 868 . 14 1 1 A 78 78 VAL CB C 78 34.467 32.501 1.966 1
1 871 . 14 1 1 A 78 78 VAL N N 78 122.453 127.157 -4.704 1
1 872 . 14 1 1 A 79 79 GLN H H 79 8.587 8.762 -0.175 1
1 873 . 14 1 1 A 79 79 GLN HA H 79 4.438 4.962 -0.524 1
1 880 . 14 1 1 A 79 79 GLN C C 79 174.999 174.605 0.394 1
1 881 . 14 1 1 A 79 79 GLN CA C 79 54.227 54.104 0.123 1
1 882 . 14 1 1 A 79 79 GLN CB C 79 33.587 32.185 1.402 1
1 884 . 14 1 1 A 79 79 GLN N N 79 125.619 127.406 -1.787 1
1 886 . 14 1 1 A 80 80 SER H H 80 8.623 9.274 -0.651 1
1 887 . 14 1 1 A 80 80 SER HA H 80 4.756 4.704 0.052 1
1 890 . 14 1 1 A 80 80 SER C C 80 172.264 174.063 -1.799 1
1 891 . 14 1 1 A 80 80 SER CA C 80 58.177 59.231 -1.054 1
1 892 . 14 1 1 A 80 80 SER CB C 80 63.920 62.965 0.955 1
1 893 . 14 1 1 A 80 80 SER N N 80 122.844 124.059 -1.215 1
1 894 . 14 1 1 A 81 81 LEU H H 81 8.348 8.741 -0.393 1
1 895 . 14 1 1 A 81 81 LEU HA H 81 5.124 4.469 0.655 1
1 905 . 14 1 1 A 81 81 LEU C C 81 175.775 176.959 -1.184 1
1 906 . 14 1 1 A 81 81 LEU CA C 81 54.033 53.394 0.639 1
1 907 . 14 1 1 A 81 81 LEU CB C 81 44.690 42.644 2.046 1
1 911 . 14 1 1 A 81 81 LEU N N 81 123.191 127.488 -4.297 1
1 912 . 14 1 1 A 82 82 ARG H H 82 8.374 8.693 -0.319 1
1 913 . 14 1 1 A 82 82 ARG HA H 82 4.616 4.569 0.047 1
1 919 . 14 1 1 A 82 82 ARG C C 82 176.864 175.844 1.020 1
1 920 . 14 1 1 A 82 82 ARG CA C 82 55.868 55.920 -0.052 1
1 921 . 14 1 1 A 82 82 ARG CB C 82 32.322 32.432 -0.110 1
1 924 . 14 1 1 A 82 82 ARG N N 82 121.029 119.647 1.382 1
1 925 . 14 1 1 A 83 83 GLY H H 83 8.309 7.498 0.811 1
1 926 . 14 1 1 A 83 83 GLY HA2 H 83 4.031 4.091 -0.060 1
1 927 . 14 1 1 A 83 83 GLY HA3 H 83 3.888 4.142 -0.254 1
1 928 . 14 1 1 A 83 83 GLY C C 83 174.562 173.914 0.648 1
1 929 . 14 1 1 A 83 83 GLY CA C 83 45.963 46.069 -0.106 1
1 930 . 14 1 1 A 83 83 GLY N N 83 109.937 107.106 2.831 1
1 931 . 14 1 1 A 84 84 PRO HA H 84 4.573 4.445 0.128 1
1 938 . 14 1 1 A 84 84 PRO C C 84 176.533 175.726 0.807 1
1 939 . 14 1 1 A 84 84 PRO CA C 84 63.485 64.237 -0.752 1
1 940 . 14 1 1 A 84 84 PRO CB C 84 32.409 32.148 0.261 1
1 943 . 14 1 1 A 85 85 GLU H H 85 7.799 7.538 0.261 1
1 944 . 14 1 1 A 85 85 GLU HA H 85 4.369 4.850 -0.481 1
1 949 . 14 1 1 A 85 85 GLU C C 85 174.722 175.294 -0.572 1
1 950 . 14 1 1 A 85 85 GLU CA C 85 55.899 54.809 1.090 1
1 951 . 14 1 1 A 85 85 GLU CB C 85 31.911 33.163 -1.252 1
1 953 . 14 1 1 A 85 85 GLU N N 85 122.093 112.683 9.410 1
1 954 . 14 1 1 A 86 86 GLY H H 86 8.329 8.664 -0.335 1
1 955 . 14 1 1 A 86 86 GLY HA2 H 86 5.298 4.328 0.970 1
1 956 . 14 1 1 A 86 86 GLY HA3 H 86 3.559 4.341 -0.782 1
1 957 . 14 1 1 A 86 86 GLY C C 86 174.355 172.870 1.485 1
1 958 . 14 1 1 A 86 86 GLY CA C 86 44.034 44.243 -0.209 1
1 959 . 14 1 1 A 86 86 GLY N N 86 109.387 108.734 0.653 1
1 960 . 14 1 1 A 87 87 SER H H 87 8.807 8.409 0.398 1
1 961 . 14 1 1 A 87 87 SER HA H 87 4.670 4.615 0.055 1
1 964 . 14 1 1 A 87 87 SER C C 87 175.195 174.552 0.643 1
1 965 . 14 1 1 A 87 87 SER CA C 87 57.737 57.807 -0.070 1
1 966 . 14 1 1 A 87 87 SER CB C 87 67.829 65.978 1.851 1
1 967 . 14 1 1 A 87 87 SER N N 87 117.698 112.613 5.085 1
1 968 . 14 1 1 A 88 88 GLU H H 88 8.754 8.649 0.105 1
1 969 . 14 1 1 A 88 88 GLU HA H 88 4.357 4.301 0.056 1
1 974 . 14 1 1 A 88 88 GLU C C 88 177.474 176.871 0.603 1
1 975 . 14 1 1 A 88 88 GLU CA C 88 57.525 56.767 0.758 1
1 976 . 14 1 1 A 88 88 GLU CB C 88 31.162 30.296 0.866 1
1 978 . 14 1 1 A 88 88 GLU N N 88 118.709 120.222 -1.513 1
1 979 . 14 1 1 A 89 89 ALA H H 89 8.855 8.405 0.450 1
1 980 . 14 1 1 A 89 89 ALA HA H 89 4.792 4.502 0.290 1
1 984 . 14 1 1 A 89 89 ALA C C 89 178.379 176.267 2.112 1
1 985 . 14 1 1 A 89 89 ALA CA C 89 51.264 52.081 -0.817 1
1 986 . 14 1 1 A 89 89 ALA CB C 89 20.040 19.312 0.728 1
1 987 . 14 1 1 A 89 89 ALA N N 89 127.301 125.037 2.264 1
1 988 . 14 1 1 A 90 90 ARG H H 90 8.549 8.789 -0.240 1
1 989 . 14 1 1 A 90 90 ARG HA H 90 4.658 4.717 -0.059 1
1 996 . 14 1 1 A 90 90 ARG C C 90 174.720 175.701 -0.981 1
1 997 . 14 1 1 A 90 90 ARG CA C 90 53.575 54.821 -1.246 1
1 998 . 14 1 1 A 90 90 ARG CB C 90 33.456 31.089 2.367 1
1 1001 . 14 1 1 A 90 90 ARG N N 90 121.289 124.393 -3.104 1
1 1002 . 14 1 1 A 91 91 GLY H H 91 8.396 8.922 -0.526 1
1 1003 . 14 1 1 A 91 91 GLY HA2 H 91 5.306 4.170 1.136 1
1 1004 . 14 1 1 A 91 91 GLY HA3 H 91 3.700 4.201 -0.501 1
1 1005 . 14 1 1 A 91 91 GLY C C 91 173.191 172.139 1.052 1
1 1006 . 14 1 1 A 91 91 GLY CA C 91 44.493 43.812 0.681 1
1 1007 . 14 1 1 A 91 91 GLY N N 91 108.579 112.124 -3.545 1
1 1008 . 14 1 1 A 92 92 ILE H H 92 8.891 8.244 0.647 1
1 1009 . 14 1 1 A 92 92 ILE HA H 92 4.499 5.018 -0.519 1
1 1019 . 14 1 1 A 92 92 ILE C C 92 171.877 173.830 -1.953 1
1 1020 . 14 1 1 A 92 92 ILE CA C 92 60.682 58.884 1.798 1
1 1021 . 14 1 1 A 92 92 ILE CB C 92 42.425 42.038 0.387 1
1 1025 . 14 1 1 A 92 92 ILE N N 92 118.313 121.340 -3.027 1
1 1026 . 14 1 1 A 93 93 ARG H H 93 7.980 8.520 -0.540 1
1 1027 . 14 1 1 A 93 93 ARG HA H 93 5.224 4.517 0.707 1
1 1034 . 14 1 1 A 93 93 ARG C C 93 175.072 175.114 -0.042 1
1 1035 . 14 1 1 A 93 93 ARG CA C 93 54.499 55.303 -0.804 1
1 1036 . 14 1 1 A 93 93 ARG CB C 93 31.767 30.320 1.447 1
1 1039 . 14 1 1 A 93 93 ARG N N 93 124.879 127.759 -2.880 1
1 1040 . 14 1 1 A 94 94 ALA H H 94 9.064 8.394 0.670 1
1 1041 . 14 1 1 A 94 94 ALA HA H 94 4.731 4.550 0.181 1
1 1045 . 14 1 1 A 94 94 ALA C C 94 174.494 177.385 -2.891 1
1 1046 . 14 1 1 A 94 94 ALA CA C 94 50.577 52.846 -2.269 1
1 1047 . 14 1 1 A 94 94 ALA CB C 94 23.082 19.818 3.264 1
1 1048 . 14 1 1 A 94 94 ALA N N 94 126.095 129.506 -3.411 1
1 1049 . 14 1 1 A 95 95 ARG H H 95 8.263 9.014 -0.751 1
1 1050 . 14 1 1 A 95 95 ARG HA H 95 5.548 5.303 0.245 1
1 1058 . 14 1 1 A 95 95 ARG C C 95 176.901 174.687 2.214 1
1 1059 . 14 1 1 A 95 95 ARG CA C 95 53.787 54.430 -0.643 1
1 1060 . 14 1 1 A 95 95 ARG CB C 95 32.426 34.038 -1.612 1
1 1063 . 14 1 1 A 95 95 ARG N N 95 123.374 117.782 5.592 1
1 1065 . 14 1 1 A 96 96 THR H H 96 9.208 8.784 0.424 1
1 1066 . 14 1 1 A 96 96 THR HA H 96 4.461 5.073 -0.612 1
1 1071 . 14 1 1 A 96 96 THR CA C 96 58.248 58.430 -0.182 1
1 1072 . 14 1 1 A 96 96 THR CB C 96 68.466 71.338 -2.872 1
1 1074 . 14 1 1 A 96 96 THR N N 96 119.492 111.952 7.540 1
1 1075 . 14 1 1 A 97 97 PRO HA H 97 4.636 4.618 0.018 1
1 1082 . 14 1 1 A 97 97 PRO C C 97 175.725 175.883 -0.158 1
1 1083 . 14 1 1 A 97 97 PRO CA C 97 61.907 62.330 -0.423 1
1 1084 . 14 1 1 A 97 97 PRO CB C 97 32.590 33.413 -0.823 1
1 1087 . 14 1 1 A 98 98 THR H H 98 7.943 8.367 -0.424 1
1 1088 . 14 1 1 A 98 98 THR HA H 98 4.208 5.022 -0.814 1
1 1093 . 14 1 1 A 98 98 THR C C 98 175.058 172.516 2.542 1
1 1094 . 14 1 1 A 98 98 THR CA C 98 62.069 60.134 1.935 1
1 1095 . 14 1 1 A 98 98 THR CB C 98 69.719 71.190 -1.471 1
1 1097 . 14 1 1 A 98 98 THR N N 98 107.148 111.110 -3.962 1
1 1098 . 14 1 1 A 99 99 SER H H 99 8.163 8.918 -0.755 1
1 1099 . 14 1 1 A 99 99 SER HA H 99 4.524 4.744 -0.220 1
1 1102 . 14 1 1 A 99 99 SER C C 99 174.319 173.778 0.541 1
1 1103 . 14 1 1 A 99 99 SER CA C 99 58.107 57.358 0.749 1
1 1104 . 14 1 1 A 99 99 SER CB C 99 64.492 63.353 1.139 1
1 1105 . 14 1 1 A 99 99 SER N N 99 115.114 122.648 -7.534 1
1 1106 . 14 1 1 A 100 100 GLY H H 100 8.336 8.476 -0.140 1
1 1107 . 14 1 1 A 100 100 GLY HA2 H 100 4.222 4.238 -0.016 1
1 1108 . 14 1 1 A 100 100 GLY HA3 H 100 4.222 4.238 -0.016 1
1 1109 . 14 1 1 A 100 100 GLY C C 100 171.696 174.513 -2.817 1
1 1110 . 14 1 1 A 100 100 GLY CA C 100 44.617 44.494 0.123 1
1 1111 . 14 1 1 A 100 100 GLY N N 100 110.678 113.866 -3.188 1
1 1112 . 14 1 1 A 101 101 PRO HA H 101 4.506 4.485 0.021 1
1 1118 . 14 1 1 A 101 101 PRO CA C 101 63.358 64.116 -0.758 1
1 1119 . 14 1 1 A 101 101 PRO CB C 101 32.313 31.754 0.559 1
1 1 . 15 1 1 A 6 6 SER HA H 6 4.528 5.386 -0.858 1
1 3 . 15 1 1 A 6 6 SER CA C 6 58.373 57.541 0.832 1
1 4 . 15 1 1 A 6 6 SER CB C 6 63.978 66.373 -2.395 1
1 5 . 15 1 1 A 7 7 GLY H H 7 8.228 8.771 -0.543 1
1 6 . 15 1 1 A 7 7 GLY HA2 H 7 4.134 4.099 0.035 1
1 7 . 15 1 1 A 7 7 GLY HA3 H 7 4.134 4.101 0.033 1
1 8 . 15 1 1 A 7 7 GLY CA C 7 44.607 43.839 0.768 1
1 9 . 15 1 1 A 7 7 GLY N N 7 110.638 109.423 1.215 1
1 10 . 15 1 1 A 8 8 PRO HA H 8 4.419 4.721 -0.302 1
1 17 . 15 1 1 A 8 8 PRO C C 8 176.908 175.046 1.862 1
1 18 . 15 1 1 A 8 8 PRO CA C 8 62.851 62.430 0.421 1
1 19 . 15 1 1 A 8 8 PRO CB C 8 32.243 29.620 2.623 1
1 22 . 15 1 1 A 9 9 LEU H H 9 8.462 8.342 0.120 1
1 23 . 15 1 1 A 9 9 LEU HA H 9 4.494 4.849 -0.355 1
1 33 . 15 1 1 A 9 9 LEU C C 9 174.124 174.272 -0.148 1
1 34 . 15 1 1 A 9 9 LEU CA C 9 52.587 51.756 0.831 1
1 35 . 15 1 1 A 9 9 LEU CB C 9 43.150 43.899 -0.749 1
1 39 . 15 1 1 A 9 9 LEU N N 9 126.015 125.010 1.005 1
1 40 . 15 1 1 A 10 10 PRO HA H 10 4.820 4.646 0.174 1
1 47 . 15 1 1 A 10 10 PRO CA C 10 61.368 62.556 -1.188 1
1 48 . 15 1 1 A 10 10 PRO CB C 10 31.391 31.691 -0.300 1
1 51 . 15 1 1 A 11 11 PRO HA H 11 4.949 4.623 0.326 1
1 58 . 15 1 1 A 11 11 PRO CA C 11 61.183 61.826 -0.643 1
1 59 . 15 1 1 A 11 11 PRO CB C 11 30.656 31.910 -1.254 1
1 62 . 15 1 1 A 12 12 PRO HA H 12 4.341 4.711 -0.370 1
1 69 . 15 1 1 A 12 12 PRO C C 12 174.849 176.701 -1.852 1
1 70 . 15 1 1 A 12 12 PRO CA C 12 63.062 62.664 0.398 1
1 71 . 15 1 1 A 12 12 PRO CB C 12 31.831 31.874 -0.043 1
1 74 . 15 1 1 A 13 13 ARG H H 13 7.828 8.332 -0.504 1
1 75 . 15 1 1 A 13 13 ARG HA H 13 4.536 4.529 0.007 1
1 82 . 15 1 1 A 13 13 ARG C C 13 174.608 176.253 -1.645 1
1 83 . 15 1 1 A 13 13 ARG CA C 13 54.774 56.361 -1.587 1
1 84 . 15 1 1 A 13 13 ARG CB C 13 33.250 31.973 1.277 1
1 87 . 15 1 1 A 13 13 ARG N N 13 120.532 117.136 3.396 1
1 88 . 15 1 1 A 14 14 ALA H H 14 8.694 7.818 0.876 1
1 89 . 15 1 1 A 14 14 ALA HA H 14 3.986 4.379 -0.393 1
1 93 . 15 1 1 A 14 14 ALA C C 14 177.232 176.665 0.567 1
1 94 . 15 1 1 A 14 14 ALA CA C 14 52.461 51.935 0.526 1
1 95 . 15 1 1 A 14 14 ALA CB C 14 16.806 17.162 -0.356 1
1 96 . 15 1 1 A 14 14 ALA N N 14 121.921 121.513 0.408 1
1 97 . 15 1 1 A 15 15 LEU H H 15 8.097 8.413 -0.316 1
1 98 . 15 1 1 A 15 15 LEU HA H 15 4.670 4.670 0.000 1
1 108 . 15 1 1 A 15 15 LEU C C 15 177.364 176.492 0.872 1
1 109 . 15 1 1 A 15 15 LEU CA C 15 57.543 54.823 2.720 1
1 110 . 15 1 1 A 15 15 LEU CB C 15 41.877 41.432 0.445 1
1 114 . 15 1 1 A 15 15 LEU N N 15 122.215 121.074 1.141 1
1 115 . 15 1 1 A 16 16 THR H H 16 9.520 9.039 0.481 1
1 116 . 15 1 1 A 16 16 THR HA H 16 4.369 4.917 -0.548 1
1 121 . 15 1 1 A 16 16 THR C C 16 172.453 172.607 -0.154 1
1 122 . 15 1 1 A 16 16 THR CA C 16 62.480 61.428 1.052 1
1 123 . 15 1 1 A 16 16 THR CB C 16 72.198 72.809 -0.611 1
1 125 . 15 1 1 A 16 16 THR N N 16 122.214 120.013 2.201 1
1 126 . 15 1 1 A 17 17 LEU H H 17 8.847 8.766 0.081 1
1 127 . 15 1 1 A 17 17 LEU HA H 17 4.573 4.537 0.036 1
1 137 . 15 1 1 A 17 17 LEU C C 17 174.695 176.751 -2.056 1
1 138 . 15 1 1 A 17 17 LEU CA C 17 53.840 54.379 -0.539 1
1 139 . 15 1 1 A 17 17 LEU CB C 17 40.290 42.073 -1.783 1
1 143 . 15 1 1 A 17 17 LEU N N 17 127.415 127.359 0.056 1
1 144 . 15 1 1 A 18 18 ALA H H 18 8.647 8.692 -0.045 1
1 145 . 15 1 1 A 18 18 ALA HA H 18 4.106 3.989 0.117 1
1 149 . 15 1 1 A 18 18 ALA C C 18 178.236 177.248 0.988 1
1 150 . 15 1 1 A 18 18 ALA CA C 18 53.926 54.363 -0.437 1
1 151 . 15 1 1 A 18 18 ALA CB C 18 18.876 18.752 0.124 1
1 152 . 15 1 1 A 18 18 ALA N N 18 133.362 129.804 3.558 1
1 153 . 15 1 1 A 19 19 ALA H H 19 7.772 6.966 0.806 1
1 154 . 15 1 1 A 19 19 ALA HA H 19 4.561 4.674 -0.113 1
1 158 . 15 1 1 A 19 19 ALA C C 19 176.032 174.365 1.667 1
1 159 . 15 1 1 A 19 19 ALA CA C 19 53.011 51.702 1.309 1
1 160 . 15 1 1 A 19 19 ALA CB C 19 21.869 22.768 -0.899 1
1 161 . 15 1 1 A 19 19 ALA N N 19 115.654 116.658 -1.004 1
1 162 . 15 1 1 A 20 20 VAL H H 20 8.697 8.911 -0.214 1
1 163 . 15 1 1 A 20 20 VAL HA H 20 4.951 4.816 0.135 1
1 171 . 15 1 1 A 20 20 VAL C C 20 174.314 174.150 0.164 1
1 172 . 15 1 1 A 20 20 VAL CA C 20 61.352 60.207 1.145 1
1 173 . 15 1 1 A 20 20 VAL CB C 20 35.394 33.552 1.842 1
1 176 . 15 1 1 A 20 20 VAL N N 20 120.848 119.739 1.109 1
1 177 . 15 1 1 A 21 21 THR H H 21 9.198 8.406 0.792 1
1 178 . 15 1 1 A 21 21 THR HA H 21 4.941 4.743 0.198 1
1 183 . 15 1 1 A 21 21 THR C C 21 174.416 174.644 -0.228 1
1 184 . 15 1 1 A 21 21 THR CA C 21 60.347 58.931 1.416 1
1 185 . 15 1 1 A 21 21 THR CB C 21 68.713 71.831 -3.118 1
1 187 . 15 1 1 A 21 21 THR N N 21 120.326 124.542 -4.216 1
1 188 . 15 1 1 A 22 22 PRO HA H 22 4.634 4.562 0.072 1
1 194 . 15 1 1 A 22 22 PRO C C 22 173.606 176.924 -3.318 1
1 195 . 15 1 1 A 22 22 PRO CA C 22 66.519 64.264 2.255 1
1 196 . 15 1 1 A 22 22 PRO CB C 22 32.078 31.624 0.454 1
1 199 . 15 1 1 A 23 23 ARG H H 23 6.621 8.150 -1.529 1
1 200 . 15 1 1 A 23 23 ARG HA H 23 4.591 4.469 0.122 1
1 207 . 15 1 1 A 23 23 ARG C C 23 176.554 175.884 0.670 1
1 208 . 15 1 1 A 23 23 ARG CA C 23 53.892 56.460 -2.568 1
1 209 . 15 1 1 A 23 23 ARG CB C 23 33.498 33.220 0.278 1
1 212 . 15 1 1 A 23 23 ARG N N 23 102.938 117.052 -14.114 1
1 213 . 15 1 1 A 24 24 THR H H 24 7.352 8.055 -0.703 1
1 214 . 15 1 1 A 24 24 THR HA H 24 5.593 5.193 0.400 1
1 219 . 15 1 1 A 24 24 THR C C 24 172.345 172.311 0.034 1
1 220 . 15 1 1 A 24 24 THR CA C 24 59.311 60.537 -1.226 1
1 221 . 15 1 1 A 24 24 THR CB C 24 73.311 71.708 1.603 1
1 223 . 15 1 1 A 24 24 THR N N 24 108.792 109.936 -1.144 1
1 224 . 15 1 1 A 25 25 VAL H H 25 8.437 9.135 -0.698 1
1 225 . 15 1 1 A 25 25 VAL HA H 25 4.512 4.848 -0.336 1
1 233 . 15 1 1 A 25 25 VAL C C 25 172.854 174.020 -1.166 1
1 234 . 15 1 1 A 25 25 VAL CA C 25 61.617 61.014 0.603 1
1 235 . 15 1 1 A 25 25 VAL CB C 25 36.742 33.623 3.119 1
1 238 . 15 1 1 A 25 25 VAL N N 25 117.023 122.588 -5.565 1
1 239 . 15 1 1 A 26 26 HIS H H 26 8.915 8.638 0.277 1
1 240 . 15 1 1 A 26 26 HIS HA H 26 5.765 5.528 0.237 1
1 245 . 15 1 1 A 26 26 HIS C C 26 173.976 173.368 0.608 1
1 246 . 15 1 1 A 26 26 HIS CA C 26 52.896 53.678 -0.782 1
1 247 . 15 1 1 A 26 26 HIS CB C 26 34.004 32.869 1.135 1
1 250 . 15 1 1 A 26 26 HIS N N 26 128.155 127.716 0.439 1
1 251 . 15 1 1 A 27 27 LEU H H 27 9.034 9.630 -0.596 1
1 252 . 15 1 1 A 27 27 LEU HA H 27 5.505 5.174 0.331 1
1 262 . 15 1 1 A 27 27 LEU C C 27 174.821 174.739 0.082 1
1 263 . 15 1 1 A 27 27 LEU CA C 27 53.376 53.496 -0.120 1
1 264 . 15 1 1 A 27 27 LEU CB C 27 46.306 47.102 -0.796 1
1 268 . 15 1 1 A 27 27 LEU N N 27 128.569 129.980 -1.411 1
1 269 . 15 1 1 A 28 28 THR H H 28 8.844 8.717 0.127 1
1 270 . 15 1 1 A 28 28 THR HA H 28 4.485 4.707 -0.222 1
1 275 . 15 1 1 A 28 28 THR C C 28 172.773 173.654 -0.881 1
1 276 . 15 1 1 A 28 28 THR CA C 28 60.052 60.317 -0.265 1
1 277 . 15 1 1 A 28 28 THR CB C 28 71.704 71.426 0.278 1
1 279 . 15 1 1 A 28 28 THR N N 28 112.165 112.886 -0.721 1
1 280 . 15 1 1 A 29 29 TRP H H 29 7.395 7.908 -0.513 1
1 281 . 15 1 1 A 29 29 TRP HA H 29 4.915 5.609 -0.694 1
1 290 . 15 1 1 A 29 29 TRP C C 29 174.013 174.872 -0.859 1
1 291 . 15 1 1 A 29 29 TRP CA C 29 56.626 54.598 2.028 1
1 292 . 15 1 1 A 29 29 TRP CB C 29 29.487 31.834 -2.347 1
1 298 . 15 1 1 A 29 29 TRP N N 29 115.623 119.881 -4.258 1
1 300 . 15 1 1 A 30 30 GLN H H 30 8.759 8.543 0.216 1
1 301 . 15 1 1 A 30 30 GLN HA H 30 4.641 4.720 -0.079 1
1 308 . 15 1 1 A 30 30 GLN C C 30 175.072 174.347 0.725 1
1 309 . 15 1 1 A 30 30 GLN CA C 30 52.975 54.221 -1.246 1
1 310 . 15 1 1 A 30 30 GLN CB C 30 28.398 28.309 0.089 1
1 312 . 15 1 1 A 30 30 GLN N N 30 117.497 120.163 -2.666 1
1 314 . 15 1 1 A 31 31 PRO HA H 31 4.487 4.624 -0.137 1
1 320 . 15 1 1 A 31 31 PRO C C 31 177.034 176.727 0.307 1
1 321 . 15 1 1 A 31 31 PRO CA C 31 62.710 63.053 -0.343 1
1 322 . 15 1 1 A 31 31 PRO CB C 31 32.738 32.325 0.413 1
1 325 . 15 1 1 A 32 32 SER H H 32 8.259 8.290 -0.031 1
1 326 . 15 1 1 A 32 32 SER HA H 32 4.670 4.626 0.044 1
1 329 . 15 1 1 A 32 32 SER C C 32 174.689 173.998 0.691 1
1 330 . 15 1 1 A 32 32 SER CA C 32 57.296 57.413 -0.117 1
1 331 . 15 1 1 A 32 32 SER CB C 32 64.748 64.564 0.184 1
1 332 . 15 1 1 A 32 32 SER N N 32 117.667 117.260 0.407 1
1 333 . 15 1 1 A 33 33 ALA H H 33 9.038 8.429 0.609 1
1 334 . 15 1 1 A 33 33 ALA HA H 33 4.126 4.797 -0.671 1
1 338 . 15 1 1 A 33 33 ALA C C 33 177.795 177.430 0.365 1
1 339 . 15 1 1 A 33 33 ALA CA C 33 54.213 50.635 3.578 1
1 340 . 15 1 1 A 33 33 ALA CB C 33 17.948 20.176 -2.228 1
1 341 . 15 1 1 A 33 33 ALA N N 33 131.772 124.880 6.892 1
1 342 . 15 1 1 A 34 34 GLY H H 34 8.576 8.522 0.054 1
1 343 . 15 1 1 A 34 34 GLY HA2 H 34 4.171 3.915 0.256 1
1 344 . 15 1 1 A 34 34 GLY HA3 H 34 3.592 3.924 -0.332 1
1 345 . 15 1 1 A 34 34 GLY C C 34 174.182 174.529 -0.347 1
1 346 . 15 1 1 A 34 34 GLY CA C 34 44.987 46.520 -1.533 1
1 347 . 15 1 1 A 34 34 GLY N N 34 111.339 111.761 -0.422 1
1 348 . 15 1 1 A 35 35 ALA H H 35 7.637 7.973 -0.336 1
1 349 . 15 1 1 A 35 35 ALA HA H 35 4.210 4.320 -0.110 1
1 353 . 15 1 1 A 35 35 ALA C C 35 178.918 177.225 1.693 1
1 354 . 15 1 1 A 35 35 ALA CA C 35 52.671 50.895 1.776 1
1 355 . 15 1 1 A 35 35 ALA CB C 35 18.988 19.610 -0.622 1
1 356 . 15 1 1 A 35 35 ALA N N 35 121.531 122.746 -1.215 1
1 357 . 15 1 1 A 36 36 THR H H 36 9.428 8.594 0.834 1
1 358 . 15 1 1 A 36 36 THR HA H 36 4.402 4.168 0.234 1
1 363 . 15 1 1 A 36 36 THR C C 36 174.739 174.404 0.335 1
1 364 . 15 1 1 A 36 36 THR CA C 36 62.692 64.267 -1.575 1
1 365 . 15 1 1 A 36 36 THR CB C 36 69.482 69.701 -0.219 1
1 367 . 15 1 1 A 36 36 THR N N 36 113.103 119.258 -6.155 1
1 368 . 15 1 1 A 37 37 HIS H H 37 7.857 7.478 0.379 1
1 369 . 15 1 1 A 37 37 HIS HA H 37 4.878 5.095 -0.217 1
1 374 . 15 1 1 A 37 37 HIS C C 37 171.103 172.171 -1.068 1
1 375 . 15 1 1 A 37 37 HIS CA C 37 55.867 54.518 1.349 1
1 376 . 15 1 1 A 37 37 HIS CB C 37 32.655 31.804 0.851 1
1 379 . 15 1 1 A 37 37 HIS N N 37 118.486 113.905 4.581 1
1 380 . 15 1 1 A 38 38 TYR H H 38 9.217 8.955 0.262 1
1 381 . 15 1 1 A 38 38 TYR HA H 38 5.303 5.029 0.274 1
1 388 . 15 1 1 A 38 38 TYR C C 38 173.922 174.366 -0.444 1
1 389 . 15 1 1 A 38 38 TYR CA C 38 56.504 56.161 0.343 1
1 390 . 15 1 1 A 38 38 TYR CB C 38 41.823 43.233 -1.410 1
1 395 . 15 1 1 A 38 38 TYR N N 38 114.077 117.393 -3.316 1
1 396 . 15 1 1 A 39 39 LEU H H 39 9.052 8.638 0.414 1
1 397 . 15 1 1 A 39 39 LEU HA H 39 5.061 5.221 -0.160 1
1 407 . 15 1 1 A 39 39 LEU C C 39 175.455 174.615 0.840 1
1 408 . 15 1 1 A 39 39 LEU CA C 39 53.855 53.736 0.119 1
1 409 . 15 1 1 A 39 39 LEU CB C 39 45.254 44.524 0.730 1
1 413 . 15 1 1 A 39 39 LEU N N 39 123.997 125.347 -1.350 1
1 414 . 15 1 1 A 40 40 VAL H H 40 9.520 9.614 -0.094 1
1 415 . 15 1 1 A 40 40 VAL HA H 40 4.988 4.662 0.326 1
1 423 . 15 1 1 A 40 40 VAL C C 40 174.578 174.919 -0.341 1
1 424 . 15 1 1 A 40 40 VAL CA C 40 60.575 61.343 -0.768 1
1 425 . 15 1 1 A 40 40 VAL CB C 40 33.284 32.683 0.601 1
1 428 . 15 1 1 A 40 40 VAL N N 40 129.678 128.692 0.986 1
1 429 . 15 1 1 A 41 41 ARG H H 41 9.096 8.909 0.187 1
1 430 . 15 1 1 A 41 41 ARG HA H 41 5.384 4.994 0.390 1
1 437 . 15 1 1 A 41 41 ARG C C 41 175.100 174.856 0.244 1
1 438 . 15 1 1 A 41 41 ARG CA C 41 54.297 55.305 -1.008 1
1 439 . 15 1 1 A 41 41 ARG CB C 41 33.003 31.558 1.445 1
1 442 . 15 1 1 A 41 41 ARG N N 41 126.332 127.174 -0.842 1
1 443 . 15 1 1 A 42 42 CYS H H 42 9.004 9.508 -0.504 1
1 444 . 15 1 1 A 42 42 CYS HA H 42 5.309 5.128 0.181 1
1 447 . 15 1 1 A 42 42 CYS C C 42 173.417 173.414 0.003 1
1 448 . 15 1 1 A 42 42 CYS CA C 42 57.508 57.044 0.464 1
1 449 . 15 1 1 A 42 42 CYS CB C 42 28.859 29.494 -0.635 1
1 450 . 15 1 1 A 42 42 CYS N N 42 123.359 124.967 -1.608 1
1 451 . 15 1 1 A 43 43 SER H H 43 9.102 8.995 0.107 1
1 452 . 15 1 1 A 43 43 SER HA H 43 5.324 5.175 0.149 1
1 455 . 15 1 1 A 43 43 SER C C 43 171.429 171.850 -0.421 1
1 456 . 15 1 1 A 43 43 SER CA C 43 55.621 55.221 0.400 1
1 457 . 15 1 1 A 43 43 SER CB C 43 64.856 65.948 -1.092 1
1 458 . 15 1 1 A 43 43 SER N N 43 125.444 123.050 2.394 1
1 459 . 15 1 1 A 44 44 PRO HA H 44 4.389 4.708 -0.319 1
1 466 . 15 1 1 A 44 44 PRO C C 44 176.559 177.237 -0.678 1
1 467 . 15 1 1 A 44 44 PRO CA C 44 63.027 62.766 0.261 1
1 468 . 15 1 1 A 44 44 PRO CB C 44 31.935 32.368 -0.433 1
1 471 . 15 1 1 A 45 45 ALA H H 45 8.261 8.189 0.072 1
1 472 . 15 1 1 A 45 45 ALA HA H 45 4.157 4.139 0.018 1
1 476 . 15 1 1 A 45 45 ALA C C 45 177.706 176.796 0.910 1
1 477 . 15 1 1 A 45 45 ALA CA C 45 53.284 53.624 -0.340 1
1 478 . 15 1 1 A 45 45 ALA CB C 45 18.978 19.269 -0.291 1
1 479 . 15 1 1 A 45 45 ALA N N 45 126.162 124.755 1.407 1
1 480 . 15 1 1 A 46 46 SER H H 46 8.275 7.646 0.629 1
1 481 . 15 1 1 A 46 46 SER HA H 46 4.779 4.748 0.031 1
1 484 . 15 1 1 A 46 46 SER C C 46 172.182 173.846 -1.664 1
1 485 . 15 1 1 A 46 46 SER CA C 46 55.091 54.660 0.431 1
1 486 . 15 1 1 A 46 46 SER CB C 46 63.130 64.406 -1.276 1
1 487 . 15 1 1 A 46 46 SER N N 46 113.009 115.178 -2.169 1
1 488 . 15 1 1 A 47 47 PRO HA H 47 4.336 4.469 -0.133 1
1 493 . 15 1 1 A 47 47 PRO C C 47 177.165 177.749 -0.584 1
1 494 . 15 1 1 A 47 47 PRO CA C 47 63.268 63.998 -0.730 1
1 495 . 15 1 1 A 47 47 PRO CB C 47 32.528 31.857 0.671 1
1 498 . 15 1 1 A 48 48 LYS H H 48 9.089 8.483 0.606 1
1 499 . 15 1 1 A 48 48 LYS HA H 48 4.408 4.071 0.337 1
1 508 . 15 1 1 A 48 48 LYS C C 48 176.917 178.310 -1.393 1
1 509 . 15 1 1 A 48 48 LYS CA C 48 55.893 58.981 -3.088 1
1 510 . 15 1 1 A 48 48 LYS CB C 48 32.997 32.173 0.824 1
1 514 . 15 1 1 A 48 48 LYS N N 48 122.579 118.542 4.037 1
1 515 . 15 1 1 A 49 49 GLY HA2 H 49 4.021 3.879 0.142 1
1 516 . 15 1 1 A 49 49 GLY HA3 H 49 3.881 3.881 0.000 1
1 517 . 15 1 1 A 49 49 GLY C C 49 174.552 175.413 -0.861 1
1 518 . 15 1 1 A 49 49 GLY CA C 49 46.011 46.517 -0.506 1
1 519 . 15 1 1 A 50 50 GLU H H 50 8.608 8.311 0.297 1
1 520 . 15 1 1 A 50 50 GLU HA H 50 4.335 3.911 0.424 1
1 525 . 15 1 1 A 50 50 GLU C C 50 176.672 175.530 1.142 1
1 526 . 15 1 1 A 50 50 GLU CA C 50 56.978 57.691 -0.713 1
1 527 . 15 1 1 A 50 50 GLU CB C 50 29.458 29.081 0.377 1
1 529 . 15 1 1 A 50 50 GLU N N 50 121.378 119.770 1.608 1
1 530 . 15 1 1 A 51 51 GLU H H 51 8.287 7.962 0.325 1
1 531 . 15 1 1 A 51 51 GLU HA H 51 4.381 4.312 0.069 1
1 536 . 15 1 1 A 51 51 GLU C C 51 176.218 176.543 -0.325 1
1 537 . 15 1 1 A 51 51 GLU CA C 51 56.996 56.922 0.074 1
1 538 . 15 1 1 A 51 51 GLU CB C 51 31.066 30.943 0.123 1
1 540 . 15 1 1 A 51 51 GLU N N 51 120.863 120.050 0.813 1
1 541 . 15 1 1 A 52 52 GLU H H 52 8.445 8.524 -0.079 1
1 542 . 15 1 1 A 52 52 GLU HA H 52 4.464 4.169 0.295 1
1 547 . 15 1 1 A 52 52 GLU C C 52 176.128 176.631 -0.503 1
1 548 . 15 1 1 A 52 52 GLU CA C 52 55.955 57.497 -1.542 1
1 549 . 15 1 1 A 52 52 GLU CB C 52 31.691 30.050 1.641 1
1 551 . 15 1 1 A 52 52 GLU N N 52 121.103 121.968 -0.865 1
1 552 . 15 1 1 A 53 53 GLU H H 53 8.441 8.618 -0.177 1
1 553 . 15 1 1 A 53 53 GLU HA H 53 4.609 4.551 0.058 1
1 558 . 15 1 1 A 53 53 GLU C C 53 175.816 176.420 -0.604 1
1 559 . 15 1 1 A 53 53 GLU CA C 53 56.697 56.198 0.499 1
1 560 . 15 1 1 A 53 53 GLU CB C 53 31.022 30.606 0.416 1
1 562 . 15 1 1 A 53 53 GLU N N 53 121.949 123.762 -1.813 1
1 563 . 15 1 1 A 54 54 ARG H H 54 8.569 8.859 -0.290 1
1 564 . 15 1 1 A 54 54 ARG HA H 54 4.768 4.650 0.118 1
1 571 . 15 1 1 A 54 54 ARG C C 54 174.881 174.992 -0.111 1
1 572 . 15 1 1 A 54 54 ARG CA C 54 54.950 55.842 -0.892 1
1 573 . 15 1 1 A 54 54 ARG CB C 54 33.374 31.218 2.156 1
1 576 . 15 1 1 A 54 54 ARG N N 54 123.714 127.521 -3.807 1
1 577 . 15 1 1 A 55 55 GLU H H 55 8.650 8.868 -0.218 1
1 578 . 15 1 1 A 55 55 GLU HA H 55 5.493 5.048 0.445 1
1 583 . 15 1 1 A 55 55 GLU C C 55 175.566 175.093 0.473 1
1 584 . 15 1 1 A 55 55 GLU CA C 55 54.915 54.989 -0.074 1
1 585 . 15 1 1 A 55 55 GLU CB C 55 33.250 31.869 1.381 1
1 587 . 15 1 1 A 55 55 GLU N N 55 123.537 127.646 -4.109 1
1 588 . 15 1 1 A 56 56 VAL H H 56 9.419 8.864 0.555 1
1 589 . 15 1 1 A 56 56 VAL HA H 56 4.524 5.068 -0.544 1
1 597 . 15 1 1 A 56 56 VAL C C 56 173.502 174.076 -0.574 1
1 598 . 15 1 1 A 56 56 VAL CA C 56 60.981 58.761 2.220 1
1 599 . 15 1 1 A 56 56 VAL CB C 56 36.117 35.498 0.619 1
1 602 . 15 1 1 A 56 56 VAL N N 56 123.343 122.042 1.301 1
1 603 . 15 1 1 A 57 57 GLN H H 57 8.767 8.909 -0.142 1
1 604 . 15 1 1 A 57 57 GLN HA H 57 5.671 5.573 0.098 1
1 611 . 15 1 1 A 57 57 GLN C C 57 176.357 174.918 1.439 1
1 612 . 15 1 1 A 57 57 GLN CA C 57 54.735 54.141 0.594 1
1 613 . 15 1 1 A 57 57 GLN CB C 57 30.781 31.341 -0.560 1
1 615 . 15 1 1 A 57 57 GLN N N 57 125.639 121.266 4.373 1
1 617 . 15 1 1 A 58 58 VAL H H 58 9.217 8.968 0.249 1
1 618 . 15 1 1 A 58 58 VAL HA H 58 5.129 4.851 0.278 1
1 626 . 15 1 1 A 58 58 VAL C C 58 175.925 176.783 -0.858 1
1 627 . 15 1 1 A 58 58 VAL CA C 58 59.652 60.532 -0.880 1
1 628 . 15 1 1 A 58 58 VAL CB C 58 36.540 34.512 2.028 1
1 631 . 15 1 1 A 58 58 VAL N N 58 117.022 118.943 -1.921 1
1 632 . 15 1 1 A 59 59 GLY H H 59 9.008 8.830 0.178 1
1 633 . 15 1 1 A 59 59 GLY HA2 H 59 4.670 3.958 0.712 1
1 634 . 15 1 1 A 59 59 GLY HA3 H 59 3.914 4.065 -0.151 1
1 635 . 15 1 1 A 59 59 GLY C C 59 173.386 174.042 -0.656 1
1 636 . 15 1 1 A 59 59 GLY CA C 59 45.093 46.883 -1.790 1
1 637 . 15 1 1 A 59 59 GLY N N 59 109.174 111.543 -2.369 1
1 638 . 15 1 1 A 60 60 ARG H H 60 7.695 7.841 -0.146 1
1 639 . 15 1 1 A 60 60 ARG HA H 60 4.866 4.716 0.150 1
1 645 . 15 1 1 A 60 60 ARG C C 60 173.760 175.704 -1.944 1
1 646 . 15 1 1 A 60 60 ARG CA C 60 52.764 52.971 -0.207 1
1 647 . 15 1 1 A 60 60 ARG CB C 60 31.785 31.169 0.616 1
1 650 . 15 1 1 A 60 60 ARG N N 60 118.520 120.107 -1.587 1
1 651 . 15 1 1 A 61 61 PRO HA H 61 3.539 3.946 -0.407 1
1 658 . 15 1 1 A 61 61 PRO C C 61 173.175 173.765 -0.590 1
1 659 . 15 1 1 A 61 61 PRO CA C 61 62.265 62.939 -0.674 1
1 660 . 15 1 1 A 61 61 PRO CB C 61 27.546 30.893 -3.347 1
1 663 . 15 1 1 A 62 62 GLU H H 62 7.879 7.697 0.182 1
1 664 . 15 1 1 A 62 62 GLU HA H 62 4.071 4.481 -0.410 1
1 669 . 15 1 1 A 62 62 GLU C C 62 174.107 174.480 -0.373 1
1 670 . 15 1 1 A 62 62 GLU CA C 62 55.229 54.582 0.647 1
1 671 . 15 1 1 A 62 62 GLU CB C 62 32.838 31.801 1.037 1
1 673 . 15 1 1 A 62 62 GLU N N 62 118.173 114.011 4.162 1
1 674 . 15 1 1 A 63 63 VAL H H 63 8.930 8.516 0.414 1
1 675 . 15 1 1 A 63 63 VAL HA H 63 4.548 5.057 -0.509 1
1 683 . 15 1 1 A 63 63 VAL C C 63 170.325 173.499 -3.174 1
1 684 . 15 1 1 A 63 63 VAL CA C 63 60.770 59.615 1.155 1
1 685 . 15 1 1 A 63 63 VAL CB C 63 35.394 35.177 0.217 1
1 688 . 15 1 1 A 63 63 VAL N N 63 117.161 125.295 -8.134 1
1 689 . 15 1 1 A 64 64 LEU H H 64 8.332 8.733 -0.401 1
1 690 . 15 1 1 A 64 64 LEU HA H 64 5.122 5.137 -0.015 1
1 700 . 15 1 1 A 64 64 LEU C C 64 176.243 174.599 1.644 1
1 701 . 15 1 1 A 64 64 LEU CA C 64 53.346 53.927 -0.581 1
1 702 . 15 1 1 A 64 64 LEU CB C 64 42.649 44.789 -2.140 1
1 706 . 15 1 1 A 64 64 LEU N N 64 130.510 128.458 2.052 1
1 707 . 15 1 1 A 65 65 LEU H H 65 9.261 9.195 0.066 1
1 708 . 15 1 1 A 65 65 LEU HA H 65 4.443 4.840 -0.397 1
1 718 . 15 1 1 A 65 65 LEU C C 65 174.016 175.972 -1.956 1
1 719 . 15 1 1 A 65 65 LEU CA C 65 53.920 54.004 -0.084 1
1 720 . 15 1 1 A 65 65 LEU CB C 65 42.976 42.317 0.659 1
1 724 . 15 1 1 A 65 65 LEU N N 65 128.611 128.670 -0.059 1
1 725 . 15 1 1 A 66 66 ASP H H 66 8.105 8.680 -0.575 1
1 726 . 15 1 1 A 66 66 ASP HA H 66 5.207 5.010 0.197 1
1 729 . 15 1 1 A 66 66 ASP C C 66 176.161 176.167 -0.006 1
1 730 . 15 1 1 A 66 66 ASP CA C 66 51.001 53.127 -2.126 1
1 731 . 15 1 1 A 66 66 ASP CB C 66 42.836 42.546 0.290 1
1 732 . 15 1 1 A 66 66 ASP N N 66 121.799 124.425 -2.626 1
1 733 . 15 1 1 A 67 67 GLY H H 67 8.688 8.561 0.127 1
1 734 . 15 1 1 A 67 67 GLY HA2 H 67 3.923 3.919 0.004 1
1 735 . 15 1 1 A 67 67 GLY HA3 H 67 3.808 3.926 -0.118 1
1 736 . 15 1 1 A 67 67 GLY C C 67 175.500 174.228 1.272 1
1 737 . 15 1 1 A 67 67 GLY CA C 67 46.591 46.736 -0.145 1
1 738 . 15 1 1 A 67 67 GLY N N 67 106.518 110.785 -4.267 1
1 739 . 15 1 1 A 68 68 LEU H H 68 8.125 7.252 0.873 1
1 740 . 15 1 1 A 68 68 LEU HA H 68 4.252 4.910 -0.658 1
1 750 . 15 1 1 A 68 68 LEU C C 68 174.914 175.414 -0.500 1
1 751 . 15 1 1 A 68 68 LEU CA C 68 53.469 53.205 0.264 1
1 752 . 15 1 1 A 68 68 LEU CB C 68 40.422 45.645 -5.223 1
1 756 . 15 1 1 A 68 68 LEU N N 68 119.345 120.090 -0.745 1
1 757 . 15 1 1 A 69 69 GLU H H 69 8.207 8.420 -0.213 1
1 758 . 15 1 1 A 69 69 GLU HA H 69 4.908 4.865 0.043 1
1 763 . 15 1 1 A 69 69 GLU C C 69 174.464 174.229 0.235 1
1 764 . 15 1 1 A 69 69 GLU CA C 69 53.081 53.172 -0.091 1
1 765 . 15 1 1 A 69 69 GLU CB C 69 31.538 30.679 0.859 1
1 767 . 15 1 1 A 69 69 GLU N N 69 119.486 120.648 -1.162 1
1 768 . 15 1 1 A 70 70 PRO HA H 70 4.866 4.337 0.529 1
1 775 . 15 1 1 A 70 70 PRO C C 70 178.285 177.424 0.861 1
1 776 . 15 1 1 A 70 70 PRO CA C 70 63.203 63.637 -0.434 1
1 777 . 15 1 1 A 70 70 PRO CB C 70 33.726 31.912 1.814 1
1 780 . 15 1 1 A 71 71 GLY H H 71 7.362 8.798 -1.436 1
1 781 . 15 1 1 A 71 71 GLY HA2 H 71 3.807 3.927 -0.120 1
1 782 . 15 1 1 A 71 71 GLY HA3 H 71 3.756 3.932 -0.176 1
