data_10279_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10279
_Entry.PDB_ID 2D9W
_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 4.458 4.525 -0.067 1
1 3 . 1 1 1 A 6 6 SER C C 6 175.108 174.554 0.554 1
1 4 . 1 1 1 A 6 6 SER CA C 6 58.689 59.978 -1.289 1
1 5 . 1 1 1 A 6 6 SER CB C 6 63.678 64.501 -0.823 1
1 6 . 1 1 1 A 7 7 GLY H H 7 8.449 7.781 0.668 1
1 7 . 1 1 1 A 7 7 GLY HA2 H 7 3.965 4.059 -0.094 1
1 8 . 1 1 1 A 7 7 GLY HA3 H 7 3.965 4.059 -0.094 1
1 9 . 1 1 1 A 7 7 GLY C C 7 174.380 173.311 1.069 1
1 10 . 1 1 1 A 7 7 GLY CA C 7 45.435 44.322 1.113 1
1 11 . 1 1 1 A 7 7 GLY N N 7 110.792 107.192 3.600 1
1 12 . 1 1 1 A 8 8 MET H H 8 8.259 8.434 -0.175 1
1 13 . 1 1 1 A 8 8 MET HA H 8 4.487 4.712 -0.225 1
1 21 . 1 1 1 A 8 8 MET C C 8 176.961 176.183 0.778 1
1 22 . 1 1 1 A 8 8 MET CA C 8 55.565 56.181 -0.616 1
1 23 . 1 1 1 A 8 8 MET CB C 8 32.835 34.032 -1.197 1
1 26 . 1 1 1 A 8 8 MET N N 8 119.639 120.740 -1.101 1
1 27 . 1 1 1 A 9 9 GLY H H 9 8.472 8.237 0.235 1
1 28 . 1 1 1 A 9 9 GLY HA2 H 9 3.946 4.193 -0.247 1
1 29 . 1 1 1 A 9 9 GLY HA3 H 9 3.946 4.198 -0.252 1
1 30 . 1 1 1 A 9 9 GLY C C 9 174.005 173.185 0.820 1
1 31 . 1 1 1 A 9 9 GLY CA C 9 45.488 46.102 -0.614 1
1 32 . 1 1 1 A 9 9 GLY N N 9 110.107 108.690 1.417 1
1 33 . 1 1 1 A 10 10 ASP H H 10 8.292 8.329 -0.037 1
1 34 . 1 1 1 A 10 10 ASP HA H 10 4.636 4.660 -0.024 1
1 37 . 1 1 1 A 10 10 ASP C C 10 176.768 175.808 0.960 1
1 38 . 1 1 1 A 10 10 ASP CA C 10 54.206 54.033 0.173 1
1 39 . 1 1 1 A 10 10 ASP CB C 10 41.306 39.849 1.457 1
1 40 . 1 1 1 A 10 10 ASP N N 10 120.370 125.105 -4.735 1
1 41 . 1 1 1 A 11 11 GLY H H 11 8.452 8.189 0.263 1
1 42 . 1 1 1 A 11 11 GLY HA2 H 11 3.980 4.014 -0.034 1
1 43 . 1 1 1 A 11 11 GLY HA3 H 11 4.022 4.053 -0.031 1
1 44 . 1 1 1 A 11 11 GLY C C 11 174.102 175.041 -0.939 1
1 45 . 1 1 1 A 11 11 GLY CA C 11 45.170 46.703 -1.533 1
1 46 . 1 1 1 A 11 11 GLY N N 11 108.391 110.743 -2.352 1
1 47 . 1 1 1 A 12 12 ALA H H 12 8.293 7.696 0.597 1
1 48 . 1 1 1 A 12 12 ALA HA H 12 3.777 4.156 -0.379 1
1 52 . 1 1 1 A 12 12 ALA C C 12 178.193 178.218 -0.025 1
1 53 . 1 1 1 A 12 12 ALA CA C 12 52.759 52.501 0.258 1
1 54 . 1 1 1 A 12 12 ALA CB C 12 17.855 19.480 -1.625 1
1 55 . 1 1 1 A 12 12 ALA N N 12 124.185 122.596 1.589 1
1 56 . 1 1 1 A 13 13 VAL H H 13 8.822 8.582 0.240 1
1 57 . 1 1 1 A 13 13 VAL HA H 13 3.912 3.812 0.100 1
1 65 . 1 1 1 A 13 13 VAL C C 13 176.073 175.815 0.258 1
1 66 . 1 1 1 A 13 13 VAL CA C 13 63.100 65.559 -2.459 1
1 67 . 1 1 1 A 13 13 VAL CB C 13 32.711 31.837 0.874 1
1 70 . 1 1 1 A 13 13 VAL N N 13 120.877 122.805 -1.928 1
1 71 . 1 1 1 A 14 14 LYS H H 14 7.093 7.487 -0.394 1
1 72 . 1 1 1 A 14 14 LYS HA H 14 4.169 4.686 -0.517 1
1 81 . 1 1 1 A 14 14 LYS C C 14 173.291 173.760 -0.469 1
1 82 . 1 1 1 A 14 14 LYS CA C 14 56.465 55.631 0.834 1
1 83 . 1 1 1 A 14 14 LYS CB C 14 35.960 35.590 0.370 1
1 87 . 1 1 1 A 14 14 LYS N N 14 118.693 118.827 -0.134 1
1 88 . 1 1 1 A 15 15 GLN H H 15 8.522 8.405 0.117 1
1 89 . 1 1 1 A 15 15 GLN HA H 15 5.542 5.193 0.349 1
1 96 . 1 1 1 A 15 15 GLN C C 15 174.992 175.407 -0.415 1
1 97 . 1 1 1 A 15 15 GLN CA C 15 54.312 53.962 0.350 1
1 98 . 1 1 1 A 15 15 GLN CB C 15 33.585 31.812 1.773 1
1 100 . 1 1 1 A 15 15 GLN N N 15 124.024 124.500 -0.476 1
1 102 . 1 1 1 A 16 16 GLY H H 16 8.740 7.802 0.938 1
1 103 . 1 1 1 A 16 16 GLY HA2 H 16 4.511 4.000 0.511 1
1 104 . 1 1 1 A 16 16 GLY HA3 H 16 4.064 4.377 -0.313 1
1 105 . 1 1 1 A 16 16 GLY C C 16 171.431 171.512 -0.081 1
1 106 . 1 1 1 A 16 16 GLY CA C 16 46.106 45.827 0.279 1
1 107 . 1 1 1 A 16 16 GLY N N 16 109.611 108.804 0.807 1
1 108 . 1 1 1 A 17 17 PHE H H 17 8.886 8.463 0.423 1
1 109 . 1 1 1 A 17 17 PHE HA H 17 5.466 4.963 0.503 1
1 114 . 1 1 1 A 17 17 PHE C C 17 174.795 175.251 -0.456 1
1 115 . 1 1 1 A 17 17 PHE CA C 17 57.788 58.135 -0.347 1
1 116 . 1 1 1 A 17 17 PHE CB C 17 41.315 40.330 0.985 1
1 119 . 1 1 1 A 17 17 PHE N N 17 122.684 120.149 2.535 1
1 120 . 1 1 1 A 18 18 LEU H H 18 8.762 8.984 -0.222 1
1 121 . 1 1 1 A 18 18 LEU HA H 18 4.946 4.548 0.398 1
1 131 . 1 1 1 A 18 18 LEU C C 18 175.461 175.449 0.012 1
1 132 . 1 1 1 A 18 18 LEU CA C 18 52.970 52.772 0.198 1
1 133 . 1 1 1 A 18 18 LEU CB C 18 47.945 44.244 3.701 1
1 137 . 1 1 1 A 18 18 LEU N N 18 119.045 124.413 -5.368 1
1 138 . 1 1 1 A 19 19 TYR H H 19 9.272 8.207 1.065 1
1 139 . 1 1 1 A 19 19 TYR HA H 19 5.682 5.155 0.527 1
1 146 . 1 1 1 A 19 19 TYR C C 19 174.829 174.243 0.586 1
1 147 . 1 1 1 A 19 19 TYR CA C 19 56.482 56.758 -0.276 1
1 148 . 1 1 1 A 19 19 TYR CB C 19 41.717 40.926 0.791 1
1 153 . 1 1 1 A 19 19 TYR N N 19 118.024 117.672 0.352 1
1 154 . 1 1 1 A 20 20 LEU H H 20 9.441 8.968 0.473 1
1 155 . 1 1 1 A 20 20 LEU HA H 20 5.283 5.269 0.014 1
1 165 . 1 1 1 A 20 20 LEU C C 20 175.935 176.203 -0.268 1
1 166 . 1 1 1 A 20 20 LEU CA C 20 53.464 53.699 -0.235 1
1 167 . 1 1 1 A 20 20 LEU CB C 20 46.570 45.615 0.955 1
1 171 . 1 1 1 A 20 20 LEU N N 20 122.838 125.723 -2.885 1
1 172 . 1 1 1 A 21 21 GLN H H 21 8.391 8.853 -0.462 1
1 173 . 1 1 1 A 21 21 GLN HA H 21 3.791 4.204 -0.413 1
1 180 . 1 1 1 A 21 21 GLN C C 21 175.157 175.018 0.139 1
1 181 . 1 1 1 A 21 21 GLN CA C 21 56.094 56.053 0.041 1
1 182 . 1 1 1 A 21 21 GLN CB C 21 28.434 29.007 -0.573 1
1 184 . 1 1 1 A 21 21 GLN N N 21 129.943 127.825 2.118 1
1 186 . 1 1 1 A 22 22 GLN H H 22 8.829 8.436 0.393 1
1 187 . 1 1 1 A 22 22 GLN HA H 22 4.553 4.975 -0.422 1
1 194 . 1 1 1 A 22 22 GLN C C 22 174.998 174.259 0.739 1
1 195 . 1 1 1 A 22 22 GLN CA C 22 54.912 53.782 1.130 1
1 196 . 1 1 1 A 22 22 GLN CB C 22 31.930 33.606 -1.676 1
1 198 . 1 1 1 A 22 22 GLN N N 22 127.199 124.476 2.723 1
1 200 . 1 1 1 A 23 23 GLN HA H 23 4.142 5.094 -0.952 1
1 207 . 1 1 1 A 23 23 GLN CA C 23 56.427 54.222 2.205 1
1 208 . 1 1 1 A 23 23 GLN CB C 23 29.227 32.430 -3.203 1
1 211 . 1 1 1 A 24 24 GLN HA H 24 4.523 4.437 0.086 1
1 218 . 1 1 1 A 24 24 GLN CB C 24 29.759 31.183 -1.424 1
1 221 . 1 1 1 A 25 25 THR HA H 25 3.870 4.271 -0.401 1
1 226 . 1 1 1 A 25 25 THR CA C 25 65.096 64.028 1.068 1
1 227 . 1 1 1 A 25 25 THR CB C 25 68.924 70.200 -1.276 1
1 229 . 1 1 1 A 26 26 PHE HA H 26 4.690 4.860 -0.170 1
1 236 . 1 1 1 A 26 26 PHE C C 26 175.523 175.271 0.252 1
1 237 . 1 1 1 A 26 26 PHE CA C 26 57.312 56.237 1.075 1
1 238 . 1 1 1 A 26 26 PHE CB C 26 39.003 41.189 -2.186 1
1 243 . 1 1 1 A 27 27 GLY H H 27 7.755 8.842 -1.087 1
1 244 . 1 1 1 A 27 27 GLY HA2 H 27 4.172 4.048 0.124 1
1 245 . 1 1 1 A 27 27 GLY HA3 H 27 3.783 4.126 -0.343 1
1 246 . 1 1 1 A 27 27 GLY C C 27 172.557 172.956 -0.399 1
1 247 . 1 1 1 A 27 27 GLY CA C 27 44.924 45.076 -0.152 1
1 248 . 1 1 1 A 27 27 GLY N N 27 109.216 109.529 -0.313 1
1 249 . 1 1 1 A 28 28 LYS H H 28 8.241 8.381 -0.140 1
1 250 . 1 1 1 A 28 28 LYS HA H 28 4.530 4.783 -0.253 1
1 259 . 1 1 1 A 28 28 LYS C C 28 176.204 175.202 1.002 1
1 260 . 1 1 1 A 28 28 LYS CA C 28 55.741 55.039 0.702 1
1 261 . 1 1 1 A 28 28 LYS CB C 28 33.904 33.144 0.760 1
1 265 . 1 1 1 A 28 28 LYS N N 28 118.743 118.898 -0.155 1
1 266 . 1 1 1 A 29 29 LYS H H 29 8.356 8.330 0.026 1
1 267 . 1 1 1 A 29 29 LYS HA H 29 4.559 4.747 -0.188 1
1 274 . 1 1 1 A 29 29 LYS C C 29 175.420 175.897 -0.477 1
1 275 . 1 1 1 A 29 29 LYS CA C 29 55.406 54.259 1.147 1
1 276 . 1 1 1 A 29 29 LYS CB C 29 35.618 35.555 0.063 1
1 280 . 1 1 1 A 29 29 LYS N N 29 121.198 123.666 -2.468 1
1 281 . 1 1 1 A 30 30 TRP H H 30 8.891 8.737 0.154 1
1 282 . 1 1 1 A 30 30 TRP HA H 30 4.951 4.969 -0.018 1
1 291 . 1 1 1 A 30 30 TRP C C 30 175.902 176.174 -0.272 1
1 292 . 1 1 1 A 30 30 TRP CA C 30 56.677 57.166 -0.489 1
1 293 . 1 1 1 A 30 30 TRP CB C 30 30.614 31.249 -0.635 1
1 299 . 1 1 1 A 30 30 TRP N N 30 123.304 121.507 1.797 1
1 301 . 1 1 1 A 31 31 ARG H H 31 8.712 9.101 -0.389 1
1 302 . 1 1 1 A 31 31 ARG HA H 31 4.820 4.853 -0.033 1
1 309 . 1 1 1 A 31 31 ARG C C 31 174.026 174.185 -0.159 1
1 310 . 1 1 1 A 31 31 ARG CA C 31 54.895 54.067 0.828 1
1 311 . 1 1 1 A 31 31 ARG CB C 31 34.045 33.505 0.540 1
1 314 . 1 1 1 A 31 31 ARG N N 31 123.973 120.607 3.366 1
1 315 . 1 1 1 A 32 32 ARG H H 32 8.820 8.561 0.259 1
1 316 . 1 1 1 A 32 32 ARG HA H 32 3.965 4.832 -0.867 1
1 323 . 1 1 1 A 32 32 ARG C C 32 174.785 174.679 0.106 1
1 324 . 1 1 1 A 32 32 ARG CA C 32 56.924 56.280 0.644 1
1 325 . 1 1 1 A 32 32 ARG CB C 32 31.806 31.048 0.758 1
1 328 . 1 1 1 A 32 32 ARG N N 32 127.041 125.092 1.949 1
1 329 . 1 1 1 A 33 33 PHE H H 33 9.372 8.561 0.811 1
1 330 . 1 1 1 A 33 33 PHE HA H 33 4.863 4.939 -0.076 1
1 338 . 1 1 1 A 33 33 PHE C C 33 176.359 175.203 1.156 1
1 339 . 1 1 1 A 33 33 PHE CA C 33 57.224 56.518 0.706 1
1 340 . 1 1 1 A 33 33 PHE CB C 33 43.385 41.570 1.815 1
1 346 . 1 1 1 A 33 33 PHE N N 33 125.882 124.774 1.108 1
1 347 . 1 1 1 A 34 34 GLY H H 34 9.160 8.813 0.347 1
1 348 . 1 1 1 A 34 34 GLY HA2 H 34 4.182 4.151 0.031 1
1 349 . 1 1 1 A 34 34 GLY HA3 H 34 3.714 4.309 -0.595 1
1 350 . 1 1 1 A 34 34 GLY C C 34 172.920 173.240 -0.320 1
1 351 . 1 1 1 A 34 34 GLY CA C 34 46.247 46.166 0.081 1