1 783 . 15 1 1 A 71 71 GLY C C 71 174.664 173.792 0.872 1
1 784 . 15 1 1 A 71 71 GLY CA C 71 46.926 46.351 0.575 1
1 785 . 15 1 1 A 71 71 GLY N N 71 113.776 111.651 2.125 1
1 786 . 15 1 1 A 72 72 ARG H H 72 8.036 7.321 0.715 1
1 787 . 15 1 1 A 72 72 ARG HA H 72 4.597 4.776 -0.179 1
1 793 . 15 1 1 A 72 72 ARG C C 72 173.293 173.674 -0.381 1
1 794 . 15 1 1 A 72 72 ARG CA C 72 54.633 54.354 0.279 1
1 795 . 15 1 1 A 72 72 ARG CB C 72 33.704 33.106 0.598 1
1 798 . 15 1 1 A 72 72 ARG N N 72 119.611 119.570 0.041 1
1 799 . 15 1 1 A 73 73 ASP H H 73 7.785 8.577 -0.792 1
1 800 . 15 1 1 A 73 73 ASP HA H 73 5.276 5.323 -0.047 1
1 803 . 15 1 1 A 73 73 ASP C C 73 175.904 174.439 1.465 1
1 804 . 15 1 1 A 73 73 ASP CA C 73 53.568 53.062 0.506 1
1 805 . 15 1 1 A 73 73 ASP CB C 73 42.970 42.561 0.409 1
1 806 . 15 1 1 A 73 73 ASP N N 73 118.900 126.799 -7.899 1
1 807 . 15 1 1 A 74 74 TYR H H 74 9.516 9.042 0.474 1
1 808 . 15 1 1 A 74 74 TYR HA H 74 4.800 5.061 -0.261 1
1 815 . 15 1 1 A 74 74 TYR C C 74 174.631 174.953 -0.322 1
1 816 . 15 1 1 A 74 74 TYR CA C 74 58.548 56.186 2.362 1
1 817 . 15 1 1 A 74 74 TYR CB C 74 42.029 42.565 -0.536 1
1 822 . 15 1 1 A 74 74 TYR N N 74 121.903 125.402 -3.499 1
1 823 . 15 1 1 A 75 75 GLU H H 75 9.248 9.070 0.178 1
1 824 . 15 1 1 A 75 75 GLU HA H 75 4.756 4.772 -0.016 1
1 829 . 15 1 1 A 75 75 GLU C C 75 175.524 175.468 0.056 1
1 830 . 15 1 1 A 75 75 GLU CA C 75 55.621 55.182 0.439 1
1 831 . 15 1 1 A 75 75 GLU CB C 75 30.778 30.107 0.671 1
1 833 . 15 1 1 A 75 75 GLU N N 75 122.425 122.837 -0.412 1
1 834 . 15 1 1 A 76 76 VAL H H 76 8.884 8.688 0.196 1
1 835 . 15 1 1 A 76 76 VAL HA H 76 5.246 4.845 0.401 1
1 843 . 15 1 1 A 76 76 VAL C C 76 174.800 175.227 -0.427 1
1 844 . 15 1 1 A 76 76 VAL CA C 76 60.199 62.645 -2.446 1
1 845 . 15 1 1 A 76 76 VAL CB C 76 33.449 31.586 1.863 1
1 848 . 15 1 1 A 76 76 VAL N N 76 126.853 125.139 1.714 1
1 849 . 15 1 1 A 77 77 SER H H 77 9.234 8.658 0.576 1
1 850 . 15 1 1 A 77 77 SER HA H 77 5.398 5.447 -0.049 1
1 853 . 15 1 1 A 77 77 SER C C 77 173.138 173.693 -0.555 1
1 854 . 15 1 1 A 77 77 SER CA C 77 56.032 56.353 -0.321 1
1 855 . 15 1 1 A 77 77 SER CB C 77 66.374 64.880 1.494 1
1 856 . 15 1 1 A 77 77 SER N N 77 120.852 121.841 -0.989 1
1 857 . 15 1 1 A 78 78 VAL H H 78 9.092 8.724 0.368 1
1 858 . 15 1 1 A 78 78 VAL HA H 78 4.756 4.634 0.122 1
1 866 . 15 1 1 A 78 78 VAL C C 78 173.641 174.554 -0.913 1
1 867 . 15 1 1 A 78 78 VAL CA C 78 61.246 60.872 0.374 1
1 868 . 15 1 1 A 78 78 VAL CB C 78 34.467 33.252 1.215 1
1 871 . 15 1 1 A 78 78 VAL N N 78 122.453 124.541 -2.088 1
1 872 . 15 1 1 A 79 79 GLN H H 79 8.587 8.453 0.134 1
1 873 . 15 1 1 A 79 79 GLN HA H 79 4.438 4.864 -0.426 1
1 880 . 15 1 1 A 79 79 GLN C C 79 174.999 174.564 0.435 1
1 881 . 15 1 1 A 79 79 GLN CA C 79 54.227 54.104 0.123 1
1 882 . 15 1 1 A 79 79 GLN CB C 79 33.587 32.691 0.896 1
1 884 . 15 1 1 A 79 79 GLN N N 79 125.619 127.671 -2.052 1
1 886 . 15 1 1 A 80 80 SER H H 80 8.623 8.884 -0.261 1
1 887 . 15 1 1 A 80 80 SER HA H 80 4.756 4.461 0.295 1
1 890 . 15 1 1 A 80 80 SER C C 80 172.264 173.969 -1.705 1
1 891 . 15 1 1 A 80 80 SER CA C 80 58.177 59.919 -1.742 1
1 892 . 15 1 1 A 80 80 SER CB C 80 63.920 63.051 0.869 1
1 893 . 15 1 1 A 80 80 SER N N 80 122.844 123.697 -0.853 1
1 894 . 15 1 1 A 81 81 LEU H H 81 8.348 8.443 -0.095 1
1 895 . 15 1 1 A 81 81 LEU HA H 81 5.124 4.428 0.696 1
1 905 . 15 1 1 A 81 81 LEU C C 81 175.775 176.857 -1.082 1
1 906 . 15 1 1 A 81 81 LEU CA C 81 54.033 53.361 0.672 1
1 907 . 15 1 1 A 81 81 LEU CB C 81 44.690 41.706 2.984 1
1 911 . 15 1 1 A 81 81 LEU N N 81 123.191 127.524 -4.333 1
1 912 . 15 1 1 A 82 82 ARG H H 82 8.374 8.783 -0.409 1
1 913 . 15 1 1 A 82 82 ARG HA H 82 4.616 4.528 0.088 1
1 919 . 15 1 1 A 82 82 ARG C C 82 176.864 175.758 1.106 1
1 920 . 15 1 1 A 82 82 ARG CA C 82 55.868 55.169 0.699 1
1 921 . 15 1 1 A 82 82 ARG CB C 82 32.322 30.984 1.338 1
1 924 . 15 1 1 A 82 82 ARG N N 82 121.029 119.963 1.066 1
1 925 . 15 1 1 A 83 83 GLY H H 83 8.309 7.415 0.894 1
1 926 . 15 1 1 A 83 83 GLY HA2 H 83 4.031 4.127 -0.096 1
1 927 . 15 1 1 A 83 83 GLY HA3 H 83 3.888 4.217 -0.329 1
1 928 . 15 1 1 A 83 83 GLY C C 83 174.562 173.889 0.673 1
1 929 . 15 1 1 A 83 83 GLY CA C 83 45.963 45.717 0.246 1
1 930 . 15 1 1 A 83 83 GLY N N 83 109.937 106.957 2.980 1
1 931 . 15 1 1 A 84 84 PRO HA H 84 4.573 4.361 0.212 1
1 938 . 15 1 1 A 84 84 PRO C C 84 176.533 176.099 0.434 1
1 939 . 15 1 1 A 84 84 PRO CA C 84 63.485 64.811 -1.326 1
1 940 . 15 1 1 A 84 84 PRO CB C 84 32.409 32.097 0.312 1
1 943 . 15 1 1 A 85 85 GLU H H 85 7.799 7.576 0.223 1
1 944 . 15 1 1 A 85 85 GLU HA H 85 4.369 4.869 -0.500 1
1 949 . 15 1 1 A 85 85 GLU C C 85 174.722 175.328 -0.606 1
1 950 . 15 1 1 A 85 85 GLU CA C 85 55.899 54.826 1.073 1
1 951 . 15 1 1 A 85 85 GLU CB C 85 31.911 33.060 -1.149 1
1 953 . 15 1 1 A 85 85 GLU N N 85 122.093 112.255 9.838 1
1 954 . 15 1 1 A 86 86 GLY H H 86 8.329 8.677 -0.348 1
1 955 . 15 1 1 A 86 86 GLY HA2 H 86 5.298 4.136 1.162 1
1 956 . 15 1 1 A 86 86 GLY HA3 H 86 3.559 4.146 -0.587 1
1 957 . 15 1 1 A 86 86 GLY C C 86 174.355 172.994 1.361 1
1 958 . 15 1 1 A 86 86 GLY CA C 86 44.034 44.132 -0.098 1
1 959 . 15 1 1 A 86 86 GLY N N 86 109.387 108.617 0.770 1
1 960 . 15 1 1 A 87 87 SER H H 87 8.807 8.204 0.603 1
1 961 . 15 1 1 A 87 87 SER HA H 87 4.670 4.660 0.010 1
1 964 . 15 1 1 A 87 87 SER C C 87 175.195 174.351 0.844 1
1 965 . 15 1 1 A 87 87 SER CA C 87 57.737 57.184 0.553 1
1 966 . 15 1 1 A 87 87 SER CB C 87 67.829 65.557 2.272 1
1 967 . 15 1 1 A 87 87 SER N N 87 117.698 114.149 3.549 1
1 968 . 15 1 1 A 88 88 GLU H H 88 8.754 8.587 0.167 1
1 969 . 15 1 1 A 88 88 GLU HA H 88 4.357 4.320 0.037 1
1 974 . 15 1 1 A 88 88 GLU C C 88 177.474 176.815 0.659 1
1 975 . 15 1 1 A 88 88 GLU CA C 88 57.525 56.674 0.851 1
1 976 . 15 1 1 A 88 88 GLU CB C 88 31.162 30.346 0.816 1
1 978 . 15 1 1 A 88 88 GLU N N 88 118.709 120.257 -1.548 1
1 979 . 15 1 1 A 89 89 ALA H H 89 8.855 8.334 0.521 1
1 980 . 15 1 1 A 89 89 ALA HA H 89 4.792 4.511 0.281 1
1 984 . 15 1 1 A 89 89 ALA C C 89 178.379 176.787 1.592 1
1 985 . 15 1 1 A 89 89 ALA CA C 89 51.264 51.871 -0.607 1
1 986 . 15 1 1 A 89 89 ALA CB C 89 20.040 19.624 0.416 1
1 987 . 15 1 1 A 89 89 ALA N N 89 127.301 124.492 2.809 1
1 988 . 15 1 1 A 90 90 ARG H H 90 8.549 8.567 -0.018 1
1 989 . 15 1 1 A 90 90 ARG HA H 90 4.658 4.913 -0.255 1
1 996 . 15 1 1 A 90 90 ARG C C 90 174.720 175.264 -0.544 1
1 997 . 15 1 1 A 90 90 ARG CA C 90 53.575 54.399 -0.824 1
1 998 . 15 1 1 A 90 90 ARG CB C 90 33.456 31.685 1.771 1
1 1001 . 15 1 1 A 90 90 ARG N N 90 121.289 123.769 -2.480 1
1 1002 . 15 1 1 A 91 91 GLY H H 91 8.396 8.963 -0.567 1
1 1003 . 15 1 1 A 91 91 GLY HA2 H 91 5.306 4.172 1.134 1
1 1004 . 15 1 1 A 91 91 GLY HA3 H 91 3.700 4.211 -0.511 1
1 1005 . 15 1 1 A 91 91 GLY C C 91 173.191 172.031 1.160 1
1 1006 . 15 1 1 A 91 91 GLY CA C 91 44.493 43.846 0.647 1
1 1007 . 15 1 1 A 91 91 GLY N N 91 108.579 112.000 -3.421 1
1 1008 . 15 1 1 A 92 92 ILE H H 92 8.891 8.527 0.364 1
1 1009 . 15 1 1 A 92 92 ILE HA H 92 4.499 4.932 -0.433 1
1 1019 . 15 1 1 A 92 92 ILE C C 92 171.877 174.992 -3.115 1
1 1020 . 15 1 1 A 92 92 ILE CA C 92 60.682 59.127 1.555 1
1 1021 . 15 1 1 A 92 92 ILE CB C 92 42.425 42.322 0.103 1
1 1025 . 15 1 1 A 92 92 ILE N N 92 118.313 121.249 -2.936 1
1 1026 . 15 1 1 A 93 93 ARG H H 93 7.980 8.500 -0.520 1
1 1027 . 15 1 1 A 93 93 ARG HA H 93 5.224 4.313 0.911 1
1 1034 . 15 1 1 A 93 93 ARG C C 93 175.072 175.927 -0.855 1
1 1035 . 15 1 1 A 93 93 ARG CA C 93 54.499 57.167 -2.668 1
1 1036 . 15 1 1 A 93 93 ARG CB C 93 31.767 30.418 1.349 1
1 1039 . 15 1 1 A 93 93 ARG N N 93 124.879 126.969 -2.090 1
1 1040 . 15 1 1 A 94 94 ALA H H 94 9.064 8.860 0.204 1
1 1041 . 15 1 1 A 94 94 ALA HA H 94 4.731 4.914 -0.183 1
1 1045 . 15 1 1 A 94 94 ALA C C 94 174.494 176.904 -2.410 1
1 1046 . 15 1 1 A 94 94 ALA CA C 94 50.577 50.836 -0.259 1
1 1047 . 15 1 1 A 94 94 ALA CB C 94 23.082 20.004 3.078 1
1 1048 . 15 1 1 A 94 94 ALA N N 94 126.095 126.241 -0.146 1
1 1049 . 15 1 1 A 95 95 ARG H H 95 8.263 8.510 -0.247 1
1 1050 . 15 1 1 A 95 95 ARG HA H 95 5.548 4.941 0.607 1
1 1058 . 15 1 1 A 95 95 ARG C C 95 176.901 175.661 1.240 1
1 1059 . 15 1 1 A 95 95 ARG CA C 95 53.787 55.380 -1.593 1
1 1060 . 15 1 1 A 95 95 ARG CB C 95 32.426 31.782 0.644 1
1 1063 . 15 1 1 A 95 95 ARG N N 95 123.374 121.327 2.047 1
1 1065 . 15 1 1 A 96 96 THR H H 96 9.208 8.794 0.414 1
1 1066 . 15 1 1 A 96 96 THR HA H 96 4.461 5.068 -0.607 1
1 1071 . 15 1 1 A 96 96 THR CA C 96 58.248 58.421 -0.173 1
1 1072 . 15 1 1 A 96 96 THR CB C 96 68.466 71.128 -2.662 1
1 1074 . 15 1 1 A 96 96 THR N N 96 119.492 111.738 7.754 1
1 1075 . 15 1 1 A 97 97 PRO HA H 97 4.636 4.617 0.019 1
1 1082 . 15 1 1 A 97 97 PRO C C 97 175.725 175.571 0.154 1
1 1083 . 15 1 1 A 97 97 PRO CA C 97 61.907 62.328 -0.421 1
1 1084 . 15 1 1 A 97 97 PRO CB C 97 32.590 33.520 -0.930 1
1 1087 . 15 1 1 A 98 98 THR H H 98 7.943 8.319 -0.376 1
1 1088 . 15 1 1 A 98 98 THR HA H 98 4.208 5.121 -0.913 1
1 1093 . 15 1 1 A 98 98 THR C C 98 175.058 173.599 1.459 1
1 1094 . 15 1 1 A 98 98 THR CA C 98 62.069 60.393 1.676 1
1 1095 . 15 1 1 A 98 98 THR CB C 98 69.719 70.147 -0.428 1
1 1097 . 15 1 1 A 98 98 THR N N 98 107.148 110.412 -3.264 1
1 1098 . 15 1 1 A 99 99 SER H H 99 8.163 8.736 -0.573 1
1 1099 . 15 1 1 A 99 99 SER HA H 99 4.524 4.266 0.258 1
1 1102 . 15 1 1 A 99 99 SER C C 99 174.319 174.858 -0.539 1
1 1103 . 15 1 1 A 99 99 SER CA C 99 58.107 59.877 -1.770 1
1 1104 . 15 1 1 A 99 99 SER CB C 99 64.492 62.674 1.818 1
1 1105 . 15 1 1 A 99 99 SER N N 99 115.114 119.650 -4.536 1
1 1106 . 15 1 1 A 100 100 GLY H H 100 8.336 8.701 -0.365 1
1 1107 . 15 1 1 A 100 100 GLY HA2 H 100 4.222 4.065 0.157 1
1 1108 . 15 1 1 A 100 100 GLY HA3 H 100 4.222 4.065 0.157 1
1 1109 . 15 1 1 A 100 100 GLY C C 100 171.696 173.201 -1.505 1
1 1110 . 15 1 1 A 100 100 GLY CA C 100 44.617 44.760 -0.143 1
1 1111 . 15 1 1 A 100 100 GLY N N 100 110.678 112.033 -1.355 1
1 1112 . 15 1 1 A 101 101 PRO HA H 101 4.506 4.658 -0.152 1
1 1118 . 15 1 1 A 101 101 PRO CA C 101 63.358 62.761 0.597 1
1 1119 . 15 1 1 A 101 101 PRO CB C 101 32.313 32.566 -0.253 1
1 1 . 16 1 1 A 6 6 SER HA H 6 4.528 5.170 -0.642 1
1 3 . 16 1 1 A 6 6 SER CA C 6 58.373 57.659 0.714 1
1 4 . 16 1 1 A 6 6 SER CB C 6 63.978 65.313 -1.335 1
1 5 . 16 1 1 A 7 7 GLY H H 7 8.228 8.378 -0.150 1
1 6 . 16 1 1 A 7 7 GLY HA2 H 7 4.134 4.160 -0.026 1
1 7 . 16 1 1 A 7 7 GLY HA3 H 7 4.134 4.162 -0.028 1
1 8 . 16 1 1 A 7 7 GLY CA C 7 44.607 45.088 -0.481 1
1 9 . 16 1 1 A 7 7 GLY N N 7 110.638 113.672 -3.034 1
1 10 . 16 1 1 A 8 8 PRO HA H 8 4.419 4.725 -0.306 1
1 17 . 16 1 1 A 8 8 PRO C C 8 176.908 175.287 1.621 1
1 18 . 16 1 1 A 8 8 PRO CA C 8 62.851 62.664 0.187 1
1 19 . 16 1 1 A 8 8 PRO CB C 8 32.243 30.583 1.660 1
1 22 . 16 1 1 A 9 9 LEU H H 9 8.462 8.201 0.261 1
1 23 . 16 1 1 A 9 9 LEU HA H 9 4.494 4.904 -0.410 1
1 33 . 16 1 1 A 9 9 LEU C C 9 174.124 174.443 -0.319 1
1 34 . 16 1 1 A 9 9 LEU CA C 9 52.587 51.776 0.811 1
1 35 . 16 1 1 A 9 9 LEU CB C 9 43.150 43.691 -0.541 1
1 39 . 16 1 1 A 9 9 LEU N N 9 126.015 124.785 1.230 1
1 40 . 16 1 1 A 10 10 PRO HA H 10 4.820 4.606 0.214 1
1 47 . 16 1 1 A 10 10 PRO CA C 10 61.368 62.556 -1.188 1
1 48 . 16 1 1 A 10 10 PRO CB C 10 31.391 31.690 -0.299 1
1 51 . 16 1 1 A 11 11 PRO HA H 11 4.949 4.616 0.333 1
1 58 . 16 1 1 A 11 11 PRO CA C 11 61.183 61.812 -0.629 1
1 59 . 16 1 1 A 11 11 PRO CB C 11 30.656 31.956 -1.300 1
1 62 . 16 1 1 A 12 12 PRO HA H 12 4.341 4.658 -0.317 1
1 69 . 16 1 1 A 12 12 PRO C C 12 174.849 176.707 -1.858 1
1 70 . 16 1 1 A 12 12 PRO CA C 12 63.062 62.599 0.463 1
1 71 . 16 1 1 A 12 12 PRO CB C 12 31.831 31.737 0.094 1
1 74 . 16 1 1 A 13 13 ARG H H 13 7.828 8.339 -0.511 1
1 75 . 16 1 1 A 13 13 ARG HA H 13 4.536 4.492 0.044 1
1 82 . 16 1 1 A 13 13 ARG C C 13 174.608 176.209 -1.601 1
1 83 . 16 1 1 A 13 13 ARG CA C 13 54.774 56.671 -1.897 1
1 84 . 16 1 1 A 13 13 ARG CB C 13 33.250 31.815 1.435 1
1 87 . 16 1 1 A 13 13 ARG N N 13 120.532 117.683 2.849 1
1 88 . 16 1 1 A 14 14 ALA H H 14 8.694 7.792 0.902 1
1 89 . 16 1 1 A 14 14 ALA HA H 14 3.986 4.380 -0.394 1
1 93 . 16 1 1 A 14 14 ALA C C 14 177.232 176.715 0.517 1
1 94 . 16 1 1 A 14 14 ALA CA C 14 52.461 51.708 0.753 1
1 95 . 16 1 1 A 14 14 ALA CB C 14 16.806 17.116 -0.310 1
1 96 . 16 1 1 A 14 14 ALA N N 14 121.921 121.385 0.536 1
1 97 . 16 1 1 A 15 15 LEU H H 15 8.097 8.394 -0.297 1
1 98 . 16 1 1 A 15 15 LEU HA H 15 4.670 4.684 -0.014 1
1 108 . 16 1 1 A 15 15 LEU C C 15 177.364 175.688 1.676 1
1 109 . 16 1 1 A 15 15 LEU CA C 15 57.543 54.726 2.817 1
1 110 . 16 1 1 A 15 15 LEU CB C 15 41.877 40.895 0.982 1
1 114 . 16 1 1 A 15 15 LEU N N 15 122.215 121.087 1.128 1
1 115 . 16 1 1 A 16 16 THR H H 16 9.520 9.223 0.297 1
1 116 . 16 1 1 A 16 16 THR HA H 16 4.369 4.853 -0.484 1
1 121 . 16 1 1 A 16 16 THR C C 16 172.453 173.391 -0.938 1
1 122 . 16 1 1 A 16 16 THR CA C 16 62.480 61.442 1.038 1
1 123 . 16 1 1 A 16 16 THR CB C 16 72.198 70.619 1.579 1
1 125 . 16 1 1 A 16 16 THR N N 16 122.214 121.619 0.595 1
1 126 . 16 1 1 A 17 17 LEU H H 17 8.847 8.588 0.259 1
1 127 . 16 1 1 A 17 17 LEU HA H 17 4.573 4.481 0.092 1
1 137 . 16 1 1 A 17 17 LEU C C 17 174.695 176.901 -2.206 1
1 138 . 16 1 1 A 17 17 LEU CA C 17 53.840 54.344 -0.504 1
1 139 . 16 1 1 A 17 17 LEU CB C 17 40.290 41.947 -1.657 1
1 143 . 16 1 1 A 17 17 LEU N N 17 127.415 127.341 0.074 1
1 144 . 16 1 1 A 18 18 ALA H H 18 8.647 8.646 0.001 1
1 145 . 16 1 1 A 18 18 ALA HA H 18 4.106 3.920 0.186 1
1 149 . 16 1 1 A 18 18 ALA C C 18 178.236 177.260 0.976 1
1 150 . 16 1 1 A 18 18 ALA CA C 18 53.926 54.558 -0.632 1
1 151 . 16 1 1 A 18 18 ALA CB C 18 18.876 18.766 0.110 1
1 152 . 16 1 1 A 18 18 ALA N N 18 133.362 129.688 3.674 1
1 153 . 16 1 1 A 19 19 ALA H H 19 7.772 7.490 0.282 1
1 154 . 16 1 1 A 19 19 ALA HA H 19 4.561 4.564 -0.003 1
1 158 . 16 1 1 A 19 19 ALA C C 19 176.032 174.581 1.451 1
1 159 . 16 1 1 A 19 19 ALA CA C 19 53.011 51.898 1.113 1
1 160 . 16 1 1 A 19 19 ALA CB C 19 21.869 22.354 -0.485 1
1 161 . 16 1 1 A 19 19 ALA N N 19 115.654 115.942 -0.288 1
1 162 . 16 1 1 A 20 20 VAL H H 20 8.697 8.841 -0.144 1
1 163 . 16 1 1 A 20 20 VAL HA H 20 4.951 4.863 0.088 1
1 171 . 16 1 1 A 20 20 VAL C C 20 174.314 174.001 0.313 1
1 172 . 16 1 1 A 20 20 VAL CA C 20 61.352 60.090 1.262 1
1 173 . 16 1 1 A 20 20 VAL CB C 20 35.394 34.077 1.317 1
1 176 . 16 1 1 A 20 20 VAL N N 20 120.848 118.035 2.813 1
1 177 . 16 1 1 A 21 21 THR H H 21 9.198 8.436 0.762 1
1 178 . 16 1 1 A 21 21 THR HA H 21 4.941 4.789 0.152 1
1 183 . 16 1 1 A 21 21 THR C C 21 174.416 174.643 -0.227 1
1 184 . 16 1 1 A 21 21 THR CA C 21 60.347 58.931 1.416 1
1 185 . 16 1 1 A 21 21 THR CB C 21 68.713 71.827 -3.114 1
1 187 . 16 1 1 A 21 21 THR N N 21 120.326 124.563 -4.237 1
1 188 . 16 1 1 A 22 22 PRO HA H 22 4.634 4.559 0.075 1
1 194 . 16 1 1 A 22 22 PRO C C 22 173.606 176.710 -3.104 1
1 195 . 16 1 1 A 22 22 PRO CA C 22 66.519 64.279 2.240 1
1 196 . 16 1 1 A 22 22 PRO CB C 22 32.078 31.637 0.441 1
1 199 . 16 1 1 A 23 23 ARG H H 23 6.621 8.210 -1.589 1
1 200 . 16 1 1 A 23 23 ARG HA H 23 4.591 4.510 0.081 1
1 207 . 16 1 1 A 23 23 ARG C C 23 176.554 175.699 0.855 1
1 208 . 16 1 1 A 23 23 ARG CA C 23 53.892 56.218 -2.326 1
1 209 . 16 1 1 A 23 23 ARG CB C 23 33.498 33.056 0.442 1
1 212 . 16 1 1 A 23 23 ARG N N 23 102.938 116.925 -13.987 1
1 213 . 16 1 1 A 24 24 THR H H 24 7.352 7.898 -0.546 1
1 214 . 16 1 1 A 24 24 THR HA H 24 5.593 5.419 0.174 1
1 219 . 16 1 1 A 24 24 THR C C 24 172.345 172.154 0.191 1
1 220 . 16 1 1 A 24 24 THR CA C 24 59.311 60.791 -1.480 1
1 221 . 16 1 1 A 24 24 THR CB C 24 73.311 71.746 1.565 1
1 223 . 16 1 1 A 24 24 THR N N 24 108.792 110.891 -2.099 1
1 224 . 16 1 1 A 25 25 VAL H H 25 8.437 8.860 -0.423 1
1 225 . 16 1 1 A 25 25 VAL HA H 25 4.512 4.942 -0.430 1
1 233 . 16 1 1 A 25 25 VAL C C 25 172.854 173.844 -0.990 1
1 234 . 16 1 1 A 25 25 VAL CA C 25 61.617 61.020 0.597 1
1 235 . 16 1 1 A 25 25 VAL CB C 25 36.742 34.465 2.277 1
1 238 . 16 1 1 A 25 25 VAL N N 25 117.023 121.116 -4.093 1
1 239 . 16 1 1 A 26 26 HIS H H 26 8.915 9.183 -0.268 1
1 240 . 16 1 1 A 26 26 HIS HA H 26 5.765 5.463 0.302 1
1 245 . 16 1 1 A 26 26 HIS C C 26 173.976 173.530 0.446 1
1 246 . 16 1 1 A 26 26 HIS CA C 26 52.896 53.798 -0.902 1
1 247 . 16 1 1 A 26 26 HIS CB C 26 34.004 33.062 0.942 1
1 250 . 16 1 1 A 26 26 HIS N N 26 128.155 127.698 0.457 1
1 251 . 16 1 1 A 27 27 LEU H H 27 9.034 9.342 -0.308 1
1 252 . 16 1 1 A 27 27 LEU HA H 27 5.505 5.114 0.391 1
1 262 . 16 1 1 A 27 27 LEU C C 27 174.821 174.551 0.270 1
1 263 . 16 1 1 A 27 27 LEU CA C 27 53.376 53.456 -0.080 1
1 264 . 16 1 1 A 27 27 LEU CB C 27 46.306 47.003 -0.697 1
1 268 . 16 1 1 A 27 27 LEU N N 27 128.569 129.076 -0.507 1
1 269 . 16 1 1 A 28 28 THR H H 28 8.844 8.605 0.239 1
1 270 . 16 1 1 A 28 28 THR HA H 28 4.485 4.716 -0.231 1
1 275 . 16 1 1 A 28 28 THR C C 28 172.773 173.394 -0.621 1
1 276 . 16 1 1 A 28 28 THR CA C 28 60.052 60.555 -0.503 1
1 277 . 16 1 1 A 28 28 THR CB C 28 71.704 71.258 0.446 1
1 279 . 16 1 1 A 28 28 THR N N 28 112.165 112.876 -0.711 1
1 280 . 16 1 1 A 29 29 TRP H H 29 7.395 7.790 -0.395 1
1 281 . 16 1 1 A 29 29 TRP HA H 29 4.915 5.500 -0.585 1
1 290 . 16 1 1 A 29 29 TRP C C 29 174.013 174.457 -0.444 1
1 291 . 16 1 1 A 29 29 TRP CA C 29 56.626 54.480 2.146 1
1 292 . 16 1 1 A 29 29 TRP CB C 29 29.487 32.039 -2.552 1
1 298 . 16 1 1 A 29 29 TRP N N 29 115.623 119.970 -4.347 1
1 300 . 16 1 1 A 30 30 GLN H H 30 8.759 8.557 0.202 1
1 301 . 16 1 1 A 30 30 GLN HA H 30 4.641 4.734 -0.093 1
1 308 . 16 1 1 A 30 30 GLN C C 30 175.072 174.142 0.930 1
1 309 . 16 1 1 A 30 30 GLN CA C 30 52.975 53.650 -0.675 1
1 310 . 16 1 1 A 30 30 GLN CB C 30 28.398 28.491 -0.093 1
1 312 . 16 1 1 A 30 30 GLN N N 30 117.497 119.948 -2.451 1
1 314 . 16 1 1 A 31 31 PRO HA H 31 4.487 4.423 0.064 1
1 320 . 16 1 1 A 31 31 PRO C C 31 177.034 176.043 0.991 1
1 321 . 16 1 1 A 31 31 PRO CA C 31 62.710 62.782 -0.072 1
1 322 . 16 1 1 A 31 31 PRO CB C 31 32.738 32.172 0.566 1
1 325 . 16 1 1 A 32 32 SER H H 32 8.259 8.828 -0.569 1
1 326 . 16 1 1 A 32 32 SER HA H 32 4.670 4.823 -0.153 1
1 329 . 16 1 1 A 32 32 SER C C 32 174.689 174.177 0.512 1
1 330 . 16 1 1 A 32 32 SER CA C 32 57.296 57.625 -0.329 1
1 331 . 16 1 1 A 32 32 SER CB C 32 64.748 64.626 0.122 1
1 332 . 16 1 1 A 32 32 SER N N 32 117.667 117.185 0.482 1
1 333 . 16 1 1 A 33 33 ALA H H 33 9.038 8.547 0.491 1
1 334 . 16 1 1 A 33 33 ALA HA H 33 4.126 4.379 -0.253 1
1 338 . 16 1 1 A 33 33 ALA C C 33 177.795 178.049 -0.254 1
1 339 . 16 1 1 A 33 33 ALA CA C 33 54.213 52.672 1.541 1
1 340 . 16 1 1 A 33 33 ALA CB C 33 17.948 18.663 -0.715 1
1 341 . 16 1 1 A 33 33 ALA N N 33 131.772 127.854 3.918 1
1 342 . 16 1 1 A 34 34 GLY H H 34 8.576 8.422 0.154 1
1 343 . 16 1 1 A 34 34 GLY HA2 H 34 4.171 4.015 0.156 1
1 344 . 16 1 1 A 34 34 GLY HA3 H 34 3.592 4.018 -0.426 1
1 345 . 16 1 1 A 34 34 GLY C C 34 174.182 174.454 -0.272 1
1 346 . 16 1 1 A 34 34 GLY CA C 34 44.987 45.186 -0.199 1
1 347 . 16 1 1 A 34 34 GLY N N 34 111.339 111.392 -0.053 1
1 348 . 16 1 1 A 35 35 ALA H H 35 7.637 7.799 -0.162 1
1 349 . 16 1 1 A 35 35 ALA HA H 35 4.210 4.104 0.106 1
1 353 . 16 1 1 A 35 35 ALA C C 35 178.918 178.288 0.630 1
1 354 . 16 1 1 A 35 35 ALA CA C 35 52.671 52.620 0.051 1
1 355 . 16 1 1 A 35 35 ALA CB C 35 18.988 19.199 -0.211 1
1 356 . 16 1 1 A 35 35 ALA N N 35 121.531 123.515 -1.984 1
1 357 . 16 1 1 A 36 36 THR H H 36 9.428 8.392 1.036 1
1 358 . 16 1 1 A 36 36 THR HA H 36 4.402 4.128 0.274 1
1 363 . 16 1 1 A 36 36 THR C C 36 174.739 174.166 0.573 1
1 364 . 16 1 1 A 36 36 THR CA C 36 62.692 63.864 -1.172 1
1 365 . 16 1 1 A 36 36 THR CB C 36 69.482 69.672 -0.190 1
1 367 . 16 1 1 A 36 36 THR N N 36 113.103 119.711 -6.608 1
1 368 . 16 1 1 A 37 37 HIS H H 37 7.857 6.710 1.147 1
1 369 . 16 1 1 A 37 37 HIS HA H 37 4.878 4.680 0.198 1
1 374 . 16 1 1 A 37 37 HIS C C 37 171.103 171.861 -0.758 1
1 375 . 16 1 1 A 37 37 HIS CA C 37 55.867 54.005 1.862 1
1 376 . 16 1 1 A 37 37 HIS CB C 37 32.655 31.572 1.083 1
1 379 . 16 1 1 A 37 37 HIS N N 37 118.486 115.145 3.341 1
1 380 . 16 1 1 A 38 38 TYR H H 38 9.217 8.409 0.808 1
1 381 . 16 1 1 A 38 38 TYR HA H 38 5.303 5.003 0.300 1
1 388 . 16 1 1 A 38 38 TYR C C 38 173.922 174.862 -0.940 1
1 389 . 16 1 1 A 38 38 TYR CA C 38 56.504 56.557 -0.053 1
1 390 . 16 1 1 A 38 38 TYR CB C 38 41.823 42.649 -0.826 1
1 395 . 16 1 1 A 38 38 TYR N N 38 114.077 117.961 -3.884 1
1 396 . 16 1 1 A 39 39 LEU H H 39 9.052 9.012 0.040 1
1 397 . 16 1 1 A 39 39 LEU HA H 39 5.061 5.031 0.030 1
1 407 . 16 1 1 A 39 39 LEU C C 39 175.455 174.873 0.582 1
1 408 . 16 1 1 A 39 39 LEU CA C 39 53.855 54.311 -0.456 1
1 409 . 16 1 1 A 39 39 LEU CB C 39 45.254 44.250 1.004 1
1 413 . 16 1 1 A 39 39 LEU N N 39 123.997 125.539 -1.542 1
1 414 . 16 1 1 A 40 40 VAL H H 40 9.520 9.001 0.519 1
1 415 . 16 1 1 A 40 40 VAL HA H 40 4.988 4.595 0.393 1
1 423 . 16 1 1 A 40 40 VAL C C 40 174.578 174.466 0.112 1
1 424 . 16 1 1 A 40 40 VAL CA C 40 60.575 61.756 -1.181 1
1 425 . 16 1 1 A 40 40 VAL CB C 40 33.284 34.599 -1.315 1
1 428 . 16 1 1 A 40 40 VAL N N 40 129.678 125.447 4.231 1
1 429 . 16 1 1 A 41 41 ARG H H 41 9.096 9.072 0.024 1
1 430 . 16 1 1 A 41 41 ARG HA H 41 5.384 5.175 0.209 1
1 437 . 16 1 1 A 41 41 ARG C C 41 175.100 174.582 0.518 1
1 438 . 16 1 1 A 41 41 ARG CA C 41 54.297 55.583 -1.286 1
1 439 . 16 1 1 A 41 41 ARG CB C 41 33.003 31.184 1.819 1
1 442 . 16 1 1 A 41 41 ARG N N 41 126.332 126.864 -0.532 1
1 443 . 16 1 1 A 42 42 CYS H H 42 9.004 9.066 -0.062 1
1 444 . 16 1 1 A 42 42 CYS HA H 42 5.309 5.003 0.306 1
1 447 . 16 1 1 A 42 42 CYS C C 42 173.417 173.673 -0.256 1
1 448 . 16 1 1 A 42 42 CYS CA C 42 57.508 57.244 0.264 1
1 449 . 16 1 1 A 42 42 CYS CB C 42 28.859 28.348 0.511 1
1 450 . 16 1 1 A 42 42 CYS N N 42 123.359 125.919 -2.560 1
1 451 . 16 1 1 A 43 43 SER H H 43 9.102 8.983 0.119 1
1 452 . 16 1 1 A 43 43 SER HA H 43 5.324 4.961 0.363 1
1 455 . 16 1 1 A 43 43 SER C C 43 171.429 171.757 -0.328 1
1 456 . 16 1 1 A 43 43 SER CA C 43 55.621 55.631 -0.010 1
1 457 . 16 1 1 A 43 43 SER CB C 43 64.856 65.211 -0.355 1
1 458 . 16 1 1 A 43 43 SER N N 43 125.444 123.360 2.084 1
1 459 . 16 1 1 A 44 44 PRO HA H 44 4.389 4.590 -0.201 1
1 466 . 16 1 1 A 44 44 PRO C C 44 176.559 176.986 -0.427 1
1 467 . 16 1 1 A 44 44 PRO CA C 44 63.027 63.171 -0.144 1
1 468 . 16 1 1 A 44 44 PRO CB C 44 31.935 32.866 -0.931 1
1 471 . 16 1 1 A 45 45 ALA H H 45 8.261 8.108 0.153 1
1 472 . 16 1 1 A 45 45 ALA HA H 45 4.157 4.114 0.043 1
1 476 . 16 1 1 A 45 45 ALA C C 45 177.706 176.926 0.780 1
1 477 . 16 1 1 A 45 45 ALA CA C 45 53.284 54.343 -1.059 1
1 478 . 16 1 1 A 45 45 ALA CB C 45 18.978 19.278 -0.300 1
1 479 . 16 1 1 A 45 45 ALA N N 45 126.162 123.729 2.433 1
1 480 . 16 1 1 A 46 46 SER H H 46 8.275 7.612 0.663 1
1 481 . 16 1 1 A 46 46 SER HA H 46 4.779 4.734 0.045 1
1 484 . 16 1 1 A 46 46 SER C C 46 172.182 173.858 -1.676 1
1 485 . 16 1 1 A 46 46 SER CA C 46 55.091 54.843 0.248 1
1 486 . 16 1 1 A 46 46 SER CB C 46 63.130 64.350 -1.220 1
1 487 . 16 1 1 A 46 46 SER N N 46 113.009 114.166 -1.157 1
1 488 . 16 1 1 A 47 47 PRO HA H 47 4.336 4.561 -0.225 1
1 493 . 16 1 1 A 47 47 PRO C C 47 177.165 176.352 0.813 1
1 494 . 16 1 1 A 47 47 PRO CA C 47 63.268 63.698 -0.430 1
1 495 . 16 1 1 A 47 47 PRO CB C 47 32.528 31.773 0.755 1
1 498 . 16 1 1 A 48 48 LYS H H 48 9.089 7.557 1.532 1
1 499 . 16 1 1 A 48 48 LYS HA H 48 4.408 4.066 0.342 1
1 508 . 16 1 1 A 48 48 LYS C C 48 176.917 177.094 -0.177 1
1 509 . 16 1 1 A 48 48 LYS CA C 48 55.893 58.445 -2.552 1
1 510 . 16 1 1 A 48 48 LYS CB C 48 32.997 32.181 0.816 1
1 514 . 16 1 1 A 48 48 LYS N N 48 122.579 119.606 2.973 1
1 515 . 16 1 1 A 49 49 GLY HA2 H 49 4.021 4.033 -0.012 1
1 516 . 16 1 1 A 49 49 GLY HA3 H 49 3.881 4.034 -0.153 1
1 517 . 16 1 1 A 49 49 GLY C C 49 174.552 173.895 0.657 1
1 518 . 16 1 1 A 49 49 GLY CA C 49 46.011 44.535 1.476 1
1 519 . 16 1 1 A 50 50 GLU H H 50 8.608 8.476 0.132 1
1 520 . 16 1 1 A 50 50 GLU HA H 50 4.335 4.490 -0.155 1
1 525 . 16 1 1 A 50 50 GLU C C 50 176.672 176.148 0.524 1
1 526 . 16 1 1 A 50 50 GLU CA C 50 56.978 55.158 1.820 1
1 527 . 16 1 1 A 50 50 GLU CB C 50 29.458 28.210 1.248 1
1 529 . 16 1 1 A 50 50 GLU N N 50 121.378 122.823 -1.445 1
1 530 . 16 1 1 A 51 51 GLU H H 51 8.287 8.378 -0.091 1
1 531 . 16 1 1 A 51 51 GLU HA H 51 4.381 4.274 0.107 1
1 536 . 16 1 1 A 51 51 GLU C C 51 176.218 176.419 -0.201 1
1 537 . 16 1 1 A 51 51 GLU CA C 51 56.996 56.760 0.236 1
1 538 . 16 1 1 A 51 51 GLU CB C 51 31.066 29.476 1.590 1
1 540 . 16 1 1 A 51 51 GLU N N 51 120.863 124.440 -3.577 1
1 541 . 16 1 1 A 52 52 GLU H H 52 8.445 8.938 -0.493 1
1 542 . 16 1 1 A 52 52 GLU HA H 52 4.464 5.062 -0.598 1
1 547 . 16 1 1 A 52 52 GLU C C 52 176.128 175.091 1.037 1
1 548 . 16 1 1 A 52 52 GLU CA C 52 55.955 55.203 0.752 1
1 549 . 16 1 1 A 52 52 GLU CB C 52 31.691 32.985 -1.294 1
1 551 . 16 1 1 A 52 52 GLU N N 52 121.103 124.749 -3.646 1
1 552 . 16 1 1 A 53 53 GLU H H 53 8.441 8.870 -0.429 1
1 553 . 16 1 1 A 53 53 GLU HA H 53 4.609 5.270 -0.661 1
1 558 . 16 1 1 A 53 53 GLU C C 53 175.816 174.855 0.961 1
1 559 . 16 1 1 A 53 53 GLU CA C 53 56.697 55.044 1.653 1
1 560 . 16 1 1 A 53 53 GLU CB C 53 31.022 32.922 -1.900 1
1 562 . 16 1 1 A 53 53 GLU N N 53 121.949 122.486 -0.537 1
1 563 . 16 1 1 A 54 54 ARG H H 54 8.569 8.861 -0.292 1
1 564 . 16 1 1 A 54 54 ARG HA H 54 4.768 5.187 -0.419 1
1 571 . 16 1 1 A 54 54 ARG C C 54 174.881 174.739 0.142 1
1 572 . 16 1 1 A 54 54 ARG CA C 54 54.950 54.056 0.894 1
1 573 . 16 1 1 A 54 54 ARG CB C 54 33.374 33.755 -0.381 1
1 576 . 16 1 1 A 54 54 ARG N N 54 123.714 123.308 0.406 1
1 577 . 16 1 1 A 55 55 GLU H H 55 8.650 8.691 -0.041 1
1 578 . 16 1 1 A 55 55 GLU HA H 55 5.493 5.109 0.384 1
1 583 . 16 1 1 A 55 55 GLU C C 55 175.566 174.927 0.639 1
1 584 . 16 1 1 A 55 55 GLU CA C 55 54.915 55.101 -0.186 1
1 585 . 16 1 1 A 55 55 GLU CB C 55 33.250 31.732 1.518 1
1 587 . 16 1 1 A 55 55 GLU N N 55 123.537 124.672 -1.135 1
1 588 . 16 1 1 A 56 56 VAL H H 56 9.419 8.658 0.761 1
1 589 . 16 1 1 A 56 56 VAL HA H 56 4.524 4.966 -0.442 1
1 597 . 16 1 1 A 56 56 VAL C C 56 173.502 173.989 -0.487 1
1 598 . 16 1 1 A 56 56 VAL CA C 56 60.981 58.767 2.214 1
1 599 . 16 1 1 A 56 56 VAL CB C 56 36.117 35.782 0.335 1
1 602 . 16 1 1 A 56 56 VAL N N 56 123.343 117.682 5.661 1
1 603 . 16 1 1 A 57 57 GLN H H 57 8.767 8.806 -0.039 1
1 604 . 16 1 1 A 57 57 GLN HA H 57 5.671 5.215 0.456 1
1 611 . 16 1 1 A 57 57 GLN C C 57 176.357 175.395 0.962 1
1 612 . 16 1 1 A 57 57 GLN CA C 57 54.735 54.595 0.140 1
1 613 . 16 1 1 A 57 57 GLN CB C 57 30.781 31.549 -0.768 1
1 615 . 16 1 1 A 57 57 GLN N N 57 125.639 121.330 4.309 1
1 617 . 16 1 1 A 58 58 VAL H H 58 9.217 9.408 -0.191 1
1 618 . 16 1 1 A 58 58 VAL HA H 58 5.129 4.914 0.215 1
1 626 . 16 1 1 A 58 58 VAL C C 58 175.925 177.010 -1.085 1
1 627 . 16 1 1 A 58 58 VAL CA C 58 59.652 60.137 -0.485 1
1 628 . 16 1 1 A 58 58 VAL CB C 58 36.540 34.906 1.634 1
1 631 . 16 1 1 A 58 58 VAL N N 58 117.022 117.869 -0.847 1
1 632 . 16 1 1 A 59 59 GLY H H 59 9.008 8.785 0.223 1
1 633 . 16 1 1 A 59 59 GLY HA2 H 59 4.670 3.931 0.739 1
1 634 . 16 1 1 A 59 59 GLY HA3 H 59 3.914 3.959 -0.045 1
1 635 . 16 1 1 A 59 59 GLY C C 59 173.386 173.962 -0.576 1
1 636 . 16 1 1 A 59 59 GLY CA C 59 45.093 46.403 -1.310 1
1 637 . 16 1 1 A 59 59 GLY N N 59 109.174 111.616 -2.442 1
1 638 . 16 1 1 A 60 60 ARG H H 60 7.695 7.592 0.103 1
1 639 . 16 1 1 A 60 60 ARG HA H 60 4.866 5.072 -0.206 1
1 645 . 16 1 1 A 60 60 ARG C C 60 173.760 175.532 -1.772 1
1 646 . 16 1 1 A 60 60 ARG CA C 60 52.764 53.568 -0.804 1
1 647 . 16 1 1 A 60 60 ARG CB C 60 31.785 32.374 -0.589 1
1 650 . 16 1 1 A 60 60 ARG N N 60 118.520 117.311 1.209 1
1 651 . 16 1 1 A 61 61 PRO HA H 61 3.539 3.973 -0.434 1
1 658 . 16 1 1 A 61 61 PRO C C 61 173.175 173.800 -0.625 1
1 659 . 16 1 1 A 61 61 PRO CA C 61 62.265 62.997 -0.732 1
1 660 . 16 1 1 A 61 61 PRO CB C 61 27.546 30.711 -3.165 1
1 663 . 16 1 1 A 62 62 GLU H H 62 7.879 7.734 0.145 1
1 664 . 16 1 1 A 62 62 GLU HA H 62 4.071 4.601 -0.530 1
1 669 . 16 1 1 A 62 62 GLU C C 62 174.107 174.542 -0.435 1
1 670 . 16 1 1 A 62 62 GLU CA C 62 55.229 54.344 0.885 1
1 671 . 16 1 1 A 62 62 GLU CB C 62 32.838 31.936 0.902 1
1 673 . 16 1 1 A 62 62 GLU N N 62 118.173 113.982 4.191 1
1 674 . 16 1 1 A 63 63 VAL H H 63 8.930 8.463 0.467 1
1 675 . 16 1 1 A 63 63 VAL HA H 63 4.548 5.115 -0.567 1
1 683 . 16 1 1 A 63 63 VAL C C 63 170.325 173.695 -3.370 1
1 684 . 16 1 1 A 63 63 VAL CA C 63 60.770 59.599 1.171 1
1 685 . 16 1 1 A 63 63 VAL CB C 63 35.394 34.961 0.433 1
1 688 . 16 1 1 A 63 63 VAL N N 63 117.161 125.520 -8.359 1