1 352 . 1 1 1 A 34 34 GLY N N 34 108.654 111.449 -2.795 1
1 353 . 1 1 1 A 35 35 ALA H H 35 8.982 8.656 0.326 1
1 354 . 1 1 1 A 35 35 ALA HA H 35 5.660 5.599 0.061 1
1 358 . 1 1 1 A 35 35 ALA C C 35 176.547 175.905 0.642 1
1 359 . 1 1 1 A 35 35 ALA CA C 35 50.500 50.608 -0.108 1
1 360 . 1 1 1 A 35 35 ALA CB C 35 24.034 22.201 1.833 1
1 361 . 1 1 1 A 35 35 ALA N N 35 130.076 127.691 2.385 1
1 362 . 1 1 1 A 36 36 SER H H 36 8.852 8.354 0.498 1
1 363 . 1 1 1 A 36 36 SER HA H 36 5.203 4.989 0.214 1
1 366 . 1 1 1 A 36 36 SER C C 36 170.939 172.298 -1.359 1
1 367 . 1 1 1 A 36 36 SER CA C 36 57.806 57.540 0.266 1
1 368 . 1 1 1 A 36 36 SER CB C 36 66.986 65.696 1.290 1
1 369 . 1 1 1 A 36 36 SER N N 36 116.620 116.682 -0.062 1
1 370 . 1 1 1 A 37 37 LEU H H 37 8.862 8.577 0.285 1
1 371 . 1 1 1 A 37 37 LEU HA H 37 5.163 4.801 0.362 1
1 381 . 1 1 1 A 37 37 LEU C C 37 173.525 174.141 -0.616 1
1 382 . 1 1 1 A 37 37 LEU CA C 37 53.112 53.586 -0.474 1
1 383 . 1 1 1 A 37 37 LEU CB C 37 46.077 43.518 2.559 1
1 387 . 1 1 1 A 37 37 LEU N N 37 127.638 129.093 -1.455 1
1 388 . 1 1 1 A 38 38 TYR H H 38 9.280 8.567 0.713 1
1 389 . 1 1 1 A 38 38 TYR HA H 38 4.820 5.403 -0.583 1
1 396 . 1 1 1 A 38 38 TYR C C 38 175.430 174.931 0.499 1
1 397 . 1 1 1 A 38 38 TYR CA C 38 57.436 55.943 1.493 1
1 398 . 1 1 1 A 38 38 TYR CB C 38 42.128 42.613 -0.485 1
1 403 . 1 1 1 A 38 38 TYR N N 38 125.215 125.991 -0.776 1
1 404 . 1 1 1 A 39 39 GLY H H 39 8.532 8.570 -0.038 1
1 405 . 1 1 1 A 39 39 GLY HA2 H 39 4.220 4.226 -0.006 1
1 406 . 1 1 1 A 39 39 GLY HA3 H 39 3.941 4.230 -0.289 1
1 407 . 1 1 1 A 39 39 GLY C C 39 172.950 173.737 -0.787 1
1 408 . 1 1 1 A 39 39 GLY CA C 39 44.817 45.031 -0.214 1
1 409 . 1 1 1 A 39 39 GLY N N 39 106.424 109.556 -3.132 1
1 410 . 1 1 1 A 40 40 GLY H H 40 8.477 8.618 -0.141 1
1 411 . 1 1 1 A 40 40 GLY HA2 H 40 4.102 3.911 0.191 1
1 412 . 1 1 1 A 40 40 GLY HA3 H 40 3.927 3.912 0.015 1
1 413 . 1 1 1 A 40 40 GLY C C 40 174.002 173.923 0.079 1
1 414 . 1 1 1 A 40 40 GLY CA C 40 44.694 47.046 -2.352 1
1 415 . 1 1 1 A 40 40 GLY N N 40 106.881 108.291 -1.410 1
1 416 . 1 1 1 A 41 41 SER H H 41 8.600 7.701 0.899 1
1 417 . 1 1 1 A 41 41 SER HA H 41 4.520 5.045 -0.525 1
1 420 . 1 1 1 A 41 41 SER C C 41 174.355 173.399 0.956 1
1 421 . 1 1 1 A 41 41 SER CA C 41 58.565 57.360 1.205 1
1 422 . 1 1 1 A 41 41 SER CB C 41 64.413 66.993 -2.580 1
1 423 . 1 1 1 A 41 41 SER N N 41 115.751 114.498 1.253 1
1 424 . 1 1 1 A 42 42 ASP H H 42 8.533 9.002 -0.469 1
1 425 . 1 1 1 A 42 42 ASP HA H 42 4.560 4.317 0.243 1
1 428 . 1 1 1 A 42 42 ASP CA C 42 55.230 57.228 -1.998 1
1 429 . 1 1 1 A 42 42 ASP CB C 42 40.648 41.407 -0.759 1
1 430 . 1 1 1 A 42 42 ASP N N 42 119.037 122.748 -3.711 1
1 431 . 1 1 1 A 43 43 CYS H H 43 8.152 7.761 0.391 1
1 432 . 1 1 1 A 43 43 CYS HA H 43 4.541 4.495 0.046 1
1 435 . 1 1 1 A 43 43 CYS C C 43 173.975 175.287 -1.312 1
1 436 . 1 1 1 A 43 43 CYS CA C 43 58.265 60.973 -2.708 1
1 437 . 1 1 1 A 43 43 CYS CB C 43 28.393 28.385 0.008 1
1 438 . 1 1 1 A 43 43 CYS N N 43 116.881 116.693 0.188 1
1 439 . 1 1 1 A 44 44 ALA H H 44 8.047 7.542 0.505 1
1 440 . 1 1 1 A 44 44 ALA HA H 44 4.395 4.211 0.184 1
1 444 . 1 1 1 A 44 44 ALA C C 44 176.472 177.844 -1.372 1
1 445 . 1 1 1 A 44 44 ALA CA C 44 52.688 53.239 -0.551 1
1 446 . 1 1 1 A 44 44 ALA CB C 44 20.579 19.155 1.424 1
1 447 . 1 1 1 A 44 44 ALA N N 44 125.989 122.621 3.368 1
1 448 . 1 1 1 A 45 45 LEU H H 45 8.052 8.544 -0.492 1
1 449 . 1 1 1 A 45 45 LEU HA H 45 4.452 4.944 -0.492 1
1 459 . 1 1 1 A 45 45 LEU C C 45 176.196 176.696 -0.500 1
1 460 . 1 1 1 A 45 45 LEU CA C 45 53.771 52.971 0.800 1
1 461 . 1 1 1 A 45 45 LEU CB C 45 43.116 44.539 -1.423 1
1 465 . 1 1 1 A 45 45 LEU N N 45 119.889 120.259 -0.370 1
1 466 . 1 1 1 A 46 46 ALA H H 46 8.381 8.385 -0.004 1
1 467 . 1 1 1 A 46 46 ALA HA H 46 4.449 5.117 -0.668 1
1 471 . 1 1 1 A 46 46 ALA C C 46 179.093 177.131 1.962 1
1 472 . 1 1 1 A 46 46 ALA CA C 46 52.829 51.364 1.465 1
1 473 . 1 1 1 A 46 46 ALA CB C 46 18.687 20.037 -1.350 1
1 474 . 1 1 1 A 46 46 ALA N N 46 125.635 122.203 3.432 1
1 475 . 1 1 1 A 47 47 ARG H H 47 9.012 8.646 0.366 1
1 476 . 1 1 1 A 47 47 ARG HA H 47 5.192 5.144 0.048 1
1 484 . 1 1 1 A 47 47 ARG C C 47 171.524 174.019 -2.495 1
1 485 . 1 1 1 A 47 47 ARG CA C 47 55.265 54.693 0.572 1
1 486 . 1 1 1 A 47 47 ARG CB C 47 30.970 34.036 -3.066 1
1 489 . 1 1 1 A 47 47 ARG N N 47 120.048 119.041 1.007 1
1 491 . 1 1 1 A 48 48 LEU H H 48 9.029 8.573 0.456 1
1 492 . 1 1 1 A 48 48 LEU HA H 48 5.221 5.018 0.203 1
1 502 . 1 1 1 A 48 48 LEU C C 48 174.348 174.956 -0.608 1
1 503 . 1 1 1 A 48 48 LEU CA C 48 53.253 53.989 -0.736 1
1 504 . 1 1 1 A 48 48 LEU CB C 48 45.419 43.909 1.510 1
1 508 . 1 1 1 A 48 48 LEU N N 48 123.315 124.349 -1.034 1
1 509 . 1 1 1 A 49 49 GLU H H 49 9.473 8.576 0.897 1
1 510 . 1 1 1 A 49 49 GLU HA H 49 5.222 5.068 0.154 1
1 515 . 1 1 1 A 49 49 GLU C C 49 175.507 175.747 -0.240 1
1 516 . 1 1 1 A 49 49 GLU CA C 49 55.159 55.101 0.058 1
1 517 . 1 1 1 A 49 49 GLU CB C 49 32.341 32.230 0.111 1
1 519 . 1 1 1 A 49 49 GLU N N 49 124.751 126.587 -1.836 1
1 520 . 1 1 1 A 50 50 LEU H H 50 9.088 8.487 0.601 1
1 521 . 1 1 1 A 50 50 LEU HA H 50 5.382 5.280 0.102 1
1 531 . 1 1 1 A 50 50 LEU C C 50 175.474 175.568 -0.094 1
1 532 . 1 1 1 A 50 50 LEU CA C 50 52.865 53.706 -0.841 1
1 533 . 1 1 1 A 50 50 LEU CB C 50 43.239 46.314 -3.075 1
1 537 . 1 1 1 A 50 50 LEU N N 50 124.221 122.067 2.154 1
1 538 . 1 1 1 A 51 51 GLN H H 51 9.602 8.837 0.765 1
1 539 . 1 1 1 A 51 51 GLN HA H 51 5.095 5.139 -0.044 1
1 546 . 1 1 1 A 51 51 GLN C C 51 175.306 174.614 0.692 1
1 547 . 1 1 1 A 51 51 GLN CA C 51 54.576 54.023 0.553 1
1 548 . 1 1 1 A 51 51 GLN CB C 51 32.177 31.190 0.987 1
1 550 . 1 1 1 A 51 51 GLN N N 51 123.268 120.377 2.891 1
1 552 . 1 1 1 A 52 52 GLU H H 52 9.172 9.048 0.124 1
1 553 . 1 1 1 A 52 52 GLU HA H 52 4.092 4.686 -0.594 1
1 558 . 1 1 1 A 52 52 GLU C C 52 176.523 176.207 0.316 1
1 559 . 1 1 1 A 52 52 GLU CA C 52 57.500 54.947 2.553 1
1 560 . 1 1 1 A 52 52 GLU CB C 52 30.696 31.457 -0.761 1
1 562 . 1 1 1 A 52 52 GLU N N 52 128.982 126.052 2.930 1
1 563 . 1 1 1 A 53 53 GLY H H 53 8.644 8.720 -0.076 1
1 564 . 1 1 1 A 53 53 GLY HA2 H 53 4.261 4.482 -0.221 1
1 565 . 1 1 1 A 53 53 GLY HA3 H 53 3.993 4.507 -0.514 1
1 566 . 1 1 1 A 53 53 GLY C C 53 172.550 172.155 0.395 1
1 567 . 1 1 1 A 53 53 GLY CA C 53 45.911 46.644 -0.733 1
1 568 . 1 1 1 A 53 53 GLY N N 53 110.844 110.994 -0.150 1
1 569 . 1 1 1 A 54 54 PRO HA H 54 4.392 4.720 -0.328 1
1 576 . 1 1 1 A 54 54 PRO C C 54 176.828 176.290 0.538 1
1 577 . 1 1 1 A 54 54 PRO CA C 54 63.665 62.502 1.163 1
1 578 . 1 1 1 A 54 54 PRO CB C 54 32.012 33.235 -1.223 1
1 581 . 1 1 1 A 55 55 GLU H H 55 8.934 9.088 -0.154 1
1 582 . 1 1 1 A 55 55 GLU HA H 55 4.193 4.574 -0.381 1
1 587 . 1 1 1 A 55 55 GLU C C 55 176.189 176.519 -0.330 1
1 588 . 1 1 1 A 55 55 GLU CA C 55 57.383 58.194 -0.811 1
1 589 . 1 1 1 A 55 55 GLU CB C 55 28.945 31.631 -2.686 1
1 591 . 1 1 1 A 55 55 GLU N N 55 120.312 119.339 0.973 1
1 592 . 1 1 1 A 56 56 LYS H H 56 7.937 7.699 0.238 1
1 593 . 1 1 1 A 56 56 LYS HA H 56 4.578 4.771 -0.193 1
1 602 . 1 1 1 A 56 56 LYS C C 56 174.295 173.532 0.763 1
1 603 . 1 1 1 A 56 56 LYS CA C 56 54.171 54.530 -0.359 1
1 604 . 1 1 1 A 56 56 LYS CB C 56 32.555 35.152 -2.597 1
1 608 . 1 1 1 A 56 56 LYS N N 56 122.008 113.945 8.063 1
1 609 . 1 1 1 A 57 57 PRO HA H 57 4.370 4.710 -0.340 1
1 616 . 1 1 1 A 57 57 PRO CA C 57 63.431 62.362 1.069 1
1 617 . 1 1 1 A 57 57 PRO CB C 57 32.072 30.000 2.072 1
1 620 . 1 1 1 A 58 58 ARG H H 58 8.310 8.609 -0.299 1
1 621 . 1 1 1 A 58 58 ARG HA H 58 4.295 4.543 -0.248 1
1 628 . 1 1 1 A 58 58 ARG CA C 58 56.570 57.620 -1.050 1
1 629 . 1 1 1 A 58 58 ARG CB C 58 30.860 31.938 -1.078 1
1 632 . 1 1 1 A 58 58 ARG N N 58 120.045 125.719 -5.674 1
1 633 . 1 1 1 A 60 60 CYS HA H 60 4.482 4.647 -0.165 1
1 636 . 1 1 1 A 60 60 CYS CA C 60 58.621 58.120 0.501 1
1 637 . 1 1 1 A 60 60 CYS CB C 60 28.267 30.303 -2.036 1
1 638 . 1 1 1 A 61 61 GLU HA H 61 4.226 4.090 0.136 1
1 643 . 1 1 1 A 61 61 GLU C C 61 176.299 176.958 -0.659 1
1 644 . 1 1 1 A 61 61 GLU CA C 61 57.100 59.541 -2.441 1
1 645 . 1 1 1 A 61 61 GLU CB C 61 29.873 29.904 -0.031 1
1 647 . 1 1 1 A 62 62 ALA H H 62 8.282 7.785 0.497 1
1 648 . 1 1 1 A 62 62 ALA HA H 62 4.302 4.717 -0.415 1
1 652 . 1 1 1 A 62 62 ALA C C 62 177.277 175.527 1.750 1
1 653 . 1 1 1 A 62 62 ALA CA C 62 52.512 50.565 1.947 1
1 654 . 1 1 1 A 62 62 ALA CB C 62 19.592 20.920 -1.328 1
1 655 . 1 1 1 A 62 62 ALA N N 62 124.386 121.836 2.550 1
1 656 . 1 1 1 A 63 63 ALA H H 63 8.399 8.819 -0.420 1
1 657 . 1 1 1 A 63 63 ALA HA H 63 4.375 4.616 -0.241 1
1 661 . 1 1 1 A 63 63 ALA C C 63 176.843 176.195 0.648 1
1 662 . 1 1 1 A 63 63 ALA CA C 63 52.658 51.114 1.544 1
1 663 . 1 1 1 A 63 63 ALA CB C 63 19.592 18.797 0.795 1
1 664 . 1 1 1 A 63 63 ALA N N 63 123.892 127.347 -3.455 1
1 665 . 1 1 1 A 64 64 ARG H H 64 8.152 8.767 -0.615 1
1 666 . 1 1 1 A 64 64 ARG HA H 64 5.008 4.937 0.071 1
1 673 . 1 1 1 A 64 64 ARG C C 64 175.594 174.872 0.722 1
1 674 . 1 1 1 A 64 64 ARG CA C 64 55.282 54.808 0.474 1
1 675 . 1 1 1 A 64 64 ARG CB C 64 32.506 33.268 -0.762 1
1 678 . 1 1 1 A 64 64 ARG N N 64 119.787 123.191 -3.404 1
1 679 . 1 1 1 A 65 65 LYS H H 65 8.945 8.822 0.123 1
1 680 . 1 1 1 A 65 65 LYS HA H 65 4.602 5.045 -0.443 1
1 689 . 1 1 1 A 65 65 LYS C C 65 174.657 174.238 0.419 1
1 690 . 1 1 1 A 65 65 LYS CA C 65 54.948 54.917 0.031 1
1 691 . 1 1 1 A 65 65 LYS CB C 65 34.068 35.422 -1.354 1
1 695 . 1 1 1 A 65 65 LYS N N 65 124.171 123.783 0.388 1
1 696 . 1 1 1 A 66 66 VAL H H 66 8.672 9.085 -0.413 1
1 697 . 1 1 1 A 66 66 VAL HA H 66 4.532 5.257 -0.725 1
1 705 . 1 1 1 A 66 66 VAL C C 66 175.078 173.819 1.259 1
1 706 . 1 1 1 A 66 66 VAL CA C 66 61.865 59.499 2.366 1
1 707 . 1 1 1 A 66 66 VAL CB C 66 33.835 34.743 -0.908 1
1 710 . 1 1 1 A 66 66 VAL N N 66 124.380 126.243 -1.863 1
1 711 . 1 1 1 A 67 67 ILE H H 67 9.071 9.062 0.009 1
1 712 . 1 1 1 A 67 67 ILE HA H 67 4.142 4.638 -0.496 1
1 722 . 1 1 1 A 67 67 ILE C C 67 175.819 175.781 0.038 1
1 723 . 1 1 1 A 67 67 ILE CA C 67 60.383 60.524 -0.141 1
1 724 . 1 1 1 A 67 67 ILE CB C 67 39.908 38.818 1.090 1
1 728 . 1 1 1 A 67 67 ILE N N 67 129.537 129.176 0.361 1
1 729 . 1 1 1 A 68 68 ARG H H 68 9.203 8.725 0.478 1
1 730 . 1 1 1 A 68 68 ARG HA H 68 4.198 4.222 -0.024 1
1 737 . 1 1 1 A 68 68 ARG C C 68 177.769 176.657 1.112 1
1 738 . 1 1 1 A 68 68 ARG CA C 68 56.835 56.604 0.231 1
1 739 . 1 1 1 A 68 68 ARG CB C 68 29.832 30.593 -0.761 1
1 742 . 1 1 1 A 68 68 ARG N N 68 128.484 128.254 0.230 1
1 743 . 1 1 1 A 69 69 LEU H H 69 8.212 8.521 -0.309 1
1 744 . 1 1 1 A 69 69 LEU HA H 69 4.221 3.863 0.358 1
1 754 . 1 1 1 A 69 69 LEU C C 69 178.996 178.453 0.543 1
1 755 . 1 1 1 A 69 69 LEU CA C 69 57.136 57.727 -0.591 1
1 756 . 1 1 1 A 69 69 LEU CB C 69 39.455 41.372 -1.917 1
1 760 . 1 1 1 A 69 69 LEU N N 69 123.807 126.136 -2.329 1
1 761 . 1 1 1 A 70 70 SER H H 70 8.823 8.068 0.755 1
1 762 . 1 1 1 A 70 70 SER HA H 70 4.331 4.005 0.326 1
1 765 . 1 1 1 A 70 70 SER C C 70 175.076 176.480 -1.404 1
1 766 . 1 1 1 A 70 70 SER CA C 70 60.329 61.084 -0.755 1
1 767 . 1 1 1 A 70 70 SER CB C 70 62.362 63.109 -0.747 1
1 768 . 1 1 1 A 70 70 SER N N 70 115.162 113.811 1.351 1
1 769 . 1 1 1 A 71 71 ASP H H 71 7.602 8.574 -0.972 1
1 770 . 1 1 1 A 71 71 ASP HA H 71 4.820 4.360 0.460 1
1 773 . 1 1 1 A 71 71 ASP C C 71 176.478 176.780 -0.302 1
1 774 . 1 1 1 A 71 71 ASP CA C 71 54.241 56.832 -2.591 1
1 775 . 1 1 1 A 71 71 ASP CB C 71 41.347 41.052 0.295 1
1 776 . 1 1 1 A 71 71 ASP N N 71 119.590 120.911 -1.321 1
1 777 . 1 1 1 A 72 72 CYS H H 72 7.715 7.802 -0.087 1
1 778 . 1 1 1 A 72 72 CYS HA H 72 4.372 4.759 -0.387 1
1 781 . 1 1 1 A 72 72 CYS C C 72 173.690 174.270 -0.580 1
1 782 . 1 1 1 A 72 72 CYS CA C 72 60.836 59.582 1.254 1
1 783 . 1 1 1 A 72 72 CYS CB C 72 27.655 27.707 -0.052 1
1 784 . 1 1 1 A 72 72 CYS N N 72 118.346 116.723 1.623 1
1 785 . 1 1 1 A 73 73 LEU H H 73 9.472 9.029 0.443 1
1 786 . 1 1 1 A 73 73 LEU HA H 73 4.593 4.110 0.483 1
1 796 . 1 1 1 A 73 73 LEU C C 73 177.562 176.757 0.805 1
1 797 . 1 1 1 A 73 73 LEU CA C 73 55.724 56.557 -0.833 1
1 798 . 1 1 1 A 73 73 LEU CB C 73 43.774 42.621 1.153 1
1 802 . 1 1 1 A 73 73 LEU N N 73 124.752 128.813 -4.061 1
1 803 . 1 1 1 A 74 74 ARG H H 74 7.658 7.711 -0.053 1
1 804 . 1 1 1 A 74 74 ARG HA H 74 4.592 5.140 -0.548 1
1 811 . 1 1 1 A 74 74 ARG C C 74 173.605 174.534 -0.929 1
1 812 . 1 1 1 A 74 74 ARG CA C 74 56.465 56.111 0.354 1
1 813 . 1 1 1 A 74 74 ARG CB C 74 34.068 33.952 0.116 1
1 816 . 1 1 1 A 74 74 ARG N N 74 115.565 116.861 -1.296 1
1 817 . 1 1 1 A 75 75 VAL H H 75 8.622 8.826 -0.204 1
1 818 . 1 1 1 A 75 75 VAL HA H 75 5.170 5.259 -0.089 1
1 826 . 1 1 1 A 75 75 VAL C C 75 173.985 174.444 -0.459 1
1 827 . 1 1 1 A 75 75 VAL CA C 75 60.930 59.668 1.262 1
1 828 . 1 1 1 A 75 75 VAL CB C 75 35.073 36.318 -1.245 1
1 831 . 1 1 1 A 75 75 VAL N N 75 124.278 119.006 5.272 1
1 832 . 1 1 1 A 76 76 ALA H H 76 8.272 8.639 -0.367 1
1 833 . 1 1 1 A 76 76 ALA HA H 76 4.648 5.126 -0.478 1
1 837 . 1 1 1 A 76 76 ALA C C 76 175.630 175.574 0.056 1
1 838 . 1 1 1 A 76 76 ALA CA C 76 51.294 51.144 0.150 1
1 839 . 1 1 1 A 76 76 ALA CB C 76 22.759 24.475 -1.716 1
1 840 . 1 1 1 A 76 76 ALA N N 76 126.015 124.544 1.471 1
1 841 . 1 1 1 A 77 77 GLU H H 77 9.184 8.721 0.463 1
1 842 . 1 1 1 A 77 77 GLU HA H 77 4.060 5.227 -1.167 1
1 847 . 1 1 1 A 77 77 GLU C C 77 174.949 175.960 -1.011 1
1 848 . 1 1 1 A 77 77 GLU CA C 77 58.424 54.835 3.589 1
1 849 . 1 1 1 A 77 77 GLU CB C 77 30.161 31.878 -1.717 1
1 851 . 1 1 1 A 77 77 GLU N N 77 120.223 118.391 1.832 1
1 852 . 1 1 1 A 78 78 ALA H H 78 7.985 9.300 -1.315 1
1 853 . 1 1 1 A 78 78 ALA HA H 78 4.776 4.842 -0.066 1
1 857 . 1 1 1 A 78 78 ALA C C 78 177.250 178.290 -1.040 1
1 858 . 1 1 1 A 78 78 ALA CA C 78 50.888 51.691 -0.803 1
1 859 . 1 1 1 A 78 78 ALA CB C 78 20.851 21.375 -0.524 1
1 860 . 1 1 1 A 78 78 ALA N N 78 125.143 128.610 -3.467 1
1 861 . 1 1 1 A 79 79 GLY H H 79 8.604 8.704 -0.100 1
1 862 . 1 1 1 A 79 79 GLY HA2 H 79 4.327 4.103 0.224 1
1 863 . 1 1 1 A 79 79 GLY HA3 H 79 3.963 4.103 -0.140 1
1 864 . 1 1 1 A 79 79 GLY C C 79 175.360 174.589 0.771 1
1 865 . 1 1 1 A 79 79 GLY CA C 79 44.925 45.376 -0.451 1
1 866 . 1 1 1 A 79 79 GLY N N 79 109.420 108.692 0.728 1
1 867 . 1 1 1 A 80 80 GLY H H 80 8.649 7.955 0.694 1
1 868 . 1 1 1 A 80 80 GLY HA2 H 80 3.962 3.906 0.056 1
1 869 . 1 1 1 A 80 80 GLY HA3 H 80 3.962 3.918 0.044 1
1 870 . 1 1 1 A 80 80 GLY C C 80 175.052 174.710 0.342 1
1 871 . 1 1 1 A 80 80 GLY CA C 80 45.955 46.611 -0.656 1
1 872 . 1 1 1 A 80 80 GLY N N 80 108.295 108.313 -0.018 1
1 873 . 1 1 1 A 81 81 GLU H H 81 8.921 8.131 0.790 1
1 874 . 1 1 1 A 81 81 GLU HA H 81 4.298 4.207 0.091 1
1 879 . 1 1 1 A 81 81 GLU C C 81 176.532 177.308 -0.776 1
1 880 . 1 1 1 A 81 81 GLU CA C 81 57.118 58.090 -0.972 1
1 881 . 1 1 1 A 81 81 GLU CB C 81 28.599 29.811 -1.212 1
1 883 . 1 1 1 A 81 81 GLU N N 81 121.170 120.946 0.224 1
1 884 . 1 1 1 A 82 82 ALA H H 82 8.032 7.295 0.737 1
1 885 . 1 1 1 A 82 82 ALA HA H 82 4.371 4.379 -0.008 1
1 889 . 1 1 1 A 82 82 ALA C C 82 177.160 177.779 -0.619 1
1 890 . 1 1 1 A 82 82 ALA CA C 82 52.653 52.329 0.324 1
1 891 . 1 1 1 A 82 82 ALA CB C 82 19.304 20.275 -0.971 1
1 892 . 1 1 1 A 82 82 ALA N N 82 124.988 122.488 2.500 1
1 893 . 1 1 1 A 83 83 SER H H 83 8.319 8.889 -0.570 1
1 894 . 1 1 1 A 83 83 SER HA H 83 4.331 4.312 0.019 1
1 897 . 1 1 1 A 83 83 SER C C 83 174.045 174.661 -0.616 1
1 898 . 1 1 1 A 83 83 SER CA C 83 58.053 61.485 -3.432 1
1 899 . 1 1 1 A 83 83 SER CB C 83 63.184 63.029 0.155 1
1 900 . 1 1 1 A 83 83 SER N N 83 114.181 114.865 -0.684 1
1 901 . 1 1 1 A 84 84 SER H H 84 7.823 8.008 -0.185 1
1 902 . 1 1 1 A 84 84 SER HA H 84 3.194 4.006 -0.812 1
1 905 . 1 1 1 A 84 84 SER C C 84 171.072 173.924 -2.852 1
1 906 . 1 1 1 A 84 84 SER CA C 84 57.206 57.045 0.161 1
1 907 . 1 1 1 A 84 84 SER CB C 84 61.622 62.876 -1.254 1
1 908 . 1 1 1 A 84 84 SER N N 84 117.302 114.218 3.084 1
1 909 . 1 1 1 A 85 85 PRO HA H 85 3.922 4.487 -0.565 1
1 916 . 1 1 1 A 85 85 PRO CA C 85 62.691 62.448 0.243 1
1 917 . 1 1 1 A 85 85 PRO CB C 85 31.515 31.745 -0.230 1
1 920 . 1 1 1 A 86 86 ARG HA H 86 3.882 4.220 -0.338 1
1 927 . 1 1 1 A 86 86 ARG C C 86 175.712 176.682 -0.970 1
1 928 . 1 1 1 A 86 86 ARG CA C 86 57.877 55.725 2.152 1
1 929 . 1 1 1 A 86 86 ARG CB C 86 29.791 31.058 -1.267 1
1 932 . 1 1 1 A 87 87 ASP H H 87 8.903 9.002 -0.099 1
1 933 . 1 1 1 A 87 87 ASP HA H 87 4.342 4.250 0.092 1
1 936 . 1 1 1 A 87 87 ASP C C 87 175.723 174.839 0.884 1
1 937 . 1 1 1 A 87 87 ASP CA C 87 56.377 55.388 0.989 1
1 938 . 1 1 1 A 87 87 ASP CB C 87 39.208 40.356 -1.148 1
1 939 . 1 1 1 A 87 87 ASP N N 87 117.520 122.050 -4.530 1
1 940 . 1 1 1 A 88 88 THR H H 88 7.776 7.441 0.335 1
1 941 . 1 1 1 A 88 88 THR HA H 88 5.101 5.151 -0.050 1
1 946 . 1 1 1 A 88 88 THR C C 88 173.825 172.886 0.939 1
1 947 . 1 1 1 A 88 88 THR CA C 88 60.154 59.776 0.378 1
1 948 . 1 1 1 A 88 88 THR CB C 88 72.702 73.036 -0.334 1
1 950 . 1 1 1 A 88 88 THR N N 88 108.770 109.299 -0.529 1
1 951 . 1 1 1 A 89 89 SER H H 89 9.006 9.444 -0.438 1
1 952 . 1 1 1 A 89 89 SER HA H 89 4.718 5.243 -0.525 1
1 955 . 1 1 1 A 89 89 SER C C 89 173.728 173.459 0.269 1
1 956 . 1 1 1 A 89 89 SER CA C 89 57.453 57.837 -0.384 1
1 957 . 1 1 1 A 89 89 SER CB C 89 65.611 65.595 0.016 1
1 958 . 1 1 1 A 89 89 SER N N 89 114.151 117.952 -3.801 1
1 959 . 1 1 1 A 90 90 ALA H H 90 9.001 8.790 0.211 1
1 960 . 1 1 1 A 90 90 ALA HA H 90 5.660 4.670 0.990 1
1 964 . 1 1 1 A 90 90 ALA C C 90 177.669 177.336 0.333 1
1 965 . 1 1 1 A 90 90 ALA CA C 90 51.670 51.985 -0.315 1
1 966 . 1 1 1 A 90 90 ALA CB C 90 22.265 20.173 2.092 1
1 967 . 1 1 1 A 90 90 ALA N N 90 126.177 129.050 -2.873 1
1 968 . 1 1 1 A 91 91 PHE H H 91 9.672 8.286 1.386 1
1 969 . 1 1 1 A 91 91 PHE HA H 91 5.039 5.607 -0.568 1
1 977 . 1 1 1 A 91 91 PHE C C 91 170.731 173.112 -2.381 1
1 978 . 1 1 1 A 91 91 PHE CA C 91 56.271 55.359 0.912 1