1 689 . 16 1 1 A 64 64 LEU H H 64 8.332 8.866 -0.534 1
1 690 . 16 1 1 A 64 64 LEU HA H 64 5.122 5.281 -0.159 1
1 700 . 16 1 1 A 64 64 LEU C C 64 176.243 174.614 1.629 1
1 701 . 16 1 1 A 64 64 LEU CA C 64 53.346 53.859 -0.513 1
1 702 . 16 1 1 A 64 64 LEU CB C 64 42.649 45.337 -2.688 1
1 706 . 16 1 1 A 64 64 LEU N N 64 130.510 128.797 1.713 1
1 707 . 16 1 1 A 65 65 LEU H H 65 9.261 9.472 -0.211 1
1 708 . 16 1 1 A 65 65 LEU HA H 65 4.443 4.912 -0.469 1
1 718 . 16 1 1 A 65 65 LEU C C 65 174.016 175.693 -1.677 1
1 719 . 16 1 1 A 65 65 LEU CA C 65 53.920 53.774 0.146 1
1 720 . 16 1 1 A 65 65 LEU CB C 65 42.976 42.807 0.169 1
1 724 . 16 1 1 A 65 65 LEU N N 65 128.611 128.948 -0.337 1
1 725 . 16 1 1 A 66 66 ASP H H 66 8.105 8.693 -0.588 1
1 726 . 16 1 1 A 66 66 ASP HA H 66 5.207 5.294 -0.087 1
1 729 . 16 1 1 A 66 66 ASP C C 66 176.161 176.424 -0.263 1
1 730 . 16 1 1 A 66 66 ASP CA C 66 51.001 52.779 -1.778 1
1 731 . 16 1 1 A 66 66 ASP CB C 66 42.836 43.326 -0.490 1
1 732 . 16 1 1 A 66 66 ASP N N 66 121.799 124.771 -2.972 1
1 733 . 16 1 1 A 67 67 GLY H H 67 8.688 8.698 -0.010 1
1 734 . 16 1 1 A 67 67 GLY HA2 H 67 3.923 3.946 -0.023 1
1 735 . 16 1 1 A 67 67 GLY HA3 H 67 3.808 3.952 -0.144 1
1 736 . 16 1 1 A 67 67 GLY C C 67 175.500 174.226 1.274 1
1 737 . 16 1 1 A 67 67 GLY CA C 67 46.591 46.618 -0.027 1
1 738 . 16 1 1 A 67 67 GLY N N 67 106.518 111.209 -4.691 1
1 739 . 16 1 1 A 68 68 LEU H H 68 8.125 7.728 0.397 1
1 740 . 16 1 1 A 68 68 LEU HA H 68 4.252 4.817 -0.565 1
1 750 . 16 1 1 A 68 68 LEU C C 68 174.914 175.673 -0.759 1
1 751 . 16 1 1 A 68 68 LEU CA C 68 53.469 53.201 0.268 1
1 752 . 16 1 1 A 68 68 LEU CB C 68 40.422 43.814 -3.392 1
1 756 . 16 1 1 A 68 68 LEU N N 68 119.345 120.425 -1.080 1
1 757 . 16 1 1 A 69 69 GLU H H 69 8.207 8.809 -0.602 1
1 758 . 16 1 1 A 69 69 GLU HA H 69 4.908 4.808 0.100 1
1 763 . 16 1 1 A 69 69 GLU C C 69 174.464 174.107 0.357 1
1 764 . 16 1 1 A 69 69 GLU CA C 69 53.081 52.857 0.224 1
1 765 . 16 1 1 A 69 69 GLU CB C 69 31.538 31.357 0.181 1
1 767 . 16 1 1 A 69 69 GLU N N 69 119.486 119.423 0.063 1
1 768 . 16 1 1 A 70 70 PRO HA H 70 4.866 4.335 0.531 1
1 775 . 16 1 1 A 70 70 PRO C C 70 178.285 177.528 0.757 1
1 776 . 16 1 1 A 70 70 PRO CA C 70 63.203 63.650 -0.447 1
1 777 . 16 1 1 A 70 70 PRO CB C 70 33.726 31.739 1.987 1
1 780 . 16 1 1 A 71 71 GLY H H 71 7.362 8.789 -1.427 1
1 781 . 16 1 1 A 71 71 GLY HA2 H 71 3.807 3.956 -0.149 1
1 782 . 16 1 1 A 71 71 GLY HA3 H 71 3.756 3.959 -0.203 1
1 783 . 16 1 1 A 71 71 GLY C C 71 174.664 173.874 0.790 1
1 784 . 16 1 1 A 71 71 GLY CA C 71 46.926 46.278 0.648 1
1 785 . 16 1 1 A 71 71 GLY N N 71 113.776 111.554 2.222 1
1 786 . 16 1 1 A 72 72 ARG H H 72 8.036 7.331 0.705 1
1 787 . 16 1 1 A 72 72 ARG HA H 72 4.597 4.797 -0.200 1
1 793 . 16 1 1 A 72 72 ARG C C 72 173.293 173.762 -0.469 1
1 794 . 16 1 1 A 72 72 ARG CA C 72 54.633 54.508 0.125 1
1 795 . 16 1 1 A 72 72 ARG CB C 72 33.704 33.326 0.378 1
1 798 . 16 1 1 A 72 72 ARG N N 72 119.611 119.720 -0.109 1
1 799 . 16 1 1 A 73 73 ASP H H 73 7.785 8.714 -0.929 1
1 800 . 16 1 1 A 73 73 ASP HA H 73 5.276 5.171 0.105 1
1 803 . 16 1 1 A 73 73 ASP C C 73 175.904 174.546 1.358 1
1 804 . 16 1 1 A 73 73 ASP CA C 73 53.568 53.340 0.228 1
1 805 . 16 1 1 A 73 73 ASP CB C 73 42.970 42.471 0.499 1
1 806 . 16 1 1 A 73 73 ASP N N 73 118.900 126.444 -7.544 1
1 807 . 16 1 1 A 74 74 TYR H H 74 9.516 8.696 0.820 1
1 808 . 16 1 1 A 74 74 TYR HA H 74 4.800 5.097 -0.297 1
1 815 . 16 1 1 A 74 74 TYR C C 74 174.631 174.910 -0.279 1
1 816 . 16 1 1 A 74 74 TYR CA C 74 58.548 56.244 2.304 1
1 817 . 16 1 1 A 74 74 TYR CB C 74 42.029 42.724 -0.695 1
1 822 . 16 1 1 A 74 74 TYR N N 74 121.903 123.339 -1.436 1
1 823 . 16 1 1 A 75 75 GLU H H 75 9.248 8.928 0.320 1
1 824 . 16 1 1 A 75 75 GLU HA H 75 4.756 4.711 0.045 1
1 829 . 16 1 1 A 75 75 GLU C C 75 175.524 175.604 -0.080 1
1 830 . 16 1 1 A 75 75 GLU CA C 75 55.621 55.185 0.436 1
1 831 . 16 1 1 A 75 75 GLU CB C 75 30.778 29.867 0.911 1
1 833 . 16 1 1 A 75 75 GLU N N 75 122.425 123.224 -0.799 1
1 834 . 16 1 1 A 76 76 VAL H H 76 8.884 8.473 0.411 1
1 835 . 16 1 1 A 76 76 VAL HA H 76 5.246 4.712 0.534 1
1 843 . 16 1 1 A 76 76 VAL C C 76 174.800 175.503 -0.703 1
1 844 . 16 1 1 A 76 76 VAL CA C 76 60.199 62.867 -2.668 1
1 845 . 16 1 1 A 76 76 VAL CB C 76 33.449 31.345 2.104 1
1 848 . 16 1 1 A 76 76 VAL N N 76 126.853 124.577 2.276 1
1 849 . 16 1 1 A 77 77 SER H H 77 9.234 8.866 0.368 1
1 850 . 16 1 1 A 77 77 SER HA H 77 5.398 5.003 0.395 1
1 853 . 16 1 1 A 77 77 SER C C 77 173.138 173.678 -0.540 1
1 854 . 16 1 1 A 77 77 SER CA C 77 56.032 57.808 -1.776 1
1 855 . 16 1 1 A 77 77 SER CB C 77 66.374 63.967 2.407 1
1 856 . 16 1 1 A 77 77 SER N N 77 120.852 125.793 -4.941 1
1 857 . 16 1 1 A 78 78 VAL H H 78 9.092 8.689 0.403 1
1 858 . 16 1 1 A 78 78 VAL HA H 78 4.756 4.458 0.298 1
1 866 . 16 1 1 A 78 78 VAL C C 78 173.641 175.266 -1.625 1
1 867 . 16 1 1 A 78 78 VAL CA C 78 61.246 60.632 0.614 1
1 868 . 16 1 1 A 78 78 VAL CB C 78 34.467 32.236 2.231 1
1 871 . 16 1 1 A 78 78 VAL N N 78 122.453 126.788 -4.335 1
1 872 . 16 1 1 A 79 79 GLN H H 79 8.587 8.149 0.438 1
1 873 . 16 1 1 A 79 79 GLN HA H 79 4.438 4.576 -0.138 1
1 880 . 16 1 1 A 79 79 GLN C C 79 174.999 174.367 0.632 1
1 881 . 16 1 1 A 79 79 GLN CA C 79 54.227 55.504 -1.277 1
1 882 . 16 1 1 A 79 79 GLN CB C 79 33.587 32.121 1.466 1
1 884 . 16 1 1 A 79 79 GLN N N 79 125.619 124.766 0.853 1
1 886 . 16 1 1 A 80 80 SER H H 80 8.623 9.074 -0.451 1
1 887 . 16 1 1 A 80 80 SER HA H 80 4.756 4.761 -0.005 1
1 890 . 16 1 1 A 80 80 SER C C 80 172.264 174.659 -2.395 1
1 891 . 16 1 1 A 80 80 SER CA C 80 58.177 58.824 -0.647 1
1 892 . 16 1 1 A 80 80 SER CB C 80 63.920 63.844 0.076 1
1 893 . 16 1 1 A 80 80 SER N N 80 122.844 123.077 -0.233 1
1 894 . 16 1 1 A 81 81 LEU H H 81 8.348 8.478 -0.130 1
1 895 . 16 1 1 A 81 81 LEU HA H 81 5.124 4.759 0.365 1
1 905 . 16 1 1 A 81 81 LEU C C 81 175.775 175.741 0.034 1
1 906 . 16 1 1 A 81 81 LEU CA C 81 54.033 53.653 0.380 1
1 907 . 16 1 1 A 81 81 LEU CB C 81 44.690 44.630 0.060 1
1 911 . 16 1 1 A 81 81 LEU N N 81 123.191 123.647 -0.456 1
1 912 . 16 1 1 A 82 82 ARG H H 82 8.374 8.972 -0.598 1
1 913 . 16 1 1 A 82 82 ARG HA H 82 4.616 4.307 0.309 1
1 919 . 16 1 1 A 82 82 ARG C C 82 176.864 175.829 1.035 1
1 920 . 16 1 1 A 82 82 ARG CA C 82 55.868 56.206 -0.338 1
1 921 . 16 1 1 A 82 82 ARG CB C 82 32.322 32.518 -0.196 1
1 924 . 16 1 1 A 82 82 ARG N N 82 121.029 126.659 -5.630 1
1 925 . 16 1 1 A 83 83 GLY H H 83 8.309 7.710 0.599 1
1 926 . 16 1 1 A 83 83 GLY HA2 H 83 4.031 4.097 -0.066 1
1 927 . 16 1 1 A 83 83 GLY HA3 H 83 3.888 4.117 -0.229 1
1 928 . 16 1 1 A 83 83 GLY C C 83 174.562 174.160 0.402 1
1 929 . 16 1 1 A 83 83 GLY CA C 83 45.963 45.401 0.562 1
1 930 . 16 1 1 A 83 83 GLY N N 83 109.937 106.579 3.358 1
1 931 . 16 1 1 A 84 84 PRO HA H 84 4.573 4.493 0.080 1
1 938 . 16 1 1 A 84 84 PRO C C 84 176.533 175.414 1.119 1
1 939 . 16 1 1 A 84 84 PRO CA C 84 63.485 64.012 -0.527 1
1 940 . 16 1 1 A 84 84 PRO CB C 84 32.409 31.857 0.552 1
1 943 . 16 1 1 A 85 85 GLU H H 85 7.799 7.514 0.285 1
1 944 . 16 1 1 A 85 85 GLU HA H 85 4.369 4.919 -0.550 1
1 949 . 16 1 1 A 85 85 GLU C C 85 174.722 175.629 -0.907 1
1 950 . 16 1 1 A 85 85 GLU CA C 85 55.899 54.854 1.045 1
1 951 . 16 1 1 A 85 85 GLU CB C 85 31.911 32.997 -1.086 1
1 953 . 16 1 1 A 85 85 GLU N N 85 122.093 113.200 8.893 1
1 954 . 16 1 1 A 86 86 GLY H H 86 8.329 8.821 -0.492 1
1 955 . 16 1 1 A 86 86 GLY HA2 H 86 5.298 4.248 1.050 1
1 956 . 16 1 1 A 86 86 GLY HA3 H 86 3.559 4.259 -0.700 1
1 957 . 16 1 1 A 86 86 GLY C C 86 174.355 173.096 1.259 1
1 958 . 16 1 1 A 86 86 GLY CA C 86 44.034 44.009 0.025 1
1 959 . 16 1 1 A 86 86 GLY N N 86 109.387 109.297 0.090 1
1 960 . 16 1 1 A 87 87 SER H H 87 8.807 8.229 0.578 1
1 961 . 16 1 1 A 87 87 SER HA H 87 4.670 4.704 -0.034 1
1 964 . 16 1 1 A 87 87 SER C C 87 175.195 174.561 0.634 1
1 965 . 16 1 1 A 87 87 SER CA C 87 57.737 57.333 0.404 1
1 966 . 16 1 1 A 87 87 SER CB C 87 67.829 65.873 1.956 1
1 967 . 16 1 1 A 87 87 SER N N 87 117.698 112.644 5.054 1
1 968 . 16 1 1 A 88 88 GLU H H 88 8.754 8.541 0.213 1
1 969 . 16 1 1 A 88 88 GLU HA H 88 4.357 4.251 0.106 1
1 974 . 16 1 1 A 88 88 GLU C C 88 177.474 176.879 0.595 1
1 975 . 16 1 1 A 88 88 GLU CA C 88 57.525 57.479 0.046 1
1 976 . 16 1 1 A 88 88 GLU CB C 88 31.162 30.253 0.909 1
1 978 . 16 1 1 A 88 88 GLU N N 88 118.709 121.055 -2.346 1
1 979 . 16 1 1 A 89 89 ALA H H 89 8.855 8.329 0.526 1
1 980 . 16 1 1 A 89 89 ALA HA H 89 4.792 4.457 0.335 1
1 984 . 16 1 1 A 89 89 ALA C C 89 178.379 176.556 1.823 1
1 985 . 16 1 1 A 89 89 ALA CA C 89 51.264 52.144 -0.880 1
1 986 . 16 1 1 A 89 89 ALA CB C 89 20.040 19.327 0.713 1
1 987 . 16 1 1 A 89 89 ALA N N 89 127.301 125.612 1.689 1
1 988 . 16 1 1 A 90 90 ARG H H 90 8.549 8.649 -0.100 1
1 989 . 16 1 1 A 90 90 ARG HA H 90 4.658 4.878 -0.220 1
1 996 . 16 1 1 A 90 90 ARG C C 90 174.720 175.331 -0.611 1
1 997 . 16 1 1 A 90 90 ARG CA C 90 53.575 54.469 -0.894 1
1 998 . 16 1 1 A 90 90 ARG CB C 90 33.456 31.661 1.795 1
1 1001 . 16 1 1 A 90 90 ARG N N 90 121.289 123.835 -2.546 1
1 1002 . 16 1 1 A 91 91 GLY H H 91 8.396 8.941 -0.545 1
1 1003 . 16 1 1 A 91 91 GLY HA2 H 91 5.306 4.175 1.131 1
1 1004 . 16 1 1 A 91 91 GLY HA3 H 91 3.700 4.208 -0.508 1
1 1005 . 16 1 1 A 91 91 GLY C C 91 173.191 172.119 1.072 1
1 1006 . 16 1 1 A 91 91 GLY CA C 91 44.493 43.814 0.679 1
1 1007 . 16 1 1 A 91 91 GLY N N 91 108.579 111.947 -3.368 1
1 1008 . 16 1 1 A 92 92 ILE H H 92 8.891 8.426 0.465 1
1 1009 . 16 1 1 A 92 92 ILE HA H 92 4.499 5.038 -0.539 1
1 1019 . 16 1 1 A 92 92 ILE C C 92 171.877 174.013 -2.136 1
1 1020 . 16 1 1 A 92 92 ILE CA C 92 60.682 59.050 1.632 1
1 1021 . 16 1 1 A 92 92 ILE CB C 92 42.425 41.819 0.606 1
1 1025 . 16 1 1 A 92 92 ILE N N 92 118.313 121.790 -3.477 1
1 1026 . 16 1 1 A 93 93 ARG H H 93 7.980 8.536 -0.556 1
1 1027 . 16 1 1 A 93 93 ARG HA H 93 5.224 4.503 0.721 1
1 1034 . 16 1 1 A 93 93 ARG C C 93 175.072 175.083 -0.011 1
1 1035 . 16 1 1 A 93 93 ARG CA C 93 54.499 55.212 -0.713 1
1 1036 . 16 1 1 A 93 93 ARG CB C 93 31.767 29.504 2.263 1
1 1039 . 16 1 1 A 93 93 ARG N N 93 124.879 128.949 -4.070 1
1 1040 . 16 1 1 A 94 94 ALA H H 94 9.064 8.183 0.881 1
1 1041 . 16 1 1 A 94 94 ALA HA H 94 4.731 4.348 0.383 1
1 1045 . 16 1 1 A 94 94 ALA C C 94 174.494 177.614 -3.120 1
1 1046 . 16 1 1 A 94 94 ALA CA C 94 50.577 53.144 -2.567 1
1 1047 . 16 1 1 A 94 94 ALA CB C 94 23.082 19.430 3.652 1
1 1048 . 16 1 1 A 94 94 ALA N N 94 126.095 128.870 -2.775 1
1 1049 . 16 1 1 A 95 95 ARG H H 95 8.263 8.902 -0.639 1
1 1050 . 16 1 1 A 95 95 ARG HA H 95 5.548 5.245 0.303 1
1 1058 . 16 1 1 A 95 95 ARG C C 95 176.901 174.694 2.207 1
1 1059 . 16 1 1 A 95 95 ARG CA C 95 53.787 54.302 -0.515 1
1 1060 . 16 1 1 A 95 95 ARG CB C 95 32.426 34.245 -1.819 1
1 1063 . 16 1 1 A 95 95 ARG N N 95 123.374 117.630 5.744 1
1 1065 . 16 1 1 A 96 96 THR H H 96 9.208 8.792 0.416 1
1 1066 . 16 1 1 A 96 96 THR HA H 96 4.461 5.054 -0.593 1
1 1071 . 16 1 1 A 96 96 THR CA C 96 58.248 58.433 -0.185 1
1 1072 . 16 1 1 A 96 96 THR CB C 96 68.466 71.468 -3.002 1
1 1074 . 16 1 1 A 96 96 THR N N 96 119.492 112.028 7.464 1
1 1075 . 16 1 1 A 97 97 PRO HA H 97 4.636 4.631 0.005 1
1 1082 . 16 1 1 A 97 97 PRO C C 97 175.725 175.722 0.003 1
1 1083 . 16 1 1 A 97 97 PRO CA C 97 61.907 62.335 -0.428 1
1 1084 . 16 1 1 A 97 97 PRO CB C 97 32.590 33.423 -0.833 1
1 1087 . 16 1 1 A 98 98 THR H H 98 7.943 8.325 -0.382 1
1 1088 . 16 1 1 A 98 98 THR HA H 98 4.208 4.979 -0.771 1
1 1093 . 16 1 1 A 98 98 THR C C 98 175.058 172.653 2.405 1
1 1094 . 16 1 1 A 98 98 THR CA C 98 62.069 60.335 1.734 1
1 1095 . 16 1 1 A 98 98 THR CB C 98 69.719 70.934 -1.215 1
1 1097 . 16 1 1 A 98 98 THR N N 98 107.148 111.453 -4.305 1
1 1098 . 16 1 1 A 99 99 SER H H 99 8.163 8.779 -0.616 1
1 1099 . 16 1 1 A 99 99 SER HA H 99 4.524 4.562 -0.038 1
1 1102 . 16 1 1 A 99 99 SER C C 99 174.319 174.104 0.215 1
1 1103 . 16 1 1 A 99 99 SER CA C 99 58.107 57.738 0.369 1
1 1104 . 16 1 1 A 99 99 SER CB C 99 64.492 62.710 1.782 1
1 1105 . 16 1 1 A 99 99 SER N N 99 115.114 123.811 -8.697 1
1 1106 . 16 1 1 A 100 100 GLY H H 100 8.336 8.393 -0.057 1
1 1107 . 16 1 1 A 100 100 GLY HA2 H 100 4.222 4.125 0.097 1
1 1108 . 16 1 1 A 100 100 GLY HA3 H 100 4.222 4.125 0.097 1
1 1109 . 16 1 1 A 100 100 GLY C C 100 171.696 173.353 -1.657 1
1 1110 . 16 1 1 A 100 100 GLY CA C 100 44.617 44.883 -0.266 1
1 1111 . 16 1 1 A 100 100 GLY N N 100 110.678 115.811 -5.133 1
1 1112 . 16 1 1 A 101 101 PRO HA H 101 4.506 4.717 -0.211 1
1 1118 . 16 1 1 A 101 101 PRO CA C 101 63.358 62.757 0.601 1
1 1119 . 16 1 1 A 101 101 PRO CB C 101 32.313 32.218 0.095 1
1 1 . 17 1 1 A 6 6 SER HA H 6 4.528 5.260 -0.732 1
1 3 . 17 1 1 A 6 6 SER CA C 6 58.373 56.691 1.682 1
1 4 . 17 1 1 A 6 6 SER CB C 6 63.978 65.691 -1.713 1
1 5 . 17 1 1 A 7 7 GLY H H 7 8.228 8.657 -0.429 1
1 6 . 17 1 1 A 7 7 GLY HA2 H 7 4.134 4.335 -0.201 1
1 7 . 17 1 1 A 7 7 GLY HA3 H 7 4.134 4.336 -0.202 1
1 8 . 17 1 1 A 7 7 GLY CA C 7 44.607 44.816 -0.209 1
1 9 . 17 1 1 A 7 7 GLY N N 7 110.638 112.163 -1.525 1
1 10 . 17 1 1 A 8 8 PRO HA H 8 4.419 4.710 -0.291 1
1 17 . 17 1 1 A 8 8 PRO C C 8 176.908 175.320 1.588 1
1 18 . 17 1 1 A 8 8 PRO CA C 8 62.851 62.750 0.101 1
1 19 . 17 1 1 A 8 8 PRO CB C 8 32.243 31.160 1.083 1
1 22 . 17 1 1 A 9 9 LEU H H 9 8.462 8.582 -0.120 1
1 23 . 17 1 1 A 9 9 LEU HA H 9 4.494 4.945 -0.451 1
1 33 . 17 1 1 A 9 9 LEU C C 9 174.124 174.422 -0.298 1
1 34 . 17 1 1 A 9 9 LEU CA C 9 52.587 51.883 0.704 1
1 35 . 17 1 1 A 9 9 LEU CB C 9 43.150 43.507 -0.357 1
1 39 . 17 1 1 A 9 9 LEU N N 9 126.015 124.533 1.482 1
1 40 . 17 1 1 A 10 10 PRO HA H 10 4.820 4.553 0.267 1
1 47 . 17 1 1 A 10 10 PRO CA C 10 61.368 62.065 -0.697 1
1 48 . 17 1 1 A 10 10 PRO CB C 10 31.391 31.945 -0.554 1
1 51 . 17 1 1 A 11 11 PRO HA H 11 4.949 4.602 0.347 1
1 58 . 17 1 1 A 11 11 PRO CA C 11 61.183 61.743 -0.560 1
1 59 . 17 1 1 A 11 11 PRO CB C 11 30.656 31.764 -1.108 1
1 62 . 17 1 1 A 12 12 PRO HA H 12 4.341 4.626 -0.285 1
1 69 . 17 1 1 A 12 12 PRO C C 12 174.849 176.731 -1.882 1
1 70 . 17 1 1 A 12 12 PRO CA C 12 63.062 62.680 0.382 1
1 71 . 17 1 1 A 12 12 PRO CB C 12 31.831 31.771 0.060 1
1 74 . 17 1 1 A 13 13 ARG H H 13 7.828 8.728 -0.900 1
1 75 . 17 1 1 A 13 13 ARG HA H 13 4.536 4.519 0.017 1
1 82 . 17 1 1 A 13 13 ARG C C 13 174.608 177.125 -2.517 1
1 83 . 17 1 1 A 13 13 ARG CA C 13 54.774 56.580 -1.806 1
1 84 . 17 1 1 A 13 13 ARG CB C 13 33.250 32.954 0.296 1
1 87 . 17 1 1 A 13 13 ARG N N 13 120.532 123.200 -2.668 1
1 88 . 17 1 1 A 14 14 ALA H H 14 8.694 7.793 0.901 1
1 89 . 17 1 1 A 14 14 ALA HA H 14 3.986 4.372 -0.386 1
1 93 . 17 1 1 A 14 14 ALA C C 14 177.232 176.806 0.426 1
1 94 . 17 1 1 A 14 14 ALA CA C 14 52.461 52.202 0.259 1
1 95 . 17 1 1 A 14 14 ALA CB C 14 16.806 17.441 -0.635 1
1 96 . 17 1 1 A 14 14 ALA N N 14 121.921 120.113 1.808 1
1 97 . 17 1 1 A 15 15 LEU H H 15 8.097 7.974 0.123 1
1 98 . 17 1 1 A 15 15 LEU HA H 15 4.670 4.567 0.103 1
1 108 . 17 1 1 A 15 15 LEU C C 15 177.364 176.472 0.892 1
1 109 . 17 1 1 A 15 15 LEU CA C 15 57.543 55.240 2.303 1
1 110 . 17 1 1 A 15 15 LEU CB C 15 41.877 42.282 -0.405 1
1 114 . 17 1 1 A 15 15 LEU N N 15 122.215 120.913 1.302 1
1 115 . 17 1 1 A 16 16 THR H H 16 9.520 8.764 0.756 1
1 116 . 17 1 1 A 16 16 THR HA H 16 4.369 4.800 -0.431 1
1 121 . 17 1 1 A 16 16 THR C C 16 172.453 172.573 -0.120 1
1 122 . 17 1 1 A 16 16 THR CA C 16 62.480 61.222 1.258 1
1 123 . 17 1 1 A 16 16 THR CB C 16 72.198 72.765 -0.567 1
1 125 . 17 1 1 A 16 16 THR N N 16 122.214 120.246 1.968 1
1 126 . 17 1 1 A 17 17 LEU H H 17 8.847 8.746 0.101 1
1 127 . 17 1 1 A 17 17 LEU HA H 17 4.573 4.511 0.062 1
1 137 . 17 1 1 A 17 17 LEU C C 17 174.695 176.808 -2.113 1
1 138 . 17 1 1 A 17 17 LEU CA C 17 53.840 54.419 -0.579 1
1 139 . 17 1 1 A 17 17 LEU CB C 17 40.290 41.689 -1.399 1
1 143 . 17 1 1 A 17 17 LEU N N 17 127.415 127.088 0.327 1
1 144 . 17 1 1 A 18 18 ALA H H 18 8.647 8.301 0.346 1
1 145 . 17 1 1 A 18 18 ALA HA H 18 4.106 4.003 0.103 1
1 149 . 17 1 1 A 18 18 ALA C C 18 178.236 177.370 0.866 1
1 150 . 17 1 1 A 18 18 ALA CA C 18 53.926 54.266 -0.340 1
1 151 . 17 1 1 A 18 18 ALA CB C 18 18.876 18.907 -0.031 1
1 152 . 17 1 1 A 18 18 ALA N N 18 133.362 129.874 3.488 1
1 153 . 17 1 1 A 19 19 ALA H H 19 7.772 7.015 0.757 1
1 154 . 17 1 1 A 19 19 ALA HA H 19 4.561 4.679 -0.118 1
1 158 . 17 1 1 A 19 19 ALA C C 19 176.032 174.371 1.661 1
1 159 . 17 1 1 A 19 19 ALA CA C 19 53.011 51.685 1.326 1
1 160 . 17 1 1 A 19 19 ALA CB C 19 21.869 22.626 -0.757 1
1 161 . 17 1 1 A 19 19 ALA N N 19 115.654 116.521 -0.867 1
1 162 . 17 1 1 A 20 20 VAL H H 20 8.697 8.924 -0.227 1
1 163 . 17 1 1 A 20 20 VAL HA H 20 4.951 4.896 0.055 1
1 171 . 17 1 1 A 20 20 VAL C C 20 174.314 174.078 0.236 1
1 172 . 17 1 1 A 20 20 VAL CA C 20 61.352 60.138 1.214 1
1 173 . 17 1 1 A 20 20 VAL CB C 20 35.394 34.157 1.237 1
1 176 . 17 1 1 A 20 20 VAL N N 20 120.848 120.002 0.846 1
1 177 . 17 1 1 A 21 21 THR H H 21 9.198 8.401 0.797 1
1 178 . 17 1 1 A 21 21 THR HA H 21 4.941 4.741 0.200 1
1 183 . 17 1 1 A 21 21 THR C C 21 174.416 174.538 -0.122 1
1 184 . 17 1 1 A 21 21 THR CA C 21 60.347 58.931 1.416 1
1 185 . 17 1 1 A 21 21 THR CB C 21 68.713 71.716 -3.003 1
1 187 . 17 1 1 A 21 21 THR N N 21 120.326 125.239 -4.913 1
1 188 . 17 1 1 A 22 22 PRO HA H 22 4.634 4.555 0.079 1
1 194 . 17 1 1 A 22 22 PRO C C 22 173.606 176.417 -2.811 1
1 195 . 17 1 1 A 22 22 PRO CA C 22 66.519 64.245 2.274 1
1 196 . 17 1 1 A 22 22 PRO CB C 22 32.078 31.545 0.533 1
1 199 . 17 1 1 A 23 23 ARG H H 23 6.621 8.052 -1.431 1
1 200 . 17 1 1 A 23 23 ARG HA H 23 4.591 4.463 0.128 1
1 207 . 17 1 1 A 23 23 ARG C C 23 176.554 175.849 0.705 1
1 208 . 17 1 1 A 23 23 ARG CA C 23 53.892 56.284 -2.392 1
1 209 . 17 1 1 A 23 23 ARG CB C 23 33.498 33.274 0.224 1
1 212 . 17 1 1 A 23 23 ARG N N 23 102.938 117.055 -14.117 1
1 213 . 17 1 1 A 24 24 THR H H 24 7.352 7.975 -0.623 1
1 214 . 17 1 1 A 24 24 THR HA H 24 5.593 5.291 0.302 1
1 219 . 17 1 1 A 24 24 THR C C 24 172.345 172.266 0.079 1
1 220 . 17 1 1 A 24 24 THR CA C 24 59.311 60.633 -1.322 1
1 221 . 17 1 1 A 24 24 THR CB C 24 73.311 71.790 1.521 1
1 223 . 17 1 1 A 24 24 THR N N 24 108.792 110.271 -1.479 1
1 224 . 17 1 1 A 25 25 VAL H H 25 8.437 8.492 -0.055 1
1 225 . 17 1 1 A 25 25 VAL HA H 25 4.512 5.007 -0.495 1
1 233 . 17 1 1 A 25 25 VAL C C 25 172.854 173.985 -1.131 1
1 234 . 17 1 1 A 25 25 VAL CA C 25 61.617 60.833 0.784 1
1 235 . 17 1 1 A 25 25 VAL CB C 25 36.742 34.573 2.169 1
1 238 . 17 1 1 A 25 25 VAL N N 25 117.023 121.146 -4.123 1
1 239 . 17 1 1 A 26 26 HIS H H 26 8.915 8.598 0.317 1
1 240 . 17 1 1 A 26 26 HIS HA H 26 5.765 5.564 0.201 1
1 245 . 17 1 1 A 26 26 HIS C C 26 173.976 173.194 0.782 1
1 246 . 17 1 1 A 26 26 HIS CA C 26 52.896 53.703 -0.807 1
1 247 . 17 1 1 A 26 26 HIS CB C 26 34.004 32.935 1.069 1
1 250 . 17 1 1 A 26 26 HIS N N 26 128.155 127.426 0.729 1
1 251 . 17 1 1 A 27 27 LEU H H 27 9.034 9.490 -0.456 1
1 252 . 17 1 1 A 27 27 LEU HA H 27 5.505 5.219 0.286 1
1 262 . 17 1 1 A 27 27 LEU C C 27 174.821 174.744 0.077 1
1 263 . 17 1 1 A 27 27 LEU CA C 27 53.376 53.512 -0.136 1
1 264 . 17 1 1 A 27 27 LEU CB C 27 46.306 47.117 -0.811 1
1 268 . 17 1 1 A 27 27 LEU N N 27 128.569 130.136 -1.567 1
1 269 . 17 1 1 A 28 28 THR H H 28 8.844 8.543 0.301 1
1 270 . 17 1 1 A 28 28 THR HA H 28 4.485 4.820 -0.335 1
1 275 . 17 1 1 A 28 28 THR C C 28 172.773 173.600 -0.827 1
1 276 . 17 1 1 A 28 28 THR CA C 28 60.052 60.180 -0.128 1
1 277 . 17 1 1 A 28 28 THR CB C 28 71.704 71.427 0.277 1
1 279 . 17 1 1 A 28 28 THR N N 28 112.165 113.095 -0.930 1
1 280 . 17 1 1 A 29 29 TRP H H 29 7.395 7.857 -0.462 1
1 281 . 17 1 1 A 29 29 TRP HA H 29 4.915 5.672 -0.757 1
1 290 . 17 1 1 A 29 29 TRP C C 29 174.013 174.197 -0.184 1
1 291 . 17 1 1 A 29 29 TRP CA C 29 56.626 54.469 2.157 1
1 292 . 17 1 1 A 29 29 TRP CB C 29 29.487 32.151 -2.664 1
1 298 . 17 1 1 A 29 29 TRP N N 29 115.623 119.958 -4.335 1
1 300 . 17 1 1 A 30 30 GLN H H 30 8.759 8.472 0.287 1
1 301 . 17 1 1 A 30 30 GLN HA H 30 4.641 4.817 -0.176 1
1 308 . 17 1 1 A 30 30 GLN C C 30 175.072 174.281 0.791 1
1 309 . 17 1 1 A 30 30 GLN CA C 30 52.975 53.203 -0.228 1
1 310 . 17 1 1 A 30 30 GLN CB C 30 28.398 28.829 -0.431 1
1 312 . 17 1 1 A 30 30 GLN N N 30 117.497 119.888 -2.391 1
1 314 . 17 1 1 A 31 31 PRO HA H 31 4.487 4.769 -0.282 1
1 320 . 17 1 1 A 31 31 PRO C C 31 177.034 175.539 1.495 1
1 321 . 17 1 1 A 31 31 PRO CA C 31 62.710 62.574 0.136 1
1 322 . 17 1 1 A 31 31 PRO CB C 31 32.738 32.685 0.053 1
1 325 . 17 1 1 A 32 32 SER H H 32 8.259 8.827 -0.568 1
1 326 . 17 1 1 A 32 32 SER HA H 32 4.670 4.976 -0.306 1
1 329 . 17 1 1 A 32 32 SER C C 32 174.689 173.234 1.455 1
1 330 . 17 1 1 A 32 32 SER CA C 32 57.296 56.637 0.659 1
1 331 . 17 1 1 A 32 32 SER CB C 32 64.748 65.876 -1.128 1
1 332 . 17 1 1 A 32 32 SER N N 32 117.667 115.613 2.054 1
1 333 . 17 1 1 A 33 33 ALA H H 33 9.038 8.692 0.346 1
1 334 . 17 1 1 A 33 33 ALA HA H 33 4.126 4.405 -0.279 1
1 338 . 17 1 1 A 33 33 ALA C C 33 177.795 178.011 -0.216 1
1 339 . 17 1 1 A 33 33 ALA CA C 33 54.213 52.678 1.535 1
1 340 . 17 1 1 A 33 33 ALA CB C 33 17.948 18.513 -0.565 1
1 341 . 17 1 1 A 33 33 ALA N N 33 131.772 127.681 4.091 1
1 342 . 17 1 1 A 34 34 GLY H H 34 8.576 8.424 0.152 1
1 343 . 17 1 1 A 34 34 GLY HA2 H 34 4.171 4.032 0.139 1
1 344 . 17 1 1 A 34 34 GLY HA3 H 34 3.592 4.036 -0.444 1
1 345 . 17 1 1 A 34 34 GLY C C 34 174.182 174.449 -0.267 1
1 346 . 17 1 1 A 34 34 GLY CA C 34 44.987 45.260 -0.273 1
1 347 . 17 1 1 A 34 34 GLY N N 34 111.339 111.332 0.007 1
1 348 . 17 1 1 A 35 35 ALA H H 35 7.637 7.775 -0.138 1
1 349 . 17 1 1 A 35 35 ALA HA H 35 4.210 4.210 0.000 1
1 353 . 17 1 1 A 35 35 ALA C C 35 178.918 177.775 1.143 1
1 354 . 17 1 1 A 35 35 ALA CA C 35 52.671 52.451 0.220 1
1 355 . 17 1 1 A 35 35 ALA CB C 35 18.988 19.098 -0.110 1
1 356 . 17 1 1 A 35 35 ALA N N 35 121.531 123.513 -1.982 1
1 357 . 17 1 1 A 36 36 THR H H 36 9.428 8.924 0.504 1
1 358 . 17 1 1 A 36 36 THR HA H 36 4.402 4.429 -0.027 1
1 363 . 17 1 1 A 36 36 THR C C 36 174.739 174.244 0.495 1
1 364 . 17 1 1 A 36 36 THR CA C 36 62.692 63.064 -0.372 1
1 365 . 17 1 1 A 36 36 THR CB C 36 69.482 69.778 -0.296 1
1 367 . 17 1 1 A 36 36 THR N N 36 113.103 117.637 -4.534 1
1 368 . 17 1 1 A 37 37 HIS H H 37 7.857 7.187 0.670 1
1 369 . 17 1 1 A 37 37 HIS HA H 37 4.878 5.097 -0.219 1
1 374 . 17 1 1 A 37 37 HIS C C 37 171.103 172.065 -0.962 1
1 375 . 17 1 1 A 37 37 HIS CA C 37 55.867 53.968 1.899 1
1 376 . 17 1 1 A 37 37 HIS CB C 37 32.655 32.912 -0.257 1
1 379 . 17 1 1 A 37 37 HIS N N 37 118.486 116.646 1.840 1
1 380 . 17 1 1 A 38 38 TYR H H 38 9.217 9.139 0.078 1
1 381 . 17 1 1 A 38 38 TYR HA H 38 5.303 5.208 0.095 1
1 388 . 17 1 1 A 38 38 TYR C C 38 173.922 174.378 -0.456 1
1 389 . 17 1 1 A 38 38 TYR CA C 38 56.504 56.265 0.239 1
1 390 . 17 1 1 A 38 38 TYR CB C 38 41.823 42.557 -0.734 1
1 395 . 17 1 1 A 38 38 TYR N N 38 114.077 118.030 -3.953 1
1 396 . 17 1 1 A 39 39 LEU H H 39 9.052 8.771 0.281 1
1 397 . 17 1 1 A 39 39 LEU HA H 39 5.061 4.811 0.250 1
1 407 . 17 1 1 A 39 39 LEU C C 39 175.455 174.579 0.876 1
1 408 . 17 1 1 A 39 39 LEU CA C 39 53.855 54.140 -0.285 1
1 409 . 17 1 1 A 39 39 LEU CB C 39 45.254 43.094 2.160 1
1 413 . 17 1 1 A 39 39 LEU N N 39 123.997 125.780 -1.783 1
1 414 . 17 1 1 A 40 40 VAL H H 40 9.520 9.603 -0.083 1
1 415 . 17 1 1 A 40 40 VAL HA H 40 4.988 4.485 0.503 1
1 423 . 17 1 1 A 40 40 VAL C C 40 174.578 174.311 0.267 1
1 424 . 17 1 1 A 40 40 VAL CA C 40 60.575 61.426 -0.851 1
1 425 . 17 1 1 A 40 40 VAL CB C 40 33.284 32.075 1.209 1
1 428 . 17 1 1 A 40 40 VAL N N 40 129.678 129.335 0.343 1
1 429 . 17 1 1 A 41 41 ARG H H 41 9.096 9.185 -0.089 1
1 430 . 17 1 1 A 41 41 ARG HA H 41 5.384 4.812 0.572 1
1 437 . 17 1 1 A 41 41 ARG C C 41 175.100 174.719 0.381 1
1 438 . 17 1 1 A 41 41 ARG CA C 41 54.297 55.083 -0.786 1
1 439 . 17 1 1 A 41 41 ARG CB C 41 33.003 31.272 1.731 1
1 442 . 17 1 1 A 41 41 ARG N N 41 126.332 128.514 -2.182 1
1 443 . 17 1 1 A 42 42 CYS H H 42 9.004 9.275 -0.271 1
1 444 . 17 1 1 A 42 42 CYS HA H 42 5.309 5.077 0.232 1
1 447 . 17 1 1 A 42 42 CYS C C 42 173.417 173.812 -0.395 1
1 448 . 17 1 1 A 42 42 CYS CA C 42 57.508 57.149 0.359 1
1 449 . 17 1 1 A 42 42 CYS CB C 42 28.859 28.675 0.184 1
1 450 . 17 1 1 A 42 42 CYS N N 42 123.359 127.848 -4.489 1
1 451 . 17 1 1 A 43 43 SER H H 43 9.102 8.301 0.801 1
1 452 . 17 1 1 A 43 43 SER HA H 43 5.324 5.000 0.324 1
1 455 . 17 1 1 A 43 43 SER C C 43 171.429 171.664 -0.235 1
1 456 . 17 1 1 A 43 43 SER CA C 43 55.621 55.699 -0.078 1
1 457 . 17 1 1 A 43 43 SER CB C 43 64.856 66.027 -1.171 1
1 458 . 17 1 1 A 43 43 SER N N 43 125.444 122.823 2.621 1
1 459 . 17 1 1 A 44 44 PRO HA H 44 4.389 4.629 -0.240 1
1 466 . 17 1 1 A 44 44 PRO C C 44 176.559 177.017 -0.458 1
1 467 . 17 1 1 A 44 44 PRO CA C 44 63.027 63.083 -0.056 1
1 468 . 17 1 1 A 44 44 PRO CB C 44 31.935 32.891 -0.956 1
1 471 . 17 1 1 A 45 45 ALA H H 45 8.261 8.438 -0.177 1
1 472 . 17 1 1 A 45 45 ALA HA H 45 4.157 4.156 0.001 1
1 476 . 17 1 1 A 45 45 ALA C C 45 177.706 177.075 0.631 1
1 477 . 17 1 1 A 45 45 ALA CA C 45 53.284 54.447 -1.163 1
1 478 . 17 1 1 A 45 45 ALA CB C 45 18.978 19.362 -0.384 1
1 479 . 17 1 1 A 45 45 ALA N N 45 126.162 123.791 2.371 1
1 480 . 17 1 1 A 46 46 SER H H 46 8.275 7.621 0.654 1
1 481 . 17 1 1 A 46 46 SER HA H 46 4.779 4.689 0.090 1
1 484 . 17 1 1 A 46 46 SER C C 46 172.182 174.056 -1.874 1
1 485 . 17 1 1 A 46 46 SER CA C 46 55.091 55.356 -0.265 1
1 486 . 17 1 1 A 46 46 SER CB C 46 63.130 64.405 -1.275 1
1 487 . 17 1 1 A 46 46 SER N N 46 113.009 114.758 -1.749 1
1 488 . 17 1 1 A 47 47 PRO HA H 47 4.336 4.485 -0.149 1
1 493 . 17 1 1 A 47 47 PRO C C 47 177.165 177.573 -0.408 1
1 494 . 17 1 1 A 47 47 PRO CA C 47 63.268 64.070 -0.802 1
1 495 . 17 1 1 A 47 47 PRO CB C 47 32.528 31.657 0.871 1
1 498 . 17 1 1 A 48 48 LYS H H 48 9.089 8.031 1.058 1
1 499 . 17 1 1 A 48 48 LYS HA H 48 4.408 4.413 -0.005 1
1 508 . 17 1 1 A 48 48 LYS C C 48 176.917 175.220 1.697 1
1 509 . 17 1 1 A 48 48 LYS CA C 48 55.893 55.353 0.540 1
1 510 . 17 1 1 A 48 48 LYS CB C 48 32.997 30.990 2.007 1
1 514 . 17 1 1 A 48 48 LYS N N 48 122.579 117.396 5.183 1
1 515 . 17 1 1 A 49 49 GLY HA2 H 49 4.021 4.401 -0.380 1
1 516 . 17 1 1 A 49 49 GLY HA3 H 49 3.881 4.404 -0.523 1
1 517 . 17 1 1 A 49 49 GLY C C 49 174.552 174.393 0.159 1
1 518 . 17 1 1 A 49 49 GLY CA C 49 46.011 44.569 1.442 1
1 519 . 17 1 1 A 50 50 GLU H H 50 8.608 8.996 -0.388 1
1 520 . 17 1 1 A 50 50 GLU HA H 50 4.335 4.132 0.203 1
1 525 . 17 1 1 A 50 50 GLU C C 50 176.672 177.377 -0.705 1
1 526 . 17 1 1 A 50 50 GLU CA C 50 56.978 58.693 -1.715 1
1 527 . 17 1 1 A 50 50 GLU CB C 50 29.458 30.033 -0.575 1
1 529 . 17 1 1 A 50 50 GLU N N 50 121.378 121.889 -0.511 1
1 530 . 17 1 1 A 51 51 GLU H H 51 8.287 7.899 0.388 1
1 531 . 17 1 1 A 51 51 GLU HA H 51 4.381 4.342 0.039 1
1 536 . 17 1 1 A 51 51 GLU C C 51 176.218 176.590 -0.372 1
1 537 . 17 1 1 A 51 51 GLU CA C 51 56.996 57.248 -0.252 1
1 538 . 17 1 1 A 51 51 GLU CB C 51 31.066 30.154 0.912 1
1 540 . 17 1 1 A 51 51 GLU N N 51 120.863 119.047 1.816 1
1 541 . 17 1 1 A 52 52 GLU H H 52 8.445 8.353 0.092 1
1 542 . 17 1 1 A 52 52 GLU HA H 52 4.464 4.607 -0.143 1
1 547 . 17 1 1 A 52 52 GLU C C 52 176.128 176.005 0.123 1
1 548 . 17 1 1 A 52 52 GLU CA C 52 55.955 54.623 1.332 1
1 549 . 17 1 1 A 52 52 GLU CB C 52 31.691 30.522 1.169 1
1 551 . 17 1 1 A 52 52 GLU N N 52 121.103 121.027 0.076 1
1 552 . 17 1 1 A 53 53 GLU H H 53 8.441 8.468 -0.027 1
1 553 . 17 1 1 A 53 53 GLU HA H 53 4.609 4.491 0.118 1
1 558 . 17 1 1 A 53 53 GLU C C 53 175.816 175.342 0.474 1
1 559 . 17 1 1 A 53 53 GLU CA C 53 56.697 56.387 0.310 1
1 560 . 17 1 1 A 53 53 GLU CB C 53 31.022 30.610 0.412 1
1 562 . 17 1 1 A 53 53 GLU N N 53 121.949 120.996 0.953 1
1 563 . 17 1 1 A 54 54 ARG H H 54 8.569 8.613 -0.044 1
1 564 . 17 1 1 A 54 54 ARG HA H 54 4.768 4.855 -0.087 1
1 571 . 17 1 1 A 54 54 ARG C C 54 174.881 174.327 0.554 1
1 572 . 17 1 1 A 54 54 ARG CA C 54 54.950 54.565 0.385 1
1 573 . 17 1 1 A 54 54 ARG CB C 54 33.374 32.131 1.243 1
1 576 . 17 1 1 A 54 54 ARG N N 54 123.714 126.387 -2.673 1
1 577 . 17 1 1 A 55 55 GLU H H 55 8.650 9.061 -0.411 1
1 578 . 17 1 1 A 55 55 GLU HA H 55 5.493 4.953 0.540 1
1 583 . 17 1 1 A 55 55 GLU C C 55 175.566 175.873 -0.307 1
1 584 . 17 1 1 A 55 55 GLU CA C 55 54.915 55.486 -0.571 1
1 585 . 17 1 1 A 55 55 GLU CB C 55 33.250 31.740 1.510 1
1 587 . 17 1 1 A 55 55 GLU N N 55 123.537 128.696 -5.159 1
1 588 . 17 1 1 A 56 56 VAL H H 56 9.419 8.939 0.480 1
1 589 . 17 1 1 A 56 56 VAL HA H 56 4.524 4.988 -0.464 1
1 597 . 17 1 1 A 56 56 VAL C C 56 173.502 174.637 -1.135 1