1 979 . 1 1 1 A 91 91 PHE CB C 91 41.553 42.355 -0.802 1
1 985 . 1 1 1 A 91 91 PHE N N 91 118.968 115.996 2.972 1
1 986 . 1 1 1 A 92 92 PHE H H 92 9.422 9.648 -0.226 1
1 987 . 1 1 1 A 92 92 PHE HA H 92 5.674 5.064 0.610 1
1 995 . 1 1 1 A 92 92 PHE C C 92 174.570 175.147 -0.577 1
1 996 . 1 1 1 A 92 92 PHE CA C 92 55.917 57.551 -1.634 1
1 997 . 1 1 1 A 92 92 PHE CB C 92 42.787 41.139 1.648 1
1 1003 . 1 1 1 A 92 92 PHE N N 92 117.543 119.048 -1.505 1
1 1004 . 1 1 1 A 93 93 LEU H H 93 9.021 8.886 0.135 1
1 1005 . 1 1 1 A 93 93 LEU HA H 93 5.122 5.082 0.040 1
1 1015 . 1 1 1 A 93 93 LEU C C 93 174.799 174.166 0.633 1
1 1016 . 1 1 1 A 93 93 LEU CA C 93 54.912 54.486 0.426 1
1 1017 . 1 1 1 A 93 93 LEU CB C 93 45.254 45.450 -0.196 1
1 1021 . 1 1 1 A 93 93 LEU N N 93 121.719 123.338 -1.619 1
1 1022 . 1 1 1 A 94 94 GLU H H 94 9.294 9.470 -0.176 1
1 1023 . 1 1 1 A 94 94 GLU HA H 94 5.043 5.194 -0.151 1
1 1028 . 1 1 1 A 94 94 GLU C C 94 175.754 175.669 0.085 1
1 1029 . 1 1 1 A 94 94 GLU CA C 94 56.018 55.141 0.877 1
1 1030 . 1 1 1 A 94 94 GLU CB C 94 32.752 32.216 0.536 1
1 1032 . 1 1 1 A 94 94 GLU N N 94 127.032 128.453 -1.421 1
1 1033 . 1 1 1 A 95 95 THR H H 95 8.822 8.676 0.146 1
1 1034 . 1 1 1 A 95 95 THR HA H 95 5.398 5.059 0.339 1
1 1039 . 1 1 1 A 95 95 THR C C 95 173.860 175.337 -1.477 1
1 1040 . 1 1 1 A 95 95 THR CA C 95 59.588 59.708 -0.120 1
1 1041 . 1 1 1 A 95 95 THR CB C 95 72.191 72.151 0.040 1
1 1043 . 1 1 1 A 95 95 THR N N 95 118.685 117.664 1.021 1
1 1044 . 1 1 1 A 96 96 LYS H H 96 8.823 9.143 -0.320 1
1 1045 . 1 1 1 A 96 96 LYS HA H 96 4.022 3.927 0.095 1
1 1054 . 1 1 1 A 96 96 LYS C C 96 177.330 178.846 -1.516 1
1 1055 . 1 1 1 A 96 96 LYS CA C 96 59.588 60.017 -0.429 1
1 1056 . 1 1 1 A 96 96 LYS CB C 96 32.588 32.060 0.528 1
1 1060 . 1 1 1 A 96 96 LYS N N 96 118.801 122.308 -3.507 1
1 1061 . 1 1 1 A 97 97 GLU H H 97 8.092 7.802 0.290 1
1 1062 . 1 1 1 A 97 97 GLU HA H 97 4.282 4.202 0.080 1
1 1067 . 1 1 1 A 97 97 GLU C C 97 176.290 176.105 0.185 1
1 1068 . 1 1 1 A 97 97 GLU CA C 97 57.365 58.941 -1.576 1
1 1069 . 1 1 1 A 97 97 GLU CB C 97 31.559 30.889 0.670 1
1 1071 . 1 1 1 A 97 97 GLU N N 97 113.992 118.714 -4.722 1
1 1072 . 1 1 1 A 98 98 ARG H H 98 7.482 7.255 0.227 1
1 1073 . 1 1 1 A 98 98 ARG HA H 98 4.397 4.611 -0.214 1
1 1080 . 1 1 1 A 98 98 ARG C C 98 172.792 173.269 -0.477 1
1 1081 . 1 1 1 A 98 98 ARG CA C 98 55.689 54.587 1.102 1
1 1082 . 1 1 1 A 98 98 ARG CB C 98 32.711 31.836 0.875 1
1 1085 . 1 1 1 A 98 98 ARG N N 98 116.022 114.879 1.143 1
1 1086 . 1 1 1 A 99 99 LEU H H 99 8.423 8.402 0.021 1
1 1087 . 1 1 1 A 99 99 LEU HA H 99 4.807 4.896 -0.089 1
1 1097 . 1 1 1 A 99 99 LEU C C 99 175.903 174.109 1.794 1
1 1098 . 1 1 1 A 99 99 LEU CA C 99 54.383 53.336 1.047 1
1 1099 . 1 1 1 A 99 99 LEU CB C 99 43.362 44.124 -0.762 1
1 1103 . 1 1 1 A 99 99 LEU N N 99 124.983 121.465 3.518 1
1 1104 . 1 1 1 A 100 100 TYR H H 100 9.144 9.163 -0.019 1
1 1105 . 1 1 1 A 100 100 TYR HA H 100 4.542 5.217 -0.675 1
1 1112 . 1 1 1 A 100 100 TYR C C 100 173.479 174.637 -1.158 1
1 1113 . 1 1 1 A 100 100 TYR CA C 100 57.735 56.532 1.203 1
1 1114 . 1 1 1 A 100 100 TYR CB C 100 39.291 40.382 -1.091 1
1 1119 . 1 1 1 A 100 100 TYR N N 100 126.679 127.181 -0.502 1
1 1120 . 1 1 1 A 101 101 LEU H H 101 9.043 8.872 0.171 1
1 1121 . 1 1 1 A 101 101 LEU HA H 101 4.747 4.802 -0.055 1
1 1131 . 1 1 1 A 101 101 LEU C C 101 173.530 175.093 -1.563 1
1 1132 . 1 1 1 A 101 101 LEU CA C 101 54.524 53.676 0.848 1
1 1133 . 1 1 1 A 101 101 LEU CB C 101 42.499 43.781 -1.282 1
1 1137 . 1 1 1 A 101 101 LEU N N 101 127.422 126.217 1.205 1
1 1138 . 1 1 1 A 102 102 LEU H H 102 8.493 8.502 -0.009 1
1 1139 . 1 1 1 A 102 102 LEU HA H 102 5.612 5.497 0.115 1
1 1149 . 1 1 1 A 102 102 LEU C C 102 175.794 175.867 -0.073 1
1 1150 . 1 1 1 A 102 102 LEU CA C 102 53.076 53.309 -0.233 1
1 1151 . 1 1 1 A 102 102 LEU CB C 102 45.994 44.067 1.927 1
1 1155 . 1 1 1 A 102 102 LEU N N 102 126.021 127.940 -1.919 1
1 1156 . 1 1 1 A 103 103 ALA H H 103 9.073 8.732 0.341 1
1 1157 . 1 1 1 A 103 103 ALA HA H 103 5.081 5.350 -0.269 1
1 1161 . 1 1 1 A 103 103 ALA C C 103 175.133 175.685 -0.552 1
1 1162 . 1 1 1 A 103 103 ALA CA C 103 51.688 50.113 1.575 1
1 1163 . 1 1 1 A 103 103 ALA CB C 103 21.689 22.445 -0.756 1
1 1164 . 1 1 1 A 103 103 ALA N N 103 117.679 122.655 -4.976 1
1 1165 . 1 1 1 A 104 104 ALA H H 104 8.582 8.681 -0.099 1
1 1166 . 1 1 1 A 104 104 ALA HA H 104 5.220 4.845 0.375 1
1 1170 . 1 1 1 A 104 104 ALA C C 104 173.471 174.326 -0.855 1
1 1171 . 1 1 1 A 104 104 ALA CA C 104 47.959 49.865 -1.906 1
1 1172 . 1 1 1 A 104 104 ALA CB C 104 21.359 22.454 -1.095 1
1 1173 . 1 1 1 A 104 104 ALA N N 104 123.419 121.637 1.782 1
1 1174 . 1 1 1 A 105 105 PRO HA H 105 4.542 4.806 -0.264 1
1 1181 . 1 1 1 A 105 105 PRO C C 105 178.409 177.924 0.485 1
1 1182 . 1 1 1 A 105 105 PRO CA C 105 64.301 62.809 1.492 1
1 1183 . 1 1 1 A 105 105 PRO CB C 105 32.094 31.680 0.414 1
1 1186 . 1 1 1 A 106 106 ALA H H 106 8.302 8.681 -0.379 1
1 1187 . 1 1 1 A 106 106 ALA HA H 106 4.022 4.038 -0.016 1
1 1191 . 1 1 1 A 106 106 ALA C C 106 179.641 179.546 0.095 1
1 1192 . 1 1 1 A 106 106 ALA CA C 106 56.341 55.056 1.285 1
1 1193 . 1 1 1 A 106 106 ALA CB C 106 18.523 18.113 0.410 1
1 1194 . 1 1 1 A 106 106 ALA N N 106 127.733 127.802 -0.069 1
1 1195 . 1 1 1 A 107 107 ALA H H 107 9.035 7.966 1.069 1
1 1196 . 1 1 1 A 107 107 ALA HA H 107 4.331 4.064 0.267 1
1 1200 . 1 1 1 A 107 107 ALA C C 107 178.586 179.887 -1.301 1
1 1201 . 1 1 1 A 107 107 ALA CA C 107 53.765 55.158 -1.393 1
1 1202 . 1 1 1 A 107 107 ALA CB C 107 18.728 18.258 0.470 1
1 1203 . 1 1 1 A 107 107 ALA N N 107 118.203 119.881 -1.678 1
1 1204 . 1 1 1 A 108 108 GLU H H 108 8.399 7.886 0.513 1
1 1205 . 1 1 1 A 108 108 GLU HA H 108 4.631 4.097 0.534 1
1 1210 . 1 1 1 A 108 108 GLU C C 108 177.127 178.739 -1.612 1
1 1211 . 1 1 1 A 108 108 GLU CA C 108 55.847 59.104 -3.257 1
1 1212 . 1 1 1 A 108 108 GLU CB C 108 32.135 29.929 2.206 1
1 1214 . 1 1 1 A 108 108 GLU N N 108 114.661 117.792 -3.131 1
1 1215 . 1 1 1 A 109 109 ARG H H 109 7.412 8.568 -1.156 1
1 1216 . 1 1 1 A 109 109 ARG HA H 109 3.682 4.151 -0.469 1
1 1223 . 1 1 1 A 109 109 ARG C C 109 176.917 179.176 -2.259 1
1 1224 . 1 1 1 A 109 109 ARG CA C 109 61.600 59.806 1.794 1
1 1225 . 1 1 1 A 109 109 ARG CB C 109 28.845 30.360 -1.515 1
1 1228 . 1 1 1 A 109 109 ARG N N 109 120.954 120.979 -0.025 1
1 1229 . 1 1 1 A 110 110 GLY H H 110 8.833 8.506 0.327 1
1 1230 . 1 1 1 A 110 110 GLY HA2 H 110 3.872 3.771 0.101 1
1 1231 . 1 1 1 A 110 110 GLY HA3 H 110 3.685 3.788 -0.103 1
1 1232 . 1 1 1 A 110 110 GLY C C 110 175.997 175.604 0.393 1
1 1233 . 1 1 1 A 110 110 GLY CA C 110 47.323 47.486 -0.163 1
1 1234 . 1 1 1 A 110 110 GLY N N 110 106.563 107.341 -0.778 1
1 1235 . 1 1 1 A 111 111 ASP H H 111 7.882 7.758 0.124 1
1 1236 . 1 1 1 A 111 111 ASP HA H 111 4.312 4.283 0.029 1
1 1239 . 1 1 1 A 111 111 ASP C C 111 179.467 178.788 0.679 1
1 1240 . 1 1 1 A 111 111 ASP CA C 111 56.976 56.828 0.148 1
1 1241 . 1 1 1 A 111 111 ASP CB C 111 40.648 40.655 -0.007 1
1 1242 . 1 1 1 A 111 111 ASP N N 111 121.402 121.249 0.153 1
1 1243 . 1 1 1 A 112 112 TRP H H 112 7.804 8.322 -0.518 1
1 1244 . 1 1 1 A 112 112 TRP HA H 112 3.831 4.193 -0.362 1
1 1253 . 1 1 1 A 112 112 TRP C C 112 177.547 178.652 -1.105 1
1 1254 . 1 1 1 A 112 112 TRP CA C 112 62.006 59.949 2.057 1
1 1255 . 1 1 1 A 112 112 TRP CB C 112 29.421 29.341 0.080 1
1 1261 . 1 1 1 A 112 112 TRP N N 112 119.904 120.406 -0.502 1
1 1263 . 1 1 1 A 113 113 VAL H H 113 7.982 8.071 -0.089 1
1 1264 . 1 1 1 A 113 113 VAL HA H 113 3.072 3.604 -0.532 1
1 1272 . 1 1 1 A 113 113 VAL C C 113 178.015 178.168 -0.153 1
1 1273 . 1 1 1 A 113 113 VAL CA C 113 67.407 66.919 0.488 1
1 1274 . 1 1 1 A 113 113 VAL CB C 113 31.724 31.503 0.221 1
1 1277 . 1 1 1 A 113 113 VAL N N 113 117.575 119.119 -1.544 1
1 1278 . 1 1 1 A 114 114 GLN H H 114 8.268 7.679 0.589 1
1 1279 . 1 1 1 A 114 114 GLN HA H 114 3.994 3.967 0.027 1
1 1286 . 1 1 1 A 114 114 GLN C C 114 178.021 178.004 0.017 1
1 1287 . 1 1 1 A 114 114 GLN CA C 114 59.112 59.033 0.079 1
1 1288 . 1 1 1 A 114 114 GLN CB C 114 28.685 28.589 0.096 1
1 1290 . 1 1 1 A 114 114 GLN N N 114 117.479 119.509 -2.030 1
1 1292 . 1 1 1 A 115 115 ALA H H 115 7.915 8.249 -0.334 1
1 1293 . 1 1 1 A 115 115 ALA HA H 115 3.972 4.113 -0.141 1
1 1297 . 1 1 1 A 115 115 ALA C C 115 180.030 179.971 0.059 1
1 1298 . 1 1 1 A 115 115 ALA CA C 115 55.142 55.156 -0.014 1
1 1299 . 1 1 1 A 115 115 ALA CB C 115 18.152 18.376 -0.224 1
1 1300 . 1 1 1 A 115 115 ALA N N 115 120.858 120.513 0.345 1
1 1301 . 1 1 1 A 116 116 ILE H H 116 8.172 8.577 -0.405 1
1 1302 . 1 1 1 A 116 116 ILE HA H 116 3.482 3.773 -0.291 1
1 1312 . 1 1 1 A 116 116 ILE C C 116 177.739 178.086 -0.347 1
1 1313 . 1 1 1 A 116 116 ILE CA C 116 66.119 65.255 0.864 1
1 1314 . 1 1 1 A 116 116 ILE CB C 116 38.222 37.825 0.397 1
1 1318 . 1 1 1 A 116 116 ILE N N 116 115.977 117.708 -1.731 1
1 1319 . 1 1 1 A 117 117 CYS H H 117 8.449 8.700 -0.251 1