1 598 . 17 1 1 A 56 56 VAL CA C 56 60.981 58.789 2.192 1
1 599 . 17 1 1 A 56 56 VAL CB C 56 36.117 36.118 -0.001 1
1 602 . 17 1 1 A 56 56 VAL N N 56 123.343 120.062 3.281 1
1 603 . 17 1 1 A 57 57 GLN H H 57 8.767 8.727 0.040 1
1 604 . 17 1 1 A 57 57 GLN HA H 57 5.671 5.354 0.317 1
1 611 . 17 1 1 A 57 57 GLN C C 57 176.357 174.785 1.572 1
1 612 . 17 1 1 A 57 57 GLN CA C 57 54.735 54.302 0.433 1
1 613 . 17 1 1 A 57 57 GLN CB C 57 30.781 31.751 -0.970 1
1 615 . 17 1 1 A 57 57 GLN N N 57 125.639 120.597 5.042 1
1 617 . 17 1 1 A 58 58 VAL H H 58 9.217 8.822 0.395 1
1 618 . 17 1 1 A 58 58 VAL HA H 58 5.129 4.868 0.261 1
1 626 . 17 1 1 A 58 58 VAL C C 58 175.925 176.527 -0.602 1
1 627 . 17 1 1 A 58 58 VAL CA C 58 59.652 59.721 -0.069 1
1 628 . 17 1 1 A 58 58 VAL CB C 58 36.540 34.788 1.752 1
1 631 . 17 1 1 A 58 58 VAL N N 58 117.022 118.319 -1.297 1
1 632 . 17 1 1 A 59 59 GLY H H 59 9.008 8.763 0.245 1
1 633 . 17 1 1 A 59 59 GLY HA2 H 59 4.670 3.951 0.719 1
1 634 . 17 1 1 A 59 59 GLY HA3 H 59 3.914 4.025 -0.111 1
1 635 . 17 1 1 A 59 59 GLY C C 59 173.386 174.204 -0.818 1
1 636 . 17 1 1 A 59 59 GLY CA C 59 45.093 45.514 -0.421 1
1 637 . 17 1 1 A 59 59 GLY N N 59 109.174 110.736 -1.562 1
1 638 . 17 1 1 A 60 60 ARG H H 60 7.695 7.531 0.164 1
1 639 . 17 1 1 A 60 60 ARG HA H 60 4.866 4.981 -0.115 1
1 645 . 17 1 1 A 60 60 ARG C C 60 173.760 175.399 -1.639 1
1 646 . 17 1 1 A 60 60 ARG CA C 60 52.764 53.360 -0.596 1
1 647 . 17 1 1 A 60 60 ARG CB C 60 31.785 32.809 -1.024 1
1 650 . 17 1 1 A 60 60 ARG N N 60 118.520 116.978 1.542 1
1 651 . 17 1 1 A 61 61 PRO HA H 61 3.539 3.796 -0.257 1
1 658 . 17 1 1 A 61 61 PRO C C 61 173.175 173.763 -0.588 1
1 659 . 17 1 1 A 61 61 PRO CA C 61 62.265 62.838 -0.573 1
1 660 . 17 1 1 A 61 61 PRO CB C 61 27.546 30.701 -3.155 1
1 663 . 17 1 1 A 62 62 GLU H H 62 7.879 7.562 0.317 1
1 664 . 17 1 1 A 62 62 GLU HA H 62 4.071 4.730 -0.659 1
1 669 . 17 1 1 A 62 62 GLU C C 62 174.107 174.612 -0.505 1
1 670 . 17 1 1 A 62 62 GLU CA C 62 55.229 54.337 0.892 1
1 671 . 17 1 1 A 62 62 GLU CB C 62 32.838 32.059 0.779 1
1 673 . 17 1 1 A 62 62 GLU N N 62 118.173 113.859 4.314 1
1 674 . 17 1 1 A 63 63 VAL H H 63 8.930 8.663 0.267 1
1 675 . 17 1 1 A 63 63 VAL HA H 63 4.548 5.049 -0.501 1
1 683 . 17 1 1 A 63 63 VAL C C 63 170.325 173.312 -2.987 1
1 684 . 17 1 1 A 63 63 VAL CA C 63 60.770 59.413 1.357 1
1 685 . 17 1 1 A 63 63 VAL CB C 63 35.394 35.570 -0.176 1
1 688 . 17 1 1 A 63 63 VAL N N 63 117.161 123.302 -6.141 1
1 689 . 17 1 1 A 64 64 LEU H H 64 8.332 8.750 -0.418 1
1 690 . 17 1 1 A 64 64 LEU HA H 64 5.122 5.067 0.055 1
1 700 . 17 1 1 A 64 64 LEU C C 64 176.243 174.717 1.526 1
1 701 . 17 1 1 A 64 64 LEU CA C 64 53.346 53.791 -0.445 1
1 702 . 17 1 1 A 64 64 LEU CB C 64 42.649 45.009 -2.360 1
1 706 . 17 1 1 A 64 64 LEU N N 64 130.510 128.074 2.436 1
1 707 . 17 1 1 A 65 65 LEU H H 65 9.261 9.292 -0.031 1
1 708 . 17 1 1 A 65 65 LEU HA H 65 4.443 4.725 -0.282 1
1 718 . 17 1 1 A 65 65 LEU C C 65 174.016 176.181 -2.165 1
1 719 . 17 1 1 A 65 65 LEU CA C 65 53.920 54.095 -0.175 1
1 720 . 17 1 1 A 65 65 LEU CB C 65 42.976 41.017 1.959 1
1 724 . 17 1 1 A 65 65 LEU N N 65 128.611 128.686 -0.075 1
1 725 . 17 1 1 A 66 66 ASP H H 66 8.105 8.671 -0.566 1
1 726 . 17 1 1 A 66 66 ASP HA H 66 5.207 4.661 0.546 1
1 729 . 17 1 1 A 66 66 ASP C C 66 176.161 176.563 -0.402 1
1 730 . 17 1 1 A 66 66 ASP CA C 66 51.001 54.651 -3.650 1
1 731 . 17 1 1 A 66 66 ASP CB C 66 42.836 40.961 1.875 1
1 732 . 17 1 1 A 66 66 ASP N N 66 121.799 125.912 -4.113 1
1 733 . 17 1 1 A 67 67 GLY H H 67 8.688 8.480 0.208 1
1 734 . 17 1 1 A 67 67 GLY HA2 H 67 3.923 3.960 -0.037 1
1 735 . 17 1 1 A 67 67 GLY HA3 H 67 3.808 3.967 -0.159 1
1 736 . 17 1 1 A 67 67 GLY C C 67 175.500 174.267 1.233 1
1 737 . 17 1 1 A 67 67 GLY CA C 67 46.591 46.729 -0.138 1
1 738 . 17 1 1 A 67 67 GLY N N 67 106.518 110.997 -4.479 1
1 739 . 17 1 1 A 68 68 LEU H H 68 8.125 7.765 0.360 1
1 740 . 17 1 1 A 68 68 LEU HA H 68 4.252 4.905 -0.653 1
1 750 . 17 1 1 A 68 68 LEU C C 68 174.914 175.323 -0.409 1
1 751 . 17 1 1 A 68 68 LEU CA C 68 53.469 53.185 0.284 1
1 752 . 17 1 1 A 68 68 LEU CB C 68 40.422 45.993 -5.571 1
1 756 . 17 1 1 A 68 68 LEU N N 68 119.345 119.854 -0.509 1
1 757 . 17 1 1 A 69 69 GLU H H 69 8.207 8.725 -0.518 1
1 758 . 17 1 1 A 69 69 GLU HA H 69 4.908 4.849 0.059 1
1 763 . 17 1 1 A 69 69 GLU C C 69 174.464 174.244 0.220 1
1 764 . 17 1 1 A 69 69 GLU CA C 69 53.081 53.065 0.016 1
1 765 . 17 1 1 A 69 69 GLU CB C 69 31.538 30.886 0.652 1
1 767 . 17 1 1 A 69 69 GLU N N 69 119.486 120.734 -1.248 1
1 768 . 17 1 1 A 70 70 PRO HA H 70 4.866 4.332 0.534 1
1 775 . 17 1 1 A 70 70 PRO C C 70 178.285 177.526 0.759 1
1 776 . 17 1 1 A 70 70 PRO CA C 70 63.203 63.647 -0.444 1
1 777 . 17 1 1 A 70 70 PRO CB C 70 33.726 31.765 1.961 1
1 780 . 17 1 1 A 71 71 GLY H H 71 7.362 8.694 -1.332 1
1 781 . 17 1 1 A 71 71 GLY HA2 H 71 3.807 3.919 -0.112 1
1 782 . 17 1 1 A 71 71 GLY HA3 H 71 3.756 3.921 -0.165 1
1 783 . 17 1 1 A 71 71 GLY C C 71 174.664 173.886 0.778 1
1 784 . 17 1 1 A 71 71 GLY CA C 71 46.926 46.594 0.332 1
1 785 . 17 1 1 A 71 71 GLY N N 71 113.776 111.713 2.063 1
1 786 . 17 1 1 A 72 72 ARG H H 72 8.036 7.309 0.727 1
1 787 . 17 1 1 A 72 72 ARG HA H 72 4.597 4.760 -0.163 1
1 793 . 17 1 1 A 72 72 ARG C C 72 173.293 173.692 -0.399 1
1 794 . 17 1 1 A 72 72 ARG CA C 72 54.633 54.438 0.195 1
1 795 . 17 1 1 A 72 72 ARG CB C 72 33.704 33.322 0.382 1
1 798 . 17 1 1 A 72 72 ARG N N 72 119.611 119.660 -0.049 1
1 799 . 17 1 1 A 73 73 ASP H H 73 7.785 8.716 -0.931 1
1 800 . 17 1 1 A 73 73 ASP HA H 73 5.276 4.994 0.282 1
1 803 . 17 1 1 A 73 73 ASP C C 73 175.904 174.660 1.244 1
1 804 . 17 1 1 A 73 73 ASP CA C 73 53.568 53.126 0.442 1
1 805 . 17 1 1 A 73 73 ASP CB C 73 42.970 42.661 0.309 1
1 806 . 17 1 1 A 73 73 ASP N N 73 118.900 126.349 -7.449 1
1 807 . 17 1 1 A 74 74 TYR H H 74 9.516 8.910 0.606 1
1 808 . 17 1 1 A 74 74 TYR HA H 74 4.800 5.044 -0.244 1
1 815 . 17 1 1 A 74 74 TYR C C 74 174.631 174.967 -0.336 1
1 816 . 17 1 1 A 74 74 TYR CA C 74 58.548 56.275 2.273 1
1 817 . 17 1 1 A 74 74 TYR CB C 74 42.029 42.276 -0.247 1
1 822 . 17 1 1 A 74 74 TYR N N 74 121.903 125.616 -3.713 1
1 823 . 17 1 1 A 75 75 GLU H H 75 9.248 9.203 0.045 1
1 824 . 17 1 1 A 75 75 GLU HA H 75 4.756 4.863 -0.107 1
1 829 . 17 1 1 A 75 75 GLU C C 75 175.524 175.488 0.036 1
1 830 . 17 1 1 A 75 75 GLU CA C 75 55.621 55.647 -0.026 1
1 831 . 17 1 1 A 75 75 GLU CB C 75 30.778 30.787 -0.009 1
1 833 . 17 1 1 A 75 75 GLU N N 75 122.425 123.186 -0.761 1
1 834 . 17 1 1 A 76 76 VAL H H 76 8.884 8.857 0.027 1
1 835 . 17 1 1 A 76 76 VAL HA H 76 5.246 4.854 0.392 1
1 843 . 17 1 1 A 76 76 VAL C C 76 174.800 175.156 -0.356 1
1 844 . 17 1 1 A 76 76 VAL CA C 76 60.199 61.320 -1.121 1
1 845 . 17 1 1 A 76 76 VAL CB C 76 33.449 33.022 0.427 1
1 848 . 17 1 1 A 76 76 VAL N N 76 126.853 126.890 -0.037 1
1 849 . 17 1 1 A 77 77 SER H H 77 9.234 9.018 0.216 1
1 850 . 17 1 1 A 77 77 SER HA H 77 5.398 5.059 0.339 1
1 853 . 17 1 1 A 77 77 SER C C 77 173.138 173.670 -0.532 1
1 854 . 17 1 1 A 77 77 SER CA C 77 56.032 57.700 -1.668 1
1 855 . 17 1 1 A 77 77 SER CB C 77 66.374 64.161 2.213 1
1 856 . 17 1 1 A 77 77 SER N N 77 120.852 125.331 -4.479 1
1 857 . 17 1 1 A 78 78 VAL H H 78 9.092 8.737 0.355 1
1 858 . 17 1 1 A 78 78 VAL HA H 78 4.756 4.415 0.341 1
1 866 . 17 1 1 A 78 78 VAL C C 78 173.641 174.109 -0.468 1
1 867 . 17 1 1 A 78 78 VAL CA C 78 61.246 60.883 0.363 1
1 868 . 17 1 1 A 78 78 VAL CB C 78 34.467 32.355 2.112 1
1 871 . 17 1 1 A 78 78 VAL N N 78 122.453 127.111 -4.658 1
1 872 . 17 1 1 A 79 79 GLN H H 79 8.587 8.632 -0.045 1
1 873 . 17 1 1 A 79 79 GLN HA H 79 4.438 5.071 -0.633 1
1 880 . 17 1 1 A 79 79 GLN C C 79 174.999 174.761 0.238 1
1 881 . 17 1 1 A 79 79 GLN CA C 79 54.227 53.877 0.350 1
1 882 . 17 1 1 A 79 79 GLN CB C 79 33.587 32.372 1.215 1
1 884 . 17 1 1 A 79 79 GLN N N 79 125.619 127.912 -2.293 1
1 886 . 17 1 1 A 80 80 SER H H 80 8.623 8.662 -0.039 1
1 887 . 17 1 1 A 80 80 SER HA H 80 4.756 4.943 -0.187 1
1 890 . 17 1 1 A 80 80 SER C C 80 172.264 173.681 -1.417 1
1 891 . 17 1 1 A 80 80 SER CA C 80 58.177 57.363 0.814 1
1 892 . 17 1 1 A 80 80 SER CB C 80 63.920 64.092 -0.172 1
1 893 . 17 1 1 A 80 80 SER N N 80 122.844 119.837 3.007 1
1 894 . 17 1 1 A 81 81 LEU H H 81 8.348 8.676 -0.328 1
1 895 . 17 1 1 A 81 81 LEU HA H 81 5.124 4.709 0.415 1
1 905 . 17 1 1 A 81 81 LEU C C 81 175.775 176.105 -0.330 1
1 906 . 17 1 1 A 81 81 LEU CA C 81 54.033 52.868 1.165 1
1 907 . 17 1 1 A 81 81 LEU CB C 81 44.690 44.027 0.663 1
1 911 . 17 1 1 A 81 81 LEU N N 81 123.191 126.836 -3.645 1
1 912 . 17 1 1 A 82 82 ARG H H 82 8.374 8.888 -0.514 1
1 913 . 17 1 1 A 82 82 ARG HA H 82 4.616 4.591 0.025 1
1 919 . 17 1 1 A 82 82 ARG C C 82 176.864 175.843 1.021 1
1 920 . 17 1 1 A 82 82 ARG CA C 82 55.868 56.780 -0.912 1
1 921 . 17 1 1 A 82 82 ARG CB C 82 32.322 33.470 -1.148 1
1 924 . 17 1 1 A 82 82 ARG N N 82 121.029 124.850 -3.821 1
1 925 . 17 1 1 A 83 83 GLY H H 83 8.309 8.057 0.252 1
1 926 . 17 1 1 A 83 83 GLY HA2 H 83 4.031 4.140 -0.109 1
1 927 . 17 1 1 A 83 83 GLY HA3 H 83 3.888 4.151 -0.263 1
1 928 . 17 1 1 A 83 83 GLY C C 83 174.562 174.397 0.165 1
1 929 . 17 1 1 A 83 83 GLY CA C 83 45.963 44.937 1.026 1
1 930 . 17 1 1 A 83 83 GLY N N 83 109.937 107.204 2.733 1
1 931 . 17 1 1 A 84 84 PRO HA H 84 4.573 4.476 0.097 1
1 938 . 17 1 1 A 84 84 PRO C C 84 176.533 175.637 0.896 1
1 939 . 17 1 1 A 84 84 PRO CA C 84 63.485 64.054 -0.569 1
1 940 . 17 1 1 A 84 84 PRO CB C 84 32.409 32.081 0.328 1
1 943 . 17 1 1 A 85 85 GLU H H 85 7.799 7.525 0.274 1
1 944 . 17 1 1 A 85 85 GLU HA H 85 4.369 4.880 -0.511 1
1 949 . 17 1 1 A 85 85 GLU C C 85 174.722 175.718 -0.996 1
1 950 . 17 1 1 A 85 85 GLU CA C 85 55.899 54.918 0.981 1
1 951 . 17 1 1 A 85 85 GLU CB C 85 31.911 32.984 -1.073 1
1 953 . 17 1 1 A 85 85 GLU N N 85 122.093 112.844 9.249 1
1 954 . 17 1 1 A 86 86 GLY H H 86 8.329 8.806 -0.477 1
1 955 . 17 1 1 A 86 86 GLY HA2 H 86 5.298 4.250 1.048 1
1 956 . 17 1 1 A 86 86 GLY HA3 H 86 3.559 4.255 -0.696 1
1 957 . 17 1 1 A 86 86 GLY C C 86 174.355 173.337 1.018 1
1 958 . 17 1 1 A 86 86 GLY CA C 86 44.034 43.751 0.283 1
1 959 . 17 1 1 A 86 86 GLY N N 86 109.387 108.828 0.559 1
1 960 . 17 1 1 A 87 87 SER H H 87 8.807 8.635 0.172 1
1 961 . 17 1 1 A 87 87 SER HA H 87 4.670 4.556 0.114 1
1 964 . 17 1 1 A 87 87 SER C C 87 175.195 174.329 0.866 1
1 965 . 17 1 1 A 87 87 SER CA C 87 57.737 57.948 -0.211 1
1 966 . 17 1 1 A 87 87 SER CB C 87 67.829 65.476 2.353 1
1 967 . 17 1 1 A 87 87 SER N N 87 117.698 113.128 4.570 1
1 968 . 17 1 1 A 88 88 GLU H H 88 8.754 8.628 0.126 1
1 969 . 17 1 1 A 88 88 GLU HA H 88 4.357 4.297 0.060 1
1 974 . 17 1 1 A 88 88 GLU C C 88 177.474 176.357 1.117 1
1 975 . 17 1 1 A 88 88 GLU CA C 88 57.525 57.120 0.405 1
1 976 . 17 1 1 A 88 88 GLU CB C 88 31.162 30.611 0.551 1
1 978 . 17 1 1 A 88 88 GLU N N 88 118.709 120.584 -1.875 1
1 979 . 17 1 1 A 89 89 ALA H H 89 8.855 8.484 0.371 1
1 980 . 17 1 1 A 89 89 ALA HA H 89 4.792 4.916 -0.124 1
1 984 . 17 1 1 A 89 89 ALA C C 89 178.379 176.541 1.838 1
1 985 . 17 1 1 A 89 89 ALA CA C 89 51.264 51.002 0.262 1
1 986 . 17 1 1 A 89 89 ALA CB C 89 20.040 20.254 -0.214 1
1 987 . 17 1 1 A 89 89 ALA N N 89 127.301 123.520 3.781 1
1 988 . 17 1 1 A 90 90 ARG H H 90 8.549 8.439 0.110 1
1 989 . 17 1 1 A 90 90 ARG HA H 90 4.658 4.985 -0.327 1
1 996 . 17 1 1 A 90 90 ARG C C 90 174.720 175.391 -0.671 1
1 997 . 17 1 1 A 90 90 ARG CA C 90 53.575 54.324 -0.749 1
1 998 . 17 1 1 A 90 90 ARG CB C 90 33.456 31.698 1.758 1
1 1001 . 17 1 1 A 90 90 ARG N N 90 121.289 123.366 -2.077 1
1 1002 . 17 1 1 A 91 91 GLY H H 91 8.396 9.046 -0.650 1
1 1003 . 17 1 1 A 91 91 GLY HA2 H 91 5.306 4.166 1.140 1
1 1004 . 17 1 1 A 91 91 GLY HA3 H 91 3.700 4.202 -0.502 1
1 1005 . 17 1 1 A 91 91 GLY C C 91 173.191 172.027 1.164 1
1 1006 . 17 1 1 A 91 91 GLY CA C 91 44.493 43.834 0.659 1
1 1007 . 17 1 1 A 91 91 GLY N N 91 108.579 112.048 -3.469 1
1 1008 . 17 1 1 A 92 92 ILE H H 92 8.891 8.374 0.517 1
1 1009 . 17 1 1 A 92 92 ILE HA H 92 4.499 4.974 -0.475 1
1 1019 . 17 1 1 A 92 92 ILE C C 92 171.877 173.977 -2.100 1
1 1020 . 17 1 1 A 92 92 ILE CA C 92 60.682 59.168 1.514 1
1 1021 . 17 1 1 A 92 92 ILE CB C 92 42.425 42.136 0.289 1
1 1025 . 17 1 1 A 92 92 ILE N N 92 118.313 121.346 -3.033 1
1 1026 . 17 1 1 A 93 93 ARG H H 93 7.980 8.460 -0.480 1
1 1027 . 17 1 1 A 93 93 ARG HA H 93 5.224 4.461 0.763 1
1 1034 . 17 1 1 A 93 93 ARG C C 93 175.072 175.426 -0.354 1
1 1035 . 17 1 1 A 93 93 ARG CA C 93 54.499 56.727 -2.228 1
1 1036 . 17 1 1 A 93 93 ARG CB C 93 31.767 30.558 1.209 1
1 1039 . 17 1 1 A 93 93 ARG N N 93 124.879 130.108 -5.229 1
1 1040 . 17 1 1 A 94 94 ALA H H 94 9.064 8.506 0.558 1
1 1041 . 17 1 1 A 94 94 ALA HA H 94 4.731 5.500 -0.769 1
1 1045 . 17 1 1 A 94 94 ALA C C 94 174.494 176.463 -1.969 1
1 1046 . 17 1 1 A 94 94 ALA CA C 94 50.577 50.182 0.395 1
1 1047 . 17 1 1 A 94 94 ALA CB C 94 23.082 22.526 0.556 1
1 1048 . 17 1 1 A 94 94 ALA N N 94 126.095 129.583 -3.488 1
1 1049 . 17 1 1 A 95 95 ARG H H 95 8.263 9.104 -0.841 1
1 1050 . 17 1 1 A 95 95 ARG HA H 95 5.548 5.212 0.336 1
1 1058 . 17 1 1 A 95 95 ARG C C 95 176.901 174.409 2.492 1
1 1059 . 17 1 1 A 95 95 ARG CA C 95 53.787 54.172 -0.385 1
1 1060 . 17 1 1 A 95 95 ARG CB C 95 32.426 34.653 -2.227 1
1 1063 . 17 1 1 A 95 95 ARG N N 95 123.374 118.613 4.761 1
1 1065 . 17 1 1 A 96 96 THR H H 96 9.208 8.775 0.433 1
1 1066 . 17 1 1 A 96 96 THR HA H 96 4.461 5.070 -0.609 1
1 1071 . 17 1 1 A 96 96 THR CA C 96 58.248 58.386 -0.138 1
1 1072 . 17 1 1 A 96 96 THR CB C 96 68.466 71.076 -2.610 1
1 1074 . 17 1 1 A 96 96 THR N N 96 119.492 111.788 7.704 1
1 1075 . 17 1 1 A 97 97 PRO HA H 97 4.636 4.608 0.028 1
1 1082 . 17 1 1 A 97 97 PRO C C 97 175.725 175.644 0.081 1
1 1083 . 17 1 1 A 97 97 PRO CA C 97 61.907 62.338 -0.431 1
1 1084 . 17 1 1 A 97 97 PRO CB C 97 32.590 33.432 -0.842 1
1 1087 . 17 1 1 A 98 98 THR H H 98 7.943 8.316 -0.373 1
1 1088 . 17 1 1 A 98 98 THR HA H 98 4.208 5.077 -0.869 1
1 1093 . 17 1 1 A 98 98 THR C C 98 175.058 172.818 2.240 1
1 1094 . 17 1 1 A 98 98 THR CA C 98 62.069 60.153 1.916 1
1 1095 . 17 1 1 A 98 98 THR CB C 98 69.719 70.100 -0.381 1
1 1097 . 17 1 1 A 98 98 THR N N 98 107.148 110.496 -3.348 1
1 1098 . 17 1 1 A 99 99 SER H H 99 8.163 9.021 -0.858 1
1 1099 . 17 1 1 A 99 99 SER HA H 99 4.524 4.611 -0.087 1
1 1102 . 17 1 1 A 99 99 SER C C 99 174.319 173.916 0.403 1
1 1103 . 17 1 1 A 99 99 SER CA C 99 58.107 59.270 -1.163 1
1 1104 . 17 1 1 A 99 99 SER CB C 99 64.492 63.389 1.103 1
1 1105 . 17 1 1 A 99 99 SER N N 99 115.114 123.927 -8.813 1
1 1106 . 17 1 1 A 100 100 GLY H H 100 8.336 8.401 -0.065 1
1 1107 . 17 1 1 A 100 100 GLY HA2 H 100 4.222 4.251 -0.029 1
1 1108 . 17 1 1 A 100 100 GLY HA3 H 100 4.222 4.252 -0.030 1
1 1109 . 17 1 1 A 100 100 GLY C C 100 171.696 174.025 -2.329 1
1 1110 . 17 1 1 A 100 100 GLY CA C 100 44.617 44.717 -0.100 1
1 1111 . 17 1 1 A 100 100 GLY N N 100 110.678 113.106 -2.428 1
1 1112 . 17 1 1 A 101 101 PRO HA H 101 4.506 4.507 -0.001 1
1 1118 . 17 1 1 A 101 101 PRO CA C 101 63.358 64.019 -0.661 1
1 1119 . 17 1 1 A 101 101 PRO CB C 101 32.313 31.699 0.614 1
1 1 . 18 1 1 A 6 6 SER HA H 6 4.528 4.945 -0.417 1
1 3 . 18 1 1 A 6 6 SER CA C 6 58.373 57.391 0.982 1
1 4 . 18 1 1 A 6 6 SER CB C 6 63.978 65.156 -1.178 1
1 5 . 18 1 1 A 7 7 GLY H H 7 8.228 8.117 0.111 1
1 6 . 18 1 1 A 7 7 GLY HA2 H 7 4.134 4.099 0.035 1
1 7 . 18 1 1 A 7 7 GLY HA3 H 7 4.134 4.100 0.034 1
1 8 . 18 1 1 A 7 7 GLY CA C 7 44.607 46.015 -1.408 1
1 9 . 18 1 1 A 7 7 GLY N N 7 110.638 107.727 2.911 1
1 10 . 18 1 1 A 8 8 PRO HA H 8 4.419 4.554 -0.135 1
1 17 . 18 1 1 A 8 8 PRO C C 8 176.908 176.804 0.104 1
1 18 . 18 1 1 A 8 8 PRO CA C 8 62.851 62.419 0.432 1
1 19 . 18 1 1 A 8 8 PRO CB C 8 32.243 33.059 -0.816 1
1 22 . 18 1 1 A 9 9 LEU H H 9 8.462 8.361 0.101 1
1 23 . 18 1 1 A 9 9 LEU HA H 9 4.494 4.541 -0.047 1
1 33 . 18 1 1 A 9 9 LEU C C 9 174.124 175.862 -1.738 1
1 34 . 18 1 1 A 9 9 LEU CA C 9 52.587 53.426 -0.839 1
1 35 . 18 1 1 A 9 9 LEU CB C 9 43.150 41.900 1.250 1
1 39 . 18 1 1 A 9 9 LEU N N 9 126.015 120.241 5.774 1
1 40 . 18 1 1 A 10 10 PRO HA H 10 4.820 4.656 0.164 1
1 47 . 18 1 1 A 10 10 PRO CA C 10 61.368 62.579 -1.211 1
1 48 . 18 1 1 A 10 10 PRO CB C 10 31.391 31.688 -0.297 1
1 51 . 18 1 1 A 11 11 PRO HA H 11 4.949 4.611 0.338 1
1 58 . 18 1 1 A 11 11 PRO CA C 11 61.183 61.785 -0.602 1
1 59 . 18 1 1 A 11 11 PRO CB C 11 30.656 31.930 -1.274 1
1 62 . 18 1 1 A 12 12 PRO HA H 12 4.341 4.650 -0.309 1
1 69 . 18 1 1 A 12 12 PRO C C 12 174.849 176.910 -2.061 1
1 70 . 18 1 1 A 12 12 PRO CA C 12 63.062 62.721 0.341 1
1 71 . 18 1 1 A 12 12 PRO CB C 12 31.831 31.581 0.250 1
1 74 . 18 1 1 A 13 13 ARG H H 13 7.828 8.363 -0.535 1
1 75 . 18 1 1 A 13 13 ARG HA H 13 4.536 4.485 0.051 1
1 82 . 18 1 1 A 13 13 ARG C C 13 174.608 176.344 -1.736 1
1 83 . 18 1 1 A 13 13 ARG CA C 13 54.774 56.686 -1.912 1
1 84 . 18 1 1 A 13 13 ARG CB C 13 33.250 31.709 1.541 1
1 87 . 18 1 1 A 13 13 ARG N N 13 120.532 120.052 0.480 1
1 88 . 18 1 1 A 14 14 ALA H H 14 8.694 7.635 1.059 1
1 89 . 18 1 1 A 14 14 ALA HA H 14 3.986 4.393 -0.407 1
1 93 . 18 1 1 A 14 14 ALA C C 14 177.232 176.668 0.564 1
1 94 . 18 1 1 A 14 14 ALA CA C 14 52.461 51.612 0.849 1
1 95 . 18 1 1 A 14 14 ALA CB C 14 16.806 17.203 -0.397 1
1 96 . 18 1 1 A 14 14 ALA N N 14 121.921 121.545 0.376 1
1 97 . 18 1 1 A 15 15 LEU H H 15 8.097 8.346 -0.249 1
1 98 . 18 1 1 A 15 15 LEU HA H 15 4.670 4.755 -0.085 1
1 108 . 18 1 1 A 15 15 LEU C C 15 177.364 175.703 1.661 1
1 109 . 18 1 1 A 15 15 LEU CA C 15 57.543 54.434 3.109 1
1 110 . 18 1 1 A 15 15 LEU CB C 15 41.877 40.960 0.917 1
1 114 . 18 1 1 A 15 15 LEU N N 15 122.215 121.861 0.354 1
1 115 . 18 1 1 A 16 16 THR H H 16 9.520 9.143 0.377 1
1 116 . 18 1 1 A 16 16 THR HA H 16 4.369 4.947 -0.578 1
1 121 . 18 1 1 A 16 16 THR C C 16 172.453 173.501 -1.048 1
1 122 . 18 1 1 A 16 16 THR CA C 16 62.480 61.652 0.828 1
1 123 . 18 1 1 A 16 16 THR CB C 16 72.198 71.122 1.076 1
1 125 . 18 1 1 A 16 16 THR N N 16 122.214 120.454 1.760 1
1 126 . 18 1 1 A 17 17 LEU H H 17 8.847 8.664 0.183 1
1 127 . 18 1 1 A 17 17 LEU HA H 17 4.573 4.420 0.153 1
1 137 . 18 1 1 A 17 17 LEU C C 17 174.695 176.900 -2.205 1
1 138 . 18 1 1 A 17 17 LEU CA C 17 53.840 55.461 -1.621 1
1 139 . 18 1 1 A 17 17 LEU CB C 17 40.290 42.379 -2.089 1
1 143 . 18 1 1 A 17 17 LEU N N 17 127.415 127.643 -0.228 1
1 144 . 18 1 1 A 18 18 ALA H H 18 8.647 8.515 0.132 1
1 145 . 18 1 1 A 18 18 ALA HA H 18 4.106 4.151 -0.045 1
1 149 . 18 1 1 A 18 18 ALA C C 18 178.236 177.522 0.714 1
1 150 . 18 1 1 A 18 18 ALA CA C 18 53.926 54.103 -0.177 1
1 151 . 18 1 1 A 18 18 ALA CB C 18 18.876 19.237 -0.361 1
1 152 . 18 1 1 A 18 18 ALA N N 18 133.362 129.514 3.848 1
1 153 . 18 1 1 A 19 19 ALA H H 19 7.772 7.559 0.213 1
1 154 . 18 1 1 A 19 19 ALA HA H 19 4.561 4.673 -0.112 1
1 158 . 18 1 1 A 19 19 ALA C C 19 176.032 174.370 1.662 1
1 159 . 18 1 1 A 19 19 ALA CA C 19 53.011 51.740 1.271 1
1 160 . 18 1 1 A 19 19 ALA CB C 19 21.869 23.058 -1.189 1
1 161 . 18 1 1 A 19 19 ALA N N 19 115.654 116.526 -0.872 1
1 162 . 18 1 1 A 20 20 VAL H H 20 8.697 8.870 -0.173 1
1 163 . 18 1 1 A 20 20 VAL HA H 20 4.951 4.892 0.059 1
1 171 . 18 1 1 A 20 20 VAL C C 20 174.314 174.255 0.059 1
1 172 . 18 1 1 A 20 20 VAL CA C 20 61.352 60.151 1.201 1
1 173 . 18 1 1 A 20 20 VAL CB C 20 35.394 33.831 1.563 1
1 176 . 18 1 1 A 20 20 VAL N N 20 120.848 118.868 1.980 1
1 177 . 18 1 1 A 21 21 THR H H 21 9.198 8.483 0.715 1
1 178 . 18 1 1 A 21 21 THR HA H 21 4.941 4.783 0.158 1
1 183 . 18 1 1 A 21 21 THR C C 21 174.416 174.643 -0.227 1
1 184 . 18 1 1 A 21 21 THR CA C 21 60.347 59.010 1.337 1
1 185 . 18 1 1 A 21 21 THR CB C 21 68.713 71.877 -3.164 1
1 187 . 18 1 1 A 21 21 THR N N 21 120.326 124.959 -4.633 1
1 188 . 18 1 1 A 22 22 PRO HA H 22 4.634 4.564 0.070 1
1 194 . 18 1 1 A 22 22 PRO C C 22 173.606 177.177 -3.571 1
1 195 . 18 1 1 A 22 22 PRO CA C 22 66.519 64.283 2.236 1
1 196 . 18 1 1 A 22 22 PRO CB C 22 32.078 31.638 0.440 1
1 199 . 18 1 1 A 23 23 ARG H H 23 6.621 8.395 -1.774 1
1 200 . 18 1 1 A 23 23 ARG HA H 23 4.591 4.544 0.047 1
1 207 . 18 1 1 A 23 23 ARG C C 23 176.554 175.527 1.027 1
1 208 . 18 1 1 A 23 23 ARG CA C 23 53.892 55.958 -2.066 1
1 209 . 18 1 1 A 23 23 ARG CB C 23 33.498 32.056 1.442 1
1 212 . 18 1 1 A 23 23 ARG N N 23 102.938 115.809 -12.871 1
1 213 . 18 1 1 A 24 24 THR H H 24 7.352 7.890 -0.538 1
1 214 . 18 1 1 A 24 24 THR HA H 24 5.593 5.177 0.416 1
1 219 . 18 1 1 A 24 24 THR C C 24 172.345 172.221 0.124 1
1 220 . 18 1 1 A 24 24 THR CA C 24 59.311 60.797 -1.486 1
1 221 . 18 1 1 A 24 24 THR CB C 24 73.311 71.682 1.629 1
1 223 . 18 1 1 A 24 24 THR N N 24 108.792 109.429 -0.637 1
1 224 . 18 1 1 A 25 25 VAL H H 25 8.437 8.711 -0.274 1
1 225 . 18 1 1 A 25 25 VAL HA H 25 4.512 4.913 -0.401 1
1 233 . 18 1 1 A 25 25 VAL C C 25 172.854 173.913 -1.059 1
1 234 . 18 1 1 A 25 25 VAL CA C 25 61.617 60.987 0.630 1
1 235 . 18 1 1 A 25 25 VAL CB C 25 36.742 34.771 1.971 1
1 238 . 18 1 1 A 25 25 VAL N N 25 117.023 121.015 -3.992 1
1 239 . 18 1 1 A 26 26 HIS H H 26 8.915 8.746 0.169 1
1 240 . 18 1 1 A 26 26 HIS HA H 26 5.765 5.384 0.381 1
1 245 . 18 1 1 A 26 26 HIS C C 26 173.976 173.589 0.387 1
1 246 . 18 1 1 A 26 26 HIS CA C 26 52.896 54.020 -1.124 1
1 247 . 18 1 1 A 26 26 HIS CB C 26 34.004 33.390 0.614 1
1 250 . 18 1 1 A 26 26 HIS N N 26 128.155 127.758 0.397 1
1 251 . 18 1 1 A 27 27 LEU H H 27 9.034 8.675 0.359 1
1 252 . 18 1 1 A 27 27 LEU HA H 27 5.505 4.895 0.610 1
1 262 . 18 1 1 A 27 27 LEU C C 27 174.821 174.524 0.297 1
1 263 . 18 1 1 A 27 27 LEU CA C 27 53.376 53.776 -0.400 1
1 264 . 18 1 1 A 27 27 LEU CB C 27 46.306 46.651 -0.345 1
1 268 . 18 1 1 A 27 27 LEU N N 27 128.569 126.671 1.898 1
1 269 . 18 1 1 A 28 28 THR H H 28 8.844 8.289 0.555 1
1 270 . 18 1 1 A 28 28 THR HA H 28 4.485 4.752 -0.267 1
1 275 . 18 1 1 A 28 28 THR C C 28 172.773 173.564 -0.791 1
1 276 . 18 1 1 A 28 28 THR CA C 28 60.052 60.456 -0.404 1
1 277 . 18 1 1 A 28 28 THR CB C 28 71.704 71.372 0.332 1
1 279 . 18 1 1 A 28 28 THR N N 28 112.165 112.882 -0.717 1
1 280 . 18 1 1 A 29 29 TRP H H 29 7.395 7.746 -0.351 1
1 281 . 18 1 1 A 29 29 TRP HA H 29 4.915 5.510 -0.595 1
1 290 . 18 1 1 A 29 29 TRP C C 29 174.013 174.361 -0.348 1
1 291 . 18 1 1 A 29 29 TRP CA C 29 56.626 54.479 2.147 1
1 292 . 18 1 1 A 29 29 TRP CB C 29 29.487 31.786 -2.299 1
1 298 . 18 1 1 A 29 29 TRP N N 29 115.623 119.949 -4.326 1
1 300 . 18 1 1 A 30 30 GLN H H 30 8.759 8.520 0.239 1
1 301 . 18 1 1 A 30 30 GLN HA H 30 4.641 4.735 -0.094 1
1 308 . 18 1 1 A 30 30 GLN C C 30 175.072 174.269 0.803 1
1 309 . 18 1 1 A 30 30 GLN CA C 30 52.975 53.816 -0.841 1
1 310 . 18 1 1 A 30 30 GLN CB C 30 28.398 28.736 -0.338 1
1 312 . 18 1 1 A 30 30 GLN N N 30 117.497 119.958 -2.461 1
1 314 . 18 1 1 A 31 31 PRO HA H 31 4.487 4.545 -0.058 1
1 320 . 18 1 1 A 31 31 PRO C C 31 177.034 176.283 0.751 1
1 321 . 18 1 1 A 31 31 PRO CA C 31 62.710 62.965 -0.255 1
1 322 . 18 1 1 A 31 31 PRO CB C 31 32.738 32.198 0.540 1
1 325 . 18 1 1 A 32 32 SER H H 32 8.259 8.653 -0.394 1
1 326 . 18 1 1 A 32 32 SER HA H 32 4.670 4.694 -0.024 1
1 329 . 18 1 1 A 32 32 SER C C 32 174.689 174.214 0.475 1
1 330 . 18 1 1 A 32 32 SER CA C 32 57.296 57.853 -0.557 1
1 331 . 18 1 1 A 32 32 SER CB C 32 64.748 64.451 0.297 1
1 332 . 18 1 1 A 32 32 SER N N 32 117.667 117.572 0.095 1
1 333 . 18 1 1 A 33 33 ALA H H 33 9.038 8.551 0.487 1
1 334 . 18 1 1 A 33 33 ALA HA H 33 4.126 4.687 -0.561 1
1 338 . 18 1 1 A 33 33 ALA C C 33 177.795 177.596 0.199 1
1 339 . 18 1 1 A 33 33 ALA CA C 33 54.213 50.697 3.516 1
1 340 . 18 1 1 A 33 33 ALA CB C 33 17.948 19.072 -1.124 1
1 341 . 18 1 1 A 33 33 ALA N N 33 131.772 126.497 5.275 1
1 342 . 18 1 1 A 34 34 GLY H H 34 8.576 8.296 0.280 1
1 343 . 18 1 1 A 34 34 GLY HA2 H 34 4.171 4.044 0.127 1
1 344 . 18 1 1 A 34 34 GLY HA3 H 34 3.592 4.044 -0.452 1
1 345 . 18 1 1 A 34 34 GLY C C 34 174.182 174.466 -0.284 1
1 346 . 18 1 1 A 34 34 GLY CA C 34 44.987 45.325 -0.338 1
1 347 . 18 1 1 A 34 34 GLY N N 34 111.339 110.940 0.399 1
1 348 . 18 1 1 A 35 35 ALA H H 35 7.637 7.797 -0.160 1
1 349 . 18 1 1 A 35 35 ALA HA H 35 4.210 4.176 0.034 1
1 353 . 18 1 1 A 35 35 ALA C C 35 178.918 177.831 1.087 1
1 354 . 18 1 1 A 35 35 ALA CA C 35 52.671 52.529 0.142 1
1 355 . 18 1 1 A 35 35 ALA CB C 35 18.988 19.302 -0.314 1
1 356 . 18 1 1 A 35 35 ALA N N 35 121.531 123.272 -1.741 1
1 357 . 18 1 1 A 36 36 THR H H 36 9.428 8.548 0.880 1
1 358 . 18 1 1 A 36 36 THR HA H 36 4.402 4.257 0.145 1
1 363 . 18 1 1 A 36 36 THR C C 36 174.739 174.548 0.191 1
1 364 . 18 1 1 A 36 36 THR CA C 36 62.692 63.794 -1.102 1
1 365 . 18 1 1 A 36 36 THR CB C 36 69.482 70.151 -0.669 1
1 367 . 18 1 1 A 36 36 THR N N 36 113.103 117.046 -3.943 1
1 368 . 18 1 1 A 37 37 HIS H H 37 7.857 7.427 0.430 1
1 369 . 18 1 1 A 37 37 HIS HA H 37 4.878 4.939 -0.061 1
1 374 . 18 1 1 A 37 37 HIS C C 37 171.103 171.958 -0.855 1
1 375 . 18 1 1 A 37 37 HIS CA C 37 55.867 53.440 2.427 1
1 376 . 18 1 1 A 37 37 HIS CB C 37 32.655 33.629 -0.974 1
1 379 . 18 1 1 A 37 37 HIS N N 37 118.486 114.563 3.923 1
1 380 . 18 1 1 A 38 38 TYR H H 38 9.217 8.863 0.354 1
1 381 . 18 1 1 A 38 38 TYR HA H 38 5.303 5.039 0.264 1
1 388 . 18 1 1 A 38 38 TYR C C 38 173.922 174.373 -0.451 1
1 389 . 18 1 1 A 38 38 TYR CA C 38 56.504 56.542 -0.038 1
1 390 . 18 1 1 A 38 38 TYR CB C 38 41.823 41.860 -0.037 1
1 395 . 18 1 1 A 38 38 TYR N N 38 114.077 118.862 -4.785 1
1 396 . 18 1 1 A 39 39 LEU H H 39 9.052 9.270 -0.218 1
1 397 . 18 1 1 A 39 39 LEU HA H 39 5.061 4.978 0.083 1
1 407 . 18 1 1 A 39 39 LEU C C 39 175.455 174.366 1.089 1
1 408 . 18 1 1 A 39 39 LEU CA C 39 53.855 53.964 -0.109 1
1 409 . 18 1 1 A 39 39 LEU CB C 39 45.254 43.989 1.265 1
1 413 . 18 1 1 A 39 39 LEU N N 39 123.997 125.816 -1.819 1
1 414 . 18 1 1 A 40 40 VAL H H 40 9.520 9.674 -0.154 1
1 415 . 18 1 1 A 40 40 VAL HA H 40 4.988 4.609 0.379 1
1 423 . 18 1 1 A 40 40 VAL C C 40 174.578 174.994 -0.416 1
1 424 . 18 1 1 A 40 40 VAL CA C 40 60.575 61.289 -0.714 1
1 425 . 18 1 1 A 40 40 VAL CB C 40 33.284 32.889 0.395 1
1 428 . 18 1 1 A 40 40 VAL N N 40 129.678 128.587 1.091 1
1 429 . 18 1 1 A 41 41 ARG H H 41 9.096 8.917 0.179 1
1 430 . 18 1 1 A 41 41 ARG HA H 41 5.384 4.756 0.628 1
1 437 . 18 1 1 A 41 41 ARG C C 41 175.100 174.964 0.136 1
1 438 . 18 1 1 A 41 41 ARG CA C 41 54.297 55.635 -1.338 1
1 439 . 18 1 1 A 41 41 ARG CB C 41 33.003 31.237 1.766 1
1 442 . 18 1 1 A 41 41 ARG N N 41 126.332 127.079 -0.747 1
1 443 . 18 1 1 A 42 42 CYS H H 42 9.004 9.414 -0.410 1
1 444 . 18 1 1 A 42 42 CYS HA H 42 5.309 5.282 0.027 1
1 447 . 18 1 1 A 42 42 CYS C C 42 173.417 173.690 -0.273 1
1 448 . 18 1 1 A 42 42 CYS CA C 42 57.508 57.027 0.481 1
1 449 . 18 1 1 A 42 42 CYS CB C 42 28.859 30.066 -1.207 1
1 450 . 18 1 1 A 42 42 CYS N N 42 123.359 124.361 -1.002 1
1 451 . 18 1 1 A 43 43 SER H H 43 9.102 8.832 0.270 1
1 452 . 18 1 1 A 43 43 SER HA H 43 5.324 5.011 0.313 1
1 455 . 18 1 1 A 43 43 SER C C 43 171.429 171.553 -0.124 1
1 456 . 18 1 1 A 43 43 SER CA C 43 55.621 55.915 -0.294 1
1 457 . 18 1 1 A 43 43 SER CB C 43 64.856 66.420 -1.564 1
1 458 . 18 1 1 A 43 43 SER N N 43 125.444 121.873 3.571 1
1 459 . 18 1 1 A 44 44 PRO HA H 44 4.389 4.622 -0.233 1
1 466 . 18 1 1 A 44 44 PRO C C 44 176.559 177.230 -0.671 1
1 467 . 18 1 1 A 44 44 PRO CA C 44 63.027 62.853 0.174 1
1 468 . 18 1 1 A 44 44 PRO CB C 44 31.935 32.859 -0.924 1
1 471 . 18 1 1 A 45 45 ALA H H 45 8.261 8.728 -0.467 1
1 472 . 18 1 1 A 45 45 ALA HA H 45 4.157 4.110 0.047 1
1 476 . 18 1 1 A 45 45 ALA C C 45 177.706 177.693 0.013 1
1 477 . 18 1 1 A 45 45 ALA CA C 45 53.284 54.780 -1.496 1
1 478 . 18 1 1 A 45 45 ALA CB C 45 18.978 19.082 -0.104 1
1 479 . 18 1 1 A 45 45 ALA N N 45 126.162 124.715 1.447 1
1 480 . 18 1 1 A 46 46 SER H H 46 8.275 7.613 0.662 1
1 481 . 18 1 1 A 46 46 SER HA H 46 4.779 4.616 0.163 1
1 484 . 18 1 1 A 46 46 SER C C 46 172.182 174.394 -2.212 1
1 485 . 18 1 1 A 46 46 SER CA C 46 55.091 55.872 -0.781 1
1 486 . 18 1 1 A 46 46 SER CB C 46 63.130 64.342 -1.212 1
1 487 . 18 1 1 A 46 46 SER N N 46 113.009 113.710 -0.701 1
1 488 . 18 1 1 A 47 47 PRO HA H 47 4.336 4.534 -0.198 1
1 493 . 18 1 1 A 47 47 PRO C C 47 177.165 175.977 1.188 1
1 494 . 18 1 1 A 47 47 PRO CA C 47 63.268 63.724 -0.456 1
1 495 . 18 1 1 A 47 47 PRO CB C 47 32.528 31.849 0.679 1
1 498 . 18 1 1 A 48 48 LYS H H 48 9.089 7.258 1.831 1
1 499 . 18 1 1 A 48 48 LYS HA H 48 4.408 3.977 0.431 1
1 508 . 18 1 1 A 48 48 LYS C C 48 176.917 176.366 0.551 1
1 509 . 18 1 1 A 48 48 LYS CA C 48 55.893 58.118 -2.225 1
1 510 . 18 1 1 A 48 48 LYS CB C 48 32.997 32.160 0.837 1
1 514 . 18 1 1 A 48 48 LYS N N 48 122.579 119.384 3.195 1