1 1320 . 1 1 1 A 117 117 CYS HA H 117 4.032 4.383 -0.351 1
1 1323 . 1 1 1 A 117 117 CYS C C 117 177.321 177.240 0.081 1
1 1324 . 1 1 1 A 117 117 CYS CA C 117 64.777 62.281 2.496 1
1 1325 . 1 1 1 A 117 117 CYS CB C 117 26.871 27.334 -0.463 1
1 1326 . 1 1 1 A 117 117 CYS N N 117 117.253 120.649 -3.396 1
1 1327 . 1 1 1 A 118 118 LEU H H 118 8.182 8.076 0.106 1
1 1328 . 1 1 1 A 118 118 LEU HA H 118 4.052 4.106 -0.054 1
1 1338 . 1 1 1 A 118 118 LEU C C 118 179.217 179.293 -0.076 1
1 1339 . 1 1 1 A 118 118 LEU CA C 118 57.877 57.409 0.468 1
1 1340 . 1 1 1 A 118 118 LEU CB C 118 42.088 41.692 0.396 1
1 1344 . 1 1 1 A 118 118 LEU N N 118 119.665 121.634 -1.969 1
1 1345 . 1 1 1 A 119 119 LEU H H 119 7.142 8.044 -0.902 1
1 1346 . 1 1 1 A 119 119 LEU HA H 119 4.192 4.241 -0.049 1
1 1356 . 1 1 1 A 119 119 LEU C C 119 178.492 178.304 0.188 1
1 1357 . 1 1 1 A 119 119 LEU CA C 119 56.259 57.604 -1.345 1
1 1358 . 1 1 1 A 119 119 LEU CB C 119 43.568 41.959 1.609 1
1 1362 . 1 1 1 A 119 119 LEU N N 119 116.244 119.632 -3.388 1
1 1363 . 1 1 1 A 120 120 ALA H H 120 8.513 8.534 -0.021 1
1 1364 . 1 1 1 A 120 120 ALA HA H 120 3.878 4.072 -0.194 1
1 1368 . 1 1 1 A 120 120 ALA C C 120 178.358 178.730 -0.372 1
1 1369 . 1 1 1 A 120 120 ALA CA C 120 53.765 55.164 -1.399 1
1 1370 . 1 1 1 A 120 120 ALA CB C 120 18.687 18.873 -0.186 1
1 1371 . 1 1 1 A 120 120 ALA N N 120 120.009 120.512 -0.503 1
1 1372 . 1 1 1 A 121 121 PHE H H 121 7.822 8.318 -0.496 1
1 1373 . 1 1 1 A 121 121 PHE HA H 121 5.156 4.916 0.240 1
1 1381 . 1 1 1 A 121 121 PHE C C 121 176.273 176.278 -0.005 1
1 1382 . 1 1 1 A 121 121 PHE CA C 121 55.741 56.833 -1.092 1
1 1383 . 1 1 1 A 121 121 PHE CB C 121 39.455 38.312 1.143 1
1 1389 . 1 1 1 A 121 121 PHE N N 121 113.981 114.868 -0.887 1
1 1390 . 1 1 1 A 122 122 SER H H 122 7.765 8.353 -0.588 1
1 1391 . 1 1 1 A 122 122 SER HA H 122 4.579 4.522 0.057 1
1 1394 . 1 1 1 A 122 122 SER C C 122 174.595 174.542 0.053 1
1 1395 . 1 1 1 A 122 122 SER CA C 122 58.777 60.783 -2.006 1
1 1396 . 1 1 1 A 122 122 SER CB C 122 63.719 63.265 0.454 1
1 1397 . 1 1 1 A 122 122 SER N N 122 115.069 115.715 -0.646 1
1 1398 . 1 1 1 A 123 123 GLY H H 123 8.223 7.932 0.291 1
1 1399 . 1 1 1 A 123 123 GLY HA2 H 123 4.174 4.351 -0.177 1
1 1400 . 1 1 1 A 123 123 GLY HA3 H 123 4.100 4.359 -0.259 1
1 1401 . 1 1 1 A 123 123 GLY C C 123 171.678 171.640 0.038 1
1 1402 . 1 1 1 A 123 123 GLY CA C 123 44.815 45.594 -0.779 1
1 1403 . 1 1 1 A 123 123 GLY N N 123 110.151 106.650 3.501 1
1 1404 . 1 1 1 A 124 124 PRO HA H 124 4.482 4.694 -0.212 1
1 1411 . 1 1 1 A 124 124 PRO C C 124 177.314 176.139 1.175 1
1 1412 . 1 1 1 A 124 124 PRO CA C 124 63.206 62.795 0.411 1
1 1413 . 1 1 1 A 124 124 PRO CB C 124 32.176 33.218 -1.042 1
1 1416 . 1 1 1 A 125 125 SER H H 125 8.485 8.437 0.048 1
1 1417 . 1 1 1 A 125 125 SER HA H 125 4.472 5.050 -0.578 1
1 1420 . 1 1 1 A 125 125 SER C C 125 174.728 173.267 1.461 1
1 1421 . 1 1 1 A 125 125 SER CA C 125 58.353 57.433 0.920 1
1 1422 . 1 1 1 A 125 125 SER CB C 125 64.048 66.096 -2.048 1
1 1423 . 1 1 1 A 125 125 SER N N 125 116.081 115.013 1.068 1
1 1424 . 1 1 1 A 126 126 SER H H 126 8.332 8.715 -0.383 1
1 1425 . 1 1 1 A 126 126 SER HA H 126 4.464 5.178 -0.714 1
1 1428 . 1 1 1 A 126 126 SER C C 126 173.980 174.040 -0.060 1
1 1429 . 1 1 1 A 126 126 SER CA C 126 58.336 56.743 1.593 1
1 1430 . 1 1 1 A 126 126 SER CB C 126 63.925 64.351 -0.426 1
1 1431 . 1 1 1 A 126 126 SER N N 126 118.037 117.619 0.418 1
1 1 . 2 1 1 A 6 6 SER HA H 6 4.458 4.521 -0.063 1
1 3 . 2 1 1 A 6 6 SER C C 6 175.108 174.462 0.646 1
1 4 . 2 1 1 A 6 6 SER CA C 6 58.689 58.563 0.126 1
1 5 . 2 1 1 A 6 6 SER CB C 6 63.678 62.495 1.183 1
1 6 . 2 1 1 A 7 7 GLY H H 7 8.449 7.743 0.706 1
1 7 . 2 1 1 A 7 7 GLY HA2 H 7 3.965 4.120 -0.155 1
1 8 . 2 1 1 A 7 7 GLY HA3 H 7 3.965 4.122 -0.157 1
1 9 . 2 1 1 A 7 7 GLY C C 7 174.380 171.854 2.526 1
1 10 . 2 1 1 A 7 7 GLY CA C 7 45.435 45.892 -0.457 1
1 11 . 2 1 1 A 7 7 GLY N N 7 110.792 111.843 -1.051 1
1 12 . 2 1 1 A 8 8 MET H H 8 8.259 8.703 -0.444 1
1 13 . 2 1 1 A 8 8 MET HA H 8 4.487 4.676 -0.189 1
1 21 . 2 1 1 A 8 8 MET C C 8 176.961 175.105 1.856 1
1 22 . 2 1 1 A 8 8 MET CA C 8 55.565 55.093 0.472 1
1 23 . 2 1 1 A 8 8 MET CB C 8 32.835 32.510 0.325 1
1 26 . 2 1 1 A 8 8 MET N N 8 119.639 120.568 -0.929 1
1 27 . 2 1 1 A 9 9 GLY H H 9 8.472 8.420 0.052 1
1 28 . 2 1 1 A 9 9 GLY HA2 H 9 3.946 4.130 -0.184 1
1 29 . 2 1 1 A 9 9 GLY HA3 H 9 3.946 4.151 -0.205 1
1 30 . 2 1 1 A 9 9 GLY C C 9 174.005 174.195 -0.190 1
1 31 . 2 1 1 A 9 9 GLY CA C 9 45.488 45.535 -0.047 1
1 32 . 2 1 1 A 9 9 GLY N N 9 110.107 112.074 -1.967 1
1 33 . 2 1 1 A 10 10 ASP H H 10 8.292 8.748 -0.456 1
1 34 . 2 1 1 A 10 10 ASP HA H 10 4.636 4.401 0.235 1
1 37 . 2 1 1 A 10 10 ASP C C 10 176.768 176.694 0.074 1
1 38 . 2 1 1 A 10 10 ASP CA C 10 54.206 55.766 -1.560 1
1 39 . 2 1 1 A 10 10 ASP CB C 10 41.306 41.458 -0.152 1
1 40 . 2 1 1 A 10 10 ASP N N 10 120.370 124.371 -4.001 1
1 41 . 2 1 1 A 11 11 GLY H H 11 8.452 7.878 0.574 1
1 42 . 2 1 1 A 11 11 GLY HA2 H 11 3.980 4.042 -0.062 1
1 43 . 2 1 1 A 11 11 GLY HA3 H 11 4.022 4.082 -0.060 1
1 44 . 2 1 1 A 11 11 GLY C C 11 174.102 173.677 0.425 1
1 45 . 2 1 1 A 11 11 GLY CA C 11 45.170 45.078 0.092 1
1 46 . 2 1 1 A 11 11 GLY N N 11 108.391 108.028 0.363 1
1 47 . 2 1 1 A 12 12 ALA H H 12 8.293 8.318 -0.025 1
1 48 . 2 1 1 A 12 12 ALA HA H 12 3.777 4.136 -0.359 1
1 52 . 2 1 1 A 12 12 ALA C C 12 178.193 178.562 -0.369 1
1 53 . 2 1 1 A 12 12 ALA CA C 12 52.759 52.451 0.308 1
1 54 . 2 1 1 A 12 12 ALA CB C 12 17.855 19.106 -1.251 1
1 55 . 2 1 1 A 12 12 ALA N N 12 124.185 126.237 -2.052 1
1 56 . 2 1 1 A 13 13 VAL H H 13 8.822 8.097 0.725 1
1 57 . 2 1 1 A 13 13 VAL HA H 13 3.912 3.855 0.057 1
1 65 . 2 1 1 A 13 13 VAL C C 13 176.073 175.252 0.821 1
1 66 . 2 1 1 A 13 13 VAL CA C 13 63.100 64.940 -1.840 1
1 67 . 2 1 1 A 13 13 VAL CB C 13 32.711 32.208 0.503 1
1 70 . 2 1 1 A 13 13 VAL N N 13 120.877 122.049 -1.172 1
1 71 . 2 1 1 A 14 14 LYS H H 14 7.093 7.101 -0.008 1
1 72 . 2 1 1 A 14 14 LYS HA H 14 4.169 4.664 -0.495 1
1 81 . 2 1 1 A 14 14 LYS C C 14 173.291 174.528 -1.237 1
1 82 . 2 1 1 A 14 14 LYS CA C 14 56.465 55.185 1.280 1
1 83 . 2 1 1 A 14 14 LYS CB C 14 35.960 35.020 0.940 1
1 87 . 2 1 1 A 14 14 LYS N N 14 118.693 120.820 -2.127 1
1 88 . 2 1 1 A 15 15 GLN H H 15 8.522 8.329 0.193 1
1 89 . 2 1 1 A 15 15 GLN HA H 15 5.542 5.138 0.404 1
1 96 . 2 1 1 A 15 15 GLN C C 15 174.992 175.764 -0.772 1
1 97 . 2 1 1 A 15 15 GLN CA C 15 54.312 54.435 -0.123 1
1 98 . 2 1 1 A 15 15 GLN CB C 15 33.585 31.209 2.376 1
1 100 . 2 1 1 A 15 15 GLN N N 15 124.024 125.465 -1.441 1
1 102 . 2 1 1 A 16 16 GLY H H 16 8.740 7.932 0.808 1
1 103 . 2 1 1 A 16 16 GLY HA2 H 16 4.511 3.735 0.776 1
1 104 . 2 1 1 A 16 16 GLY HA3 H 16 4.064 4.282 -0.218 1
1 105 . 2 1 1 A 16 16 GLY C C 16 171.431 171.317 0.114 1
1 106 . 2 1 1 A 16 16 GLY CA C 16 46.106 45.928 0.178 1
1 107 . 2 1 1 A 16 16 GLY N N 16 109.611 108.433 1.178 1
1 108 . 2 1 1 A 17 17 PHE H H 17 8.886 8.300 0.586 1
1 109 . 2 1 1 A 17 17 PHE HA H 17 5.466 5.225 0.241 1
1 114 . 2 1 1 A 17 17 PHE C C 17 174.795 174.810 -0.015 1
1 115 . 2 1 1 A 17 17 PHE CA C 17 57.788 56.299 1.489 1
1 116 . 2 1 1 A 17 17 PHE CB C 17 41.315 41.680 -0.365 1
1 119 . 2 1 1 A 17 17 PHE N N 17 122.684 119.445 3.239 1
1 120 . 2 1 1 A 18 18 LEU H H 18 8.762 8.538 0.224 1
1 121 . 2 1 1 A 18 18 LEU HA H 18 4.946 4.851 0.095 1
1 131 . 2 1 1 A 18 18 LEU C C 18 175.461 175.126 0.335 1
1 132 . 2 1 1 A 18 18 LEU CA C 18 52.970 53.320 -0.350 1
1 133 . 2 1 1 A 18 18 LEU CB C 18 47.945 44.446 3.499 1
1 137 . 2 1 1 A 18 18 LEU N N 18 119.045 123.559 -4.514 1
1 138 . 2 1 1 A 19 19 TYR H H 19 9.272 8.367 0.905 1
1 139 . 2 1 1 A 19 19 TYR HA H 19 5.682 5.181 0.501 1
1 146 . 2 1 1 A 19 19 TYR C C 19 174.829 174.782 0.047 1
1 147 . 2 1 1 A 19 19 TYR CA C 19 56.482 57.130 -0.648 1
1 148 . 2 1 1 A 19 19 TYR CB C 19 41.717 40.029 1.688 1
1 153 . 2 1 1 A 19 19 TYR N N 19 118.024 123.825 -5.801 1
1 154 . 2 1 1 A 20 20 LEU H H 20 9.441 8.935 0.506 1
1 155 . 2 1 1 A 20 20 LEU HA H 20 5.283 5.363 -0.080 1
1 165 . 2 1 1 A 20 20 LEU C C 20 175.935 175.199 0.736 1
1 166 . 2 1 1 A 20 20 LEU CA C 20 53.464 53.820 -0.356 1
1 167 . 2 1 1 A 20 20 LEU CB C 20 46.570 46.285 0.285 1
1 171 . 2 1 1 A 20 20 LEU N N 20 122.838 125.848 -3.010 1
1 172 . 2 1 1 A 21 21 GLN H H 21 8.391 8.476 -0.085 1
1 173 . 2 1 1 A 21 21 GLN HA H 21 3.791 4.475 -0.684 1
1 180 . 2 1 1 A 21 21 GLN C C 21 175.157 174.947 0.210 1
1 181 . 2 1 1 A 21 21 GLN CA C 21 56.094 55.215 0.879 1
1 182 . 2 1 1 A 21 21 GLN CB C 21 28.434 29.171 -0.737 1
1 184 . 2 1 1 A 21 21 GLN N N 21 129.943 127.964 1.979 1
1 186 . 2 1 1 A 22 22 GLN H H 22 8.829 8.486 0.343 1
1 187 . 2 1 1 A 22 22 GLN HA H 22 4.553 4.643 -0.090 1
1 194 . 2 1 1 A 22 22 GLN C C 22 174.998 174.768 0.230 1
1 195 . 2 1 1 A 22 22 GLN CA C 22 54.912 55.490 -0.578 1
1 196 . 2 1 1 A 22 22 GLN CB C 22 31.930 29.646 2.284 1
1 198 . 2 1 1 A 22 22 GLN N N 22 127.199 125.690 1.509 1
1 200 . 2 1 1 A 23 23 GLN HA H 23 4.142 4.388 -0.246 1