1 515 . 18 1 1 A 49 49 GLY HA2 H 49 4.021 4.186 -0.165 1
1 516 . 18 1 1 A 49 49 GLY HA3 H 49 3.881 4.186 -0.305 1
1 517 . 18 1 1 A 49 49 GLY C C 49 174.552 173.264 1.288 1
1 518 . 18 1 1 A 49 49 GLY CA C 49 46.011 44.680 1.331 1
1 519 . 18 1 1 A 50 50 GLU H H 50 8.608 8.548 0.060 1
1 520 . 18 1 1 A 50 50 GLU HA H 50 4.335 4.660 -0.325 1
1 525 . 18 1 1 A 50 50 GLU C C 50 176.672 175.105 1.567 1
1 526 . 18 1 1 A 50 50 GLU CA C 50 56.978 55.779 1.199 1
1 527 . 18 1 1 A 50 50 GLU CB C 50 29.458 28.856 0.602 1
1 529 . 18 1 1 A 50 50 GLU N N 50 121.378 121.502 -0.124 1
1 530 . 18 1 1 A 51 51 GLU H H 51 8.287 8.465 -0.178 1
1 531 . 18 1 1 A 51 51 GLU HA H 51 4.381 4.823 -0.442 1
1 536 . 18 1 1 A 51 51 GLU C C 51 176.218 176.340 -0.122 1
1 537 . 18 1 1 A 51 51 GLU CA C 51 56.996 55.438 1.558 1
1 538 . 18 1 1 A 51 51 GLU CB C 51 31.066 31.669 -0.603 1
1 540 . 18 1 1 A 51 51 GLU N N 51 120.863 125.365 -4.502 1
1 541 . 18 1 1 A 52 52 GLU H H 52 8.445 8.540 -0.095 1
1 542 . 18 1 1 A 52 52 GLU HA H 52 4.464 4.266 0.198 1
1 547 . 18 1 1 A 52 52 GLU C C 52 176.128 176.648 -0.520 1
1 548 . 18 1 1 A 52 52 GLU CA C 52 55.955 57.331 -1.376 1
1 549 . 18 1 1 A 52 52 GLU CB C 52 31.691 29.756 1.935 1
1 551 . 18 1 1 A 52 52 GLU N N 52 121.103 126.325 -5.222 1
1 552 . 18 1 1 A 53 53 GLU H H 53 8.441 8.660 -0.219 1
1 553 . 18 1 1 A 53 53 GLU HA H 53 4.609 4.536 0.073 1
1 558 . 18 1 1 A 53 53 GLU C C 53 175.816 176.325 -0.509 1
1 559 . 18 1 1 A 53 53 GLU CA C 53 56.697 56.552 0.145 1
1 560 . 18 1 1 A 53 53 GLU CB C 53 31.022 30.333 0.689 1
1 562 . 18 1 1 A 53 53 GLU N N 53 121.949 122.627 -0.678 1
1 563 . 18 1 1 A 54 54 ARG H H 54 8.569 8.597 -0.028 1
1 564 . 18 1 1 A 54 54 ARG HA H 54 4.768 4.869 -0.101 1
1 571 . 18 1 1 A 54 54 ARG C C 54 174.881 175.140 -0.259 1
1 572 . 18 1 1 A 54 54 ARG CA C 54 54.950 55.653 -0.703 1
1 573 . 18 1 1 A 54 54 ARG CB C 54 33.374 31.864 1.510 1
1 576 . 18 1 1 A 54 54 ARG N N 54 123.714 125.099 -1.385 1
1 577 . 18 1 1 A 55 55 GLU H H 55 8.650 9.271 -0.621 1
1 578 . 18 1 1 A 55 55 GLU HA H 55 5.493 5.157 0.336 1
1 583 . 18 1 1 A 55 55 GLU C C 55 175.566 175.073 0.493 1
1 584 . 18 1 1 A 55 55 GLU CA C 55 54.915 54.826 0.089 1
1 585 . 18 1 1 A 55 55 GLU CB C 55 33.250 32.465 0.785 1
1 587 . 18 1 1 A 55 55 GLU N N 55 123.537 122.496 1.041 1
1 588 . 18 1 1 A 56 56 VAL H H 56 9.419 9.264 0.155 1
1 589 . 18 1 1 A 56 56 VAL HA H 56 4.524 5.002 -0.478 1
1 597 . 18 1 1 A 56 56 VAL C C 56 173.502 174.217 -0.715 1
1 598 . 18 1 1 A 56 56 VAL CA C 56 60.981 58.886 2.095 1
1 599 . 18 1 1 A 56 56 VAL CB C 56 36.117 35.675 0.442 1
1 602 . 18 1 1 A 56 56 VAL N N 56 123.343 119.091 4.252 1
1 603 . 18 1 1 A 57 57 GLN H H 57 8.767 8.805 -0.038 1
1 604 . 18 1 1 A 57 57 GLN HA H 57 5.671 5.182 0.489 1
1 611 . 18 1 1 A 57 57 GLN C C 57 176.357 175.400 0.957 1
1 612 . 18 1 1 A 57 57 GLN CA C 57 54.735 54.294 0.441 1
1 613 . 18 1 1 A 57 57 GLN CB C 57 30.781 31.947 -1.166 1
1 615 . 18 1 1 A 57 57 GLN N N 57 125.639 121.433 4.206 1
1 617 . 18 1 1 A 58 58 VAL H H 58 9.217 8.426 0.791 1
1 618 . 18 1 1 A 58 58 VAL HA H 58 5.129 4.834 0.295 1
1 626 . 18 1 1 A 58 58 VAL C C 58 175.925 176.595 -0.670 1
1 627 . 18 1 1 A 58 58 VAL CA C 58 59.652 59.816 -0.164 1
1 628 . 18 1 1 A 58 58 VAL CB C 58 36.540 35.526 1.014 1
1 631 . 18 1 1 A 58 58 VAL N N 58 117.022 117.679 -0.657 1
1 632 . 18 1 1 A 59 59 GLY H H 59 9.008 8.919 0.089 1
1 633 . 18 1 1 A 59 59 GLY HA2 H 59 4.670 3.924 0.746 1
1 634 . 18 1 1 A 59 59 GLY HA3 H 59 3.914 3.946 -0.032 1
1 635 . 18 1 1 A 59 59 GLY C C 59 173.386 174.199 -0.813 1
1 636 . 18 1 1 A 59 59 GLY CA C 59 45.093 46.874 -1.781 1
1 637 . 18 1 1 A 59 59 GLY N N 59 109.174 111.040 -1.866 1
1 638 . 18 1 1 A 60 60 ARG H H 60 7.695 7.896 -0.201 1
1 639 . 18 1 1 A 60 60 ARG HA H 60 4.866 4.835 0.031 1
1 645 . 18 1 1 A 60 60 ARG C C 60 173.760 176.061 -2.301 1
1 646 . 18 1 1 A 60 60 ARG CA C 60 52.764 53.188 -0.424 1
1 647 . 18 1 1 A 60 60 ARG CB C 60 31.785 31.067 0.718 1
1 650 . 18 1 1 A 60 60 ARG N N 60 118.520 119.929 -1.409 1
1 651 . 18 1 1 A 61 61 PRO HA H 61 3.539 3.902 -0.363 1
1 658 . 18 1 1 A 61 61 PRO C C 61 173.175 173.818 -0.643 1
1 659 . 18 1 1 A 61 61 PRO CA C 61 62.265 62.912 -0.647 1
1 660 . 18 1 1 A 61 61 PRO CB C 61 27.546 30.761 -3.215 1
1 663 . 18 1 1 A 62 62 GLU H H 62 7.879 7.816 0.063 1
1 664 . 18 1 1 A 62 62 GLU HA H 62 4.071 4.512 -0.441 1
1 669 . 18 1 1 A 62 62 GLU C C 62 174.107 174.706 -0.599 1
1 670 . 18 1 1 A 62 62 GLU CA C 62 55.229 54.691 0.538 1
1 671 . 18 1 1 A 62 62 GLU CB C 62 32.838 31.496 1.342 1
1 673 . 18 1 1 A 62 62 GLU N N 62 118.173 114.094 4.079 1
1 674 . 18 1 1 A 63 63 VAL H H 63 8.930 8.446 0.484 1
1 675 . 18 1 1 A 63 63 VAL HA H 63 4.548 5.134 -0.586 1
1 683 . 18 1 1 A 63 63 VAL C C 63 170.325 173.748 -3.423 1
1 684 . 18 1 1 A 63 63 VAL CA C 63 60.770 59.625 1.145 1
1 685 . 18 1 1 A 63 63 VAL CB C 63 35.394 35.036 0.358 1
1 688 . 18 1 1 A 63 63 VAL N N 63 117.161 125.726 -8.565 1
1 689 . 18 1 1 A 64 64 LEU H H 64 8.332 8.847 -0.515 1
1 690 . 18 1 1 A 64 64 LEU HA H 64 5.122 5.312 -0.190 1
1 700 . 18 1 1 A 64 64 LEU C C 64 176.243 175.146 1.097 1
1 701 . 18 1 1 A 64 64 LEU CA C 64 53.346 53.927 -0.581 1
1 702 . 18 1 1 A 64 64 LEU CB C 64 42.649 44.852 -2.203 1
1 706 . 18 1 1 A 64 64 LEU N N 64 130.510 128.842 1.668 1
1 707 . 18 1 1 A 65 65 LEU H H 65 9.261 9.004 0.257 1
1 708 . 18 1 1 A 65 65 LEU HA H 65 4.443 4.560 -0.117 1
1 718 . 18 1 1 A 65 65 LEU C C 65 174.016 176.161 -2.145 1
1 719 . 18 1 1 A 65 65 LEU CA C 65 53.920 54.362 -0.442 1
1 720 . 18 1 1 A 65 65 LEU CB C 65 42.976 42.675 0.301 1
1 724 . 18 1 1 A 65 65 LEU N N 65 128.611 128.705 -0.094 1
1 725 . 18 1 1 A 66 66 ASP H H 66 8.105 8.403 -0.298 1
1 726 . 18 1 1 A 66 66 ASP HA H 66 5.207 5.088 0.119 1
1 729 . 18 1 1 A 66 66 ASP C C 66 176.161 175.736 0.425 1
1 730 . 18 1 1 A 66 66 ASP CA C 66 51.001 51.839 -0.838 1
1 731 . 18 1 1 A 66 66 ASP CB C 66 42.836 42.862 -0.026 1
1 732 . 18 1 1 A 66 66 ASP N N 66 121.799 122.878 -1.079 1
1 733 . 18 1 1 A 67 67 GLY H H 67 8.688 8.861 -0.173 1
1 734 . 18 1 1 A 67 67 GLY HA2 H 67 3.923 3.838 0.085 1
1 735 . 18 1 1 A 67 67 GLY HA3 H 67 3.808 3.845 -0.037 1
1 736 . 18 1 1 A 67 67 GLY C C 67 175.500 174.398 1.102 1
1 737 . 18 1 1 A 67 67 GLY CA C 67 46.591 47.054 -0.463 1
1 738 . 18 1 1 A 67 67 GLY N N 67 106.518 109.416 -2.898 1
1 739 . 18 1 1 A 68 68 LEU H H 68 8.125 7.190 0.935 1
1 740 . 18 1 1 A 68 68 LEU HA H 68 4.252 4.850 -0.598 1
1 750 . 18 1 1 A 68 68 LEU C C 68 174.914 175.931 -1.017 1
1 751 . 18 1 1 A 68 68 LEU CA C 68 53.469 53.021 0.448 1
1 752 . 18 1 1 A 68 68 LEU CB C 68 40.422 44.440 -4.018 1
1 756 . 18 1 1 A 68 68 LEU N N 68 119.345 120.002 -0.657 1
1 757 . 18 1 1 A 69 69 GLU H H 69 8.207 9.033 -0.826 1
1 758 . 18 1 1 A 69 69 GLU HA H 69 4.908 5.081 -0.173 1
1 763 . 18 1 1 A 69 69 GLU C C 69 174.464 174.666 -0.202 1
1 764 . 18 1 1 A 69 69 GLU CA C 69 53.081 53.615 -0.534 1
1 765 . 18 1 1 A 69 69 GLU CB C 69 31.538 32.245 -0.707 1
1 767 . 18 1 1 A 69 69 GLU N N 69 119.486 118.287 1.199 1
1 768 . 18 1 1 A 70 70 PRO HA H 70 4.866 4.333 0.533 1
1 775 . 18 1 1 A 70 70 PRO C C 70 178.285 177.244 1.041 1
1 776 . 18 1 1 A 70 70 PRO CA C 70 63.203 63.600 -0.397 1
1 777 . 18 1 1 A 70 70 PRO CB C 70 33.726 32.232 1.494 1
1 780 . 18 1 1 A 71 71 GLY H H 71 7.362 8.868 -1.506 1
1 781 . 18 1 1 A 71 71 GLY HA2 H 71 3.807 3.915 -0.108 1
1 782 . 18 1 1 A 71 71 GLY HA3 H 71 3.756 3.916 -0.160 1
1 783 . 18 1 1 A 71 71 GLY C C 71 174.664 173.570 1.094 1
1 784 . 18 1 1 A 71 71 GLY CA C 71 46.926 46.421 0.505 1
1 785 . 18 1 1 A 71 71 GLY N N 71 113.776 111.478 2.298 1
1 786 . 18 1 1 A 72 72 ARG H H 72 8.036 7.256 0.780 1
1 787 . 18 1 1 A 72 72 ARG HA H 72 4.597 4.819 -0.222 1
1 793 . 18 1 1 A 72 72 ARG C C 72 173.293 173.614 -0.321 1
1 794 . 18 1 1 A 72 72 ARG CA C 72 54.633 54.379 0.254 1
1 795 . 18 1 1 A 72 72 ARG CB C 72 33.704 33.892 -0.188 1
1 798 . 18 1 1 A 72 72 ARG N N 72 119.611 119.406 0.205 1
1 799 . 18 1 1 A 73 73 ASP H H 73 7.785 8.396 -0.611 1
1 800 . 18 1 1 A 73 73 ASP HA H 73 5.276 5.509 -0.233 1
1 803 . 18 1 1 A 73 73 ASP C C 73 175.904 174.779 1.125 1
1 804 . 18 1 1 A 73 73 ASP CA C 73 53.568 52.594 0.974 1
1 805 . 18 1 1 A 73 73 ASP CB C 73 42.970 43.209 -0.239 1
1 806 . 18 1 1 A 73 73 ASP N N 73 118.900 123.680 -4.780 1
1 807 . 18 1 1 A 74 74 TYR H H 74 9.516 9.234 0.282 1
1 808 . 18 1 1 A 74 74 TYR HA H 74 4.800 5.073 -0.273 1
1 815 . 18 1 1 A 74 74 TYR C C 74 174.631 174.954 -0.323 1
1 816 . 18 1 1 A 74 74 TYR CA C 74 58.548 56.803 1.745 1
1 817 . 18 1 1 A 74 74 TYR CB C 74 42.029 41.545 0.484 1
1 822 . 18 1 1 A 74 74 TYR N N 74 121.903 121.018 0.885 1
1 823 . 18 1 1 A 75 75 GLU H H 75 9.248 9.205 0.043 1
1 824 . 18 1 1 A 75 75 GLU HA H 75 4.756 4.606 0.150 1
1 829 . 18 1 1 A 75 75 GLU C C 75 175.524 175.371 0.153 1
1 830 . 18 1 1 A 75 75 GLU CA C 75 55.621 55.981 -0.360 1
1 831 . 18 1 1 A 75 75 GLU CB C 75 30.778 29.270 1.508 1
1 833 . 18 1 1 A 75 75 GLU N N 75 122.425 124.154 -1.729 1
1 834 . 18 1 1 A 76 76 VAL H H 76 8.884 8.127 0.757 1
1 835 . 18 1 1 A 76 76 VAL HA H 76 5.246 4.593 0.653 1
1 843 . 18 1 1 A 76 76 VAL C C 76 174.800 175.436 -0.636 1
1 844 . 18 1 1 A 76 76 VAL CA C 76 60.199 62.627 -2.428 1
1 845 . 18 1 1 A 76 76 VAL CB C 76 33.449 31.557 1.892 1
1 848 . 18 1 1 A 76 76 VAL N N 76 126.853 125.245 1.608 1
1 849 . 18 1 1 A 77 77 SER H H 77 9.234 8.684 0.550 1
1 850 . 18 1 1 A 77 77 SER HA H 77 5.398 5.050 0.348 1
1 853 . 18 1 1 A 77 77 SER C C 77 173.138 173.957 -0.819 1
1 854 . 18 1 1 A 77 77 SER CA C 77 56.032 57.775 -1.743 1
1 855 . 18 1 1 A 77 77 SER CB C 77 66.374 64.388 1.986 1
1 856 . 18 1 1 A 77 77 SER N N 77 120.852 125.349 -4.497 1
1 857 . 18 1 1 A 78 78 VAL H H 78 9.092 8.598 0.494 1
1 858 . 18 1 1 A 78 78 VAL HA H 78 4.756 4.541 0.215 1
1 866 . 18 1 1 A 78 78 VAL C C 78 173.641 174.506 -0.865 1
1 867 . 18 1 1 A 78 78 VAL CA C 78 61.246 60.925 0.321 1
1 868 . 18 1 1 A 78 78 VAL CB C 78 34.467 32.790 1.677 1
1 871 . 18 1 1 A 78 78 VAL N N 78 122.453 127.151 -4.698 1
1 872 . 18 1 1 A 79 79 GLN H H 79 8.587 8.810 -0.223 1
1 873 . 18 1 1 A 79 79 GLN HA H 79 4.438 4.840 -0.402 1
1 880 . 18 1 1 A 79 79 GLN C C 79 174.999 174.506 0.493 1
1 881 . 18 1 1 A 79 79 GLN CA C 79 54.227 54.090 0.137 1
1 882 . 18 1 1 A 79 79 GLN CB C 79 33.587 32.598 0.989 1
1 884 . 18 1 1 A 79 79 GLN N N 79 125.619 127.669 -2.050 1
1 886 . 18 1 1 A 80 80 SER H H 80 8.623 9.045 -0.422 1
1 887 . 18 1 1 A 80 80 SER HA H 80 4.756 4.868 -0.112 1
1 890 . 18 1 1 A 80 80 SER C C 80 172.264 173.897 -1.633 1
1 891 . 18 1 1 A 80 80 SER CA C 80 58.177 59.551 -1.374 1
1 892 . 18 1 1 A 80 80 SER CB C 80 63.920 63.205 0.715 1
1 893 . 18 1 1 A 80 80 SER N N 80 122.844 124.455 -1.611 1
1 894 . 18 1 1 A 81 81 LEU H H 81 8.348 9.330 -0.982 1
1 895 . 18 1 1 A 81 81 LEU HA H 81 5.124 4.530 0.594 1
1 905 . 18 1 1 A 81 81 LEU C C 81 175.775 175.691 0.084 1
1 906 . 18 1 1 A 81 81 LEU CA C 81 54.033 53.688 0.345 1
1 907 . 18 1 1 A 81 81 LEU CB C 81 44.690 41.826 2.864 1
1 911 . 18 1 1 A 81 81 LEU N N 81 123.191 127.668 -4.477 1
1 912 . 18 1 1 A 82 82 ARG H H 82 8.374 8.370 0.004 1
1 913 . 18 1 1 A 82 82 ARG HA H 82 4.616 4.476 0.140 1
1 919 . 18 1 1 A 82 82 ARG C C 82 176.864 176.003 0.861 1
1 920 . 18 1 1 A 82 82 ARG CA C 82 55.868 55.256 0.612 1
1 921 . 18 1 1 A 82 82 ARG CB C 82 32.322 30.772 1.550 1
1 924 . 18 1 1 A 82 82 ARG N N 82 121.029 125.904 -4.875 1
1 925 . 18 1 1 A 83 83 GLY H H 83 8.309 7.730 0.579 1
1 926 . 18 1 1 A 83 83 GLY HA2 H 83 4.031 4.014 0.017 1
1 927 . 18 1 1 A 83 83 GLY HA3 H 83 3.888 4.118 -0.230 1
1 928 . 18 1 1 A 83 83 GLY C C 83 174.562 174.602 -0.040 1
1 929 . 18 1 1 A 83 83 GLY CA C 83 45.963 45.350 0.613 1
1 930 . 18 1 1 A 83 83 GLY N N 83 109.937 107.918 2.019 1
1 931 . 18 1 1 A 84 84 PRO HA H 84 4.573 4.450 0.123 1
1 938 . 18 1 1 A 84 84 PRO C C 84 176.533 176.167 0.366 1
1 939 . 18 1 1 A 84 84 PRO CA C 84 63.485 64.765 -1.280 1
1 940 . 18 1 1 A 84 84 PRO CB C 84 32.409 32.039 0.370 1
1 943 . 18 1 1 A 85 85 GLU H H 85 7.799 7.708 0.091 1
1 944 . 18 1 1 A 85 85 GLU HA H 85 4.369 4.796 -0.427 1
1 949 . 18 1 1 A 85 85 GLU C C 85 174.722 175.481 -0.759 1
1 950 . 18 1 1 A 85 85 GLU CA C 85 55.899 55.024 0.875 1
1 951 . 18 1 1 A 85 85 GLU CB C 85 31.911 32.921 -1.010 1
1 953 . 18 1 1 A 85 85 GLU N N 85 122.093 112.514 9.579 1
1 954 . 18 1 1 A 86 86 GLY H H 86 8.329 8.658 -0.329 1
1 955 . 18 1 1 A 86 86 GLY HA2 H 86 5.298 4.168 1.130 1
1 956 . 18 1 1 A 86 86 GLY HA3 H 86 3.559 4.180 -0.621 1
1 957 . 18 1 1 A 86 86 GLY C C 86 174.355 172.988 1.367 1
1 958 . 18 1 1 A 86 86 GLY CA C 86 44.034 44.146 -0.112 1
1 959 . 18 1 1 A 86 86 GLY N N 86 109.387 109.002 0.385 1
1 960 . 18 1 1 A 87 87 SER H H 87 8.807 8.488 0.319 1
1 961 . 18 1 1 A 87 87 SER HA H 87 4.670 4.701 -0.031 1
1 964 . 18 1 1 A 87 87 SER C C 87 175.195 174.608 0.587 1
1 965 . 18 1 1 A 87 87 SER CA C 87 57.737 57.238 0.499 1
1 966 . 18 1 1 A 87 87 SER CB C 87 67.829 66.033 1.796 1
1 967 . 18 1 1 A 87 87 SER N N 87 117.698 113.930 3.768 1
1 968 . 18 1 1 A 88 88 GLU H H 88 8.754 8.551 0.203 1
1 969 . 18 1 1 A 88 88 GLU HA H 88 4.357 4.298 0.059 1
1 974 . 18 1 1 A 88 88 GLU C C 88 177.474 176.933 0.541 1
1 975 . 18 1 1 A 88 88 GLU CA C 88 57.525 56.941 0.584 1
1 976 . 18 1 1 A 88 88 GLU CB C 88 31.162 30.362 0.800 1
1 978 . 18 1 1 A 88 88 GLU N N 88 118.709 120.707 -1.998 1
1 979 . 18 1 1 A 89 89 ALA H H 89 8.855 8.274 0.581 1
1 980 . 18 1 1 A 89 89 ALA HA H 89 4.792 4.461 0.331 1
1 984 . 18 1 1 A 89 89 ALA C C 89 178.379 176.713 1.666 1
1 985 . 18 1 1 A 89 89 ALA CA C 89 51.264 52.159 -0.895 1
1 986 . 18 1 1 A 89 89 ALA CB C 89 20.040 19.313 0.727 1
1 987 . 18 1 1 A 89 89 ALA N N 89 127.301 125.291 2.010 1
1 988 . 18 1 1 A 90 90 ARG H H 90 8.549 8.361 0.188 1
1 989 . 18 1 1 A 90 90 ARG HA H 90 4.658 4.855 -0.197 1
1 996 . 18 1 1 A 90 90 ARG C C 90 174.720 175.560 -0.840 1
1 997 . 18 1 1 A 90 90 ARG CA C 90 53.575 54.330 -0.755 1
1 998 . 18 1 1 A 90 90 ARG CB C 90 33.456 31.699 1.757 1
1 1001 . 18 1 1 A 90 90 ARG N N 90 121.289 123.566 -2.277 1
1 1002 . 18 1 1 A 91 91 GLY H H 91 8.396 9.070 -0.674 1
1 1003 . 18 1 1 A 91 91 GLY HA2 H 91 5.306 4.170 1.136 1
1 1004 . 18 1 1 A 91 91 GLY HA3 H 91 3.700 4.203 -0.503 1
1 1005 . 18 1 1 A 91 91 GLY C C 91 173.191 172.108 1.083 1
1 1006 . 18 1 1 A 91 91 GLY CA C 91 44.493 44.075 0.418 1
1 1007 . 18 1 1 A 91 91 GLY N N 91 108.579 112.214 -3.635 1
1 1008 . 18 1 1 A 92 92 ILE H H 92 8.891 8.224 0.667 1
1 1009 . 18 1 1 A 92 92 ILE HA H 92 4.499 4.974 -0.475 1
1 1019 . 18 1 1 A 92 92 ILE C C 92 171.877 173.702 -1.825 1
1 1020 . 18 1 1 A 92 92 ILE CA C 92 60.682 59.059 1.623 1
1 1021 . 18 1 1 A 92 92 ILE CB C 92 42.425 42.219 0.206 1
1 1025 . 18 1 1 A 92 92 ILE N N 92 118.313 121.311 -2.998 1
1 1026 . 18 1 1 A 93 93 ARG H H 93 7.980 8.493 -0.513 1
1 1027 . 18 1 1 A 93 93 ARG HA H 93 5.224 4.515 0.709 1
1 1034 . 18 1 1 A 93 93 ARG C C 93 175.072 175.035 0.037 1
1 1035 . 18 1 1 A 93 93 ARG CA C 93 54.499 56.173 -1.674 1
1 1036 . 18 1 1 A 93 93 ARG CB C 93 31.767 30.737 1.030 1
1 1039 . 18 1 1 A 93 93 ARG N N 93 124.879 129.618 -4.739 1
1 1040 . 18 1 1 A 94 94 ALA H H 94 9.064 8.395 0.669 1
1 1041 . 18 1 1 A 94 94 ALA HA H 94 4.731 5.210 -0.479 1
1 1045 . 18 1 1 A 94 94 ALA C C 94 174.494 176.826 -2.332 1
1 1046 . 18 1 1 A 94 94 ALA CA C 94 50.577 50.632 -0.055 1
1 1047 . 18 1 1 A 94 94 ALA CB C 94 23.082 20.780 2.302 1
1 1048 . 18 1 1 A 94 94 ALA N N 94 126.095 129.716 -3.621 1
1 1049 . 18 1 1 A 95 95 ARG H H 95 8.263 9.022 -0.759 1
1 1050 . 18 1 1 A 95 95 ARG HA H 95 5.548 5.275 0.273 1
1 1058 . 18 1 1 A 95 95 ARG C C 95 176.901 174.978 1.923 1
1 1059 . 18 1 1 A 95 95 ARG CA C 95 53.787 53.977 -0.190 1
1 1060 . 18 1 1 A 95 95 ARG CB C 95 32.426 34.310 -1.884 1
1 1063 . 18 1 1 A 95 95 ARG N N 95 123.374 121.040 2.334 1
1 1065 . 18 1 1 A 96 96 THR H H 96 9.208 8.869 0.339 1
1 1066 . 18 1 1 A 96 96 THR HA H 96 4.461 5.071 -0.610 1
1 1071 . 18 1 1 A 96 96 THR CA C 96 58.248 58.384 -0.136 1
1 1072 . 18 1 1 A 96 96 THR CB C 96 68.466 70.861 -2.395 1
1 1074 . 18 1 1 A 96 96 THR N N 96 119.492 111.925 7.567 1
1 1075 . 18 1 1 A 97 97 PRO HA H 97 4.636 4.606 0.030 1
1 1082 . 18 1 1 A 97 97 PRO C C 97 175.725 175.771 -0.046 1
1 1083 . 18 1 1 A 97 97 PRO CA C 97 61.907 62.326 -0.419 1
1 1084 . 18 1 1 A 97 97 PRO CB C 97 32.590 33.413 -0.823 1
1 1087 . 18 1 1 A 98 98 THR H H 98 7.943 8.429 -0.486 1
1 1088 . 18 1 1 A 98 98 THR HA H 98 4.208 5.063 -0.855 1
1 1093 . 18 1 1 A 98 98 THR C C 98 175.058 172.934 2.124 1
1 1094 . 18 1 1 A 98 98 THR CA C 98 62.069 60.255 1.814 1
1 1095 . 18 1 1 A 98 98 THR CB C 98 69.719 71.023 -1.304 1
1 1097 . 18 1 1 A 98 98 THR N N 98 107.148 111.410 -4.262 1
1 1098 . 18 1 1 A 99 99 SER H H 99 8.163 8.943 -0.780 1
1 1099 . 18 1 1 A 99 99 SER HA H 99 4.524 4.577 -0.053 1
1 1102 . 18 1 1 A 99 99 SER C C 99 174.319 174.182 0.137 1
1 1103 . 18 1 1 A 99 99 SER CA C 99 58.107 57.596 0.511 1
1 1104 . 18 1 1 A 99 99 SER CB C 99 64.492 62.445 2.047 1
1 1105 . 18 1 1 A 99 99 SER N N 99 115.114 120.621 -5.507 1
1 1106 . 18 1 1 A 100 100 GLY H H 100 8.336 8.103 0.233 1
1 1107 . 18 1 1 A 100 100 GLY HA2 H 100 4.222 3.947 0.275 1
1 1108 . 18 1 1 A 100 100 GLY HA3 H 100 4.222 3.948 0.274 1
1 1109 . 18 1 1 A 100 100 GLY C C 100 171.696 173.251 -1.555 1
1 1110 . 18 1 1 A 100 100 GLY CA C 100 44.617 45.089 -0.472 1
1 1111 . 18 1 1 A 100 100 GLY N N 100 110.678 110.384 0.294 1
1 1112 . 18 1 1 A 101 101 PRO HA H 101 4.506 4.814 -0.308 1
1 1118 . 18 1 1 A 101 101 PRO CA C 101 63.358 62.817 0.541 1
1 1119 . 18 1 1 A 101 101 PRO CB C 101 32.313 32.146 0.167 1
1 1 . 19 1 1 A 6 6 SER HA H 6 4.528 4.254 0.274 1
1 3 . 19 1 1 A 6 6 SER CA C 6 58.373 61.785 -3.412 1
1 4 . 19 1 1 A 6 6 SER CB C 6 63.978 63.423 0.555 1
1 5 . 19 1 1 A 7 7 GLY H H 7 8.228 7.251 0.977 1
1 6 . 19 1 1 A 7 7 GLY HA2 H 7 4.134 4.047 0.087 1
1 7 . 19 1 1 A 7 7 GLY HA3 H 7 4.134 4.047 0.087 1
1 8 . 19 1 1 A 7 7 GLY CA C 7 44.607 45.086 -0.479 1
1 9 . 19 1 1 A 7 7 GLY N N 7 110.638 104.672 5.966 1
1 10 . 19 1 1 A 8 8 PRO HA H 8 4.419 4.829 -0.410 1
1 17 . 19 1 1 A 8 8 PRO C C 8 176.908 175.303 1.605 1
1 18 . 19 1 1 A 8 8 PRO CA C 8 62.851 62.815 0.036 1
1 19 . 19 1 1 A 8 8 PRO CB C 8 32.243 31.672 0.571 1
1 22 . 19 1 1 A 9 9 LEU H H 9 8.462 8.660 -0.198 1
1 23 . 19 1 1 A 9 9 LEU HA H 9 4.494 4.969 -0.475 1
1 33 . 19 1 1 A 9 9 LEU C C 9 174.124 174.606 -0.482 1
1 34 . 19 1 1 A 9 9 LEU CA C 9 52.587 51.557 1.030 1
1 35 . 19 1 1 A 9 9 LEU CB C 9 43.150 43.437 -0.287 1
1 39 . 19 1 1 A 9 9 LEU N N 9 126.015 124.331 1.684 1
1 40 . 19 1 1 A 10 10 PRO HA H 10 4.820 4.591 0.229 1
1 47 . 19 1 1 A 10 10 PRO CA C 10 61.368 61.866 -0.498 1
1 48 . 19 1 1 A 10 10 PRO CB C 10 31.391 32.401 -1.010 1
1 51 . 19 1 1 A 11 11 PRO HA H 11 4.949 4.557 0.392 1
1 58 . 19 1 1 A 11 11 PRO CA C 11 61.183 61.804 -0.621 1
1 59 . 19 1 1 A 11 11 PRO CB C 11 30.656 31.893 -1.237 1
1 62 . 19 1 1 A 12 12 PRO HA H 12 4.341 4.607 -0.266 1
1 69 . 19 1 1 A 12 12 PRO C C 12 174.849 177.327 -2.478 1
1 70 . 19 1 1 A 12 12 PRO CA C 12 63.062 62.624 0.438 1
1 71 . 19 1 1 A 12 12 PRO CB C 12 31.831 31.480 0.351 1
1 74 . 19 1 1 A 13 13 ARG H H 13 7.828 8.369 -0.541 1
1 75 . 19 1 1 A 13 13 ARG HA H 13 4.536 4.301 0.235 1
1 82 . 19 1 1 A 13 13 ARG C C 13 174.608 176.786 -2.178 1
1 83 . 19 1 1 A 13 13 ARG CA C 13 54.774 58.651 -3.877 1
1 84 . 19 1 1 A 13 13 ARG CB C 13 33.250 30.631 2.619 1
1 87 . 19 1 1 A 13 13 ARG N N 13 120.532 121.852 -1.320 1
1 88 . 19 1 1 A 14 14 ALA H H 14 8.694 7.779 0.915 1
1 89 . 19 1 1 A 14 14 ALA HA H 14 3.986 4.396 -0.410 1
1 93 . 19 1 1 A 14 14 ALA C C 14 177.232 176.637 0.595 1
1 94 . 19 1 1 A 14 14 ALA CA C 14 52.461 51.711 0.750 1
1 95 . 19 1 1 A 14 14 ALA CB C 14 16.806 17.114 -0.308 1
1 96 . 19 1 1 A 14 14 ALA N N 14 121.921 120.385 1.536 1
1 97 . 19 1 1 A 15 15 LEU H H 15 8.097 8.595 -0.498 1
1 98 . 19 1 1 A 15 15 LEU HA H 15 4.670 4.813 -0.143 1
1 108 . 19 1 1 A 15 15 LEU C C 15 177.364 175.720 1.644 1
1 109 . 19 1 1 A 15 15 LEU CA C 15 57.543 54.461 3.082 1
1 110 . 19 1 1 A 15 15 LEU CB C 15 41.877 40.871 1.006 1
1 114 . 19 1 1 A 15 15 LEU N N 15 122.215 121.610 0.605 1
1 115 . 19 1 1 A 16 16 THR H H 16 9.520 8.860 0.660 1
1 116 . 19 1 1 A 16 16 THR HA H 16 4.369 4.895 -0.526 1
1 121 . 19 1 1 A 16 16 THR C C 16 172.453 173.263 -0.810 1
1 122 . 19 1 1 A 16 16 THR CA C 16 62.480 61.331 1.149 1
1 123 . 19 1 1 A 16 16 THR CB C 16 72.198 71.569 0.629 1
1 125 . 19 1 1 A 16 16 THR N N 16 122.214 120.371 1.843 1
1 126 . 19 1 1 A 17 17 LEU H H 17 8.847 8.710 0.137 1
1 127 . 19 1 1 A 17 17 LEU HA H 17 4.573 4.582 -0.009 1
1 137 . 19 1 1 A 17 17 LEU C C 17 174.695 176.640 -1.945 1
1 138 . 19 1 1 A 17 17 LEU CA C 17 53.840 54.973 -1.133 1
1 139 . 19 1 1 A 17 17 LEU CB C 17 40.290 42.342 -2.052 1
1 143 . 19 1 1 A 17 17 LEU N N 17 127.415 127.714 -0.299 1
1 144 . 19 1 1 A 18 18 ALA H H 18 8.647 8.351 0.296 1
1 145 . 19 1 1 A 18 18 ALA HA H 18 4.106 4.057 0.049 1
1 149 . 19 1 1 A 18 18 ALA C C 18 178.236 177.443 0.793 1
1 150 . 19 1 1 A 18 18 ALA CA C 18 53.926 54.235 -0.309 1
1 151 . 19 1 1 A 18 18 ALA CB C 18 18.876 19.203 -0.327 1
1 152 . 19 1 1 A 18 18 ALA N N 18 133.362 130.084 3.278 1
1 153 . 19 1 1 A 19 19 ALA H H 19 7.772 7.134 0.638 1
1 154 . 19 1 1 A 19 19 ALA HA H 19 4.561 4.662 -0.101 1
1 158 . 19 1 1 A 19 19 ALA C C 19 176.032 174.917 1.115 1
1 159 . 19 1 1 A 19 19 ALA CA C 19 53.011 51.606 1.405 1
1 160 . 19 1 1 A 19 19 ALA CB C 19 21.869 22.498 -0.629 1
1 161 . 19 1 1 A 19 19 ALA N N 19 115.654 116.652 -0.998 1
1 162 . 19 1 1 A 20 20 VAL H H 20 8.697 8.859 -0.162 1
1 163 . 19 1 1 A 20 20 VAL HA H 20 4.951 4.731 0.220 1
1 171 . 19 1 1 A 20 20 VAL C C 20 174.314 174.176 0.138 1
1 172 . 19 1 1 A 20 20 VAL CA C 20 61.352 60.472 0.880 1
1 173 . 19 1 1 A 20 20 VAL CB C 20 35.394 33.145 2.249 1
1 176 . 19 1 1 A 20 20 VAL N N 20 120.848 123.084 -2.236 1
1 177 . 19 1 1 A 21 21 THR H H 21 9.198 8.485 0.713 1
1 178 . 19 1 1 A 21 21 THR HA H 21 4.941 4.755 0.186 1
1 183 . 19 1 1 A 21 21 THR C C 21 174.416 174.613 -0.197 1
1 184 . 19 1 1 A 21 21 THR CA C 21 60.347 58.936 1.411 1
1 185 . 19 1 1 A 21 21 THR CB C 21 68.713 71.766 -3.053 1
1 187 . 19 1 1 A 21 21 THR N N 21 120.326 125.220 -4.894 1
1 188 . 19 1 1 A 22 22 PRO HA H 22 4.634 4.565 0.069 1
1 194 . 19 1 1 A 22 22 PRO C C 22 173.606 177.288 -3.682 1
1 195 . 19 1 1 A 22 22 PRO CA C 22 66.519 64.311 2.208 1
1 196 . 19 1 1 A 22 22 PRO CB C 22 32.078 31.698 0.380 1
1 199 . 19 1 1 A 23 23 ARG H H 23 6.621 8.411 -1.790 1
1 200 . 19 1 1 A 23 23 ARG HA H 23 4.591 4.534 0.057 1
1 207 . 19 1 1 A 23 23 ARG C C 23 176.554 175.480 1.074 1
1 208 . 19 1 1 A 23 23 ARG CA C 23 53.892 55.865 -1.973 1
1 209 . 19 1 1 A 23 23 ARG CB C 23 33.498 32.023 1.475 1
1 212 . 19 1 1 A 23 23 ARG N N 23 102.938 115.800 -12.862 1
1 213 . 19 1 1 A 24 24 THR H H 24 7.352 7.818 -0.466 1
1 214 . 19 1 1 A 24 24 THR HA H 24 5.593 5.126 0.467 1
1 219 . 19 1 1 A 24 24 THR C C 24 172.345 172.169 0.176 1
1 220 . 19 1 1 A 24 24 THR CA C 24 59.311 60.956 -1.645 1
1 221 . 19 1 1 A 24 24 THR CB C 24 73.311 72.038 1.273 1
1 223 . 19 1 1 A 24 24 THR N N 24 108.792 109.618 -0.826 1
1 224 . 19 1 1 A 25 25 VAL H H 25 8.437 8.636 -0.199 1
1 225 . 19 1 1 A 25 25 VAL HA H 25 4.512 4.887 -0.375 1
1 233 . 19 1 1 A 25 25 VAL C C 25 172.854 174.038 -1.184 1
1 234 . 19 1 1 A 25 25 VAL CA C 25 61.617 60.950 0.667 1
1 235 . 19 1 1 A 25 25 VAL CB C 25 36.742 34.821 1.921 1
1 238 . 19 1 1 A 25 25 VAL N N 25 117.023 120.974 -3.951 1
1 239 . 19 1 1 A 26 26 HIS H H 26 8.915 8.518 0.397 1
1 240 . 19 1 1 A 26 26 HIS HA H 26 5.765 5.686 0.079 1
1 245 . 19 1 1 A 26 26 HIS C C 26 173.976 172.621 1.355 1
1 246 . 19 1 1 A 26 26 HIS CA C 26 52.896 53.715 -0.819 1
1 247 . 19 1 1 A 26 26 HIS CB C 26 34.004 32.909 1.095 1
1 250 . 19 1 1 A 26 26 HIS N N 26 128.155 127.382 0.773 1
1 251 . 19 1 1 A 27 27 LEU H H 27 9.034 9.210 -0.176 1
1 252 . 19 1 1 A 27 27 LEU HA H 27 5.505 5.314 0.191 1
1 262 . 19 1 1 A 27 27 LEU C C 27 174.821 175.289 -0.468 1
1 263 . 19 1 1 A 27 27 LEU CA C 27 53.376 53.464 -0.088 1
1 264 . 19 1 1 A 27 27 LEU CB C 27 46.306 45.349 0.957 1
1 268 . 19 1 1 A 27 27 LEU N N 27 128.569 130.595 -2.026 1
1 269 . 19 1 1 A 28 28 THR H H 28 8.844 8.728 0.116 1
1 270 . 19 1 1 A 28 28 THR HA H 28 4.485 4.977 -0.492 1
1 275 . 19 1 1 A 28 28 THR C C 28 172.773 173.748 -0.975 1
1 276 . 19 1 1 A 28 28 THR CA C 28 60.052 59.647 0.405 1
1 277 . 19 1 1 A 28 28 THR CB C 28 71.704 71.370 0.334 1
1 279 . 19 1 1 A 28 28 THR N N 28 112.165 115.598 -3.433 1
1 280 . 19 1 1 A 29 29 TRP H H 29 7.395 7.784 -0.389 1
1 281 . 19 1 1 A 29 29 TRP HA H 29 4.915 5.657 -0.742 1
1 290 . 19 1 1 A 29 29 TRP C C 29 174.013 174.645 -0.632 1
1 291 . 19 1 1 A 29 29 TRP CA C 29 56.626 54.371 2.255 1
1 292 . 19 1 1 A 29 29 TRP CB C 29 29.487 32.083 -2.596 1
1 298 . 19 1 1 A 29 29 TRP N N 29 115.623 120.050 -4.427 1
1 300 . 19 1 1 A 30 30 GLN H H 30 8.759 8.482 0.277 1
1 301 . 19 1 1 A 30 30 GLN HA H 30 4.641 4.732 -0.091 1
1 308 . 19 1 1 A 30 30 GLN C C 30 175.072 174.335 0.737 1
1 309 . 19 1 1 A 30 30 GLN CA C 30 52.975 53.964 -0.989 1
1 310 . 19 1 1 A 30 30 GLN CB C 30 28.398 28.336 0.062 1
1 312 . 19 1 1 A 30 30 GLN N N 30 117.497 120.032 -2.535 1
1 314 . 19 1 1 A 31 31 PRO HA H 31 4.487 4.665 -0.178 1
1 320 . 19 1 1 A 31 31 PRO C C 31 177.034 177.124 -0.090 1
1 321 . 19 1 1 A 31 31 PRO CA C 31 62.710 62.970 -0.260 1
1 322 . 19 1 1 A 31 31 PRO CB C 31 32.738 32.337 0.401 1
1 325 . 19 1 1 A 32 32 SER H H 32 8.259 8.637 -0.378 1
1 326 . 19 1 1 A 32 32 SER HA H 32 4.670 4.761 -0.091 1
1 329 . 19 1 1 A 32 32 SER C C 32 174.689 174.099 0.590 1
1 330 . 19 1 1 A 32 32 SER CA C 32 57.296 59.297 -2.001 1
1 331 . 19 1 1 A 32 32 SER CB C 32 64.748 64.275 0.473 1
1 332 . 19 1 1 A 32 32 SER N N 32 117.667 118.794 -1.127 1
1 333 . 19 1 1 A 33 33 ALA H H 33 9.038 8.478 0.560 1
1 334 . 19 1 1 A 33 33 ALA HA H 33 4.126 4.595 -0.469 1
1 338 . 19 1 1 A 33 33 ALA C C 33 177.795 177.733 0.062 1
1 339 . 19 1 1 A 33 33 ALA CA C 33 54.213 51.428 2.785 1
1 340 . 19 1 1 A 33 33 ALA CB C 33 17.948 17.681 0.267 1
1 341 . 19 1 1 A 33 33 ALA N N 33 131.772 126.707 5.065 1
1 342 . 19 1 1 A 34 34 GLY H H 34 8.576 8.081 0.495 1
1 343 . 19 1 1 A 34 34 GLY HA2 H 34 4.171 4.041 0.130 1
1 344 . 19 1 1 A 34 34 GLY HA3 H 34 3.592 4.044 -0.452 1
1 345 . 19 1 1 A 34 34 GLY C C 34 174.182 174.456 -0.274 1
1 346 . 19 1 1 A 34 34 GLY CA C 34 44.987 45.324 -0.337 1
1 347 . 19 1 1 A 34 34 GLY N N 34 111.339 109.705 1.634 1
1 348 . 19 1 1 A 35 35 ALA H H 35 7.637 7.782 -0.145 1
1 349 . 19 1 1 A 35 35 ALA HA H 35 4.210 4.156 0.054 1
1 353 . 19 1 1 A 35 35 ALA C C 35 178.918 177.577 1.341 1
1 354 . 19 1 1 A 35 35 ALA CA C 35 52.671 52.455 0.216 1
1 355 . 19 1 1 A 35 35 ALA CB C 35 18.988 19.387 -0.399 1
1 356 . 19 1 1 A 35 35 ALA N N 35 121.531 123.315 -1.784 1
1 357 . 19 1 1 A 36 36 THR H H 36 9.428 8.708 0.720 1
1 358 . 19 1 1 A 36 36 THR HA H 36 4.402 4.323 0.079 1
1 363 . 19 1 1 A 36 36 THR C C 36 174.739 174.320 0.419 1
1 364 . 19 1 1 A 36 36 THR CA C 36 62.692 63.112 -0.420 1
1 365 . 19 1 1 A 36 36 THR CB C 36 69.482 70.088 -0.606 1
1 367 . 19 1 1 A 36 36 THR N N 36 113.103 117.050 -3.947 1
1 368 . 19 1 1 A 37 37 HIS H H 37 7.857 6.794 1.063 1
1 369 . 19 1 1 A 37 37 HIS HA H 37 4.878 4.855 0.023 1
1 374 . 19 1 1 A 37 37 HIS C C 37 171.103 172.193 -1.090 1
1 375 . 19 1 1 A 37 37 HIS CA C 37 55.867 54.012 1.855 1
1 376 . 19 1 1 A 37 37 HIS CB C 37 32.655 32.890 -0.235 1
1 379 . 19 1 1 A 37 37 HIS N N 37 118.486 116.052 2.434 1
1 380 . 19 1 1 A 38 38 TYR H H 38 9.217 8.995 0.222 1
1 381 . 19 1 1 A 38 38 TYR HA H 38 5.303 5.112 0.191 1
1 388 . 19 1 1 A 38 38 TYR C C 38 173.922 174.665 -0.743 1
1 389 . 19 1 1 A 38 38 TYR CA C 38 56.504 56.359 0.145 1
1 390 . 19 1 1 A 38 38 TYR CB C 38 41.823 42.913 -1.090 1
1 395 . 19 1 1 A 38 38 TYR N N 38 114.077 118.852 -4.775 1
1 396 . 19 1 1 A 39 39 LEU H H 39 9.052 9.089 -0.037 1
1 397 . 19 1 1 A 39 39 LEU HA H 39 5.061 5.208 -0.147 1
1 407 . 19 1 1 A 39 39 LEU C C 39 175.455 174.586 0.869 1
1 408 . 19 1 1 A 39 39 LEU CA C 39 53.855 53.875 -0.020 1
1 409 . 19 1 1 A 39 39 LEU CB C 39 45.254 44.933 0.321 1
1 413 . 19 1 1 A 39 39 LEU N N 39 123.997 124.219 -0.222 1
1 414 . 19 1 1 A 40 40 VAL H H 40 9.520 9.365 0.155 1
1 415 . 19 1 1 A 40 40 VAL HA H 40 4.988 4.693 0.295 1
1 423 . 19 1 1 A 40 40 VAL C C 40 174.578 174.786 -0.208 1
1 424 . 19 1 1 A 40 40 VAL CA C 40 60.575 61.597 -1.022 1
1 425 . 19 1 1 A 40 40 VAL CB C 40 33.284 33.554 -0.270 1
1 428 . 19 1 1 A 40 40 VAL N N 40 129.678 128.038 1.640 1