1 207 . 2 1 1 A 23 23 GLN CA C 23 56.427 54.943 1.484 1
1 208 . 2 1 1 A 23 23 GLN CB C 23 29.227 30.359 -1.132 1
1 211 . 2 1 1 A 24 24 GLN HA H 24 4.523 3.873 0.650 1
1 218 . 2 1 1 A 24 24 GLN CB C 24 29.759 27.561 2.198 1
1 221 . 2 1 1 A 25 25 THR HA H 25 3.870 4.840 -0.970 1
1 226 . 2 1 1 A 25 25 THR CA C 25 65.096 61.022 4.074 1
1 227 . 2 1 1 A 25 25 THR CB C 25 68.924 72.415 -3.491 1
1 229 . 2 1 1 A 26 26 PHE HA H 26 4.690 4.274 0.416 1
1 236 . 2 1 1 A 26 26 PHE C C 26 175.523 176.300 -0.777 1
1 237 . 2 1 1 A 26 26 PHE CA C 26 57.312 58.971 -1.659 1
1 238 . 2 1 1 A 26 26 PHE CB C 26 39.003 38.491 0.512 1
1 243 . 2 1 1 A 27 27 GLY H H 27 7.755 8.789 -1.034 1
1 244 . 2 1 1 A 27 27 GLY HA2 H 27 4.172 3.677 0.495 1
1 245 . 2 1 1 A 27 27 GLY HA3 H 27 3.783 3.878 -0.095 1
1 246 . 2 1 1 A 27 27 GLY C C 27 172.557 174.762 -2.205 1
1 247 . 2 1 1 A 27 27 GLY CA C 27 44.924 45.272 -0.348 1
1 248 . 2 1 1 A 27 27 GLY N N 27 109.216 112.144 -2.928 1
1 249 . 2 1 1 A 28 28 LYS H H 28 8.241 7.566 0.675 1
1 250 . 2 1 1 A 28 28 LYS HA H 28 4.530 4.036 0.494 1
1 259 . 2 1 1 A 28 28 LYS C C 28 176.204 174.631 1.573 1
1 260 . 2 1 1 A 28 28 LYS CA C 28 55.741 57.095 -1.354 1
1 261 . 2 1 1 A 28 28 LYS CB C 28 33.904 29.667 4.237 1
1 265 . 2 1 1 A 28 28 LYS N N 28 118.743 116.083 2.660 1
1 266 . 2 1 1 A 29 29 LYS H H 29 8.356 7.410 0.946 1
1 267 . 2 1 1 A 29 29 LYS HA H 29 4.559 4.606 -0.047 1
1 274 . 2 1 1 A 29 29 LYS C C 29 175.420 175.585 -0.165 1
1 275 . 2 1 1 A 29 29 LYS CA C 29 55.406 54.000 1.406 1
1 276 . 2 1 1 A 29 29 LYS CB C 29 35.618 36.738 -1.120 1
1 280 . 2 1 1 A 29 29 LYS N N 29 121.198 116.110 5.088 1
1 281 . 2 1 1 A 30 30 TRP H H 30 8.891 8.287 0.604 1
1 282 . 2 1 1 A 30 30 TRP HA H 30 4.951 4.683 0.268 1
1 291 . 2 1 1 A 30 30 TRP C C 30 175.902 176.564 -0.662 1
1 292 . 2 1 1 A 30 30 TRP CA C 30 56.677 58.383 -1.706 1
1 293 . 2 1 1 A 30 30 TRP CB C 30 30.614 30.509 0.105 1
1 299 . 2 1 1 A 30 30 TRP N N 30 123.304 120.429 2.875 1
1 301 . 2 1 1 A 31 31 ARG H H 31 8.712 8.796 -0.084 1
1 302 . 2 1 1 A 31 31 ARG HA H 31 4.820 4.662 0.158 1
1 309 . 2 1 1 A 31 31 ARG C C 31 174.026 174.570 -0.544 1
1 310 . 2 1 1 A 31 31 ARG CA C 31 54.895 53.778 1.117 1
1 311 . 2 1 1 A 31 31 ARG CB C 31 34.045 33.733 0.312 1
1 314 . 2 1 1 A 31 31 ARG N N 31 123.973 122.433 1.540 1
1 315 . 2 1 1 A 32 32 ARG H H 32 8.820 8.429 0.391 1
1 316 . 2 1 1 A 32 32 ARG HA H 32 3.965 4.444 -0.479 1
1 323 . 2 1 1 A 32 32 ARG C C 32 174.785 174.894 -0.109 1
1 324 . 2 1 1 A 32 32 ARG CA C 32 56.924 56.337 0.587 1
1 325 . 2 1 1 A 32 32 ARG CB C 32 31.806 30.966 0.840 1
1 328 . 2 1 1 A 32 32 ARG N N 32 127.041 124.339 2.702 1
1 329 . 2 1 1 A 33 33 PHE H H 33 9.372 8.758 0.614 1
1 330 . 2 1 1 A 33 33 PHE HA H 33 4.863 5.027 -0.164 1
1 338 . 2 1 1 A 33 33 PHE C C 33 176.359 175.292 1.067 1
1 339 . 2 1 1 A 33 33 PHE CA C 33 57.224 56.609 0.615 1
1 340 . 2 1 1 A 33 33 PHE CB C 33 43.385 42.800 0.585 1
1 346 . 2 1 1 A 33 33 PHE N N 33 125.882 124.522 1.360 1
1 347 . 2 1 1 A 34 34 GLY H H 34 9.160 8.852 0.308 1
1 348 . 2 1 1 A 34 34 GLY HA2 H 34 4.182 4.120 0.062 1
1 349 . 2 1 1 A 34 34 GLY HA3 H 34 3.714 4.185 -0.471 1
1 350 . 2 1 1 A 34 34 GLY C C 34 172.920 173.199 -0.279 1
1 351 . 2 1 1 A 34 34 GLY CA C 34 46.247 46.054 0.193 1
1 352 . 2 1 1 A 34 34 GLY N N 34 108.654 111.225 -2.571 1
1 353 . 2 1 1 A 35 35 ALA H H 35 8.982 8.498 0.484 1
1 354 . 2 1 1 A 35 35 ALA HA H 35 5.660 5.239 0.421 1
1 358 . 2 1 1 A 35 35 ALA C C 35 176.547 176.528 0.019 1
1 359 . 2 1 1 A 35 35 ALA CA C 35 50.500 50.560 -0.060 1
1 360 . 2 1 1 A 35 35 ALA CB C 35 24.034 20.851 3.183 1
1 361 . 2 1 1 A 35 35 ALA N N 35 130.076 127.939 2.137 1
1 362 . 2 1 1 A 36 36 SER H H 36 8.852 8.767 0.085 1
1 363 . 2 1 1 A 36 36 SER HA H 36 5.203 5.045 0.158 1
1 366 . 2 1 1 A 36 36 SER C C 36 170.939 172.565 -1.626 1
1 367 . 2 1 1 A 36 36 SER CA C 36 57.806 57.485 0.321 1
1 368 . 2 1 1 A 36 36 SER CB C 36 66.986 65.218 1.768 1
1 369 . 2 1 1 A 36 36 SER N N 36 116.620 119.444 -2.824 1
1 370 . 2 1 1 A 37 37 LEU H H 37 8.862 8.369 0.493 1
1 371 . 2 1 1 A 37 37 LEU HA H 37 5.163 4.816 0.347 1
1 381 . 2 1 1 A 37 37 LEU C C 37 173.525 173.947 -0.422 1
1 382 . 2 1 1 A 37 37 LEU CA C 37 53.112 53.505 -0.393 1
1 383 . 2 1 1 A 37 37 LEU CB C 37 46.077 43.453 2.624 1
1 387 . 2 1 1 A 37 37 LEU N N 37 127.638 129.170 -1.532 1
1 388 . 2 1 1 A 38 38 TYR H H 38 9.280 8.701 0.579 1
1 389 . 2 1 1 A 38 38 TYR HA H 38 4.820 5.503 -0.683 1
1 396 . 2 1 1 A 38 38 TYR C C 38 175.430 176.021 -0.591 1
1 397 . 2 1 1 A 38 38 TYR CA C 38 57.436 55.821 1.615 1
1 398 . 2 1 1 A 38 38 TYR CB C 38 42.128 41.040 1.088 1
1 403 . 2 1 1 A 38 38 TYR N N 38 125.215 126.735 -1.520 1
1 404 . 2 1 1 A 39 39 GLY H H 39 8.532 8.334 0.198 1
1 405 . 2 1 1 A 39 39 GLY HA2 H 39 4.220 4.302 -0.082 1
1 406 . 2 1 1 A 39 39 GLY HA3 H 39 3.941 4.317 -0.376 1
1 407 . 2 1 1 A 39 39 GLY C C 39 172.950 171.796 1.154 1
1 408 . 2 1 1 A 39 39 GLY CA C 39 44.817 45.896 -1.079 1
1 409 . 2 1 1 A 39 39 GLY N N 39 106.424 110.108 -3.684 1
1 410 . 2 1 1 A 40 40 GLY H H 40 8.477 8.387 0.090 1
1 411 . 2 1 1 A 40 40 GLY HA2 H 40 4.102 4.248 -0.146 1
1 412 . 2 1 1 A 40 40 GLY HA3 H 40 3.927 4.253 -0.326 1
1 413 . 2 1 1 A 40 40 GLY C C 40 174.002 173.845 0.157 1
1 414 . 2 1 1 A 40 40 GLY CA C 40 44.694 45.819 -1.125 1
1 415 . 2 1 1 A 40 40 GLY N N 40 106.881 108.122 -1.241 1
1 416 . 2 1 1 A 41 41 SER H H 41 8.600 8.790 -0.190 1
1 417 . 2 1 1 A 41 41 SER HA H 41 4.520 4.290 0.230 1
1 420 . 2 1 1 A 41 41 SER C C 41 174.355 176.493 -2.138 1
1 421 . 2 1 1 A 41 41 SER CA C 41 58.565 60.897 -2.332 1
1 422 . 2 1 1 A 41 41 SER CB C 41 64.413 63.508 0.905 1
1 423 . 2 1 1 A 41 41 SER N N 41 115.751 114.210 1.541 1
1 424 . 2 1 1 A 42 42 ASP H H 42 8.533 8.168 0.365 1
1 425 . 2 1 1 A 42 42 ASP HA H 42 4.560 4.509 0.051 1
1 428 . 2 1 1 A 42 42 ASP CA C 42 55.230 57.337 -2.107 1
1 429 . 2 1 1 A 42 42 ASP CB C 42 40.648 40.691 -0.043 1
1 430 . 2 1 1 A 42 42 ASP N N 42 119.037 120.893 -1.856 1
1 431 . 2 1 1 A 43 43 CYS H H 43 8.152 8.047 0.105 1
1 432 . 2 1 1 A 43 43 CYS HA H 43 4.541 4.850 -0.309 1
1 435 . 2 1 1 A 43 43 CYS C C 43 173.975 174.807 -0.832 1
1 436 . 2 1 1 A 43 43 CYS CA C 43 58.265 57.814 0.451 1
1 437 . 2 1 1 A 43 43 CYS CB C 43 28.393 29.216 -0.823 1
1 438 . 2 1 1 A 43 43 CYS N N 43 116.881 116.593 0.288 1
1 439 . 2 1 1 A 44 44 ALA H H 44 8.047 8.660 -0.613 1
1 440 . 2 1 1 A 44 44 ALA HA H 44 4.395 4.484 -0.089 1
1 444 . 2 1 1 A 44 44 ALA C C 44 176.472 177.482 -1.010 1
1 445 . 2 1 1 A 44 44 ALA CA C 44 52.688 52.216 0.472 1
1 446 . 2 1 1 A 44 44 ALA CB C 44 20.579 19.042 1.537 1
1 447 . 2 1 1 A 44 44 ALA N N 44 125.989 125.393 0.596 1
1 448 . 2 1 1 A 45 45 LEU H H 45 8.052 7.408 0.644 1
1 449 . 2 1 1 A 45 45 LEU HA H 45 4.452 4.508 -0.056 1
1 459 . 2 1 1 A 45 45 LEU C C 45 176.196 175.436 0.760 1
1 460 . 2 1 1 A 45 45 LEU CA C 45 53.771 54.197 -0.426 1
1 461 . 2 1 1 A 45 45 LEU CB C 45 43.116 40.018 3.098 1
1 465 . 2 1 1 A 45 45 LEU N N 45 119.889 121.205 -1.316 1
1 466 . 2 1 1 A 46 46 ALA H H 46 8.381 8.469 -0.088 1
1 467 . 2 1 1 A 46 46 ALA HA H 46 4.449 5.805 -1.356 1
1 471 . 2 1 1 A 46 46 ALA C C 46 179.093 176.270 2.823 1
1 472 . 2 1 1 A 46 46 ALA CA C 46 52.829 50.312 2.517 1
1 473 . 2 1 1 A 46 46 ALA CB C 46 18.687 21.441 -2.754 1
1 474 . 2 1 1 A 46 46 ALA N N 46 125.635 128.177 -2.542 1
1 475 . 2 1 1 A 47 47 ARG H H 47 9.012 8.585 0.427 1
1 476 . 2 1 1 A 47 47 ARG HA H 47 5.192 5.076 0.116 1
1 484 . 2 1 1 A 47 47 ARG C C 47 171.524 173.796 -2.272 1
1 485 . 2 1 1 A 47 47 ARG CA C 47 55.265 54.895 0.370 1
1 486 . 2 1 1 A 47 47 ARG CB C 47 30.970 33.910 -2.940 1
1 489 . 2 1 1 A 47 47 ARG N N 47 120.048 120.311 -0.263 1
1 491 . 2 1 1 A 48 48 LEU H H 48 9.029 8.509 0.520 1
1 492 . 2 1 1 A 48 48 LEU HA H 48 5.221 5.038 0.183 1
1 502 . 2 1 1 A 48 48 LEU C C 48 174.348 174.859 -0.511 1
1 503 . 2 1 1 A 48 48 LEU CA C 48 53.253 54.032 -0.779 1
1 504 . 2 1 1 A 48 48 LEU CB C 48 45.419 43.840 1.579 1
1 508 . 2 1 1 A 48 48 LEU N N 48 123.315 123.925 -0.610 1
1 509 . 2 1 1 A 49 49 GLU H H 49 9.473 8.771 0.702 1
1 510 . 2 1 1 A 49 49 GLU HA H 49 5.222 5.047 0.175 1
1 515 . 2 1 1 A 49 49 GLU C C 49 175.507 175.539 -0.032 1
1 516 . 2 1 1 A 49 49 GLU CA C 49 55.159 54.913 0.246 1
1 517 . 2 1 1 A 49 49 GLU CB C 49 32.341 32.779 -0.438 1
1 519 . 2 1 1 A 49 49 GLU N N 49 124.751 126.790 -2.039 1
1 520 . 2 1 1 A 50 50 LEU H H 50 9.088 8.485 0.603 1
1 521 . 2 1 1 A 50 50 LEU HA H 50 5.382 5.243 0.139 1
1 531 . 2 1 1 A 50 50 LEU C C 50 175.474 175.727 -0.253 1
1 532 . 2 1 1 A 50 50 LEU CA C 50 52.865 53.414 -0.549 1
1 533 . 2 1 1 A 50 50 LEU CB C 50 43.239 45.574 -2.335 1
1 537 . 2 1 1 A 50 50 LEU N N 50 124.221 122.102 2.119 1
1 538 . 2 1 1 A 51 51 GLN H H 51 9.602 8.625 0.977 1
1 539 . 2 1 1 A 51 51 GLN HA H 51 5.095 4.746 0.349 1
1 546 . 2 1 1 A 51 51 GLN C C 51 175.306 176.391 -1.085 1
1 547 . 2 1 1 A 51 51 GLN CA C 51 54.576 53.958 0.618 1
1 548 . 2 1 1 A 51 51 GLN CB C 51 32.177 31.729 0.448 1
1 550 . 2 1 1 A 51 51 GLN N N 51 123.268 121.349 1.919 1
1 552 . 2 1 1 A 52 52 GLU H H 52 9.172 9.223 -0.051 1
1 553 . 2 1 1 A 52 52 GLU HA H 52 4.092 4.418 -0.326 1
1 558 . 2 1 1 A 52 52 GLU C C 52 176.523 176.635 -0.112 1
1 559 . 2 1 1 A 52 52 GLU CA C 52 57.500 58.204 -0.704 1
1 560 . 2 1 1 A 52 52 GLU CB C 52 30.696 30.944 -0.248 1
1 562 . 2 1 1 A 52 52 GLU N N 52 128.982 123.081 5.901 1
1 563 . 2 1 1 A 53 53 GLY H H 53 8.644 7.570 1.074 1
1 564 . 2 1 1 A 53 53 GLY HA2 H 53 4.261 4.126 0.135 1
1 565 . 2 1 1 A 53 53 GLY HA3 H 53 3.993 4.137 -0.144 1
1 566 . 2 1 1 A 53 53 GLY C C 53 172.550 174.426 -1.876 1
1 567 . 2 1 1 A 53 53 GLY CA C 53 45.911 46.278 -0.367 1
1 568 . 2 1 1 A 53 53 GLY N N 53 110.844 107.317 3.527 1
1 569 . 2 1 1 A 54 54 PRO HA H 54 4.392 4.325 0.067 1
1 576 . 2 1 1 A 54 54 PRO C C 54 176.828 177.901 -1.073 1
1 577 . 2 1 1 A 54 54 PRO CA C 54 63.665 65.067 -1.402 1
1 578 . 2 1 1 A 54 54 PRO CB C 54 32.012 31.167 0.845 1
1 581 . 2 1 1 A 55 55 GLU H H 55 8.934 8.143 0.791 1
1 582 . 2 1 1 A 55 55 GLU HA H 55 4.193 3.999 0.194 1
1 587 . 2 1 1 A 55 55 GLU C C 55 176.189 176.261 -0.072 1
1 588 . 2 1 1 A 55 55 GLU CA C 55 57.383 57.582 -0.199 1
1 589 . 2 1 1 A 55 55 GLU CB C 55 28.945 28.642 0.303 1
1 591 . 2 1 1 A 55 55 GLU N N 55 120.312 117.239 3.073 1
1 592 . 2 1 1 A 56 56 LYS H H 56 7.937 7.724 0.213 1
1 593 . 2 1 1 A 56 56 LYS HA H 56 4.578 4.429 0.149 1
1 602 . 2 1 1 A 56 56 LYS C C 56 174.295 176.805 -2.510 1
1 603 . 2 1 1 A 56 56 LYS CA C 56 54.171 55.666 -1.495 1
1 604 . 2 1 1 A 56 56 LYS CB C 56 32.555 32.566 -0.011 1
1 608 . 2 1 1 A 56 56 LYS N N 56 122.008 118.517 3.491 1
1 609 . 2 1 1 A 57 57 PRO HA H 57 4.370 4.308 0.062 1
1 616 . 2 1 1 A 57 57 PRO CA C 57 63.431 65.188 -1.757 1
1 617 . 2 1 1 A 57 57 PRO CB C 57 32.072 32.101 -0.029 1
1 620 . 2 1 1 A 58 58 ARG H H 58 8.310 8.329 -0.019 1
1 621 . 2 1 1 A 58 58 ARG HA H 58 4.295 4.099 0.196 1
1 628 . 2 1 1 A 58 58 ARG CA C 58 56.570 59.243 -2.673 1
1 629 . 2 1 1 A 58 58 ARG CB C 58 30.860 30.150 0.710 1
1 632 . 2 1 1 A 58 58 ARG N N 58 120.045 118.231 1.814 1
1 633 . 2 1 1 A 60 60 CYS HA H 60 4.482 5.248 -0.766 1
1 636 . 2 1 1 A 60 60 CYS CA C 60 58.621 56.935 1.686 1
1 637 . 2 1 1 A 60 60 CYS CB C 60 28.267 30.446 -2.179 1
1 638 . 2 1 1 A 61 61 GLU HA H 61 4.226 4.991 -0.765 1
1 643 . 2 1 1 A 61 61 GLU C C 61 176.299 175.465 0.834 1
1 644 . 2 1 1 A 61 61 GLU CA C 61 57.100 54.733 2.367 1
1 645 . 2 1 1 A 61 61 GLU CB C 61 29.873 33.522 -3.649 1
1 647 . 2 1 1 A 62 62 ALA H H 62 8.282 8.438 -0.156 1
1 648 . 2 1 1 A 62 62 ALA HA H 62 4.302 4.602 -0.300 1
1 652 . 2 1 1 A 62 62 ALA C C 62 177.277 178.056 -0.779 1
1 653 . 2 1 1 A 62 62 ALA CA C 62 52.512 51.327 1.185 1
1 654 . 2 1 1 A 62 62 ALA CB C 62 19.592 18.982 0.610 1
1 655 . 2 1 1 A 62 62 ALA N N 62 124.386 124.076 0.310 1
1 656 . 2 1 1 A 63 63 ALA H H 63 8.399 8.014 0.385 1
1 657 . 2 1 1 A 63 63 ALA HA H 63 4.375 4.437 -0.062 1
1 661 . 2 1 1 A 63 63 ALA C C 63 176.843 176.360 0.483 1
1 662 . 2 1 1 A 63 63 ALA CA C 63 52.658 51.889 0.769 1
1 663 . 2 1 1 A 63 63 ALA CB C 63 19.592 18.929 0.663 1
1 664 . 2 1 1 A 63 63 ALA N N 63 123.892 121.532 2.360 1
1 665 . 2 1 1 A 64 64 ARG H H 64 8.152 7.555 0.597 1
1 666 . 2 1 1 A 64 64 ARG HA H 64 5.008 4.887 0.121 1
1 673 . 2 1 1 A 64 64 ARG C C 64 175.594 175.246 0.348 1
1 674 . 2 1 1 A 64 64 ARG CA C 64 55.282 55.046 0.236 1
1 675 . 2 1 1 A 64 64 ARG CB C 64 32.506 32.529 -0.023 1
1 678 . 2 1 1 A 64 64 ARG N N 64 119.787 117.237 2.550 1
1 679 . 2 1 1 A 65 65 LYS H H 65 8.945 8.601 0.344 1
1 680 . 2 1 1 A 65 65 LYS HA H 65 4.602 5.011 -0.409 1
1 689 . 2 1 1 A 65 65 LYS C C 65 174.657 175.050 -0.393 1
1 690 . 2 1 1 A 65 65 LYS CA C 65 54.948 54.988 -0.040 1
1 691 . 2 1 1 A 65 65 LYS CB C 65 34.068 35.399 -1.331 1
1 695 . 2 1 1 A 65 65 LYS N N 65 124.171 124.008 0.163 1
1 696 . 2 1 1 A 66 66 VAL H H 66 8.672 8.947 -0.275 1
1 697 . 2 1 1 A 66 66 VAL HA H 66 4.532 5.077 -0.545 1
1 705 . 2 1 1 A 66 66 VAL C C 66 175.078 173.720 1.358 1
1 706 . 2 1 1 A 66 66 VAL CA C 66 61.865 60.244 1.621 1
1 707 . 2 1 1 A 66 66 VAL CB C 66 33.835 34.527 -0.692 1
1 710 . 2 1 1 A 66 66 VAL N N 66 124.380 120.455 3.925 1
1 711 . 2 1 1 A 67 67 ILE H H 67 9.071 9.156 -0.085 1
1 712 . 2 1 1 A 67 67 ILE HA H 67 4.142 4.517 -0.375 1
1 722 . 2 1 1 A 67 67 ILE C C 67 175.819 175.604 0.215 1
1 723 . 2 1 1 A 67 67 ILE CA C 67 60.383 60.302 0.081 1
1 724 . 2 1 1 A 67 67 ILE CB C 67 39.908 37.836 2.072 1
1 728 . 2 1 1 A 67 67 ILE N N 67 129.537 129.819 -0.282 1
1 729 . 2 1 1 A 68 68 ARG H H 68 9.203 8.628 0.575 1
1 730 . 2 1 1 A 68 68 ARG HA H 68 4.198 4.259 -0.061 1
1 737 . 2 1 1 A 68 68 ARG C C 68 177.769 177.175 0.594 1
1 738 . 2 1 1 A 68 68 ARG CA C 68 56.835 56.623 0.212 1
1 739 . 2 1 1 A 68 68 ARG CB C 68 29.832 30.670 -0.838 1
1 742 . 2 1 1 A 68 68 ARG N N 68 128.484 128.415 0.069 1
1 743 . 2 1 1 A 69 69 LEU H H 69 8.212 8.650 -0.438 1
1 744 . 2 1 1 A 69 69 LEU HA H 69 4.221 4.142 0.079 1
1 754 . 2 1 1 A 69 69 LEU C C 69 178.996 178.363 0.633 1
1 755 . 2 1 1 A 69 69 LEU CA C 69 57.136 56.850 0.286 1
1 756 . 2 1 1 A 69 69 LEU CB C 69 39.455 41.602 -2.147 1
1 760 . 2 1 1 A 69 69 LEU N N 69 123.807 123.174 0.633 1
1 761 . 2 1 1 A 70 70 SER H H 70 8.823 8.226 0.597 1
1 762 . 2 1 1 A 70 70 SER HA H 70 4.331 4.223 0.108 1
1 765 . 2 1 1 A 70 70 SER C C 70 175.076 176.277 -1.201 1
1 766 . 2 1 1 A 70 70 SER CA C 70 60.329 61.173 -0.844 1
1 767 . 2 1 1 A 70 70 SER CB C 70 62.362 63.211 -0.849 1
1 768 . 2 1 1 A 70 70 SER N N 70 115.162 115.768 -0.606 1
1 769 . 2 1 1 A 71 71 ASP H H 71 7.602 7.704 -0.102 1
1 770 . 2 1 1 A 71 71 ASP HA H 71 4.820 4.501 0.319 1
1 773 . 2 1 1 A 71 71 ASP C C 71 176.478 177.123 -0.645 1
1 774 . 2 1 1 A 71 71 ASP CA C 71 54.241 57.102 -2.861 1
1 775 . 2 1 1 A 71 71 ASP CB C 71 41.347 40.745 0.602 1
1 776 . 2 1 1 A 71 71 ASP N N 71 119.590 120.422 -0.832 1
1 777 . 2 1 1 A 72 72 CYS H H 72 7.715 7.607 0.108 1
1 778 . 2 1 1 A 72 72 CYS HA H 72 4.372 4.688 -0.316 1
1 781 . 2 1 1 A 72 72 CYS C C 72 173.690 174.600 -0.910 1
1 782 . 2 1 1 A 72 72 CYS CA C 72 60.836 58.725 2.111 1
1 783 . 2 1 1 A 72 72 CYS CB C 72 27.655 27.382 0.273 1
1 784 . 2 1 1 A 72 72 CYS N N 72 118.346 117.809 0.537 1
1 785 . 2 1 1 A 73 73 LEU H H 73 9.472 9.205 0.267 1
1 786 . 2 1 1 A 73 73 LEU HA H 73 4.593 4.085 0.508 1
1 796 . 2 1 1 A 73 73 LEU C C 73 177.562 176.770 0.792 1
1 797 . 2 1 1 A 73 73 LEU CA C 73 55.724 57.353 -1.629 1
1 798 . 2 1 1 A 73 73 LEU CB C 73 43.774 42.113 1.661 1
1 802 . 2 1 1 A 73 73 LEU N N 73 124.752 129.111 -4.359 1
1 803 . 2 1 1 A 74 74 ARG H H 74 7.658 7.331 0.327 1
1 804 . 2 1 1 A 74 74 ARG HA H 74 4.592 5.183 -0.591 1
1 811 . 2 1 1 A 74 74 ARG C C 74 173.605 174.349 -0.744 1
1 812 . 2 1 1 A 74 74 ARG CA C 74 56.465 55.804 0.661 1
1 813 . 2 1 1 A 74 74 ARG CB C 74 34.068 33.656 0.412 1
1 816 . 2 1 1 A 74 74 ARG N N 74 115.565 116.046 -0.481 1
1 817 . 2 1 1 A 75 75 VAL H H 75 8.622 8.711 -0.089 1
1 818 . 2 1 1 A 75 75 VAL HA H 75 5.170 5.214 -0.044 1
1 826 . 2 1 1 A 75 75 VAL C C 75 173.985 174.261 -0.276 1
1 827 . 2 1 1 A 75 75 VAL CA C 75 60.930 59.280 1.650 1
1 828 . 2 1 1 A 75 75 VAL CB C 75 35.073 36.506 -1.433 1
1 831 . 2 1 1 A 75 75 VAL N N 75 124.278 118.643 5.635 1
1 832 . 2 1 1 A 76 76 ALA H H 76 8.272 8.926 -0.654 1
1 833 . 2 1 1 A 76 76 ALA HA H 76 4.648 4.881 -0.233 1
1 837 . 2 1 1 A 76 76 ALA C C 76 175.630 175.807 -0.177 1
1 838 . 2 1 1 A 76 76 ALA CA C 76 51.294 51.294 0.000 1
1 839 . 2 1 1 A 76 76 ALA CB C 76 22.759 23.383 -0.624 1
1 840 . 2 1 1 A 76 76 ALA N N 76 126.015 123.304 2.711 1
1 841 . 2 1 1 A 77 77 GLU H H 77 9.184 8.729 0.455 1
1 842 . 2 1 1 A 77 77 GLU HA H 77 4.060 5.105 -1.045 1
1 847 . 2 1 1 A 77 77 GLU C C 77 174.949 175.927 -0.978 1
1 848 . 2 1 1 A 77 77 GLU CA C 77 58.424 55.232 3.192 1
1 849 . 2 1 1 A 77 77 GLU CB C 77 30.161 31.582 -1.421 1
1 851 . 2 1 1 A 77 77 GLU N N 77 120.223 118.264 1.959 1
1 852 . 2 1 1 A 78 78 ALA H H 78 7.985 8.661 -0.676 1
1 853 . 2 1 1 A 78 78 ALA HA H 78 4.776 4.693 0.083 1
1 857 . 2 1 1 A 78 78 ALA C C 78 177.250 178.600 -1.350 1
1 858 . 2 1 1 A 78 78 ALA CA C 78 50.888 51.727 -0.839 1
1 859 . 2 1 1 A 78 78 ALA CB C 78 20.851 18.029 2.822 1
1 860 . 2 1 1 A 78 78 ALA N N 78 125.143 129.145 -4.002 1
1 861 . 2 1 1 A 79 79 GLY H H 79 8.604 8.465 0.139 1
1 862 . 2 1 1 A 79 79 GLY HA2 H 79 4.327 3.917 0.410 1
1 863 . 2 1 1 A 79 79 GLY HA3 H 79 3.963 3.927 0.036 1
1 864 . 2 1 1 A 79 79 GLY C C 79 175.360 175.859 -0.499 1
1 865 . 2 1 1 A 79 79 GLY CA C 79 44.925 46.311 -1.386 1
1 866 . 2 1 1 A 79 79 GLY N N 79 109.420 108.413 1.007 1
1 867 . 2 1 1 A 80 80 GLY H H 80 8.649 8.324 0.325 1
1 868 . 2 1 1 A 80 80 GLY HA2 H 80 3.962 3.827 0.135 1
1 869 . 2 1 1 A 80 80 GLY HA3 H 80 3.962 3.844 0.118 1
1 870 . 2 1 1 A 80 80 GLY C C 80 175.052 173.945 1.107 1
1 871 . 2 1 1 A 80 80 GLY CA C 80 45.955 47.091 -1.136 1
1 872 . 2 1 1 A 80 80 GLY N N 80 108.295 108.797 -0.502 1
1 873 . 2 1 1 A 81 81 GLU H H 81 8.921 7.872 1.049 1