1 429 . 19 1 1 A 41 41 ARG H H 41 9.096 8.925 0.171 1
1 430 . 19 1 1 A 41 41 ARG HA H 41 5.384 5.253 0.131 1
1 437 . 19 1 1 A 41 41 ARG C C 41 175.100 174.291 0.809 1
1 438 . 19 1 1 A 41 41 ARG CA C 41 54.297 54.646 -0.349 1
1 439 . 19 1 1 A 41 41 ARG CB C 41 33.003 31.785 1.218 1
1 442 . 19 1 1 A 41 41 ARG N N 41 126.332 126.989 -0.657 1
1 443 . 19 1 1 A 42 42 CYS H H 42 9.004 9.049 -0.045 1
1 444 . 19 1 1 A 42 42 CYS HA H 42 5.309 5.076 0.233 1
1 447 . 19 1 1 A 42 42 CYS C C 42 173.417 173.750 -0.333 1
1 448 . 19 1 1 A 42 42 CYS CA C 42 57.508 57.595 -0.087 1
1 449 . 19 1 1 A 42 42 CYS CB C 42 28.859 29.495 -0.636 1
1 450 . 19 1 1 A 42 42 CYS N N 42 123.359 126.060 -2.701 1
1 451 . 19 1 1 A 43 43 SER H H 43 9.102 8.913 0.189 1
1 452 . 19 1 1 A 43 43 SER HA H 43 5.324 5.112 0.212 1
1 455 . 19 1 1 A 43 43 SER C C 43 171.429 172.009 -0.580 1
1 456 . 19 1 1 A 43 43 SER CA C 43 55.621 55.380 0.241 1
1 457 . 19 1 1 A 43 43 SER CB C 43 64.856 65.985 -1.129 1
1 458 . 19 1 1 A 43 43 SER N N 43 125.444 121.705 3.739 1
1 459 . 19 1 1 A 44 44 PRO HA H 44 4.389 4.735 -0.346 1
1 466 . 19 1 1 A 44 44 PRO C C 44 176.559 177.212 -0.653 1
1 467 . 19 1 1 A 44 44 PRO CA C 44 63.027 62.852 0.175 1
1 468 . 19 1 1 A 44 44 PRO CB C 44 31.935 32.811 -0.876 1
1 471 . 19 1 1 A 45 45 ALA H H 45 8.261 7.961 0.300 1
1 472 . 19 1 1 A 45 45 ALA HA H 45 4.157 4.112 0.045 1
1 476 . 19 1 1 A 45 45 ALA C C 45 177.706 178.130 -0.424 1
1 477 . 19 1 1 A 45 45 ALA CA C 45 53.284 54.517 -1.233 1
1 478 . 19 1 1 A 45 45 ALA CB C 45 18.978 19.192 -0.214 1
1 479 . 19 1 1 A 45 45 ALA N N 45 126.162 124.381 1.781 1
1 480 . 19 1 1 A 46 46 SER H H 46 8.275 7.658 0.617 1
1 481 . 19 1 1 A 46 46 SER HA H 46 4.779 4.612 0.167 1
1 484 . 19 1 1 A 46 46 SER C C 46 172.182 174.340 -2.158 1
1 485 . 19 1 1 A 46 46 SER CA C 46 55.091 56.415 -1.324 1
1 486 . 19 1 1 A 46 46 SER CB C 46 63.130 63.063 0.067 1
1 487 . 19 1 1 A 46 46 SER N N 46 113.009 111.773 1.236 1
1 488 . 19 1 1 A 47 47 PRO HA H 47 4.336 4.511 -0.175 1
1 493 . 19 1 1 A 47 47 PRO C C 47 177.165 177.864 -0.699 1
1 494 . 19 1 1 A 47 47 PRO CA C 47 63.268 64.044 -0.776 1
1 495 . 19 1 1 A 47 47 PRO CB C 47 32.528 31.843 0.685 1
1 498 . 19 1 1 A 48 48 LYS H H 48 9.089 8.756 0.333 1
1 499 . 19 1 1 A 48 48 LYS HA H 48 4.408 4.057 0.351 1
1 508 . 19 1 1 A 48 48 LYS C C 48 176.917 177.110 -0.193 1
1 509 . 19 1 1 A 48 48 LYS CA C 48 55.893 58.981 -3.088 1
1 510 . 19 1 1 A 48 48 LYS CB C 48 32.997 32.459 0.538 1
1 514 . 19 1 1 A 48 48 LYS N N 48 122.579 118.691 3.888 1
1 515 . 19 1 1 A 49 49 GLY HA2 H 49 4.021 4.116 -0.095 1
1 516 . 19 1 1 A 49 49 GLY HA3 H 49 3.881 4.120 -0.239 1
1 517 . 19 1 1 A 49 49 GLY C C 49 174.552 173.420 1.132 1
1 518 . 19 1 1 A 49 49 GLY CA C 49 46.011 44.896 1.115 1
1 519 . 19 1 1 A 50 50 GLU H H 50 8.608 8.856 -0.248 1
1 520 . 19 1 1 A 50 50 GLU HA H 50 4.335 4.591 -0.256 1
1 525 . 19 1 1 A 50 50 GLU C C 50 176.672 176.089 0.583 1
1 526 . 19 1 1 A 50 50 GLU CA C 50 56.978 55.864 1.114 1
1 527 . 19 1 1 A 50 50 GLU CB C 50 29.458 29.842 -0.384 1
1 529 . 19 1 1 A 50 50 GLU N N 50 121.378 125.688 -4.310 1
1 530 . 19 1 1 A 51 51 GLU H H 51 8.287 7.712 0.575 1
1 531 . 19 1 1 A 51 51 GLU HA H 51 4.381 4.473 -0.092 1
1 536 . 19 1 1 A 51 51 GLU C C 51 176.218 176.591 -0.373 1
1 537 . 19 1 1 A 51 51 GLU CA C 51 56.996 55.608 1.388 1
1 538 . 19 1 1 A 51 51 GLU CB C 51 31.066 30.232 0.834 1
1 540 . 19 1 1 A 51 51 GLU N N 51 120.863 119.547 1.316 1
1 541 . 19 1 1 A 52 52 GLU H H 52 8.445 8.439 0.006 1
1 542 . 19 1 1 A 52 52 GLU HA H 52 4.464 4.194 0.270 1
1 547 . 19 1 1 A 52 52 GLU C C 52 176.128 176.795 -0.667 1
1 548 . 19 1 1 A 52 52 GLU CA C 52 55.955 57.659 -1.704 1
1 549 . 19 1 1 A 52 52 GLU CB C 52 31.691 29.941 1.750 1
1 551 . 19 1 1 A 52 52 GLU N N 52 121.103 122.257 -1.154 1
1 552 . 19 1 1 A 53 53 GLU H H 53 8.441 8.633 -0.192 1
1 553 . 19 1 1 A 53 53 GLU HA H 53 4.609 4.412 0.197 1
1 558 . 19 1 1 A 53 53 GLU C C 53 175.816 176.173 -0.357 1
1 559 . 19 1 1 A 53 53 GLU CA C 53 56.697 56.667 0.030 1
1 560 . 19 1 1 A 53 53 GLU CB C 53 31.022 30.321 0.701 1
1 562 . 19 1 1 A 53 53 GLU N N 53 121.949 122.544 -0.595 1
1 563 . 19 1 1 A 54 54 ARG H H 54 8.569 8.512 0.057 1
1 564 . 19 1 1 A 54 54 ARG HA H 54 4.768 4.591 0.177 1
1 571 . 19 1 1 A 54 54 ARG C C 54 174.881 175.109 -0.228 1
1 572 . 19 1 1 A 54 54 ARG CA C 54 54.950 56.299 -1.349 1
1 573 . 19 1 1 A 54 54 ARG CB C 54 33.374 31.328 2.046 1
1 576 . 19 1 1 A 54 54 ARG N N 54 123.714 123.245 0.469 1
1 577 . 19 1 1 A 55 55 GLU H H 55 8.650 8.666 -0.016 1
1 578 . 19 1 1 A 55 55 GLU HA H 55 5.493 5.200 0.293 1
1 583 . 19 1 1 A 55 55 GLU C C 55 175.566 174.871 0.695 1
1 584 . 19 1 1 A 55 55 GLU CA C 55 54.915 55.010 -0.095 1
1 585 . 19 1 1 A 55 55 GLU CB C 55 33.250 32.323 0.927 1
1 587 . 19 1 1 A 55 55 GLU N N 55 123.537 124.275 -0.738 1
1 588 . 19 1 1 A 56 56 VAL H H 56 9.419 8.753 0.666 1
1 589 . 19 1 1 A 56 56 VAL HA H 56 4.524 4.982 -0.458 1
1 597 . 19 1 1 A 56 56 VAL C C 56 173.502 174.327 -0.825 1
1 598 . 19 1 1 A 56 56 VAL CA C 56 60.981 58.721 2.260 1
1 599 . 19 1 1 A 56 56 VAL CB C 56 36.117 35.719 0.398 1
1 602 . 19 1 1 A 56 56 VAL N N 56 123.343 117.773 5.570 1
1 603 . 19 1 1 A 57 57 GLN H H 57 8.767 8.776 -0.009 1
1 604 . 19 1 1 A 57 57 GLN HA H 57 5.671 5.441 0.230 1
1 611 . 19 1 1 A 57 57 GLN C C 57 176.357 175.013 1.344 1
1 612 . 19 1 1 A 57 57 GLN CA C 57 54.735 54.235 0.500 1
1 613 . 19 1 1 A 57 57 GLN CB C 57 30.781 32.175 -1.394 1
1 615 . 19 1 1 A 57 57 GLN N N 57 125.639 120.890 4.749 1
1 617 . 19 1 1 A 58 58 VAL H H 58 9.217 8.865 0.352 1
1 618 . 19 1 1 A 58 58 VAL HA H 58 5.129 4.857 0.272 1
1 626 . 19 1 1 A 58 58 VAL C C 58 175.925 176.508 -0.583 1
1 627 . 19 1 1 A 58 58 VAL CA C 58 59.652 59.917 -0.265 1
1 628 . 19 1 1 A 58 58 VAL CB C 58 36.540 35.442 1.098 1
1 631 . 19 1 1 A 58 58 VAL N N 58 117.022 118.142 -1.120 1
1 632 . 19 1 1 A 59 59 GLY H H 59 9.008 8.893 0.115 1
1 633 . 19 1 1 A 59 59 GLY HA2 H 59 4.670 3.898 0.772 1
1 634 . 19 1 1 A 59 59 GLY HA3 H 59 3.914 3.902 0.012 1
1 635 . 19 1 1 A 59 59 GLY C C 59 173.386 173.996 -0.610 1
1 636 . 19 1 1 A 59 59 GLY CA C 59 45.093 46.799 -1.706 1
1 637 . 19 1 1 A 59 59 GLY N N 59 109.174 111.252 -2.078 1
1 638 . 19 1 1 A 60 60 ARG H H 60 7.695 7.975 -0.280 1
1 639 . 19 1 1 A 60 60 ARG HA H 60 4.866 4.956 -0.090 1
1 645 . 19 1 1 A 60 60 ARG C C 60 173.760 176.156 -2.396 1
1 646 . 19 1 1 A 60 60 ARG CA C 60 52.764 53.218 -0.454 1
1 647 . 19 1 1 A 60 60 ARG CB C 60 31.785 31.340 0.445 1
1 650 . 19 1 1 A 60 60 ARG N N 60 118.520 120.179 -1.659 1
1 651 . 19 1 1 A 61 61 PRO HA H 61 3.539 3.841 -0.302 1
1 658 . 19 1 1 A 61 61 PRO C C 61 173.175 173.909 -0.734 1
1 659 . 19 1 1 A 61 61 PRO CA C 61 62.265 62.958 -0.693 1
1 660 . 19 1 1 A 61 61 PRO CB C 61 27.546 30.817 -3.271 1
1 663 . 19 1 1 A 62 62 GLU H H 62 7.879 7.888 -0.009 1
1 664 . 19 1 1 A 62 62 GLU HA H 62 4.071 4.617 -0.546 1
1 669 . 19 1 1 A 62 62 GLU C C 62 174.107 174.649 -0.542 1
1 670 . 19 1 1 A 62 62 GLU CA C 62 55.229 54.780 0.449 1
1 671 . 19 1 1 A 62 62 GLU CB C 62 32.838 31.808 1.030 1
1 673 . 19 1 1 A 62 62 GLU N N 62 118.173 114.154 4.019 1
1 674 . 19 1 1 A 63 63 VAL H H 63 8.930 8.618 0.312 1
1 675 . 19 1 1 A 63 63 VAL HA H 63 4.548 4.999 -0.451 1
1 683 . 19 1 1 A 63 63 VAL C C 63 170.325 173.281 -2.956 1
1 684 . 19 1 1 A 63 63 VAL CA C 63 60.770 59.554 1.216 1
1 685 . 19 1 1 A 63 63 VAL CB C 63 35.394 35.461 -0.067 1
1 688 . 19 1 1 A 63 63 VAL N N 63 117.161 124.711 -7.550 1
1 689 . 19 1 1 A 64 64 LEU H H 64 8.332 8.699 -0.367 1
1 690 . 19 1 1 A 64 64 LEU HA H 64 5.122 5.055 0.067 1
1 700 . 19 1 1 A 64 64 LEU C C 64 176.243 174.578 1.665 1
1 701 . 19 1 1 A 64 64 LEU CA C 64 53.346 53.777 -0.431 1
1 702 . 19 1 1 A 64 64 LEU CB C 64 42.649 45.169 -2.520 1
1 706 . 19 1 1 A 64 64 LEU N N 64 130.510 128.068 2.442 1
1 707 . 19 1 1 A 65 65 LEU H H 65 9.261 9.432 -0.171 1
1 708 . 19 1 1 A 65 65 LEU HA H 65 4.443 4.938 -0.495 1
1 718 . 19 1 1 A 65 65 LEU C C 65 174.016 175.975 -1.959 1
1 719 . 19 1 1 A 65 65 LEU CA C 65 53.920 53.828 0.092 1
1 720 . 19 1 1 A 65 65 LEU CB C 65 42.976 43.117 -0.141 1
1 724 . 19 1 1 A 65 65 LEU N N 65 128.611 128.678 -0.067 1
1 725 . 19 1 1 A 66 66 ASP H H 66 8.105 8.595 -0.490 1
1 726 . 19 1 1 A 66 66 ASP HA H 66 5.207 4.995 0.212 1
1 729 . 19 1 1 A 66 66 ASP C C 66 176.161 176.037 0.124 1
1 730 . 19 1 1 A 66 66 ASP CA C 66 51.001 52.273 -1.272 1
1 731 . 19 1 1 A 66 66 ASP CB C 66 42.836 42.690 0.146 1
1 732 . 19 1 1 A 66 66 ASP N N 66 121.799 123.699 -1.900 1
1 733 . 19 1 1 A 67 67 GLY H H 67 8.688 8.800 -0.112 1
1 734 . 19 1 1 A 67 67 GLY HA2 H 67 3.923 3.869 0.054 1
1 735 . 19 1 1 A 67 67 GLY HA3 H 67 3.808 3.876 -0.068 1
1 736 . 19 1 1 A 67 67 GLY C C 67 175.500 174.011 1.489 1
1 737 . 19 1 1 A 67 67 GLY CA C 67 46.591 46.827 -0.236 1
1 738 . 19 1 1 A 67 67 GLY N N 67 106.518 110.323 -3.805 1
1 739 . 19 1 1 A 68 68 LEU H H 68 8.125 7.050 1.075 1
1 740 . 19 1 1 A 68 68 LEU HA H 68 4.252 4.876 -0.624 1
1 750 . 19 1 1 A 68 68 LEU C C 68 174.914 175.298 -0.384 1
1 751 . 19 1 1 A 68 68 LEU CA C 68 53.469 53.066 0.403 1
1 752 . 19 1 1 A 68 68 LEU CB C 68 40.422 45.475 -5.053 1
1 756 . 19 1 1 A 68 68 LEU N N 68 119.345 119.800 -0.455 1
1 757 . 19 1 1 A 69 69 GLU H H 69 8.207 8.487 -0.280 1
1 758 . 19 1 1 A 69 69 GLU HA H 69 4.908 4.842 0.066 1
1 763 . 19 1 1 A 69 69 GLU C C 69 174.464 174.128 0.336 1
1 764 . 19 1 1 A 69 69 GLU CA C 69 53.081 52.912 0.169 1
1 765 . 19 1 1 A 69 69 GLU CB C 69 31.538 31.032 0.506 1
1 767 . 19 1 1 A 69 69 GLU N N 69 119.486 120.660 -1.174 1
1 768 . 19 1 1 A 70 70 PRO HA H 70 4.866 4.324 0.542 1
1 775 . 19 1 1 A 70 70 PRO C C 70 178.285 177.216 1.069 1
1 776 . 19 1 1 A 70 70 PRO CA C 70 63.203 63.589 -0.386 1
1 777 . 19 1 1 A 70 70 PRO CB C 70 33.726 32.279 1.447 1
1 780 . 19 1 1 A 71 71 GLY H H 71 7.362 9.200 -1.838 1
1 781 . 19 1 1 A 71 71 GLY HA2 H 71 3.807 3.935 -0.128 1
1 782 . 19 1 1 A 71 71 GLY HA3 H 71 3.756 3.939 -0.183 1
1 783 . 19 1 1 A 71 71 GLY C C 71 174.664 173.754 0.910 1
1 784 . 19 1 1 A 71 71 GLY CA C 71 46.926 46.388 0.538 1
1 785 . 19 1 1 A 71 71 GLY N N 71 113.776 111.213 2.563 1
1 786 . 19 1 1 A 72 72 ARG H H 72 8.036 7.637 0.399 1
1 787 . 19 1 1 A 72 72 ARG HA H 72 4.597 4.857 -0.260 1
1 793 . 19 1 1 A 72 72 ARG C C 72 173.293 173.699 -0.406 1
1 794 . 19 1 1 A 72 72 ARG CA C 72 54.633 54.394 0.239 1
1 795 . 19 1 1 A 72 72 ARG CB C 72 33.704 33.252 0.452 1
1 798 . 19 1 1 A 72 72 ARG N N 72 119.611 119.776 -0.165 1
1 799 . 19 1 1 A 73 73 ASP H H 73 7.785 8.546 -0.761 1
1 800 . 19 1 1 A 73 73 ASP HA H 73 5.276 5.590 -0.314 1
1 803 . 19 1 1 A 73 73 ASP C C 73 175.904 175.339 0.565 1
1 804 . 19 1 1 A 73 73 ASP CA C 73 53.568 52.665 0.903 1
1 805 . 19 1 1 A 73 73 ASP CB C 73 42.970 43.001 -0.031 1
1 806 . 19 1 1 A 73 73 ASP N N 73 118.900 125.340 -6.440 1
1 807 . 19 1 1 A 74 74 TYR H H 74 9.516 9.398 0.118 1
1 808 . 19 1 1 A 74 74 TYR HA H 74 4.800 4.972 -0.172 1
1 815 . 19 1 1 A 74 74 TYR C C 74 174.631 174.935 -0.304 1
1 816 . 19 1 1 A 74 74 TYR CA C 74 58.548 56.227 2.321 1
1 817 . 19 1 1 A 74 74 TYR CB C 74 42.029 42.618 -0.589 1
1 822 . 19 1 1 A 74 74 TYR N N 74 121.903 120.833 1.070 1
1 823 . 19 1 1 A 75 75 GLU H H 75 9.248 9.085 0.163 1
1 824 . 19 1 1 A 75 75 GLU HA H 75 4.756 4.713 0.043 1
1 829 . 19 1 1 A 75 75 GLU C C 75 175.524 175.400 0.124 1
1 830 . 19 1 1 A 75 75 GLU CA C 75 55.621 55.797 -0.176 1
1 831 . 19 1 1 A 75 75 GLU CB C 75 30.778 29.875 0.903 1
1 833 . 19 1 1 A 75 75 GLU N N 75 122.425 123.108 -0.683 1
1 834 . 19 1 1 A 76 76 VAL H H 76 8.884 8.663 0.221 1
1 835 . 19 1 1 A 76 76 VAL HA H 76 5.246 4.743 0.503 1
1 843 . 19 1 1 A 76 76 VAL C C 76 174.800 175.217 -0.417 1
1 844 . 19 1 1 A 76 76 VAL CA C 76 60.199 62.264 -2.065 1
1 845 . 19 1 1 A 76 76 VAL CB C 76 33.449 31.694 1.755 1
1 848 . 19 1 1 A 76 76 VAL N N 76 126.853 126.702 0.151 1
1 849 . 19 1 1 A 77 77 SER H H 77 9.234 8.720 0.514 1
1 850 . 19 1 1 A 77 77 SER HA H 77 5.398 4.979 0.419 1
1 853 . 19 1 1 A 77 77 SER C C 77 173.138 173.979 -0.841 1
1 854 . 19 1 1 A 77 77 SER CA C 77 56.032 57.900 -1.868 1
1 855 . 19 1 1 A 77 77 SER CB C 77 66.374 63.861 2.513 1
1 856 . 19 1 1 A 77 77 SER N N 77 120.852 124.470 -3.618 1
1 857 . 19 1 1 A 78 78 VAL H H 78 9.092 8.663 0.429 1
1 858 . 19 1 1 A 78 78 VAL HA H 78 4.756 4.708 0.048 1
1 866 . 19 1 1 A 78 78 VAL C C 78 173.641 174.541 -0.900 1
1 867 . 19 1 1 A 78 78 VAL CA C 78 61.246 61.024 0.222 1
1 868 . 19 1 1 A 78 78 VAL CB C 78 34.467 32.673 1.794 1
1 871 . 19 1 1 A 78 78 VAL N N 78 122.453 127.738 -5.285 1
1 872 . 19 1 1 A 79 79 GLN H H 79 8.587 8.732 -0.145 1
1 873 . 19 1 1 A 79 79 GLN HA H 79 4.438 4.700 -0.262 1
1 880 . 19 1 1 A 79 79 GLN C C 79 174.999 174.854 0.145 1
1 881 . 19 1 1 A 79 79 GLN CA C 79 54.227 54.212 0.015 1
1 882 . 19 1 1 A 79 79 GLN CB C 79 33.587 32.394 1.193 1
1 884 . 19 1 1 A 79 79 GLN N N 79 125.619 126.660 -1.041 1
1 886 . 19 1 1 A 80 80 SER H H 80 8.623 8.775 -0.152 1
1 887 . 19 1 1 A 80 80 SER HA H 80 4.756 4.742 0.014 1
1 890 . 19 1 1 A 80 80 SER C C 80 172.264 174.487 -2.223 1
1 891 . 19 1 1 A 80 80 SER CA C 80 58.177 59.375 -1.198 1
1 892 . 19 1 1 A 80 80 SER CB C 80 63.920 64.158 -0.238 1
1 893 . 19 1 1 A 80 80 SER N N 80 122.844 123.634 -0.790 1
1 894 . 19 1 1 A 81 81 LEU H H 81 8.348 8.484 -0.136 1
1 895 . 19 1 1 A 81 81 LEU HA H 81 5.124 4.974 0.150 1
1 905 . 19 1 1 A 81 81 LEU C C 81 175.775 175.751 0.024 1
1 906 . 19 1 1 A 81 81 LEU CA C 81 54.033 53.342 0.691 1
1 907 . 19 1 1 A 81 81 LEU CB C 81 44.690 45.232 -0.542 1
1 911 . 19 1 1 A 81 81 LEU N N 81 123.191 124.615 -1.424 1
1 912 . 19 1 1 A 82 82 ARG H H 82 8.374 8.772 -0.398 1
1 913 . 19 1 1 A 82 82 ARG HA H 82 4.616 4.287 0.329 1
1 919 . 19 1 1 A 82 82 ARG C C 82 176.864 175.811 1.053 1
1 920 . 19 1 1 A 82 82 ARG CA C 82 55.868 57.023 -1.155 1
1 921 . 19 1 1 A 82 82 ARG CB C 82 32.322 33.292 -0.970 1
1 924 . 19 1 1 A 82 82 ARG N N 82 121.029 125.393 -4.364 1
1 925 . 19 1 1 A 83 83 GLY H H 83 8.309 7.952 0.357 1
1 926 . 19 1 1 A 83 83 GLY HA2 H 83 4.031 4.139 -0.108 1
1 927 . 19 1 1 A 83 83 GLY HA3 H 83 3.888 4.158 -0.270 1
1 928 . 19 1 1 A 83 83 GLY C C 83 174.562 174.521 0.041 1
1 929 . 19 1 1 A 83 83 GLY CA C 83 45.963 44.474 1.489 1
1 930 . 19 1 1 A 83 83 GLY N N 83 109.937 107.366 2.571 1
1 931 . 19 1 1 A 84 84 PRO HA H 84 4.573 4.514 0.059 1
1 938 . 19 1 1 A 84 84 PRO C C 84 176.533 175.447 1.086 1
1 939 . 19 1 1 A 84 84 PRO CA C 84 63.485 64.205 -0.720 1
1 940 . 19 1 1 A 84 84 PRO CB C 84 32.409 31.854 0.555 1
1 943 . 19 1 1 A 85 85 GLU H H 85 7.799 7.490 0.309 1
1 944 . 19 1 1 A 85 85 GLU HA H 85 4.369 4.888 -0.519 1
1 949 . 19 1 1 A 85 85 GLU C C 85 174.722 175.709 -0.987 1
1 950 . 19 1 1 A 85 85 GLU CA C 85 55.899 54.644 1.255 1
1 951 . 19 1 1 A 85 85 GLU CB C 85 31.911 32.967 -1.056 1
1 953 . 19 1 1 A 85 85 GLU N N 85 122.093 113.236 8.857 1
1 954 . 19 1 1 A 86 86 GLY H H 86 8.329 8.922 -0.593 1
1 955 . 19 1 1 A 86 86 GLY HA2 H 86 5.298 4.135 1.163 1
1 956 . 19 1 1 A 86 86 GLY HA3 H 86 3.559 4.148 -0.589 1
1 957 . 19 1 1 A 86 86 GLY C C 86 174.355 172.782 1.573 1
1 958 . 19 1 1 A 86 86 GLY CA C 86 44.034 44.083 -0.049 1
1 959 . 19 1 1 A 86 86 GLY N N 86 109.387 109.740 -0.353 1
1 960 . 19 1 1 A 87 87 SER H H 87 8.807 8.781 0.026 1
1 961 . 19 1 1 A 87 87 SER HA H 87 4.670 4.729 -0.059 1
1 964 . 19 1 1 A 87 87 SER C C 87 175.195 173.572 1.623 1
1 965 . 19 1 1 A 87 87 SER CA C 87 57.737 56.386 1.351 1
1 966 . 19 1 1 A 87 87 SER CB C 87 67.829 65.580 2.249 1
1 967 . 19 1 1 A 87 87 SER N N 87 117.698 115.423 2.275 1
1 968 . 19 1 1 A 88 88 GLU H H 88 8.754 8.170 0.584 1
1 969 . 19 1 1 A 88 88 GLU HA H 88 4.357 4.299 0.058 1
1 974 . 19 1 1 A 88 88 GLU C C 88 177.474 176.021 1.453 1
1 975 . 19 1 1 A 88 88 GLU CA C 88 57.525 56.400 1.125 1
1 976 . 19 1 1 A 88 88 GLU CB C 88 31.162 30.671 0.491 1
1 978 . 19 1 1 A 88 88 GLU N N 88 118.709 123.695 -4.986 1
1 979 . 19 1 1 A 89 89 ALA H H 89 8.855 8.486 0.369 1
1 980 . 19 1 1 A 89 89 ALA HA H 89 4.792 5.207 -0.415 1
1 984 . 19 1 1 A 89 89 ALA C C 89 178.379 176.172 2.207 1
1 985 . 19 1 1 A 89 89 ALA CA C 89 51.264 50.621 0.643 1
1 986 . 19 1 1 A 89 89 ALA CB C 89 20.040 20.601 -0.561 1
1 987 . 19 1 1 A 89 89 ALA N N 89 127.301 125.523 1.778 1
1 988 . 19 1 1 A 90 90 ARG H H 90 8.549 8.521 0.028 1
1 989 . 19 1 1 A 90 90 ARG HA H 90 4.658 5.062 -0.404 1
1 996 . 19 1 1 A 90 90 ARG C C 90 174.720 175.530 -0.810 1
1 997 . 19 1 1 A 90 90 ARG CA C 90 53.575 54.328 -0.753 1
1 998 . 19 1 1 A 90 90 ARG CB C 90 33.456 32.316 1.140 1
1 1001 . 19 1 1 A 90 90 ARG N N 90 121.289 123.233 -1.944 1
1 1002 . 19 1 1 A 91 91 GLY H H 91 8.396 9.113 -0.717 1
1 1003 . 19 1 1 A 91 91 GLY HA2 H 91 5.306 4.220 1.086 1
1 1004 . 19 1 1 A 91 91 GLY HA3 H 91 3.700 4.237 -0.537 1
1 1005 . 19 1 1 A 91 91 GLY C C 91 173.191 171.969 1.222 1
1 1006 . 19 1 1 A 91 91 GLY CA C 91 44.493 43.896 0.597 1
1 1007 . 19 1 1 A 91 91 GLY N N 91 108.579 112.813 -4.234 1
1 1008 . 19 1 1 A 92 92 ILE H H 92 8.891 8.303 0.588 1
1 1009 . 19 1 1 A 92 92 ILE HA H 92 4.499 4.927 -0.428 1
1 1019 . 19 1 1 A 92 92 ILE C C 92 171.877 173.788 -1.911 1
1 1020 . 19 1 1 A 92 92 ILE CA C 92 60.682 58.977 1.705 1
1 1021 . 19 1 1 A 92 92 ILE CB C 92 42.425 42.343 0.082 1
1 1025 . 19 1 1 A 92 92 ILE N N 92 118.313 122.668 -4.355 1
1 1026 . 19 1 1 A 93 93 ARG H H 93 7.980 8.478 -0.498 1
1 1027 . 19 1 1 A 93 93 ARG HA H 93 5.224 4.440 0.784 1
1 1034 . 19 1 1 A 93 93 ARG C C 93 175.072 174.984 0.088 1
1 1035 . 19 1 1 A 93 93 ARG CA C 93 54.499 56.770 -2.271 1
1 1036 . 19 1 1 A 93 93 ARG CB C 93 31.767 30.443 1.324 1
1 1039 . 19 1 1 A 93 93 ARG N N 93 124.879 129.882 -5.003 1
1 1040 . 19 1 1 A 94 94 ALA H H 94 9.064 8.634 0.430 1
1 1041 . 19 1 1 A 94 94 ALA HA H 94 4.731 4.988 -0.257 1
1 1045 . 19 1 1 A 94 94 ALA C C 94 174.494 177.014 -2.520 1
1 1046 . 19 1 1 A 94 94 ALA CA C 94 50.577 50.605 -0.028 1
1 1047 . 19 1 1 A 94 94 ALA CB C 94 23.082 20.063 3.019 1
1 1048 . 19 1 1 A 94 94 ALA N N 94 126.095 130.242 -4.147 1
1 1049 . 19 1 1 A 95 95 ARG H H 95 8.263 8.488 -0.225 1
1 1050 . 19 1 1 A 95 95 ARG HA H 95 5.548 5.024 0.524 1
1 1058 . 19 1 1 A 95 95 ARG C C 95 176.901 175.558 1.343 1
1 1059 . 19 1 1 A 95 95 ARG CA C 95 53.787 55.033 -1.246 1
1 1060 . 19 1 1 A 95 95 ARG CB C 95 32.426 31.661 0.765 1
1 1063 . 19 1 1 A 95 95 ARG N N 95 123.374 122.109 1.265 1
1 1065 . 19 1 1 A 96 96 THR H H 96 9.208 8.798 0.410 1
1 1066 . 19 1 1 A 96 96 THR HA H 96 4.461 4.917 -0.456 1
1 1071 . 19 1 1 A 96 96 THR CA C 96 58.248 58.772 -0.524 1
1 1072 . 19 1 1 A 96 96 THR CB C 96 68.466 70.993 -2.527 1
1 1074 . 19 1 1 A 96 96 THR N N 96 119.492 108.855 10.637 1
1 1075 . 19 1 1 A 97 97 PRO HA H 97 4.636 4.614 0.022 1
1 1082 . 19 1 1 A 97 97 PRO C C 97 175.725 175.917 -0.192 1
1 1083 . 19 1 1 A 97 97 PRO CA C 97 61.907 62.332 -0.425 1
1 1084 . 19 1 1 A 97 97 PRO CB C 97 32.590 33.394 -0.804 1
1 1087 . 19 1 1 A 98 98 THR H H 98 7.943 8.358 -0.415 1
1 1088 . 19 1 1 A 98 98 THR HA H 98 4.208 5.056 -0.848 1
1 1093 . 19 1 1 A 98 98 THR C C 98 175.058 172.464 2.594 1
1 1094 . 19 1 1 A 98 98 THR CA C 98 62.069 60.389 1.680 1
1 1095 . 19 1 1 A 98 98 THR CB C 98 69.719 70.991 -1.272 1
1 1097 . 19 1 1 A 98 98 THR N N 98 107.148 110.584 -3.436 1
1 1098 . 19 1 1 A 99 99 SER H H 99 8.163 8.964 -0.801 1
1 1099 . 19 1 1 A 99 99 SER HA H 99 4.524 5.078 -0.554 1
1 1102 . 19 1 1 A 99 99 SER C C 99 174.319 174.035 0.284 1
1 1103 . 19 1 1 A 99 99 SER CA C 99 58.107 57.352 0.755 1
1 1104 . 19 1 1 A 99 99 SER CB C 99 64.492 64.474 0.018 1
1 1105 . 19 1 1 A 99 99 SER N N 99 115.114 123.638 -8.524 1
1 1106 . 19 1 1 A 100 100 GLY H H 100 8.336 8.817 -0.481 1
1 1107 . 19 1 1 A 100 100 GLY HA2 H 100 4.222 4.190 0.032 1
1 1108 . 19 1 1 A 100 100 GLY HA3 H 100 4.222 4.191 0.031 1
1 1109 . 19 1 1 A 100 100 GLY C C 100 171.696 173.748 -2.052 1
1 1110 . 19 1 1 A 100 100 GLY CA C 100 44.617 44.758 -0.141 1
1 1111 . 19 1 1 A 100 100 GLY N N 100 110.678 113.189 -2.511 1
1 1112 . 19 1 1 A 101 101 PRO HA H 101 4.506 4.591 -0.085 1
1 1118 . 19 1 1 A 101 101 PRO CA C 101 63.358 62.459 0.899 1
1 1119 . 19 1 1 A 101 101 PRO CB C 101 32.313 33.317 -1.004 1
1 1 . 20 1 1 A 6 6 SER HA H 6 4.528 5.424 -0.896 1
1 3 . 20 1 1 A 6 6 SER CA C 6 58.373 56.694 1.679 1
1 4 . 20 1 1 A 6 6 SER CB C 6 63.978 64.830 -0.852 1
1 5 . 20 1 1 A 7 7 GLY H H 7 8.228 8.426 -0.198 1
1 6 . 20 1 1 A 7 7 GLY HA2 H 7 4.134 4.186 -0.052 1
1 7 . 20 1 1 A 7 7 GLY HA3 H 7 4.134 4.188 -0.054 1
1 8 . 20 1 1 A 7 7 GLY CA C 7 44.607 45.246 -0.639 1
1 9 . 20 1 1 A 7 7 GLY N N 7 110.638 110.016 0.622 1
1 10 . 20 1 1 A 8 8 PRO HA H 8 4.419 4.674 -0.255 1
1 17 . 20 1 1 A 8 8 PRO C C 8 176.908 175.313 1.595 1
1 18 . 20 1 1 A 8 8 PRO CA C 8 62.851 62.833 0.018 1
1 19 . 20 1 1 A 8 8 PRO CB C 8 32.243 31.696 0.547 1
1 22 . 20 1 1 A 9 9 LEU H H 9 8.462 8.515 -0.053 1
1 23 . 20 1 1 A 9 9 LEU HA H 9 4.494 4.943 -0.449 1
1 33 . 20 1 1 A 9 9 LEU C C 9 174.124 174.457 -0.333 1
1 34 . 20 1 1 A 9 9 LEU CA C 9 52.587 51.779 0.808 1
1 35 . 20 1 1 A 9 9 LEU CB C 9 43.150 43.577 -0.427 1
1 39 . 20 1 1 A 9 9 LEU N N 9 126.015 124.220 1.795 1
1 40 . 20 1 1 A 10 10 PRO HA H 10 4.820 4.571 0.249 1
1 47 . 20 1 1 A 10 10 PRO CA C 10 61.368 62.559 -1.191 1
1 48 . 20 1 1 A 10 10 PRO CB C 10 31.391 31.696 -0.305 1
1 51 . 20 1 1 A 11 11 PRO HA H 11 4.949 4.611 0.338 1
1 58 . 20 1 1 A 11 11 PRO CA C 11 61.183 61.785 -0.602 1
1 59 . 20 1 1 A 11 11 PRO CB C 11 30.656 31.932 -1.276 1
1 62 . 20 1 1 A 12 12 PRO HA H 12 4.341 4.636 -0.295 1
1 69 . 20 1 1 A 12 12 PRO C C 12 174.849 176.875 -2.026 1
1 70 . 20 1 1 A 12 12 PRO CA C 12 63.062 62.702 0.360 1
1 71 . 20 1 1 A 12 12 PRO CB C 12 31.831 31.538 0.293 1
1 74 . 20 1 1 A 13 13 ARG H H 13 7.828 8.379 -0.551 1
1 75 . 20 1 1 A 13 13 ARG HA H 13 4.536 4.424 0.112 1
1 82 . 20 1 1 A 13 13 ARG C C 13 174.608 176.215 -1.607 1
1 83 . 20 1 1 A 13 13 ARG CA C 13 54.774 56.850 -2.076 1
1 84 . 20 1 1 A 13 13 ARG CB C 13 33.250 31.493 1.757 1
1 87 . 20 1 1 A 13 13 ARG N N 13 120.532 119.574 0.958 1
1 88 . 20 1 1 A 14 14 ALA H H 14 8.694 7.811 0.883 1
1 89 . 20 1 1 A 14 14 ALA HA H 14 3.986 4.377 -0.391 1
1 93 . 20 1 1 A 14 14 ALA C C 14 177.232 176.605 0.627 1
1 94 . 20 1 1 A 14 14 ALA CA C 14 52.461 51.706 0.755 1
1 95 . 20 1 1 A 14 14 ALA CB C 14 16.806 17.225 -0.419 1
1 96 . 20 1 1 A 14 14 ALA N N 14 121.921 121.130 0.791 1
1 97 . 20 1 1 A 15 15 LEU H H 15 8.097 8.443 -0.346 1
1 98 . 20 1 1 A 15 15 LEU HA H 15 4.670 4.661 0.009 1
1 108 . 20 1 1 A 15 15 LEU C C 15 177.364 176.022 1.342 1
1 109 . 20 1 1 A 15 15 LEU CA C 15 57.543 54.806 2.737 1
1 110 . 20 1 1 A 15 15 LEU CB C 15 41.877 41.064 0.813 1
1 114 . 20 1 1 A 15 15 LEU N N 15 122.215 121.378 0.837 1
1 115 . 20 1 1 A 16 16 THR H H 16 9.520 9.246 0.274 1
1 116 . 20 1 1 A 16 16 THR HA H 16 4.369 4.945 -0.576 1
1 121 . 20 1 1 A 16 16 THR C C 16 172.453 173.083 -0.630 1
1 122 . 20 1 1 A 16 16 THR CA C 16 62.480 61.488 0.992 1
1 123 . 20 1 1 A 16 16 THR CB C 16 72.198 71.095 1.103 1
1 125 . 20 1 1 A 16 16 THR N N 16 122.214 120.073 2.141 1
1 126 . 20 1 1 A 17 17 LEU H H 17 8.847 8.690 0.157 1
1 127 . 20 1 1 A 17 17 LEU HA H 17 4.573 4.561 0.012 1
1 137 . 20 1 1 A 17 17 LEU C C 17 174.695 176.482 -1.787 1
1 138 . 20 1 1 A 17 17 LEU CA C 17 53.840 54.729 -0.889 1
1 139 . 20 1 1 A 17 17 LEU CB C 17 40.290 42.059 -1.769 1
1 143 . 20 1 1 A 17 17 LEU N N 17 127.415 127.504 -0.089 1
1 144 . 20 1 1 A 18 18 ALA H H 18 8.647 8.249 0.398 1
1 145 . 20 1 1 A 18 18 ALA HA H 18 4.106 4.069 0.037 1
1 149 . 20 1 1 A 18 18 ALA C C 18 178.236 177.518 0.718 1
1 150 . 20 1 1 A 18 18 ALA CA C 18 53.926 54.261 -0.335 1
1 151 . 20 1 1 A 18 18 ALA CB C 18 18.876 19.177 -0.301 1
1 152 . 20 1 1 A 18 18 ALA N N 18 133.362 129.865 3.497 1
1 153 . 20 1 1 A 19 19 ALA H H 19 7.772 7.573 0.199 1
1 154 . 20 1 1 A 19 19 ALA HA H 19 4.561 4.688 -0.127 1
1 158 . 20 1 1 A 19 19 ALA C C 19 176.032 174.525 1.507 1
1 159 . 20 1 1 A 19 19 ALA CA C 19 53.011 51.747 1.264 1
1 160 . 20 1 1 A 19 19 ALA CB C 19 21.869 22.833 -0.964 1
1 161 . 20 1 1 A 19 19 ALA N N 19 115.654 116.554 -0.900 1
1 162 . 20 1 1 A 20 20 VAL H H 20 8.697 8.846 -0.149 1
1 163 . 20 1 1 A 20 20 VAL HA H 20 4.951 4.829 0.122 1
1 171 . 20 1 1 A 20 20 VAL C C 20 174.314 174.149 0.165 1
1 172 . 20 1 1 A 20 20 VAL CA C 20 61.352 60.421 0.931 1
1 173 . 20 1 1 A 20 20 VAL CB C 20 35.394 33.877 1.517 1
1 176 . 20 1 1 A 20 20 VAL N N 20 120.848 121.612 -0.764 1
1 177 . 20 1 1 A 21 21 THR H H 21 9.198 8.468 0.730 1
1 178 . 20 1 1 A 21 21 THR HA H 21 4.941 4.777 0.164 1
1 183 . 20 1 1 A 21 21 THR C C 21 174.416 174.628 -0.212 1
1 184 . 20 1 1 A 21 21 THR CA C 21 60.347 59.002 1.345 1
1 185 . 20 1 1 A 21 21 THR CB C 21 68.713 71.872 -3.159 1
1 187 . 20 1 1 A 21 21 THR N N 21 120.326 125.262 -4.936 1
1 188 . 20 1 1 A 22 22 PRO HA H 22 4.634 4.561 0.073 1
1 194 . 20 1 1 A 22 22 PRO C C 22 173.606 177.139 -3.533 1
1 195 . 20 1 1 A 22 22 PRO CA C 22 66.519 64.248 2.271 1
1 196 . 20 1 1 A 22 22 PRO CB C 22 32.078 31.623 0.455 1
1 199 . 20 1 1 A 23 23 ARG H H 23 6.621 8.373 -1.752 1
1 200 . 20 1 1 A 23 23 ARG HA H 23 4.591 4.525 0.066 1
1 207 . 20 1 1 A 23 23 ARG C C 23 176.554 175.518 1.036 1
1 208 . 20 1 1 A 23 23 ARG CA C 23 53.892 55.946 -2.054 1
1 209 . 20 1 1 A 23 23 ARG CB C 23 33.498 32.253 1.245 1
1 212 . 20 1 1 A 23 23 ARG N N 23 102.938 115.798 -12.860 1
1 213 . 20 1 1 A 24 24 THR H H 24 7.352 7.915 -0.563 1
1 214 . 20 1 1 A 24 24 THR HA H 24 5.593 5.175 0.418 1
1 219 . 20 1 1 A 24 24 THR C C 24 172.345 172.254 0.091 1
1 220 . 20 1 1 A 24 24 THR CA C 24 59.311 60.701 -1.390 1
1 221 . 20 1 1 A 24 24 THR CB C 24 73.311 71.768 1.543 1
1 223 . 20 1 1 A 24 24 THR N N 24 108.792 109.470 -0.678 1
1 224 . 20 1 1 A 25 25 VAL H H 25 8.437 8.670 -0.233 1
1 225 . 20 1 1 A 25 25 VAL HA H 25 4.512 4.929 -0.417 1
1 233 . 20 1 1 A 25 25 VAL C C 25 172.854 174.044 -1.190 1
1 234 . 20 1 1 A 25 25 VAL CA C 25 61.617 60.939 0.678 1
1 235 . 20 1 1 A 25 25 VAL CB C 25 36.742 34.476 2.266 1
1 238 . 20 1 1 A 25 25 VAL N N 25 117.023 121.225 -4.202 1
1 239 . 20 1 1 A 26 26 HIS H H 26 8.915 8.684 0.231 1
1 240 . 20 1 1 A 26 26 HIS HA H 26 5.765 5.496 0.269 1
1 245 . 20 1 1 A 26 26 HIS C C 26 173.976 173.299 0.677 1
1 246 . 20 1 1 A 26 26 HIS CA C 26 52.896 53.694 -0.798 1
1 247 . 20 1 1 A 26 26 HIS CB C 26 34.004 32.870 1.134 1
1 250 . 20 1 1 A 26 26 HIS N N 26 128.155 127.694 0.461 1
1 251 . 20 1 1 A 27 27 LEU H H 27 9.034 9.061 -0.027 1
1 252 . 20 1 1 A 27 27 LEU HA H 27 5.505 5.078 0.427 1
1 262 . 20 1 1 A 27 27 LEU C C 27 174.821 174.630 0.191 1
1 263 . 20 1 1 A 27 27 LEU CA C 27 53.376 53.404 -0.028 1
1 264 . 20 1 1 A 27 27 LEU CB C 27 46.306 47.050 -0.744 1
1 268 . 20 1 1 A 27 27 LEU N N 27 128.569 128.954 -0.385 1
1 269 . 20 1 1 A 28 28 THR H H 28 8.844 8.628 0.216 1
1 270 . 20 1 1 A 28 28 THR HA H 28 4.485 4.828 -0.343 1
1 275 . 20 1 1 A 28 28 THR C C 28 172.773 173.671 -0.898 1
1 276 . 20 1 1 A 28 28 THR CA C 28 60.052 59.976 0.076 1
1 277 . 20 1 1 A 28 28 THR CB C 28 71.704 71.267 0.437 1
1 279 . 20 1 1 A 28 28 THR N N 28 112.165 113.548 -1.383 1
1 280 . 20 1 1 A 29 29 TRP H H 29 7.395 7.824 -0.429 1
1 281 . 20 1 1 A 29 29 TRP HA H 29 4.915 5.301 -0.386 1
1 290 . 20 1 1 A 29 29 TRP C C 29 174.013 174.272 -0.259 1
1 291 . 20 1 1 A 29 29 TRP CA C 29 56.626 54.527 2.099 1
1 292 . 20 1 1 A 29 29 TRP CB C 29 29.487 31.696 -2.209 1
1 298 . 20 1 1 A 29 29 TRP N N 29 115.623 119.895 -4.272 1
1 300 . 20 1 1 A 30 30 GLN H H 30 8.759 8.541 0.218 1
1 301 . 20 1 1 A 30 30 GLN HA H 30 4.641 4.774 -0.133 1
1 308 . 20 1 1 A 30 30 GLN C C 30 175.072 174.478 0.594 1
1 309 . 20 1 1 A 30 30 GLN CA C 30 52.975 53.369 -0.394 1
1 310 . 20 1 1 A 30 30 GLN CB C 30 28.398 28.795 -0.397 1
1 312 . 20 1 1 A 30 30 GLN N N 30 117.497 119.976 -2.479 1
1 314 . 20 1 1 A 31 31 PRO HA H 31 4.487 4.607 -0.120 1
1 320 . 20 1 1 A 31 31 PRO C C 31 177.034 176.658 0.376 1
1 321 . 20 1 1 A 31 31 PRO CA C 31 62.710 63.055 -0.345 1
1 322 . 20 1 1 A 31 31 PRO CB C 31 32.738 32.544 0.194 1
1 325 . 20 1 1 A 32 32 SER H H 32 8.259 8.768 -0.509 1
1 326 . 20 1 1 A 32 32 SER HA H 32 4.670 4.713 -0.043 1
1 329 . 20 1 1 A 32 32 SER C C 32 174.689 174.236 0.453 1
1 330 . 20 1 1 A 32 32 SER CA C 32 57.296 58.285 -0.989 1
1 331 . 20 1 1 A 32 32 SER CB C 32 64.748 64.095 0.653 1
1 332 . 20 1 1 A 32 32 SER N N 32 117.667 117.504 0.163 1
1 333 . 20 1 1 A 33 33 ALA H H 33 9.038 8.457 0.581 1
1 334 . 20 1 1 A 33 33 ALA HA H 33 4.126 4.516 -0.390 1
1 338 . 20 1 1 A 33 33 ALA C C 33 177.795 177.544 0.251 1
1 339 . 20 1 1 A 33 33 ALA CA C 33 54.213 51.309 2.904 1
1 340 . 20 1 1 A 33 33 ALA CB C 33 17.948 17.542 0.406 1
1 341 . 20 1 1 A 33 33 ALA N N 33 131.772 127.084 4.688 1
1 342 . 20 1 1 A 34 34 GLY H H 34 8.576 7.517 1.059 1
1 343 . 20 1 1 A 34 34 GLY HA2 H 34 4.171 3.997 0.174 1
1 344 . 20 1 1 A 34 34 GLY HA3 H 34 3.592 3.998 -0.406 1
1 345 . 20 1 1 A 34 34 GLY C C 34 174.182 174.527 -0.345 1
1 346 . 20 1 1 A 34 34 GLY CA C 34 44.987 45.474 -0.487 1
1 347 . 20 1 1 A 34 34 GLY N N 34 111.339 106.851 4.488 1
1 348 . 20 1 1 A 35 35 ALA H H 35 7.637 7.870 -0.233 1
1 349 . 20 1 1 A 35 35 ALA HA H 35 4.210 4.104 0.106 1
1 353 . 20 1 1 A 35 35 ALA C C 35 178.918 177.876 1.042 1
1 354 . 20 1 1 A 35 35 ALA CA C 35 52.671 52.431 0.240 1
1 355 . 20 1 1 A 35 35 ALA CB C 35 18.988 19.380 -0.392 1
1 356 . 20 1 1 A 35 35 ALA N N 35 121.531 123.405 -1.874 1
1 357 . 20 1 1 A 36 36 THR H H 36 9.428 8.073 1.355 1
1 358 . 20 1 1 A 36 36 THR HA H 36 4.402 4.233 0.169 1
1 363 . 20 1 1 A 36 36 THR C C 36 174.739 174.463 0.276 1
1 364 . 20 1 1 A 36 36 THR CA C 36 62.692 63.565 -0.873 1
1 365 . 20 1 1 A 36 36 THR CB C 36 69.482 70.023 -0.541 1
1 367 . 20 1 1 A 36 36 THR N N 36 113.103 116.411 -3.308 1
1 368 . 20 1 1 A 37 37 HIS H H 37 7.857 6.958 0.899 1
1 369 . 20 1 1 A 37 37 HIS HA H 37 4.878 4.896 -0.018 1
1 374 . 20 1 1 A 37 37 HIS C C 37 171.103 172.058 -0.955 1
1 375 . 20 1 1 A 37 37 HIS CA C 37 55.867 53.783 2.084 1
1 376 . 20 1 1 A 37 37 HIS CB C 37 32.655 33.314 -0.659 1
1 379 . 20 1 1 A 37 37 HIS N N 37 118.486 114.964 3.522 1
1 380 . 20 1 1 A 38 38 TYR H H 38 9.217 8.427 0.790 1
1 381 . 20 1 1 A 38 38 TYR HA H 38 5.303 5.150 0.153 1
1 388 . 20 1 1 A 38 38 TYR C C 38 173.922 174.449 -0.527 1
1 389 . 20 1 1 A 38 38 TYR CA C 38 56.504 56.506 -0.002 1
1 390 . 20 1 1 A 38 38 TYR CB C 38 41.823 42.189 -0.366 1
1 395 . 20 1 1 A 38 38 TYR N N 38 114.077 118.294 -4.217 1
1 396 . 20 1 1 A 39 39 LEU H H 39 9.052 8.865 0.187 1
1 397 . 20 1 1 A 39 39 LEU HA H 39 5.061 5.305 -0.244 1
1 407 . 20 1 1 A 39 39 LEU C C 39 175.455 174.629 0.826 1
1 408 . 20 1 1 A 39 39 LEU CA C 39 53.855 53.792 0.063 1
1 409 . 20 1 1 A 39 39 LEU CB C 39 45.254 44.450 0.804 1
1 413 . 20 1 1 A 39 39 LEU N N 39 123.997 125.020 -1.023 1
1 414 . 20 1 1 A 40 40 VAL H H 40 9.520 9.276 0.244 1
1 415 . 20 1 1 A 40 40 VAL HA H 40 4.988 4.577 0.411 1
1 423 . 20 1 1 A 40 40 VAL C C 40 174.578 174.887 -0.309 1
1 424 . 20 1 1 A 40 40 VAL CA C 40 60.575 61.435 -0.860 1
1 425 . 20 1 1 A 40 40 VAL CB C 40 33.284 32.832 0.452 1
1 428 . 20 1 1 A 40 40 VAL N N 40 129.678 128.878 0.800 1
1 429 . 20 1 1 A 41 41 ARG H H 41 9.096 8.788 0.308 1
1 430 . 20 1 1 A 41 41 ARG HA H 41 5.384 5.067 0.317 1
1 437 . 20 1 1 A 41 41 ARG C C 41 175.100 174.577 0.523 1
1 438 . 20 1 1 A 41 41 ARG CA C 41 54.297 55.398 -1.101 1
1 439 . 20 1 1 A 41 41 ARG CB C 41 33.003 31.064 1.939 1
1 442 . 20 1 1 A 41 41 ARG N N 41 126.332 127.222 -0.890 1
1 443 . 20 1 1 A 42 42 CYS H H 42 9.004 9.295 -0.291 1
1 444 . 20 1 1 A 42 42 CYS HA H 42 5.309 5.042 0.267 1
1 447 . 20 1 1 A 42 42 CYS C C 42 173.417 173.698 -0.281 1
1 448 . 20 1 1 A 42 42 CYS CA C 42 57.508 57.631 -0.123 1
1 449 . 20 1 1 A 42 42 CYS CB C 42 28.859 28.879 -0.020 1
1 450 . 20 1 1 A 42 42 CYS N N 42 123.359 125.958 -2.599 1
1 451 . 20 1 1 A 43 43 SER H H 43 9.102 8.903 0.199 1
1 452 . 20 1 1 A 43 43 SER HA H 43 5.324 5.203 0.121 1
1 455 . 20 1 1 A 43 43 SER C C 43 171.429 172.031 -0.602 1
1 456 . 20 1 1 A 43 43 SER CA C 43 55.621 55.295 0.326 1
1 457 . 20 1 1 A 43 43 SER CB C 43 64.856 65.872 -1.016 1
1 458 . 20 1 1 A 43 43 SER N N 43 125.444 122.799 2.645 1
1 459 . 20 1 1 A 44 44 PRO HA H 44 4.389 4.599 -0.210 1
1 466 . 20 1 1 A 44 44 PRO C C 44 176.559 177.309 -0.750 1
1 467 . 20 1 1 A 44 44 PRO CA C 44 63.027 62.649 0.378 1
1 468 . 20 1 1 A 44 44 PRO CB C 44 31.935 32.292 -0.357 1
1 471 . 20 1 1 A 45 45 ALA H H 45 8.261 8.372 -0.111 1
1 472 . 20 1 1 A 45 45 ALA HA H 45 4.157 4.236 -0.079 1
1 476 . 20 1 1 A 45 45 ALA C C 45 177.706 177.409 0.297 1
1 477 . 20 1 1 A 45 45 ALA CA C 45 53.284 53.239 0.045 1
1 478 . 20 1 1 A 45 45 ALA CB C 45 18.978 19.257 -0.279 1
1 479 . 20 1 1 A 45 45 ALA N N 45 126.162 123.498 2.664 1
1 480 . 20 1 1 A 46 46 SER H H 46 8.275 7.642 0.633 1
1 481 . 20 1 1 A 46 46 SER HA H 46 4.779 4.520 0.259 1
1 484 . 20 1 1 A 46 46 SER C C 46 172.182 174.039 -1.857 1
1 485 . 20 1 1 A 46 46 SER CA C 46 55.091 56.696 -1.605 1
1 486 . 20 1 1 A 46 46 SER CB C 46 63.130 63.174 -0.044 1
1 487 . 20 1 1 A 46 46 SER N N 46 113.009 115.457 -2.448 1
1 488 . 20 1 1 A 47 47 PRO HA H 47 4.336 4.507 -0.171 1
1 493 . 20 1 1 A 47 47 PRO C C 47 177.165 178.092 -0.927 1
1 494 . 20 1 1 A 47 47 PRO CA C 47 63.268 64.039 -0.771 1
1 495 . 20 1 1 A 47 47 PRO CB C 47 32.528 31.843 0.685 1
1 498 . 20 1 1 A 48 48 LYS H H 48 9.089 8.646 0.443 1
1 499 . 20 1 1 A 48 48 LYS HA H 48 4.408 4.028 0.380 1
1 508 . 20 1 1 A 48 48 LYS C C 48 176.917 177.570 -0.653 1
1 509 . 20 1 1 A 48 48 LYS CA C 48 55.893 59.287 -3.394 1
1 510 . 20 1 1 A 48 48 LYS CB C 48 32.997 32.184 0.813 1
1 514 . 20 1 1 A 48 48 LYS N N 48 122.579 118.549 4.030 1
1 515 . 20 1 1 A 49 49 GLY HA2 H 49 4.021 3.997 0.024 1
1 516 . 20 1 1 A 49 49 GLY HA3 H 49 3.881 4.000 -0.119 1
1 517 . 20 1 1 A 49 49 GLY C C 49 174.552 173.955 0.597 1
1 518 . 20 1 1 A 49 49 GLY CA C 49 46.011 44.950 1.061 1
1 519 . 20 1 1 A 50 50 GLU H H 50 8.608 9.139 -0.531 1
1 520 . 20 1 1 A 50 50 GLU HA H 50 4.335 4.440 -0.105 1
1 525 . 20 1 1 A 50 50 GLU C C 50 176.672 177.193 -0.521 1
1 526 . 20 1 1 A 50 50 GLU CA C 50 56.978 57.758 -0.780 1
1 527 . 20 1 1 A 50 50 GLU CB C 50 29.458 30.855 -1.397 1
1 529 . 20 1 1 A 50 50 GLU N N 50 121.378 124.815 -3.437 1
1 530 . 20 1 1 A 51 51 GLU H H 51 8.287 8.178 0.109 1
1 531 . 20 1 1 A 51 51 GLU HA H 51 4.381 4.394 -0.013 1
1 536 . 20 1 1 A 51 51 GLU C C 51 176.218 175.560 0.658 1
1 537 . 20 1 1 A 51 51 GLU CA C 51 56.996 55.693 1.303 1
1 538 . 20 1 1 A 51 51 GLU CB C 51 31.066 29.027 2.039 1
1 540 . 20 1 1 A 51 51 GLU N N 51 120.863 115.775 5.088 1
1 541 . 20 1 1 A 52 52 GLU H H 52 8.445 7.669 0.776 1
1 542 . 20 1 1 A 52 52 GLU HA H 52 4.464 4.810 -0.346 1
1 547 . 20 1 1 A 52 52 GLU C C 52 176.128 174.557 1.571 1
1 548 . 20 1 1 A 52 52 GLU CA C 52 55.955 55.059 0.896 1
1 549 . 20 1 1 A 52 52 GLU CB C 52 31.691 30.135 1.556 1
1 551 . 20 1 1 A 52 52 GLU N N 52 121.103 122.664 -1.561 1
1 552 . 20 1 1 A 53 53 GLU H H 53 8.441 8.717 -0.276 1
1 553 . 20 1 1 A 53 53 GLU HA H 53 4.609 5.001 -0.392 1
1 558 . 20 1 1 A 53 53 GLU C C 53 175.816 174.604 1.212 1
1 559 . 20 1 1 A 53 53 GLU CA C 53 56.697 54.777 1.920 1
1 560 . 20 1 1 A 53 53 GLU CB C 53 31.022 33.064 -2.042 1
1 562 . 20 1 1 A 53 53 GLU N N 53 121.949 126.266 -4.317 1
1 563 . 20 1 1 A 54 54 ARG H H 54 8.569 8.864 -0.295 1
1 564 . 20 1 1 A 54 54 ARG HA H 54 4.768 4.730 0.038 1
1 571 . 20 1 1 A 54 54 ARG C C 54 174.881 175.104 -0.223 1
1 572 . 20 1 1 A 54 54 ARG CA C 54 54.950 55.327 -0.377 1
1 573 . 20 1 1 A 54 54 ARG CB C 54 33.374 31.655 1.719 1
1 576 . 20 1 1 A 54 54 ARG N N 54 123.714 124.262 -0.548 1
1 577 . 20 1 1 A 55 55 GLU H H 55 8.650 8.906 -0.256 1
1 578 . 20 1 1 A 55 55 GLU HA H 55 5.493 4.875 0.618 1
1 583 . 20 1 1 A 55 55 GLU C C 55 175.566 175.494 0.072 1
1 584 . 20 1 1 A 55 55 GLU CA C 55 54.915 55.729 -0.814 1
1 585 . 20 1 1 A 55 55 GLU CB C 55 33.250 30.830 2.420 1
1 587 . 20 1 1 A 55 55 GLU N N 55 123.537 128.466 -4.929 1
1 588 . 20 1 1 A 56 56 VAL H H 56 9.419 9.009 0.410 1
1 589 . 20 1 1 A 56 56 VAL HA H 56 4.524 4.877 -0.353 1
1 597 . 20 1 1 A 56 56 VAL C C 56 173.502 174.559 -1.057 1
1 598 . 20 1 1 A 56 56 VAL CA C 56 60.981 60.400 0.581 1
1 599 . 20 1 1 A 56 56 VAL CB C 56 36.117 35.519 0.598 1
1 602 . 20 1 1 A 56 56 VAL N N 56 123.343 126.637 -3.294 1
1 603 . 20 1 1 A 57 57 GLN H H 57 8.767 8.703 0.064 1
1 604 . 20 1 1 A 57 57 GLN HA H 57 5.671 5.441 0.230 1
1 611 . 20 1 1 A 57 57 GLN C C 57 176.357 174.756 1.601 1
1 612 . 20 1 1 A 57 57 GLN CA C 57 54.735 54.320 0.415 1
1 613 . 20 1 1 A 57 57 GLN CB C 57 30.781 31.511 -0.730 1
1 615 . 20 1 1 A 57 57 GLN N N 57 125.639 121.576 4.063 1
1 617 . 20 1 1 A 58 58 VAL H H 58 9.217 8.961 0.256 1
1 618 . 20 1 1 A 58 58 VAL HA H 58 5.129 4.819 0.310 1
1 626 . 20 1 1 A 58 58 VAL C C 58 175.925 176.899 -0.974 1
1 627 . 20 1 1 A 58 58 VAL CA C 58 59.652 60.405 -0.753 1
1 628 . 20 1 1 A 58 58 VAL CB C 58 36.540 34.789 1.751 1
1 631 . 20 1 1 A 58 58 VAL N N 58 117.022 118.770 -1.748 1
1 632 . 20 1 1 A 59 59 GLY H H 59 9.008 8.805 0.203 1
1 633 . 20 1 1 A 59 59 GLY HA2 H 59 4.670 3.930 0.740 1
1 634 . 20 1 1 A 59 59 GLY HA3 H 59 3.914 3.976 -0.062 1
1 635 . 20 1 1 A 59 59 GLY C C 59 173.386 174.145 -0.759 1
1 636 . 20 1 1 A 59 59 GLY CA C 59 45.093 46.061 -0.968 1
1 637 . 20 1 1 A 59 59 GLY N N 59 109.174 111.298 -2.124 1
1 638 . 20 1 1 A 60 60 ARG H H 60 7.695 7.620 0.075 1
1 639 . 20 1 1 A 60 60 ARG HA H 60 4.866 5.041 -0.175 1
1 645 . 20 1 1 A 60 60 ARG C C 60 173.760 175.632 -1.872 1
1 646 . 20 1 1 A 60 60 ARG CA C 60 52.764 53.472 -0.708 1
1 647 . 20 1 1 A 60 60 ARG CB C 60 31.785 32.117 -0.332 1
1 650 . 20 1 1 A 60 60 ARG N N 60 118.520 118.162 0.358 1
1 651 . 20 1 1 A 61 61 PRO HA H 61 3.539 3.833 -0.294 1
1 658 . 20 1 1 A 61 61 PRO C C 61 173.175 173.715 -0.540 1
1 659 . 20 1 1 A 61 61 PRO CA C 61 62.265 62.965 -0.700 1
1 660 . 20 1 1 A 61 61 PRO CB C 61 27.546 30.676 -3.130 1
1 663 . 20 1 1 A 62 62 GLU H H 62 7.879 7.675 0.204 1
1 664 . 20 1 1 A 62 62 GLU HA H 62 4.071 4.737 -0.666 1
1 669 . 20 1 1 A 62 62 GLU C C 62 174.107 174.396 -0.289 1
1 670 . 20 1 1 A 62 62 GLU CA C 62 55.229 54.092 1.137 1
1 671 . 20 1 1 A 62 62 GLU CB C 62 32.838 31.687 1.151 1
1 673 . 20 1 1 A 62 62 GLU N N 62 118.173 114.173 4.000 1
1 674 . 20 1 1 A 63 63 VAL H H 63 8.930 8.527 0.403 1
1 675 . 20 1 1 A 63 63 VAL HA H 63 4.548 5.052 -0.504 1
1 683 . 20 1 1 A 63 63 VAL C C 63 170.325 173.913 -3.588 1
1 684 . 20 1 1 A 63 63 VAL CA C 63 60.770 59.748 1.022 1
1 685 . 20 1 1 A 63 63 VAL CB C 63 35.394 34.483 0.911 1
1 688 . 20 1 1 A 63 63 VAL N N 63 117.161 125.908 -8.747 1
1 689 . 20 1 1 A 64 64 LEU H H 64 8.332 8.931 -0.599 1
1 690 . 20 1 1 A 64 64 LEU HA H 64 5.122 5.378 -0.256 1
1 700 . 20 1 1 A 64 64 LEU C C 64 176.243 174.916 1.327 1
1 701 . 20 1 1 A 64 64 LEU CA C 64 53.346 53.443 -0.097 1
1 702 . 20 1 1 A 64 64 LEU CB C 64 42.649 44.727 -2.078 1
1 706 . 20 1 1 A 64 64 LEU N N 64 130.510 129.559 0.951 1
1 707 . 20 1 1 A 65 65 LEU H H 65 9.261 9.300 -0.039 1
1 708 . 20 1 1 A 65 65 LEU HA H 65 4.443 4.625 -0.182 1
1 718 . 20 1 1 A 65 65 LEU C C 65 174.016 175.915 -1.899 1
1 719 . 20 1 1 A 65 65 LEU CA C 65 53.920 54.273 -0.353 1
1 720 . 20 1 1 A 65 65 LEU CB C 65 42.976 41.799 1.177 1
1 724 . 20 1 1 A 65 65 LEU N N 65 128.611 128.763 -0.152 1
1 725 . 20 1 1 A 66 66 ASP H H 66 8.105 8.626 -0.521 1
1 726 . 20 1 1 A 66 66 ASP HA H 66 5.207 5.192 0.015 1
1 729 . 20 1 1 A 66 66 ASP C C 66 176.161 176.101 0.060 1
1 730 . 20 1 1 A 66 66 ASP CA C 66 51.001 52.819 -1.818 1
1 731 . 20 1 1 A 66 66 ASP CB C 66 42.836 43.108 -0.272 1
1 732 . 20 1 1 A 66 66 ASP N N 66 121.799 123.913 -2.114 1
1 733 . 20 1 1 A 67 67 GLY H H 67 8.688 8.361 0.327 1
1 734 . 20 1 1 A 67 67 GLY HA2 H 67 3.923 3.914 0.009 1
1 735 . 20 1 1 A 67 67 GLY HA3 H 67 3.808 3.919 -0.111 1
1 736 . 20 1 1 A 67 67 GLY C C 67 175.500 174.222 1.278 1
1 737 . 20 1 1 A 67 67 GLY CA C 67 46.591 46.729 -0.138 1
1 738 . 20 1 1 A 67 67 GLY N N 67 106.518 110.792 -4.274 1
1 739 . 20 1 1 A 68 68 LEU H H 68 8.125 7.541 0.584 1
1 740 . 20 1 1 A 68 68 LEU HA H 68 4.252 4.919 -0.667 1
1 750 . 20 1 1 A 68 68 LEU C C 68 174.914 175.311 -0.397 1
1 751 . 20 1 1 A 68 68 LEU CA C 68 53.469 53.194 0.275 1
1 752 . 20 1 1 A 68 68 LEU CB C 68 40.422 45.937 -5.515 1
1 756 . 20 1 1 A 68 68 LEU N N 68 119.345 120.085 -0.740 1
1 757 . 20 1 1 A 69 69 GLU H H 69 8.207 8.155 0.052 1
1 758 . 20 1 1 A 69 69 GLU HA H 69 4.908 4.872 0.036 1
1 763 . 20 1 1 A 69 69 GLU C C 69 174.464 174.271 0.193 1
1 764 . 20 1 1 A 69 69 GLU CA C 69 53.081 53.120 -0.039 1
1 765 . 20 1 1 A 69 69 GLU CB C 69 31.538 30.481 1.057 1
1 767 . 20 1 1 A 69 69 GLU N N 69 119.486 120.778 -1.292 1
1 768 . 20 1 1 A 70 70 PRO HA H 70 4.866 4.335 0.531 1
1 775 . 20 1 1 A 70 70 PRO C C 70 178.285 177.501 0.784 1
1 776 . 20 1 1 A 70 70 PRO CA C 70 63.203 63.623 -0.420 1
1 777 . 20 1 1 A 70 70 PRO CB C 70 33.726 31.748 1.978 1
1 780 . 20 1 1 A 71 71 GLY H H 71 7.362 8.817 -1.455 1
1 781 . 20 1 1 A 71 71 GLY HA2 H 71 3.807 3.950 -0.143 1
1 782 . 20 1 1 A 71 71 GLY HA3 H 71 3.756 3.954 -0.198 1
1 783 . 20 1 1 A 71 71 GLY C C 71 174.664 173.637 1.027 1
1 784 . 20 1 1 A 71 71 GLY CA C 71 46.926 46.364 0.562 1
1 785 . 20 1 1 A 71 71 GLY N N 71 113.776 111.624 2.152 1
1 786 . 20 1 1 A 72 72 ARG H H 72 8.036 7.302 0.734 1
1 787 . 20 1 1 A 72 72 ARG HA H 72 4.597 4.863 -0.266 1
1 793 . 20 1 1 A 72 72 ARG C C 72 173.293 173.967 -0.674 1
1 794 . 20 1 1 A 72 72 ARG CA C 72 54.633 54.385 0.248 1
1 795 . 20 1 1 A 72 72 ARG CB C 72 33.704 34.107 -0.403 1
1 798 . 20 1 1 A 72 72 ARG N N 72 119.611 119.528 0.083 1
1 799 . 20 1 1 A 73 73 ASP H H 73 7.785 8.573 -0.788 1
1 800 . 20 1 1 A 73 73 ASP HA H 73 5.276 5.882 -0.606 1
1 803 . 20 1 1 A 73 73 ASP C C 73 175.904 174.311 1.593 1
1 804 . 20 1 1 A 73 73 ASP CA C 73 53.568 52.262 1.306 1
1 805 . 20 1 1 A 73 73 ASP CB C 73 42.970 44.218 -1.248 1
1 806 . 20 1 1 A 73 73 ASP N N 73 118.900 121.300 -2.400 1
1 807 . 20 1 1 A 74 74 TYR H H 74 9.516 8.844 0.672 1
1 808 . 20 1 1 A 74 74 TYR HA H 74 4.800 5.125 -0.325 1
1 815 . 20 1 1 A 74 74 TYR C C 74 174.631 175.117 -0.486 1
1 816 . 20 1 1 A 74 74 TYR CA C 74 58.548 56.294 2.254 1
1 817 . 20 1 1 A 74 74 TYR CB C 74 42.029 41.728 0.301 1
1 822 . 20 1 1 A 74 74 TYR N N 74 121.903 120.738 1.165 1
1 823 . 20 1 1 A 75 75 GLU H H 75 9.248 9.319 -0.071 1
1 824 . 20 1 1 A 75 75 GLU HA H 75 4.756 4.520 0.236 1
1 829 . 20 1 1 A 75 75 GLU C C 75 175.524 175.398 0.126 1
1 830 . 20 1 1 A 75 75 GLU CA C 75 55.621 55.970 -0.349 1
1 831 . 20 1 1 A 75 75 GLU CB C 75 30.778 28.241 2.537 1
1 833 . 20 1 1 A 75 75 GLU N N 75 122.425 124.464 -2.039 1
1 834 . 20 1 1 A 76 76 VAL H H 76 8.884 8.104 0.780 1
1 835 . 20 1 1 A 76 76 VAL HA H 76 5.246 4.474 0.772 1
1 843 . 20 1 1 A 76 76 VAL C C 76 174.800 175.543 -0.743 1
1 844 . 20 1 1 A 76 76 VAL CA C 76 60.199 62.878 -2.679 1
1 845 . 20 1 1 A 76 76 VAL CB C 76 33.449 31.261 2.188 1
1 848 . 20 1 1 A 76 76 VAL N N 76 126.853 124.825 2.028 1
1 849 . 20 1 1 A 77 77 SER H H 77 9.234 8.623 0.611 1
1 850 . 20 1 1 A 77 77 SER HA H 77 5.398 5.058 0.340 1
1 853 . 20 1 1 A 77 77 SER C C 77 173.138 173.787 -0.649 1
1 854 . 20 1 1 A 77 77 SER CA C 77 56.032 57.753 -1.721 1
1 855 . 20 1 1 A 77 77 SER CB C 77 66.374 63.809 2.565 1
1 856 . 20 1 1 A 77 77 SER N N 77 120.852 125.305 -4.453 1
1 857 . 20 1 1 A 78 78 VAL H H 78 9.092 8.914 0.178 1
1 858 . 20 1 1 A 78 78 VAL HA H 78 4.756 4.590 0.166 1
1 866 . 20 1 1 A 78 78 VAL C C 78 173.641 175.009 -1.368 1
1 867 . 20 1 1 A 78 78 VAL CA C 78 61.246 60.788 0.458 1
1 868 . 20 1 1 A 78 78 VAL CB C 78 34.467 32.660 1.807 1
1 871 . 20 1 1 A 78 78 VAL N N 78 122.453 127.723 -5.270 1
1 872 . 20 1 1 A 79 79 GLN H H 79 8.587 8.463 0.124 1
1 873 . 20 1 1 A 79 79 GLN HA H 79 4.438 4.556 -0.118 1
1 880 . 20 1 1 A 79 79 GLN C C 79 174.999 174.000 0.999 1
1 881 . 20 1 1 A 79 79 GLN CA C 79 54.227 55.272 -1.045 1
1 882 . 20 1 1 A 79 79 GLN CB C 79 33.587 32.899 0.688 1
1 884 . 20 1 1 A 79 79 GLN N N 79 125.619 124.992 0.627 1
1 886 . 20 1 1 A 80 80 SER H H 80 8.623 8.918 -0.295 1
1 887 . 20 1 1 A 80 80 SER HA H 80 4.756 4.931 -0.175 1
1 890 . 20 1 1 A 80 80 SER C C 80 172.264 174.032 -1.768 1
1 891 . 20 1 1 A 80 80 SER CA C 80 58.177 58.488 -0.311 1
1 892 . 20 1 1 A 80 80 SER CB C 80 63.920 63.804 0.116 1
1 893 . 20 1 1 A 80 80 SER N N 80 122.844 123.765 -0.921 1
1 894 . 20 1 1 A 81 81 LEU H H 81 8.348 8.952 -0.604 1
1 895 . 20 1 1 A 81 81 LEU HA H 81 5.124 4.722 0.402 1
1 905 . 20 1 1 A 81 81 LEU C C 81 175.775 175.619 0.156 1
1 906 . 20 1 1 A 81 81 LEU CA C 81 54.033 53.325 0.708 1
1 907 . 20 1 1 A 81 81 LEU CB C 81 44.690 42.371 2.319 1
1 911 . 20 1 1 A 81 81 LEU N N 81 123.191 127.572 -4.381 1
1 912 . 20 1 1 A 82 82 ARG H H 82 8.374 8.009 0.365 1
1 913 . 20 1 1 A 82 82 ARG HA H 82 4.616 4.491 0.125 1
1 919 . 20 1 1 A 82 82 ARG C C 82 176.864 175.855 1.009 1
1 920 . 20 1 1 A 82 82 ARG CA C 82 55.868 54.767 1.101 1
1 921 . 20 1 1 A 82 82 ARG CB C 82 32.322 31.026 1.296 1
1 924 . 20 1 1 A 82 82 ARG N N 82 121.029 125.717 -4.688 1
1 925 . 20 1 1 A 83 83 GLY H H 83 8.309 7.525 0.784 1
1 926 . 20 1 1 A 83 83 GLY HA2 H 83 4.031 4.113 -0.082 1
1 927 . 20 1 1 A 83 83 GLY HA3 H 83 3.888 4.142 -0.254 1
1 928 . 20 1 1 A 83 83 GLY C C 83 174.562 174.130 0.432 1
1 929 . 20 1 1 A 83 83 GLY CA C 83 45.963 44.072 1.891 1
1 930 . 20 1 1 A 83 83 GLY N N 83 109.937 109.435 0.502 1
1 931 . 20 1 1 A 84 84 PRO HA H 84 4.573 4.491 0.082 1
1 938 . 20 1 1 A 84 84 PRO C C 84 176.533 175.706 0.827 1
1 939 . 20 1 1 A 84 84 PRO CA C 84 63.485 64.068 -0.583 1
1 940 . 20 1 1 A 84 84 PRO CB C 84 32.409 32.180 0.229 1
1 943 . 20 1 1 A 85 85 GLU H H 85 7.799 7.520 0.279 1
1 944 . 20 1 1 A 85 85 GLU HA H 85 4.369 4.874 -0.505 1
1 949 . 20 1 1 A 85 85 GLU C C 85 174.722 175.460 -0.738 1
1 950 . 20 1 1 A 85 85 GLU CA C 85 55.899 54.942 0.957 1
1 951 . 20 1 1 A 85 85 GLU CB C 85 31.911 33.021 -1.110 1
1 953 . 20 1 1 A 85 85 GLU N N 85 122.093 112.835 9.258 1
1 954 . 20 1 1 A 86 86 GLY H H 86 8.329 8.783 -0.454 1
1 955 . 20 1 1 A 86 86 GLY HA2 H 86 5.298 4.226 1.072 1
1 956 . 20 1 1 A 86 86 GLY HA3 H 86 3.559 4.242 -0.683 1
1 957 . 20 1 1 A 86 86 GLY C C 86 174.355 173.012 1.343 1
1 958 . 20 1 1 A 86 86 GLY CA C 86 44.034 44.068 -0.034 1
1 959 . 20 1 1 A 86 86 GLY N N 86 109.387 109.183 0.204 1
1 960 . 20 1 1 A 87 87 SER H H 87 8.807 8.391 0.416 1
1 961 . 20 1 1 A 87 87 SER HA H 87 4.670 4.612 0.058 1
1 964 . 20 1 1 A 87 87 SER C C 87 175.195 174.483 0.712 1
1 965 . 20 1 1 A 87 87 SER CA C 87 57.737 57.806 -0.069 1
1 966 . 20 1 1 A 87 87 SER CB C 87 67.829 66.044 1.785 1
1 967 . 20 1 1 A 87 87 SER N N 87 117.698 112.837 4.861 1
1 968 . 20 1 1 A 88 88 GLU H H 88 8.754 8.646 0.108 1
1 969 . 20 1 1 A 88 88 GLU HA H 88 4.357 4.345 0.012 1
1 974 . 20 1 1 A 88 88 GLU C C 88 177.474 176.854 0.620 1
1 975 . 20 1 1 A 88 88 GLU CA C 88 57.525 56.945 0.580 1
1 976 . 20 1 1 A 88 88 GLU CB C 88 31.162 30.202 0.960 1
1 978 . 20 1 1 A 88 88 GLU N N 88 118.709 120.067 -1.358 1
1 979 . 20 1 1 A 89 89 ALA H H 89 8.855 8.342 0.513 1
1 980 . 20 1 1 A 89 89 ALA HA H 89 4.792 4.485 0.307 1
1 984 . 20 1 1 A 89 89 ALA C C 89 178.379 176.553 1.826 1
1 985 . 20 1 1 A 89 89 ALA CA C 89 51.264 51.969 -0.705 1
1 986 . 20 1 1 A 89 89 ALA CB C 89 20.040 19.361 0.679 1
1 987 . 20 1 1 A 89 89 ALA N N 89 127.301 125.393 1.908 1
1 988 . 20 1 1 A 90 90 ARG H H 90 8.549 8.743 -0.194 1
1 989 . 20 1 1 A 90 90 ARG HA H 90 4.658 5.002 -0.344 1
1 996 . 20 1 1 A 90 90 ARG C C 90 174.720 175.180 -0.460 1
1 997 . 20 1 1 A 90 90 ARG CA C 90 53.575 54.430 -0.855 1
1 998 . 20 1 1 A 90 90 ARG CB C 90 33.456 31.824 1.632 1
1 1001 . 20 1 1 A 90 90 ARG N N 90 121.289 124.278 -2.989 1
1 1002 . 20 1 1 A 91 91 GLY H H 91 8.396 8.955 -0.559 1
1 1003 . 20 1 1 A 91 91 GLY HA2 H 91 5.306 4.215 1.091 1
1 1004 . 20 1 1 A 91 91 GLY HA3 H 91 3.700 4.243 -0.543 1
1 1005 . 20 1 1 A 91 91 GLY C C 91 173.191 172.197 0.994 1
1 1006 . 20 1 1 A 91 91 GLY CA C 91 44.493 43.914 0.579 1
1 1007 . 20 1 1 A 91 91 GLY N N 91 108.579 112.273 -3.694 1
1 1008 . 20 1 1 A 92 92 ILE H H 92 8.891 8.364 0.527 1
1 1009 . 20 1 1 A 92 92 ILE HA H 92 4.499 4.962 -0.463 1
1 1019 . 20 1 1 A 92 92 ILE C C 92 171.877 173.711 -1.834 1
1 1020 . 20 1 1 A 92 92 ILE CA C 92 60.682 59.121 1.561 1
1 1021 . 20 1 1 A 92 92 ILE CB C 92 42.425 42.045 0.380 1
1 1025 . 20 1 1 A 92 92 ILE N N 92 118.313 121.032 -2.719 1
1 1026 . 20 1 1 A 93 93 ARG H H 93 7.980 8.500 -0.520 1
1 1027 . 20 1 1 A 93 93 ARG HA H 93 5.224 4.503 0.721 1
1 1034 . 20 1 1 A 93 93 ARG C C 93 175.072 175.108 -0.036 1
1 1035 . 20 1 1 A 93 93 ARG CA C 93 54.499 56.216 -1.717 1
1 1036 . 20 1 1 A 93 93 ARG CB C 93 31.767 30.750 1.017 1
1 1039 . 20 1 1 A 93 93 ARG N N 93 124.879 129.568 -4.689 1
1 1040 . 20 1 1 A 94 94 ALA H H 94 9.064 8.306 0.758 1
1 1041 . 20 1 1 A 94 94 ALA HA H 94 4.731 5.163 -0.432 1
1 1045 . 20 1 1 A 94 94 ALA C C 94 174.494 177.045 -2.551 1
1 1046 . 20 1 1 A 94 94 ALA CA C 94 50.577 50.792 -0.215 1
1 1047 . 20 1 1 A 94 94 ALA CB C 94 23.082 20.763 2.319 1
1 1048 . 20 1 1 A 94 94 ALA N N 94 126.095 129.878 -3.783 1
1 1049 . 20 1 1 A 95 95 ARG H H 95 8.263 9.123 -0.860 1
1 1050 . 20 1 1 A 95 95 ARG HA H 95 5.548 5.225 0.323 1
1 1058 . 20 1 1 A 95 95 ARG C C 95 176.901 174.728 2.173 1
1 1059 . 20 1 1 A 95 95 ARG CA C 95 53.787 54.040 -0.253 1
1 1060 . 20 1 1 A 95 95 ARG CB C 95 32.426 34.450 -2.024 1
1 1063 . 20 1 1 A 95 95 ARG N N 95 123.374 121.020 2.354 1
1 1065 . 20 1 1 A 96 96 THR H H 96 9.208 8.891 0.317 1
1 1066 . 20 1 1 A 96 96 THR HA H 96 4.461 5.055 -0.594 1
1 1071 . 20 1 1 A 96 96 THR CA C 96 58.248 58.420 -0.172 1
1 1072 . 20 1 1 A 96 96 THR CB C 96 68.466 71.133 -2.667 1
1 1074 . 20 1 1 A 96 96 THR N N 96 119.492 111.858 7.634 1
1 1075 . 20 1 1 A 97 97 PRO HA H 97 4.636 4.625 0.011 1
1 1082 . 20 1 1 A 97 97 PRO C C 97 175.725 175.901 -0.176 1
1 1083 . 20 1 1 A 97 97 PRO CA C 97 61.907 62.296 -0.389 1
1 1084 . 20 1 1 A 97 97 PRO CB C 97 32.590 33.428 -0.838 1
1 1087 . 20 1 1 A 98 98 THR H H 98 7.943 8.328 -0.385 1
1 1088 . 20 1 1 A 98 98 THR HA H 98 4.208 5.019 -0.811 1
1 1093 . 20 1 1 A 98 98 THR C C 98 175.058 173.215 1.843 1
1 1094 . 20 1 1 A 98 98 THR CA C 98 62.069 60.535 1.534 1
1 1095 . 20 1 1 A 98 98 THR CB C 98 69.719 71.082 -1.363 1
1 1097 . 20 1 1 A 98 98 THR N N 98 107.148 110.699 -3.551 1
1 1098 . 20 1 1 A 99 99 SER H H 99 8.163 9.017 -0.854 1
1 1099 . 20 1 1 A 99 99 SER HA H 99 4.524 4.467 0.057 1
1 1102 . 20 1 1 A 99 99 SER C C 99 174.319 174.664 -0.345 1
1 1103 . 20 1 1 A 99 99 SER CA C 99 58.107 59.052 -0.945 1
1 1104 . 20 1 1 A 99 99 SER CB C 99 64.492 63.803 0.689 1
1 1105 . 20 1 1 A 99 99 SER N N 99 115.114 122.685 -7.571 1
1 1106 . 20 1 1 A 100 100 GLY H H 100 8.336 8.389 -0.053 1
1 1107 . 20 1 1 A 100 100 GLY HA2 H 100 4.222 4.153 0.069 1
1 1108 . 20 1 1 A 100 100 GLY HA3 H 100 4.222 4.154 0.068 1
1 1109 . 20 1 1 A 100 100 GLY C C 100 171.696 174.632 -2.936 1
1 1110 . 20 1 1 A 100 100 GLY CA C 100 44.617 43.866 0.751 1
1 1111 . 20 1 1 A 100 100 GLY N N 100 110.678 113.646 -2.968 1
1 1112 . 20 1 1 A 101 101 PRO HA H 101 4.506 4.574 -0.068 1
1 1118 . 20 1 1 A 101 101 PRO CA C 101 63.358 63.453 -0.095 1
1 1119 . 20 1 1 A 101 101 PRO CB C 101 32.313 32.194 0.119 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 90 1.154 1
2 1 1 1 "RMS(OBS, PRED)" CA 96 1.090 1
3 1 1 1 "RMS(OBS, PRED)" CB 86 1.411 1
4 1 1 1 "RMS(OBS, PRED)" H 81 0.534 1
5 1 1 1 "RMS(OBS, PRED)" HA 106 0.371 1
6 1 1 1 "RMS(OBS, PRED)" N 81 3.615 1
7 1 2 1 "RMS(OBS, PRED)" C 90 1.171 1
8 1 2 1 "RMS(OBS, PRED)" CA 96 1.159 1
9 1 2 1 "RMS(OBS, PRED)" CB 86 1.456 1
10 1 2 1 "RMS(OBS, PRED)" H 81 0.569 1
11 1 2 1 "RMS(OBS, PRED)" HA 106 0.352 1
12 1 2 1 "RMS(OBS, PRED)" N 81 3.834 1
13 1 3 1 "RMS(OBS, PRED)" C 90 1.139 1
14 1 3 1 "RMS(OBS, PRED)" CA 96 1.104 1
15 1 3 1 "RMS(OBS, PRED)" CB 86 1.354 1
16 1 3 1 "RMS(OBS, PRED)" H 81 0.545 1
17 1 3 1 "RMS(OBS, PRED)" HA 106 0.376 1
18 1 3 1 "RMS(OBS, PRED)" N 81 3.641 1
19 1 4 1 "RMS(OBS, PRED)" C 90 1.247 1
20 1 4 1 "RMS(OBS, PRED)" CA 96 1.119 1
21 1 4 1 "RMS(OBS, PRED)" CB 86 1.552 1
22 1 4 1 "RMS(OBS, PRED)" H 81 0.593 1
23 1 4 1 "RMS(OBS, PRED)" HA 106 0.376 1
24 1 4 1 "RMS(OBS, PRED)" N 81 3.857 1
25 1 5 1 "RMS(OBS, PRED)" C 90 1.228 1
26 1 5 1 "RMS(OBS, PRED)" CA 96 1.103 1
27 1 5 1 "RMS(OBS, PRED)" CB 86 1.483 1
28 1 5 1 "RMS(OBS, PRED)" H 81 0.520 1
29 1 5 1 "RMS(OBS, PRED)" HA 106 0.366 1
30 1 5 1 "RMS(OBS, PRED)" N 81 3.891 1
31 1 6 1 "RMS(OBS, PRED)" C 90 1.208 1
32 1 6 1 "RMS(OBS, PRED)" CA 96 1.293 1
33 1 6 1 "RMS(OBS, PRED)" CB 86 1.518 1
34 1 6 1 "RMS(OBS, PRED)" H 81 0.549 1
35 1 6 1 "RMS(OBS, PRED)" HA 106 0.352 1
36 1 6 1 "RMS(OBS, PRED)" N 81 3.663 1
37 1 7 1 "RMS(OBS, PRED)" C 90 1.169 1
38 1 7 1 "RMS(OBS, PRED)" CA 96 1.154 1
39 1 7 1 "RMS(OBS, PRED)" CB 86 1.462 1
40 1 7 1 "RMS(OBS, PRED)" H 81 0.616 1
41 1 7 1 "RMS(OBS, PRED)" HA 106 0.369 1
42 1 7 1 "RMS(OBS, PRED)" N 81 3.850 1
43 1 8 1 "RMS(OBS, PRED)" C 90 1.169 1
44 1 8 1 "RMS(OBS, PRED)" CA 96 1.198 1
45 1 8 1 "RMS(OBS, PRED)" CB 86 1.467 1
46 1 8 1 "RMS(OBS, PRED)" H 81 0.509 1
47 1 8 1 "RMS(OBS, PRED)" HA 106 0.356 1
48 1 8 1 "RMS(OBS, PRED)" N 81 3.880 1
49 1 9 1 "RMS(OBS, PRED)" C 90 1.237 1
50 1 9 1 "RMS(OBS, PRED)" CA 96 1.164 1
51 1 9 1 "RMS(OBS, PRED)" CB 86 1.561 1
52 1 9 1 "RMS(OBS, PRED)" H 81 0.542 1
53 1 9 1 "RMS(OBS, PRED)" HA 106 0.366 1
54 1 9 1 "RMS(OBS, PRED)" N 81 3.685 1
55 1 10 1 "RMS(OBS, PRED)" C 90 1.160 1
56 1 10 1 "RMS(OBS, PRED)" CA 96 1.241 1
57 1 10 1 "RMS(OBS, PRED)" CB 86 1.464 1
58 1 10 1 "RMS(OBS, PRED)" H 81 0.556 1
59 1 10 1 "RMS(OBS, PRED)" HA 106 0.351 1
60 1 10 1 "RMS(OBS, PRED)" N 81 3.525 1
61 1 11 1 "RMS(OBS, PRED)" C 90 1.194 1
62 1 11 1 "RMS(OBS, PRED)" CA 96 1.094 1
63 1 11 1 "RMS(OBS, PRED)" CB 86 1.434 1
64 1 11 1 "RMS(OBS, PRED)" H 81 0.580 1
65 1 11 1 "RMS(OBS, PRED)" HA 106 0.367 1
66 1 11 1 "RMS(OBS, PRED)" N 81 3.648 1
67 1 12 1 "RMS(OBS, PRED)" C 90 1.188 1
68 1 12 1 "RMS(OBS, PRED)" CA 96 1.150 1
69 1 12 1 "RMS(OBS, PRED)" CB 86 1.421 1
70 1 12 1 "RMS(OBS, PRED)" H 81 0.520 1
71 1 12 1 "RMS(OBS, PRED)" HA 106 0.369 1
72 1 12 1 "RMS(OBS, PRED)" N 81 3.631 1
73 1 13 1 "RMS(OBS, PRED)" C 90 1.182 1
74 1 13 1 "RMS(OBS, PRED)" CA 96 1.102 1
75 1 13 1 "RMS(OBS, PRED)" CB 86 1.411 1
76 1 13 1 "RMS(OBS, PRED)" H 81 0.592 1
77 1 13 1 "RMS(OBS, PRED)" HA 106 0.360 1
78 1 13 1 "RMS(OBS, PRED)" N 81 3.938 1
79 1 14 1 "RMS(OBS, PRED)" C 90 1.226 1
80 1 14 1 "RMS(OBS, PRED)" CA 96 1.117 1
81 1 14 1 "RMS(OBS, PRED)" CB 86 1.489 1
82 1 14 1 "RMS(OBS, PRED)" H 81 0.556 1
83 1 14 1 "RMS(OBS, PRED)" HA 106 0.369 1
84 1 14 1 "RMS(OBS, PRED)" N 81 3.627 1
85 1 15 1 "RMS(OBS, PRED)" C 90 1.148 1
86 1 15 1 "RMS(OBS, PRED)" CA 96 1.204 1
87 1 15 1 "RMS(OBS, PRED)" CB 86 1.488 1
88 1 15 1 "RMS(OBS, PRED)" H 81 0.494 1
89 1 15 1 "RMS(OBS, PRED)" HA 106 0.371 1
90 1 15 1 "RMS(OBS, PRED)" N 81 3.575 1
91 1 16 1 "RMS(OBS, PRED)" C 90 1.173 1
92 1 16 1 "RMS(OBS, PRED)" CA 96 1.125 1
93 1 16 1 "RMS(OBS, PRED)" CB 86 1.417 1
94 1 16 1 "RMS(OBS, PRED)" H 81 0.552 1
95 1 16 1 "RMS(OBS, PRED)" HA 106 0.363 1
96 1 16 1 "RMS(OBS, PRED)" N 81 3.848 1
97 1 17 1 "RMS(OBS, PRED)" C 90 1.152 1
98 1 17 1 "RMS(OBS, PRED)" CA 96 1.071 1
99 1 17 1 "RMS(OBS, PRED)" CB 86 1.399 1
100 1 17 1 "RMS(OBS, PRED)" H 81 0.503 1
101 1 17 1 "RMS(OBS, PRED)" HA 106 0.378 1
102 1 17 1 "RMS(OBS, PRED)" N 81 3.798 1
103 1 18 1 "RMS(OBS, PRED)" C 90 1.166 1
104 1 18 1 "RMS(OBS, PRED)" CA 96 1.161 1
105 1 18 1 "RMS(OBS, PRED)" CB 86 1.378 1
106 1 18 1 "RMS(OBS, PRED)" H 81 0.566 1
107 1 18 1 "RMS(OBS, PRED)" HA 106 0.367 1
108 1 18 1 "RMS(OBS, PRED)" N 81 3.589 1
109 1 19 1 "RMS(OBS, PRED)" C 90 1.232 1
110 1 19 1 "RMS(OBS, PRED)" CA 96 1.290 1
111 1 19 1 "RMS(OBS, PRED)" CB 86 1.371 1
112 1 19 1 "RMS(OBS, PRED)" H 81 0.526 1
113 1 19 1 "RMS(OBS, PRED)" HA 106 0.359 1
114 1 19 1 "RMS(OBS, PRED)" N 81 3.769 1
115 1 20 1 "RMS(OBS, PRED)" C 90 1.194 1
116 1 20 1 "RMS(OBS, PRED)" CA 96 1.159 1
117 1 20 1 "RMS(OBS, PRED)" CB 86 1.487 1
118 1 20 1 "RMS(OBS, PRED)" H 81 0.552 1
119 1 20 1 "RMS(OBS, PRED)" HA 106 0.368 1
120 1 20 1 "RMS(OBS, PRED)" N 81 3.643 1
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.Conformer_type "average"
_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.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 6 6 SER HA H 6 4.528 4.882 -0.354 2
1 3 . 1 1 A 6 6 SER CA C 6 58.373 58.047 0.326 2
1 4 . 1 1 A 6 6 SER CB C 6 63.978 64.517 -0.539 2
1 5 . 1 1 A 7 7 GLY H H 7 8.228 8.380 -0.152 2
1 6 . 1 1 A 7 7 GLY HA2 H 7 4.134 4.134 0.000 2
1 7 . 1 1 A 7 7 GLY HA3 H 7 4.134 4.135 -0.001 2
1 8 . 1 1 A 7 7 GLY CA C 7 44.607 45.033 -0.426 2
1 9 . 1 1 A 7 7 GLY N N 7 110.638 110.854 -0.216 2
1 10 . 1 1 A 8 8 PRO HA H 8 4.419 4.657 -0.238 2
1 17 . 1 1 A 8 8 PRO C C 8 176.908 175.417 1.491 2
1 18 . 1 1 A 8 8 PRO CA C 8 62.851 62.735 0.116 2
1 19 . 1 1 A 8 8 PRO CB C 8 32.243 31.943 0.300 2
1 22 . 1 1 A 9 9 LEU H H 9 8.462 8.447 0.015 2
1 23 . 1 1 A 9 9 LEU HA H 9 4.494 4.870 -0.376 2
1 33 . 1 1 A 9 9 LEU C C 9 174.124 174.615 -0.491 2
1 34 . 1 1 A 9 9 LEU CA C 9 52.587 51.773 0.814 2
1 35 . 1 1 A 9 9 LEU CB C 9 43.150 43.551 -0.401 2
1 39 . 1 1 A 9 9 LEU N N 9 126.015 123.462 2.553 2
1 40 . 1 1 A 10 10 PRO HA H 10 4.820 4.606 0.214 2
1 47 . 1 1 A 10 10 PRO CA C 10 61.368 62.374 -1.006 2
1 48 . 1 1 A 10 10 PRO CB C 10 31.391 31.818 -0.427 2
1 51 . 1 1 A 11 11 PRO HA H 11 4.949 4.631 0.318 2
1 58 . 1 1 A 11 11 PRO CA C 11 61.183 61.803 -0.620 2
1 59 . 1 1 A 11 11 PRO CB C 11 30.656 31.922 -1.266 2
1 62 . 1 1 A 12 12 PRO HA H 12 4.341 4.649 -0.308 2
1 69 . 1 1 A 12 12 PRO C C 12 174.849 176.885 -2.036 2
1 70 . 1 1 A 12 12 PRO CA C 12 63.062 62.651 0.411 2
1 71 . 1 1 A 12 12 PRO CB C 12 31.831 31.670 0.161 2
1 74 . 1 1 A 13 13 ARG H H 13 7.828 8.563 -0.735 2
1 75 . 1 1 A 13 13 ARG HA H 13 4.536 4.453 0.083 2
1 82 . 1 1 A 13 13 ARG C C 13 174.608 176.663 -2.055 2
1 83 . 1 1 A 13 13 ARG CA C 13 54.774 57.049 -2.275 2
1 84 . 1 1 A 13 13 ARG CB C 13 33.250 31.775 1.475 2
1 87 . 1 1 A 13 13 ARG N N 13 120.532 120.986 -0.454 2
1 88 . 1 1 A 14 14 ALA H H 14 8.694 7.746 0.948 2
1 89 . 1 1 A 14 14 ALA HA H 14 3.986 4.377 -0.390 2
1 93 . 1 1 A 14 14 ALA C C 14 177.232 176.689 0.543 2
1 94 . 1 1 A 14 14 ALA CA C 14 52.461 51.934 0.527 2
1 95 . 1 1 A 14 14 ALA CB C 14 16.806 17.332 -0.526 2
1 96 . 1 1 A 14 14 ALA N N 14 121.921 120.718 1.203 2
1 97 . 1 1 A 15 15 LEU H H 15 8.097 8.259 -0.162 2
1 98 . 1 1 A 15 15 LEU HA H 15 4.670 4.713 -0.043 2
1 108 . 1 1 A 15 15 LEU C C 15 177.364 175.951 1.413 2
1 109 . 1 1 A 15 15 LEU CA C 15 57.543 54.641 2.902 2
1 110 . 1 1 A 15 15 LEU CB C 15 41.877 41.160 0.717 2
1 114 . 1 1 A 15 15 LEU N N 15 122.215 121.262 0.953 2
1 115 . 1 1 A 16 16 THR H H 16 9.520 8.920 0.600 2
1 116 . 1 1 A 16 16 THR HA H 16 4.369 4.866 -0.497 2
1 121 . 1 1 A 16 16 THR C C 16 172.453 173.133 -0.680 2
1 122 . 1 1 A 16 16 THR CA C 16 62.480 61.376 1.104 2
1 123 . 1 1 A 16 16 THR CB C 16 72.198 71.935 0.263 2
1 125 . 1 1 A 16 16 THR N N 16 122.214 120.486 1.728 2
1 126 . 1 1 A 17 17 LEU H H 17 8.847 8.670 0.177 2
1 127 . 1 1 A 17 17 LEU HA H 17 4.573 4.476 0.097 2
1 137 . 1 1 A 17 17 LEU C C 17 174.695 176.641 -1.946 2
1 138 . 1 1 A 17 17 LEU CA C 17 53.840 54.857 -1.017 2
1 139 . 1 1 A 17 17 LEU CB C 17 40.290 42.249 -1.959 2
1 143 . 1 1 A 17 17 LEU N N 17 127.415 127.529 -0.114 2
1 144 . 1 1 A 18 18 ALA H H 18 8.647 8.538 0.109 2
1 145 . 1 1 A 18 18 ALA HA H 18 4.106 4.046 0.060 2
1 149 . 1 1 A 18 18 ALA C C 18 178.236 177.385 0.851 2
1 150 . 1 1 A 18 18 ALA CA C 18 53.926 54.292 -0.366 2
1 151 . 1 1 A 18 18 ALA CB C 18 18.876 19.023 -0.147 2
1 152 . 1 1 A 18 18 ALA N N 18 133.362 129.953 3.409 2
1 153 . 1 1 A 19 19 ALA H H 19 7.772 7.250 0.522 2
1 154 . 1 1 A 19 19 ALA HA H 19 4.561 4.669 -0.108 2
1 158 . 1 1 A 19 19 ALA C C 19 176.032 174.662 1.370 2
1 159 . 1 1 A 19 19 ALA CA C 19 53.011 51.703 1.308 2
1 160 . 1 1 A 19 19 ALA CB C 19 21.869 22.627 -0.758 2
1 161 . 1 1 A 19 19 ALA N N 19 115.654 116.597 -0.944 2
1 162 . 1 1 A 20 20 VAL H H 20 8.697 8.858 -0.161 2
1 163 . 1 1 A 20 20 VAL HA H 20 4.951 4.788 0.163 2
1 171 . 1 1 A 20 20 VAL C C 20 174.314 174.178 0.136 2
1 172 . 1 1 A 20 20 VAL CA C 20 61.352 60.443 0.909 2
1 173 . 1 1 A 20 20 VAL CB C 20 35.394 33.565 1.829 2
1 176 . 1 1 A 20 20 VAL N N 20 120.848 121.208 -0.360 2
1 177 . 1 1 A 21 21 THR H H 21 9.198 8.427 0.771 2
1 178 . 1 1 A 21 21 THR HA H 21 4.941 4.763 0.178 2
1 183 . 1 1 A 21 21 THR C C 21 174.416 174.620 -0.204 2
1 184 . 1 1 A 21 21 THR CA C 21 60.347 58.950 1.397 2
1 185 . 1 1 A 21 21 THR CB C 21 68.713 71.769 -3.056 2
1 187 . 1 1 A 21 21 THR N N 21 120.326 125.025 -4.699 2
1 188 . 1 1 A 22 22 PRO HA H 22 4.634 4.559 0.075 2
1 194 . 1 1 A 22 22 PRO C C 22 173.606 176.925 -3.319 2
1 195 . 1 1 A 22 22 PRO CA C 22 66.519 64.286 2.233 2
1 196 . 1 1 A 22 22 PRO CB C 22 32.078 31.651 0.427 2
1 199 . 1 1 A 23 23 ARG H H 23 6.621 8.234 -1.613 2
1 200 . 1 1 A 23 23 ARG HA H 23 4.591 4.511 0.080 2
1 207 . 1 1 A 23 23 ARG C C 23 176.554 175.684 0.870 2
1 208 . 1 1 A 23 23 ARG CA C 23 53.892 56.209 -2.317 2
1 209 . 1 1 A 23 23 ARG CB C 23 33.498 32.715 0.783 2
1 212 . 1 1 A 23 23 ARG N N 23 102.938 116.579 -13.641 2
1 213 . 1 1 A 24 24 THR H H 24 7.352 7.941 -0.589 2
1 214 . 1 1 A 24 24 THR HA H 24 5.593 5.243 0.350 2
1 219 . 1 1 A 24 24 THR C C 24 172.345 172.248 0.097 2
1 220 . 1 1 A 24 24 THR CA C 24 59.311 60.668 -1.357 2
1 221 . 1 1 A 24 24 THR CB C 24 73.311 71.888 1.423 2
1 223 . 1 1 A 24 24 THR N N 24 108.792 110.205 -1.413 2
1 224 . 1 1 A 25 25 VAL H H 25 8.437 8.647 -0.210 2
1 225 . 1 1 A 25 25 VAL HA H 25 4.512 4.889 -0.377 2
1 233 . 1 1 A 25 25 VAL C C 25 172.854 174.031 -1.177 2
1 234 . 1 1 A 25 25 VAL CA C 25 61.617 60.997 0.620 2
1 235 . 1 1 A 25 25 VAL CB C 25 36.742 34.243 2.499 2
1 238 . 1 1 A 25 25 VAL N N 25 117.023 121.478 -4.455 2
1 239 . 1 1 A 26 26 HIS H H 26 8.915 8.718 0.197 2
1 240 . 1 1 A 26 26 HIS HA H 26 5.765 5.551 0.214 2
1 245 . 1 1 A 26 26 HIS C C 26 173.976 173.240 0.736 2
1 246 . 1 1 A 26 26 HIS CA C 26 52.896 53.711 -0.815 2
1 247 . 1 1 A 26 26 HIS CB C 26 34.004 32.839 1.165 2
1 250 . 1 1 A 26 26 HIS N N 26 128.155 127.658 0.497 2
1 251 . 1 1 A 27 27 LEU H H 27 9.034 9.312 -0.278 2
1 252 . 1 1 A 27 27 LEU HA H 27 5.505 5.188 0.317 2
1 262 . 1 1 A 27 27 LEU C C 27 174.821 174.867 -0.046 2
1 263 . 1 1 A 27 27 LEU CA C 27 53.376 53.464 -0.088 2
1 264 . 1 1 A 27 27 LEU CB C 27 46.306 46.757 -0.451 2
1 268 . 1 1 A 27 27 LEU N N 27 128.569 129.767 -1.198 2
1 269 . 1 1 A 28 28 THR H H 28 8.844 8.541 0.302 2
1 270 . 1 1 A 28 28 THR HA H 28 4.485 4.838 -0.353 2
1 275 . 1 1 A 28 28 THR C C 28 172.773 173.504 -0.731 2
1 276 . 1 1 A 28 28 THR CA C 28 60.052 60.097 -0.045 2
1 277 . 1 1 A 28 28 THR CB C 28 71.704 71.397 0.307 2
1 279 . 1 1 A 28 28 THR N N 28 112.165 113.608 -1.443 2
1 280 . 1 1 A 29 29 TRP H H 29 7.395 7.847 -0.452 2
1 281 . 1 1 A 29 29 TRP HA H 29 4.915 5.596 -0.681 2
1 290 . 1 1 A 29 29 TRP C C 29 174.013 174.292 -0.279 2
1 291 . 1 1 A 29 29 TRP CA C 29 56.626 54.622 2.004 2
1 292 . 1 1 A 29 29 TRP CB C 29 29.487 31.829 -2.342 2
1 298 . 1 1 A 29 29 TRP N N 29 115.623 119.861 -4.238 2
1 300 . 1 1 A 30 30 GLN H H 30 8.759 8.532 0.227 2
1 301 . 1 1 A 30 30 GLN HA H 30 4.641 4.756 -0.115 2
1 308 . 1 1 A 30 30 GLN C C 30 175.072 174.206 0.866 2
1 309 . 1 1 A 30 30 GLN CA C 30 52.975 53.643 -0.668 2
1 310 . 1 1 A 30 30 GLN CB C 30 28.398 28.584 -0.186 2
1 312 . 1 1 A 30 30 GLN N N 30 117.497 120.057 -2.560 2
1 314 . 1 1 A 31 31 PRO HA H 31 4.487 4.561 -0.074 2
1 320 . 1 1 A 31 31 PRO C C 31 177.034 176.401 0.633 2
1 321 . 1 1 A 31 31 PRO CA C 31 62.710 62.810 -0.100 2
1 322 . 1 1 A 31 31 PRO CB C 31 32.738 32.311 0.427 2
1 325 . 1 1 A 32 32 SER H H 32 8.259 8.673 -0.414 2
1 326 . 1 1 A 32 32 SER HA H 32 4.670 4.817 -0.147 2
1 329 . 1 1 A 32 32 SER C C 32 174.689 174.037 0.652 2
1 330 . 1 1 A 32 32 SER CA C 32 57.296 57.631 -0.335 2
1 331 . 1 1 A 32 32 SER CB C 32 64.748 64.737 0.011 2
1 332 . 1 1 A 32 32 SER N N 32 117.667 117.006 0.661 2
1 333 . 1 1 A 33 33 ALA H H 33 9.038 8.540 0.498 2
1 334 . 1 1 A 33 33 ALA HA H 33 4.126 4.556 -0.430 2
1 338 . 1 1 A 33 33 ALA C C 33 177.795 177.739 0.056 2
1 339 . 1 1 A 33 33 ALA CA C 33 54.213 51.583 2.630 2
1 340 . 1 1 A 33 33 ALA CB C 33 17.948 18.969 -1.021 2
1 341 . 1 1 A 33 33 ALA N N 33 131.772 126.082 5.690 2
1 342 . 1 1 A 34 34 GLY H H 34 8.576 8.320 0.256 2
1 343 . 1 1 A 34 34 GLY HA2 H 34 4.171 4.002 0.169 2
1 344 . 1 1 A 34 34 GLY HA3 H 34 3.592 4.005 -0.413 2
1 345 . 1 1 A 34 34 GLY C C 34 174.182 174.484 -0.303 2
1 346 . 1 1 A 34 34 GLY CA C 34 44.987 45.420 -0.433 2
1 347 . 1 1 A 34 34 GLY N N 34 111.339 109.614 1.725 2
1 348 . 1 1 A 35 35 ALA H H 35 7.637 7.807 -0.170 2
1 349 . 1 1 A 35 35 ALA HA H 35 4.210 4.233 -0.023 2
1 353 . 1 1 A 35 35 ALA C C 35 178.918 177.710 1.208 2
1 354 . 1 1 A 35 35 ALA CA C 35 52.671 52.353 0.318 2
1 355 . 1 1 A 35 35 ALA CB C 35 18.988 19.386 -0.398 2
1 356 . 1 1 A 35 35 ALA N N 35 121.531 123.346 -1.815 2
1 357 . 1 1 A 36 36 THR H H 36 9.428 8.439 0.989 2
1 358 . 1 1 A 36 36 THR HA H 36 4.402 4.285 0.117 2
1 363 . 1 1 A 36 36 THR C C 36 174.739 174.332 0.407 2
1 364 . 1 1 A 36 36 THR CA C 36 62.692 63.510 -0.818 2
1 365 . 1 1 A 36 36 THR CB C 36 69.482 69.971 -0.489 2
1 367 . 1 1 A 36 36 THR N N 36 113.103 117.324 -4.221 2
1 368 . 1 1 A 37 37 HIS H H 37 7.857 7.008 0.849 2
1 369 . 1 1 A 37 37 HIS HA H 37 4.878 4.796 0.082 2
1 374 . 1 1 A 37 37 HIS C C 37 171.103 172.050 -0.947 2
1 375 . 1 1 A 37 37 HIS CA C 37 55.867 54.204 1.663 2
1 376 . 1 1 A 37 37 HIS CB C 37 32.655 32.003 0.652 2
1 379 . 1 1 A 37 37 HIS N N 37 118.486 115.236 3.250 2
1 380 . 1 1 A 38 38 TYR H H 38 9.217 8.721 0.496 2
1 381 . 1 1 A 38 38 TYR HA H 38 5.303 5.165 0.138 2
1 388 . 1 1 A 38 38 TYR C C 38 173.922 174.577 -0.655 2
1 389 . 1 1 A 38 38 TYR CA C 38 56.504 56.384 0.120 2
1 390 . 1 1 A 38 38 TYR CB C 38 41.823 42.230 -0.407 2
1 395 . 1 1 A 38 38 TYR N N 38 114.077 118.306 -4.229 2
1 396 . 1 1 A 39 39 LEU H H 39 9.052 8.986 0.066 2
1 397 . 1 1 A 39 39 LEU HA H 39 5.061 5.029 0.032 2
1 407 . 1 1 A 39 39 LEU C C 39 175.455 174.624 0.831 2
1 408 . 1 1 A 39 39 LEU CA C 39 53.855 54.035 -0.180 2
1 409 . 1 1 A 39 39 LEU CB C 39 45.254 44.103 1.151 2
1 413 . 1 1 A 39 39 LEU N N 39 123.997 125.516 -1.519 2
1 414 . 1 1 A 40 40 VAL H H 40 9.520 9.470 0.050 2
1 415 . 1 1 A 40 40 VAL HA H 40 4.988 4.669 0.319 2
1 423 . 1 1 A 40 40 VAL C C 40 174.578 174.615 -0.037 2
1 424 . 1 1 A 40 40 VAL CA C 40 60.575 61.489 -0.914 2
1 425 . 1 1 A 40 40 VAL CB C 40 33.284 33.164 0.120 2
1 428 . 1 1 A 40 40 VAL N N 40 129.678 128.404 1.274 2
1 429 . 1 1 A 41 41 ARG H H 41 9.096 8.958 0.138 2
1 430 . 1 1 A 41 41 ARG HA H 41 5.384 5.098 0.286 2
1 437 . 1 1 A 41 41 ARG C C 41 175.100 174.648 0.452 2
1 438 . 1 1 A 41 41 ARG CA C 41 54.297 54.977 -0.679 2
1 439 . 1 1 A 41 41 ARG CB C 41 33.003 31.660 1.343 2
1 442 . 1 1 A 41 41 ARG N N 41 126.332 127.612 -1.280 2
1 443 . 1 1 A 42 42 CYS H H 42 9.004 9.273 -0.269 2
1 444 . 1 1 A 42 42 CYS HA H 42 5.309 5.116 0.193 2
1 447 . 1 1 A 42 42 CYS C C 42 173.417 173.841 -0.424 2
1 448 . 1 1 A 42 42 CYS CA C 42 57.508 57.401 0.107 2
1 449 . 1 1 A 42 42 CYS CB C 42 28.859 29.096 -0.237 2
1 450 . 1 1 A 42 42 CYS N N 42 123.359 126.165 -2.806 2
1 451 . 1 1 A 43 43 SER H H 43 9.102 8.805 0.297 2
1 452 . 1 1 A 43 43 SER HA H 43 5.324 5.065 0.259 2
1 455 . 1 1 A 43 43 SER C C 43 171.429 171.765 -0.336 2
1 456 . 1 1 A 43 43 SER CA C 43 55.621 55.514 0.107 2
1 457 . 1 1 A 43 43 SER CB C 43 64.856 65.744 -0.888 2
1 458 . 1 1 A 43 43 SER N N 43 125.444 121.837 3.607 2
1 459 . 1 1 A 44 44 PRO HA H 44 4.389 4.650 -0.261 2
1 466 . 1 1 A 44 44 PRO C C 44 176.559 177.185 -0.626 2
1 467 . 1 1 A 44 44 PRO CA C 44 63.027 62.898 0.129 2
1 468 . 1 1 A 44 44 PRO CB C 44 31.935 32.680 -0.745 2
1 471 . 1 1 A 45 45 ALA H H 45 8.261 8.157 0.104 2
1 472 . 1 1 A 45 45 ALA HA H 45 4.157 4.170 -0.013 2
1 476 . 1 1 A 45 45 ALA C C 45 177.706 177.349 0.357 2
1 477 . 1 1 A 45 45 ALA CA C 45 53.284 54.177 -0.893 2
1 478 . 1 1 A 45 45 ALA CB C 45 18.978 19.242 -0.264 2
1 479 . 1 1 A 45 45 ALA N N 45 126.162 124.114 2.048 2
1 480 . 1 1 A 46 46 SER H H 46 8.275 7.677 0.598 2
1 481 . 1 1 A 46 46 SER HA H 46 4.779 4.677 0.102 2
1 484 . 1 1 A 46 46 SER C C 46 172.182 174.123 -1.941 2
1 485 . 1 1 A 46 46 SER CA C 46 55.091 55.601 -0.510 2
1 486 . 1 1 A 46 46 SER CB C 46 63.130 64.028 -0.898 2
1 487 . 1 1 A 46 46 SER N N 46 113.009 113.700 -0.691 2
1 488 . 1 1 A 47 47 PRO HA H 47 4.336 4.545 -0.209 2
1 493 . 1 1 A 47 47 PRO C C 47 177.165 176.634 0.531 2
1 494 . 1 1 A 47 47 PRO CA C 47 63.268 63.824 -0.556 2
1 495 . 1 1 A 47 47 PRO CB C 47 32.528 31.715 0.812 2
1 498 . 1 1 A 48 48 LYS H H 48 9.089 7.861 1.228 2
1 499 . 1 1 A 48 48 LYS HA H 48 4.408 4.217 0.191 2
1 508 . 1 1 A 48 48 LYS C C 48 176.917 176.675 0.242 2
1 509 . 1 1 A 48 48 LYS CA C 48 55.893 57.376 -1.483 2
1 510 . 1 1 A 48 48 LYS CB C 48 32.997 32.195 0.802 2
1 514 . 1 1 A 48 48 LYS N N 48 122.579 118.135 4.445 2
1 515 . 1 1 A 49 49 GLY HA2 H 49 4.021 4.088 -0.067 2
1 516 . 1 1 A 49 49 GLY HA3 H 49 3.881 4.090 -0.209 2
1 517 . 1 1 A 49 49 GLY C C 49 174.552 173.829 0.723 2
1 518 . 1 1 A 49 49 GLY CA C 49 46.011 45.061 0.950 2
1 519 . 1 1 A 50 50 GLU H H 50 8.608 8.647 -0.039 2
1 520 . 1 1 A 50 50 GLU HA H 50 4.335 4.471 -0.136 2
1 525 . 1 1 A 50 50 GLU C C 50 176.672 176.144 0.528 2
1 526 . 1 1 A 50 50 GLU CA C 50 56.978 56.288 0.690 2
1 527 . 1 1 A 50 50 GLU CB C 50 29.458 29.556 -0.098 2
1 529 . 1 1 A 50 50 GLU N N 50 121.378 122.089 -0.711 2
1 530 . 1 1 A 51 51 GLU H H 51 8.287 8.078 0.209 2
1 531 . 1 1 A 51 51 GLU HA H 51 4.381 4.409 -0.028 2
1 536 . 1 1 A 51 51 GLU C C 51 176.218 176.076 0.142 2
1 537 . 1 1 A 51 51 GLU CA C 51 56.996 56.308 0.688 2
1 538 . 1 1 A 51 51 GLU CB C 51 31.066 30.028 1.038 2
1 540 . 1 1 A 51 51 GLU N N 51 120.863 121.078 -0.215 2
1 541 . 1 1 A 52 52 GLU H H 52 8.445 8.394 0.051 2
1 542 . 1 1 A 52 52 GLU HA H 52 4.464 4.493 -0.029 2
1 547 . 1 1 A 52 52 GLU C C 52 176.128 175.735 0.393 2
1 548 . 1 1 A 52 52 GLU CA C 52 55.955 56.158 -0.203 2
1 549 . 1 1 A 52 52 GLU CB C 52 31.691 31.048 0.643 2
1 551 . 1 1 A 52 52 GLU N N 52 121.103 122.430 -1.327 2
1 552 . 1 1 A 53 53 GLU H H 53 8.441 8.644 -0.203 2
1 553 . 1 1 A 53 53 GLU HA H 53 4.609 4.717 -0.108 2
1 558 . 1 1 A 53 53 GLU C C 53 175.816 175.542 0.274 2
1 559 . 1 1 A 53 53 GLU CA C 53 56.697 55.981 0.716 2
1 560 . 1 1 A 53 53 GLU CB C 53 31.022 31.269 -0.247 2
1 562 . 1 1 A 53 53 GLU N N 53 121.949 123.535 -1.586 2
1 563 . 1 1 A 54 54 ARG H H 54 8.569 8.750 -0.181 2
1 564 . 1 1 A 54 54 ARG HA H 54 4.768 4.869 -0.101 2
1 571 . 1 1 A 54 54 ARG C C 54 174.881 174.881 -0.000 2
1 572 . 1 1 A 54 54 ARG CA C 54 54.950 55.267 -0.318 2
1 573 . 1 1 A 54 54 ARG CB C 54 33.374 32.189 1.185 2
1 576 . 1 1 A 54 54 ARG N N 54 123.714 124.757 -1.043 2
1 577 . 1 1 A 55 55 GLU H H 55 8.650 8.927 -0.277 2
1 578 . 1 1 A 55 55 GLU HA H 55 5.493 5.180 0.313 2
1 583 . 1 1 A 55 55 GLU C C 55 175.566 175.319 0.247 2
1 584 . 1 1 A 55 55 GLU CA C 55 54.915 55.093 -0.178 2
1 585 . 1 1 A 55 55 GLU CB C 55 33.250 32.201 1.049 2
1 587 . 1 1 A 55 55 GLU N N 55 123.537 125.519 -1.982 2
1 588 . 1 1 A 56 56 VAL H H 56 9.419 8.943 0.476 2
1 589 . 1 1 A 56 56 VAL HA H 56 4.524 4.960 -0.436 2
1 597 . 1 1 A 56 56 VAL C C 56 173.502 174.250 -0.748 2
1 598 . 1 1 A 56 56 VAL CA C 56 60.981 58.957 2.024 2
1 599 . 1 1 A 56 56 VAL CB C 56 36.117 35.770 0.347 2
1 602 . 1 1 A 56 56 VAL N N 56 123.343 119.399 3.944 2
1 603 . 1 1 A 57 57 GLN H H 57 8.767 8.784 -0.017 2
1 604 . 1 1 A 57 57 GLN HA H 57 5.671 5.266 0.405 2
1 611 . 1 1 A 57 57 GLN C C 57 176.357 175.062 1.295 2
1 612 . 1 1 A 57 57 GLN CA C 57 54.735 54.261 0.474 2
1 613 . 1 1 A 57 57 GLN CB C 57 30.781 31.505 -0.724 2
1 615 . 1 1 A 57 57 GLN N N 57 125.639 121.107 4.532 2
1 617 . 1 1 A 58 58 VAL H H 58 9.217 8.910 0.307 2
1 618 . 1 1 A 58 58 VAL HA H 58 5.129 4.850 0.279 2
1 626 . 1 1 A 58 58 VAL C C 58 175.925 176.670 -0.745 2
1 627 . 1 1 A 58 58 VAL CA C 58 59.652 60.046 -0.394 2
1 628 . 1 1 A 58 58 VAL CB C 58 36.540 34.963 1.577 2
1 631 . 1 1 A 58 58 VAL N N 58 117.022 118.494 -1.472 2
1 632 . 1 1 A 59 59 GLY H H 59 9.008 8.810 0.198 2
1 633 . 1 1 A 59 59 GLY HA2 H 59 4.670 3.897 0.773 2
1 634 . 1 1 A 59 59 GLY HA3 H 59 3.914 3.946 -0.032 2
1 635 . 1 1 A 59 59 GLY C C 59 173.386 174.094 -0.708 2
1 636 . 1 1 A 59 59 GLY CA C 59 45.093 46.349 -1.256 2
1 637 . 1 1 A 59 59 GLY N N 59 109.174 111.198 -2.024 2
1 638 . 1 1 A 60 60 ARG H H 60 7.695 7.713 -0.018 2
1 639 . 1 1 A 60 60 ARG HA H 60 4.866 4.930 -0.064 2
1 645 . 1 1 A 60 60 ARG C C 60 173.760 175.807 -2.047 2
1 646 . 1 1 A 60 60 ARG CA C 60 52.764 53.419 -0.655 2
1 647 . 1 1 A 60 60 ARG CB C 60 31.785 31.750 0.035 2
1 650 . 1 1 A 60 60 ARG N N 60 118.520 118.852 -0.332 2
1 651 . 1 1 A 61 61 PRO HA H 61 3.539 3.932 -0.393 2
1 658 . 1 1 A 61 61 PRO C C 61 173.175 173.807 -0.632 2
1 659 . 1 1 A 61 61 PRO CA C 61 62.265 62.981 -0.716 2
1 660 . 1 1 A 61 61 PRO CB C 61 27.546 30.826 -3.280 2
1 663 . 1 1 A 62 62 GLU H H 62 7.879 7.697 0.182 2
1 664 . 1 1 A 62 62 GLU HA H 62 4.071 4.604 -0.533 2
1 669 . 1 1 A 62 62 GLU C C 62 174.107 174.646 -0.539 2
1 670 . 1 1 A 62 62 GLU CA C 62 55.229 54.596 0.632 2
1 671 . 1 1 A 62 62 GLU CB C 62 32.838 31.936 0.902 2
1 673 . 1 1 A 62 62 GLU N N 62 118.173 114.127 4.046 2
1 674 . 1 1 A 63 63 VAL H H 63 8.930 8.561 0.369 2
1 675 . 1 1 A 63 63 VAL HA H 63 4.548 5.042 -0.494 2
1 683 . 1 1 A 63 63 VAL C C 63 170.325 173.403 -3.078 2
1 684 . 1 1 A 63 63 VAL CA C 63 60.770 59.524 1.246 2
1 685 . 1 1 A 63 63 VAL CB C 63 35.394 35.300 0.094 2
1 688 . 1 1 A 63 63 VAL N N 63 117.161 123.548 -6.387 2
1 689 . 1 1 A 64 64 LEU H H 64 8.332 8.841 -0.509 2
1 690 . 1 1 A 64 64 LEU HA H 64 5.122 5.211 -0.089 2
1 700 . 1 1 A 64 64 LEU C C 64 176.243 174.714 1.529 2
1 701 . 1 1 A 64 64 LEU CA C 64 53.346 53.712 -0.366 2
1 702 . 1 1 A 64 64 LEU CB C 64 42.649 45.047 -2.398 2
1 706 . 1 1 A 64 64 LEU N N 64 130.510 128.698 1.812 2
1 707 . 1 1 A 65 65 LEU H H 65 9.261 9.300 -0.039 2
1 708 . 1 1 A 65 65 LEU HA H 65 4.443 4.767 -0.324 2
1 718 . 1 1 A 65 65 LEU C C 65 174.016 175.973 -1.957 2
1 719 . 1 1 A 65 65 LEU CA C 65 53.920 54.021 -0.101 2
1 720 . 1 1 A 65 65 LEU CB C 65 42.976 42.313 0.663 2
1 724 . 1 1 A 65 65 LEU N N 65 128.611 128.666 -0.055 2
1 725 . 1 1 A 66 66 ASP H H 66 8.105 8.646 -0.541 2
1 726 . 1 1 A 66 66 ASP HA H 66 5.207 5.029 0.179 2
1 729 . 1 1 A 66 66 ASP C C 66 176.161 176.270 -0.109 2
1 730 . 1 1 A 66 66 ASP CA C 66 51.001 53.237 -2.236 2
1 731 . 1 1 A 66 66 ASP CB C 66 42.836 42.425 0.411 2
1 732 . 1 1 A 66 66 ASP N N 66 121.799 124.378 -2.579 2
1 733 . 1 1 A 67 67 GLY H H 67 8.688 8.550 0.138 2
1 734 . 1 1 A 67 67 GLY HA2 H 67 3.923 3.923 -0.000 2
1 735 . 1 1 A 67 67 GLY HA3 H 67 3.808 3.930 -0.122 2
1 736 . 1 1 A 67 67 GLY C C 67 175.500 174.268 1.232 2
1 737 . 1 1 A 67 67 GLY CA C 67 46.591 46.695 -0.104 2
1 738 . 1 1 A 67 67 GLY N N 67 106.518 110.768 -4.250 2
1 739 . 1 1 A 68 68 LEU H H 68 8.125 7.470 0.656 2
1 740 . 1 1 A 68 68 LEU HA H 68 4.252 4.878 -0.626 2
1 750 . 1 1 A 68 68 LEU C C 68 174.914 175.435 -0.521 2
1 751 . 1 1 A 68 68 LEU CA C 68 53.469 53.226 0.243 2
1 752 . 1 1 A 68 68 LEU CB C 68 40.422 45.209 -4.787 2
1 756 . 1 1 A 68 68 LEU N N 68 119.345 120.116 -0.771 2
1 757 . 1 1 A 69 69 GLU H H 69 8.207 8.559 -0.352 2
1 758 . 1 1 A 69 69 GLU HA H 69 4.908 4.859 0.049 2
1 763 . 1 1 A 69 69 GLU C C 69 174.464 174.239 0.225 2
1 764 . 1 1 A 69 69 GLU CA C 69 53.081 53.093 -0.012 2
1 765 . 1 1 A 69 69 GLU CB C 69 31.538 31.060 0.478 2
1 767 . 1 1 A 69 69 GLU N N 69 119.486 120.388 -0.902 2
1 768 . 1 1 A 70 70 PRO HA H 70 4.866 4.336 0.530 2
1 775 . 1 1 A 70 70 PRO C C 70 178.285 177.489 0.796 2
1 776 . 1 1 A 70 70 PRO CA C 70 63.203 63.638 -0.435 2
1 777 . 1 1 A 70 70 PRO CB C 70 33.726 31.808 1.918 2
1 780 . 1 1 A 71 71 GLY H H 71 7.362 8.849 -1.487 2
1 781 . 1 1 A 71 71 GLY HA2 H 71 3.807 3.940 -0.133 2
1 782 . 1 1 A 71 71 GLY HA3 H 71 3.756 3.944 -0.188 2
1 783 . 1 1 A 71 71 GLY C C 71 174.664 173.779 0.885 2
1 784 . 1 1 A 71 71 GLY CA C 71 46.926 46.379 0.547 2
1 785 . 1 1 A 71 71 GLY N N 71 113.776 111.684 2.092 2
1 786 . 1 1 A 72 72 ARG H H 72 8.036 7.355 0.681 2
1 787 . 1 1 A 72 72 ARG HA H 72 4.597 4.800 -0.203 2
1 793 . 1 1 A 72 72 ARG C C 72 173.293 173.858 -0.565 2
1 794 . 1 1 A 72 72 ARG CA C 72 54.633 54.402 0.231 2
1 795 . 1 1 A 72 72 ARG CB C 72 33.704 33.383 0.321 2
1 798 . 1 1 A 72 72 ARG N N 72 119.611 119.653 -0.042 2
1 799 . 1 1 A 73 73 ASP H H 73 7.785 8.574 -0.789 2
1 800 . 1 1 A 73 73 ASP HA H 73 5.276 5.354 -0.078 2
1 803 . 1 1 A 73 73 ASP C C 73 175.904 174.868 1.036 2
1 804 . 1 1 A 73 73 ASP CA C 73 53.568 52.945 0.623 2
1 805 . 1 1 A 73 73 ASP CB C 73 42.970 42.734 0.236 2
1 806 . 1 1 A 73 73 ASP N N 73 118.900 125.264 -6.364 2
1 807 . 1 1 A 74 74 TYR H H 74 9.516 8.961 0.555 2
1 808 . 1 1 A 74 74 TYR HA H 74 4.800 5.097 -0.297 2
1 815 . 1 1 A 74 74 TYR C C 74 174.631 175.008 -0.377 2
1 816 . 1 1 A 74 74 TYR CA C 74 58.548 56.508 2.040 2
1 817 . 1 1 A 74 74 TYR CB C 74 42.029 42.656 -0.627 2
1 822 . 1 1 A 74 74 TYR N N 74 121.903 122.028 -0.125 2
1 823 . 1 1 A 75 75 GLU H H 75 9.248 9.168 0.080 2
1 824 . 1 1 A 75 75 GLU HA H 75 4.756 4.845 -0.089 2
1 829 . 1 1 A 75 75 GLU C C 75 175.524 175.449 0.075 2
1 830 . 1 1 A 75 75 GLU CA C 75 55.621 55.555 0.066 2
1 831 . 1 1 A 75 75 GLU CB C 75 30.778 30.327 0.451 2
1 833 . 1 1 A 75 75 GLU N N 75 122.425 122.507 -0.082 2
1 834 . 1 1 A 76 76 VAL H H 76 8.884 8.650 0.234 2
1 835 . 1 1 A 76 76 VAL HA H 76 5.246 4.779 0.467 2
1 843 . 1 1 A 76 76 VAL C C 76 174.800 175.087 -0.287 2
1 844 . 1 1 A 76 76 VAL CA C 76 60.199 62.069 -1.870 2
1 845 . 1 1 A 76 76 VAL CB C 76 33.449 32.256 1.193 2
1 848 . 1 1 A 76 76 VAL N N 76 126.853 125.656 1.197 2
1 849 . 1 1 A 77 77 SER H H 77 9.234 8.790 0.444 2
1 850 . 1 1 A 77 77 SER HA H 77 5.398 5.154 0.244 2
1 853 . 1 1 A 77 77 SER C C 77 173.138 173.688 -0.550 2
1 854 . 1 1 A 77 77 SER CA C 77 56.032 57.237 -1.205 2
1 855 . 1 1 A 77 77 SER CB C 77 66.374 64.431 1.943 2
1 856 . 1 1 A 77 77 SER N N 77 120.852 123.900 -3.048 2
1 857 . 1 1 A 78 78 VAL H H 78 9.092 8.786 0.306 2
1 858 . 1 1 A 78 78 VAL HA H 78 4.756 4.704 0.052 2
1 866 . 1 1 A 78 78 VAL C C 78 173.641 174.536 -0.895 2
1 867 . 1 1 A 78 78 VAL CA C 78 61.246 60.809 0.437 2
1 868 . 1 1 A 78 78 VAL CB C 78 34.467 33.042 1.425 2
1 871 . 1 1 A 78 78 VAL N N 78 122.453 126.333 -3.880 2
1 872 . 1 1 A 79 79 GLN H H 79 8.587 8.556 0.031 2
1 873 . 1 1 A 79 79 GLN HA H 79 4.438 4.799 -0.361 2
1 880 . 1 1 A 79 79 GLN C C 79 174.999 174.507 0.492 2
1 881 . 1 1 A 79 79 GLN CA C 79 54.227 54.344 -0.117 2
1 882 . 1 1 A 79 79 GLN CB C 79 33.587 32.431 1.156 2
1 884 . 1 1 A 79 79 GLN N N 79 125.619 127.001 -1.382 2
1 886 . 1 1 A 80 80 SER H H 80 8.623 8.874 -0.251 2
1 887 . 1 1 A 80 80 SER HA H 80 4.756 4.736 0.020 2
1 890 . 1 1 A 80 80 SER C C 80 172.264 174.084 -1.820 2
1 891 . 1 1 A 80 80 SER CA C 80 58.177 59.117 -0.940 2
1 892 . 1 1 A 80 80 SER CB C 80 63.920 63.458 0.462 2
1 893 . 1 1 A 80 80 SER N N 80 122.844 123.574 -0.730 2
1 894 . 1 1 A 81 81 LEU H H 81 8.348 8.845 -0.497 2
1 895 . 1 1 A 81 81 LEU HA H 81 5.124 4.611 0.513 2
1 905 . 1 1 A 81 81 LEU C C 81 175.775 176.143 -0.368 2
1 906 . 1 1 A 81 81 LEU CA C 81 54.033 53.485 0.548 2
1 907 . 1 1 A 81 81 LEU CB C 81 44.690 42.849 1.841 2
1 911 . 1 1 A 81 81 LEU N N 81 123.191 127.003 -3.812 2
1 912 . 1 1 A 82 82 ARG H H 82 8.374 8.728 -0.354 2
1 913 . 1 1 A 82 82 ARG HA H 82 4.616 4.399 0.217 2
1 919 . 1 1 A 82 82 ARG C C 82 176.864 175.857 1.007 2
1 920 . 1 1 A 82 82 ARG CA C 82 55.868 56.021 -0.153 2
1 921 . 1 1 A 82 82 ARG CB C 82 32.322 32.052 0.270 2
1 924 . 1 1 A 82 82 ARG N N 82 121.029 124.816 -3.787 2
1 925 . 1 1 A 83 83 GLY H H 83 8.309 7.568 0.741 2
1 926 . 1 1 A 83 83 GLY HA2 H 83 4.031 4.087 -0.056 2
1 927 . 1 1 A 83 83 GLY HA3 H 83 3.888 4.122 -0.234 2
1 928 . 1 1 A 83 83 GLY C C 83 174.562 174.161 0.401 2
1 929 . 1 1 A 83 83 GLY CA C 83 45.963 45.305 0.658 2
1 930 . 1 1 A 83 83 GLY N N 83 109.937 107.702 2.235 2
1 931 . 1 1 A 84 84 PRO HA H 84 4.573 4.429 0.144 2
1 938 . 1 1 A 84 84 PRO C C 84 176.533 175.820 0.713 2
1 939 . 1 1 A 84 84 PRO CA C 84 63.485 64.430 -0.945 2
1 940 . 1 1 A 84 84 PRO CB C 84 32.409 31.995 0.414 2
1 943 . 1 1 A 85 85 GLU H H 85 7.799 7.580 0.219 2
1 944 . 1 1 A 85 85 GLU HA H 85 4.369 4.861 -0.492 2
1 949 . 1 1 A 85 85 GLU C C 85 174.722 175.617 -0.895 2
1 950 . 1 1 A 85 85 GLU CA C 85 55.899 54.844 1.055 2
1 951 . 1 1 A 85 85 GLU CB C 85 31.911 33.019 -1.108 2
1 953 . 1 1 A 85 85 GLU N N 85 122.093 112.741 9.352 2
1 954 . 1 1 A 86 86 GLY H H 86 8.329 8.773 -0.444 2
1 955 . 1 1 A 86 86 GLY HA2 H 86 5.298 4.219 1.079 2
1 956 . 1 1 A 86 86 GLY HA3 H 86 3.559 4.233 -0.674 2
1 957 . 1 1 A 86 86 GLY C C 86 174.355 172.969 1.386 2
1 958 . 1 1 A 86 86 GLY CA C 86 44.034 43.949 0.086 2
1 959 . 1 1 A 86 86 GLY N N 86 109.387 109.176 0.211 2
1 960 . 1 1 A 87 87 SER H H 87 8.807 8.517 0.290 2
1 961 . 1 1 A 87 87 SER HA H 87 4.670 4.636 0.034 2
1 964 . 1 1 A 87 87 SER C C 87 175.195 174.302 0.893 2
1 965 . 1 1 A 87 87 SER CA C 87 57.737 57.346 0.391 2
1 966 . 1 1 A 87 87 SER CB C 87 67.829 65.319 2.510 2
1 967 . 1 1 A 87 87 SER N N 87 117.698 114.159 3.539 2
1 968 . 1 1 A 88 88 GLU H H 88 8.754 8.558 0.196 2
1 969 . 1 1 A 88 88 GLU HA H 88 4.357 4.309 0.048 2
1 974 . 1 1 A 88 88 GLU C C 88 177.474 176.615 0.859 2
1 975 . 1 1 A 88 88 GLU CA C 88 57.525 56.833 0.692 2
1 976 . 1 1 A 88 88 GLU CB C 88 31.162 30.487 0.675 2
1 978 . 1 1 A 88 88 GLU N N 88 118.709 121.331 -2.622 2
1 979 . 1 1 A 89 89 ALA H H 89 8.855 8.411 0.444 2
1 980 . 1 1 A 89 89 ALA HA H 89 4.792 4.676 0.116 2
1 984 . 1 1 A 89 89 ALA C C 89 178.379 176.568 1.811 2
1 985 . 1 1 A 89 89 ALA CA C 89 51.264 51.546 -0.282 2
1 986 . 1 1 A 89 89 ALA CB C 89 20.040 19.822 0.218 2
1 987 . 1 1 A 89 89 ALA N N 89 127.301 124.643 2.658 2
1 988 . 1 1 A 90 90 ARG H H 90 8.549 8.563 -0.014 2
1 989 . 1 1 A 90 90 ARG HA H 90 4.658 4.928 -0.270 2
1 996 . 1 1 A 90 90 ARG C C 90 174.720 175.396 -0.676 2
1 997 . 1 1 A 90 90 ARG CA C 90 53.575 54.399 -0.824 2
1 998 . 1 1 A 90 90 ARG CB C 90 33.456 31.775 1.681 2
1 1001 . 1 1 A 90 90 ARG N N 90 121.289 123.578 -2.289 2
1 1002 . 1 1 A 91 91 GLY H H 91 8.396 8.997 -0.601 2
1 1003 . 1 1 A 91 91 GLY HA2 H 91 5.306 4.180 1.126 2
1 1004 . 1 1 A 91 91 GLY HA3 H 91 3.700 4.213 -0.513 2
1 1005 . 1 1 A 91 91 GLY C C 91 173.191 172.047 1.144 2
1 1006 . 1 1 A 91 91 GLY CA C 91 44.493 43.873 0.620 2
1 1007 . 1 1 A 91 91 GLY N N 91 108.579 112.114 -3.535 2
1 1008 . 1 1 A 92 92 ILE H H 92 8.891 8.363 0.528 2
1 1009 . 1 1 A 92 92 ILE HA H 92 4.499 4.963 -0.464 2
1 1019 . 1 1 A 92 92 ILE C C 92 171.877 174.243 -2.366 2
1 1020 . 1 1 A 92 92 ILE CA C 92 60.682 59.174 1.508 2
1 1021 . 1 1 A 92 92 ILE CB C 92 42.425 41.957 0.468 2
1 1025 . 1 1 A 92 92 ILE N N 92 118.313 121.781 -3.468 2
1 1026 . 1 1 A 93 93 ARG H H 93 7.980 8.508 -0.528 2
1 1027 . 1 1 A 93 93 ARG HA H 93 5.224 4.483 0.741 2
1 1034 . 1 1 A 93 93 ARG C C 93 175.072 175.391 -0.319 2
1 1035 . 1 1 A 93 93 ARG CA C 93 54.499 56.271 -1.772 2
1 1036 . 1 1 A 93 93 ARG CB C 93 31.767 30.468 1.299 2
1 1039 . 1 1 A 93 93 ARG N N 93 124.879 129.385 -4.506 2
1 1040 . 1 1 A 94 94 ALA H H 94 9.064 8.404 0.660 2
1 1041 . 1 1 A 94 94 ALA HA H 94 4.731 4.769 -0.038 2
1 1045 . 1 1 A 94 94 ALA C C 94 174.494 177.079 -2.585 2
1 1046 . 1 1 A 94 94 ALA CA C 94 50.577 51.838 -1.261 2
1 1047 . 1 1 A 94 94 ALA CB C 94 23.082 20.225 2.857 2
1 1048 . 1 1 A 94 94 ALA N N 94 126.095 129.180 -3.085 2
1 1049 . 1 1 A 95 95 ARG H H 95 8.263 8.902 -0.639 2
1 1050 . 1 1 A 95 95 ARG HA H 95 5.548 5.147 0.401 2
1 1058 . 1 1 A 95 95 ARG C C 95 176.901 174.802 2.099 2
1 1059 . 1 1 A 95 95 ARG CA C 95 53.787 54.640 -0.853 2
1 1060 . 1 1 A 95 95 ARG CB C 95 32.426 33.875 -1.449 2
1 1063 . 1 1 A 95 95 ARG N N 95 123.374 119.281 4.093 2
1 1065 . 1 1 A 96 96 THR H H 96 9.208 8.805 0.403 2
1 1066 . 1 1 A 96 96 THR HA H 96 4.461 5.050 -0.589 2
1 1071 . 1 1 A 96 96 THR CA C 96 58.248 58.425 -0.178 2
1 1072 . 1 1 A 96 96 THR CB C 96 68.466 71.072 -2.606 2
1 1074 . 1 1 A 96 96 THR N N 96 119.492 112.067 7.425 2
1 1075 . 1 1 A 97 97 PRO HA H 97 4.636 4.616 0.020 2
1 1082 . 1 1 A 97 97 PRO C C 97 175.725 175.818 -0.093 2
1 1083 . 1 1 A 97 97 PRO CA C 97 61.907 62.327 -0.420 2
1 1084 . 1 1 A 97 97 PRO CB C 97 32.590 33.422 -0.832 2
1 1087 . 1 1 A 98 98 THR H H 98 7.943 8.336 -0.393 2
1 1088 . 1 1 A 98 98 THR HA H 98 4.208 5.066 -0.858 2
1 1093 . 1 1 A 98 98 THR C C 98 175.058 173.259 1.799 2
1 1094 . 1 1 A 98 98 THR CA C 98 62.069 60.358 1.711 2
1 1095 . 1 1 A 98 98 THR CB C 98 69.719 70.696 -0.977 2
1 1097 . 1 1 A 98 98 THR N N 98 107.148 111.086 -3.938 2
1 1098 . 1 1 A 99 99 SER H H 99 8.163 8.891 -0.728 2
1 1099 . 1 1 A 99 99 SER HA H 99 4.524 4.577 -0.053 2
1 1102 . 1 1 A 99 99 SER C C 99 174.319 174.380 -0.061 2
1 1103 . 1 1 A 99 99 SER CA C 99 58.107 58.577 -0.470 2
1 1104 . 1 1 A 99 99 SER CB C 99 64.492 63.443 1.049 2
1 1105 . 1 1 A 99 99 SER N N 99 115.114 122.130 -7.016 2
1 1106 . 1 1 A 100 100 GLY H H 100 8.336 8.397 -0.061 2
1 1107 . 1 1 A 100 100 GLY HA2 H 100 4.222 4.121 0.101 2
1 1108 . 1 1 A 100 100 GLY HA3 H 100 4.222 4.122 0.100 2
1 1109 . 1 1 A 100 100 GLY C C 100 171.696 173.489 -1.793 2
1 1110 . 1 1 A 100 100 GLY CA C 100 44.617 45.243 -0.626 2
1 1111 . 1 1 A 100 100 GLY N N 100 110.678 112.552 -1.874 2
1 1112 . 1 1 A 101 101 PRO HA H 101 4.506 4.614 -0.108 2
1 1118 . 1 1 A 101 101 PRO CA C 101 63.358 63.179 0.179 2
1 1119 . 1 1 A 101 101 PRO CB C 101 32.313 31.968 0.345 2
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