1 874 . 2 1 1 A 81 81 GLU HA H 81 4.298 4.756 -0.458 1
1 879 . 2 1 1 A 81 81 GLU C C 81 176.532 174.847 1.685 1
1 880 . 2 1 1 A 81 81 GLU CA C 81 57.118 55.098 2.020 1
1 881 . 2 1 1 A 81 81 GLU CB C 81 28.599 33.908 -5.309 1
1 883 . 2 1 1 A 81 81 GLU N N 81 121.170 116.557 4.613 1
1 884 . 2 1 1 A 82 82 ALA H H 82 8.032 8.358 -0.326 1
1 885 . 2 1 1 A 82 82 ALA HA H 82 4.371 4.721 -0.350 1
1 889 . 2 1 1 A 82 82 ALA C C 82 177.160 177.078 0.082 1
1 890 . 2 1 1 A 82 82 ALA CA C 82 52.653 51.398 1.255 1
1 891 . 2 1 1 A 82 82 ALA CB C 82 19.304 22.019 -2.715 1
1 892 . 2 1 1 A 82 82 ALA N N 82 124.988 123.130 1.858 1
1 893 . 2 1 1 A 83 83 SER H H 83 8.319 8.851 -0.532 1
1 894 . 2 1 1 A 83 83 SER HA H 83 4.331 4.252 0.079 1
1 897 . 2 1 1 A 83 83 SER C C 83 174.045 175.335 -1.290 1
1 898 . 2 1 1 A 83 83 SER CA C 83 58.053 62.188 -4.135 1
1 899 . 2 1 1 A 83 83 SER CB C 83 63.184 62.919 0.265 1
1 900 . 2 1 1 A 83 83 SER N N 83 114.181 116.392 -2.211 1
1 901 . 2 1 1 A 84 84 SER H H 84 7.823 7.701 0.122 1
1 902 . 2 1 1 A 84 84 SER HA H 84 3.194 4.559 -1.365 1
1 905 . 2 1 1 A 84 84 SER C C 84 171.072 173.853 -2.781 1
1 906 . 2 1 1 A 84 84 SER CA C 84 57.206 56.893 0.313 1
1 907 . 2 1 1 A 84 84 SER CB C 84 61.622 63.079 -1.457 1
1 908 . 2 1 1 A 84 84 SER N N 84 117.302 114.908 2.394 1
1 909 . 2 1 1 A 85 85 PRO HA H 85 3.922 4.559 -0.637 1
1 916 . 2 1 1 A 85 85 PRO CA C 85 62.691 62.544 0.147 1
1 917 . 2 1 1 A 85 85 PRO CB C 85 31.515 32.462 -0.947 1
1 920 . 2 1 1 A 86 86 ARG HA H 86 3.882 3.971 -0.089 1
1 927 . 2 1 1 A 86 86 ARG C C 86 175.712 176.606 -0.894 1
1 928 . 2 1 1 A 86 86 ARG CA C 86 57.877 58.713 -0.836 1
1 929 . 2 1 1 A 86 86 ARG CB C 86 29.791 29.713 0.078 1
1 932 . 2 1 1 A 87 87 ASP H H 87 8.903 7.754 1.149 1
1 933 . 2 1 1 A 87 87 ASP HA H 87 4.342 4.682 -0.340 1
1 936 . 2 1 1 A 87 87 ASP C C 87 175.723 176.015 -0.292 1
1 937 . 2 1 1 A 87 87 ASP CA C 87 56.377 53.749 2.628 1
1 938 . 2 1 1 A 87 87 ASP CB C 87 39.208 41.213 -2.005 1
1 939 . 2 1 1 A 87 87 ASP N N 87 117.520 119.357 -1.837 1
1 940 . 2 1 1 A 88 88 THR H H 88 7.776 7.634 0.142 1
1 941 . 2 1 1 A 88 88 THR HA H 88 5.101 5.066 0.035 1
1 946 . 2 1 1 A 88 88 THR C C 88 173.825 172.439 1.386 1
1 947 . 2 1 1 A 88 88 THR CA C 88 60.154 60.381 -0.227 1
1 948 . 2 1 1 A 88 88 THR CB C 88 72.702 72.720 -0.018 1
1 950 . 2 1 1 A 88 88 THR N N 88 108.770 112.027 -3.257 1
1 951 . 2 1 1 A 89 89 SER H H 89 9.006 9.234 -0.228 1
1 952 . 2 1 1 A 89 89 SER HA H 89 4.718 5.198 -0.480 1
1 955 . 2 1 1 A 89 89 SER C C 89 173.728 173.386 0.342 1
1 956 . 2 1 1 A 89 89 SER CA C 89 57.453 57.838 -0.385 1
1 957 . 2 1 1 A 89 89 SER CB C 89 65.611 65.465 0.146 1
1 958 . 2 1 1 A 89 89 SER N N 89 114.151 117.629 -3.478 1
1 959 . 2 1 1 A 90 90 ALA H H 90 9.001 8.757 0.244 1
1 960 . 2 1 1 A 90 90 ALA HA H 90 5.660 4.617 1.043 1
1 964 . 2 1 1 A 90 90 ALA C C 90 177.669 177.353 0.316 1
1 965 . 2 1 1 A 90 90 ALA CA C 90 51.670 51.966 -0.296 1
1 966 . 2 1 1 A 90 90 ALA CB C 90 22.265 20.097 2.168 1
1 967 . 2 1 1 A 90 90 ALA N N 90 126.177 128.934 -2.757 1
1 968 . 2 1 1 A 91 91 PHE H H 91 9.672 8.240 1.432 1
1 969 . 2 1 1 A 91 91 PHE HA H 91 5.039 5.565 -0.526 1
1 977 . 2 1 1 A 91 91 PHE C C 91 170.731 173.630 -2.899 1
1 978 . 2 1 1 A 91 91 PHE CA C 91 56.271 55.306 0.965 1
1 979 . 2 1 1 A 91 91 PHE CB C 91 41.553 42.035 -0.482 1
1 985 . 2 1 1 A 91 91 PHE N N 91 118.968 115.884 3.084 1
1 986 . 2 1 1 A 92 92 PHE H H 92 9.422 9.560 -0.138 1
1 987 . 2 1 1 A 92 92 PHE HA H 92 5.674 5.088 0.586 1
1 995 . 2 1 1 A 92 92 PHE C C 92 174.570 175.448 -0.878 1
1 996 . 2 1 1 A 92 92 PHE CA C 92 55.917 57.794 -1.877 1
1 997 . 2 1 1 A 92 92 PHE CB C 92 42.787 41.473 1.314 1
1 1003 . 2 1 1 A 92 92 PHE N N 92 117.543 118.369 -0.826 1
1 1004 . 2 1 1 A 93 93 LEU H H 93 9.021 8.869 0.152 1
1 1005 . 2 1 1 A 93 93 LEU HA H 93 5.122 4.886 0.236 1
1 1015 . 2 1 1 A 93 93 LEU C C 93 174.799 174.260 0.539 1
1 1016 . 2 1 1 A 93 93 LEU CA C 93 54.912 54.830 0.082 1
1 1017 . 2 1 1 A 93 93 LEU CB C 93 45.254 45.150 0.104 1
1 1021 . 2 1 1 A 93 93 LEU N N 93 121.719 121.731 -0.012 1
1 1022 . 2 1 1 A 94 94 GLU H H 94 9.294 9.302 -0.008 1
1 1023 . 2 1 1 A 94 94 GLU HA H 94 5.043 5.316 -0.273 1
1 1028 . 2 1 1 A 94 94 GLU C C 94 175.754 175.352 0.402 1
1 1029 . 2 1 1 A 94 94 GLU CA C 94 56.018 54.754 1.264 1
1 1030 . 2 1 1 A 94 94 GLU CB C 94 32.752 32.870 -0.118 1
1 1032 . 2 1 1 A 94 94 GLU N N 94 127.032 128.691 -1.659 1
1 1033 . 2 1 1 A 95 95 THR H H 95 8.822 8.469 0.353 1
1 1034 . 2 1 1 A 95 95 THR HA H 95 5.398 5.217 0.181 1
1 1039 . 2 1 1 A 95 95 THR C C 95 173.860 175.618 -1.758 1
1 1040 . 2 1 1 A 95 95 THR CA C 95 59.588 59.503 0.085 1
1 1041 . 2 1 1 A 95 95 THR CB C 95 72.191 72.288 -0.097 1
1 1043 . 2 1 1 A 95 95 THR N N 95 118.685 118.354 0.331 1
1 1044 . 2 1 1 A 96 96 LYS H H 96 8.823 9.157 -0.334 1
1 1045 . 2 1 1 A 96 96 LYS HA H 96 4.022 4.006 0.016 1
1 1054 . 2 1 1 A 96 96 LYS C C 96 177.330 178.869 -1.539 1
1 1055 . 2 1 1 A 96 96 LYS CA C 96 59.588 60.231 -0.643 1
1 1056 . 2 1 1 A 96 96 LYS CB C 96 32.588 32.082 0.506 1
1 1060 . 2 1 1 A 96 96 LYS N N 96 118.801 122.316 -3.515 1
1 1061 . 2 1 1 A 97 97 GLU H H 97 8.092 7.860 0.232 1
1 1062 . 2 1 1 A 97 97 GLU HA H 97 4.282 4.220 0.062 1
1 1067 . 2 1 1 A 97 97 GLU C C 97 176.290 176.170 0.120 1
1 1068 . 2 1 1 A 97 97 GLU CA C 97 57.365 59.091 -1.726 1
1 1069 . 2 1 1 A 97 97 GLU CB C 97 31.559 30.832 0.727 1
1 1071 . 2 1 1 A 97 97 GLU N N 97 113.992 118.911 -4.919 1
1 1072 . 2 1 1 A 98 98 ARG H H 98 7.482 7.319 0.163 1
1 1073 . 2 1 1 A 98 98 ARG HA H 98 4.397 4.630 -0.233 1
1 1080 . 2 1 1 A 98 98 ARG C C 98 172.792 173.381 -0.589 1
1 1081 . 2 1 1 A 98 98 ARG CA C 98 55.689 54.756 0.933 1
1 1082 . 2 1 1 A 98 98 ARG CB C 98 32.711 31.936 0.775 1
1 1085 . 2 1 1 A 98 98 ARG N N 98 116.022 114.550 1.472 1
1 1086 . 2 1 1 A 99 99 LEU H H 99 8.423 8.285 0.138 1
1 1087 . 2 1 1 A 99 99 LEU HA H 99 4.807 4.851 -0.044 1
1 1097 . 2 1 1 A 99 99 LEU C C 99 175.903 174.131 1.772 1
1 1098 . 2 1 1 A 99 99 LEU CA C 99 54.383 53.883 0.500 1
1 1099 . 2 1 1 A 99 99 LEU CB C 99 43.362 43.114 0.248 1
1 1103 . 2 1 1 A 99 99 LEU N N 99 124.983 122.147 2.836 1
1 1104 . 2 1 1 A 100 100 TYR H H 100 9.144 9.539 -0.395 1
1 1105 . 2 1 1 A 100 100 TYR HA H 100 4.542 5.057 -0.515 1
1 1112 . 2 1 1 A 100 100 TYR C C 100 173.479 174.589 -1.110 1
1 1113 . 2 1 1 A 100 100 TYR CA C 100 57.735 57.033 0.702 1
1 1114 . 2 1 1 A 100 100 TYR CB C 100 39.291 40.462 -1.171 1
1 1119 . 2 1 1 A 100 100 TYR N N 100 126.679 127.780 -1.101 1
1 1120 . 2 1 1 A 101 101 LEU H H 101 9.043 8.845 0.198 1
1 1121 . 2 1 1 A 101 101 LEU HA H 101 4.747 4.930 -0.183 1
1 1131 . 2 1 1 A 101 101 LEU C C 101 173.530 175.137 -1.607 1
1 1132 . 2 1 1 A 101 101 LEU CA C 101 54.524 53.633 0.891 1
1 1133 . 2 1 1 A 101 101 LEU CB C 101 42.499 43.603 -1.104 1
1 1137 . 2 1 1 A 101 101 LEU N N 101 127.422 125.506 1.916 1
1 1138 . 2 1 1 A 102 102 LEU H H 102 8.493 8.542 -0.049 1
1 1139 . 2 1 1 A 102 102 LEU HA H 102 5.612 5.552 0.060 1
1 1149 . 2 1 1 A 102 102 LEU C C 102 175.794 175.862 -0.068 1
1 1150 . 2 1 1 A 102 102 LEU CA C 102 53.076 53.173 -0.097 1
1 1151 . 2 1 1 A 102 102 LEU CB C 102 45.994 44.487 1.507 1
1 1155 . 2 1 1 A 102 102 LEU N N 102 126.021 128.625 -2.604 1
1 1156 . 2 1 1 A 103 103 ALA H H 103 9.073 8.789 0.284 1
1 1157 . 2 1 1 A 103 103 ALA HA H 103 5.081 5.258 -0.177 1
1 1161 . 2 1 1 A 103 103 ALA C C 103 175.133 175.750 -0.617 1
1 1162 . 2 1 1 A 103 103 ALA CA C 103 51.688 49.800 1.888 1
1 1163 . 2 1 1 A 103 103 ALA CB C 103 21.689 22.338 -0.649 1
1 1164 . 2 1 1 A 103 103 ALA N N 103 117.679 122.531 -4.852 1
1 1165 . 2 1 1 A 104 104 ALA H H 104 8.582 8.533 0.049 1
1 1166 . 2 1 1 A 104 104 ALA HA H 104 5.220 4.766 0.454 1
1 1170 . 2 1 1 A 104 104 ALA C C 104 173.471 173.951 -0.480 1
1 1171 . 2 1 1 A 104 104 ALA CA C 104 47.959 49.958 -1.999 1
1 1172 . 2 1 1 A 104 104 ALA CB C 104 21.359 22.102 -0.743 1
1 1173 . 2 1 1 A 104 104 ALA N N 104 123.419 120.778 2.641 1
1 1174 . 2 1 1 A 105 105 PRO HA H 105 4.542 4.741 -0.199 1
1 1181 . 2 1 1 A 105 105 PRO C C 105 178.409 177.912 0.497 1
1 1182 . 2 1 1 A 105 105 PRO CA C 105 64.301 62.813 1.488 1
1 1183 . 2 1 1 A 105 105 PRO CB C 105 32.094 31.594 0.500 1
1 1186 . 2 1 1 A 106 106 ALA H H 106 8.302 8.660 -0.358 1
1 1187 . 2 1 1 A 106 106 ALA HA H 106 4.022 4.040 -0.018 1
1 1191 . 2 1 1 A 106 106 ALA C C 106 179.641 179.646 -0.005 1
1 1192 . 2 1 1 A 106 106 ALA CA C 106 56.341 54.949 1.392 1
1 1193 . 2 1 1 A 106 106 ALA CB C 106 18.523 18.178 0.345 1
1 1194 . 2 1 1 A 106 106 ALA N N 106 127.733 128.408 -0.675 1
1 1195 . 2 1 1 A 107 107 ALA H H 107 9.035 8.156 0.879 1
1 1196 . 2 1 1 A 107 107 ALA HA H 107 4.331 4.085 0.246 1
1 1200 . 2 1 1 A 107 107 ALA C C 107 178.586 178.942 -0.356 1
1 1201 . 2 1 1 A 107 107 ALA CA C 107 53.765 55.074 -1.309 1
1 1202 . 2 1 1 A 107 107 ALA CB C 107 18.728 18.487 0.241 1
1 1203 . 2 1 1 A 107 107 ALA N N 107 118.203 119.813 -1.610 1
1 1204 . 2 1 1 A 108 108 GLU H H 108 8.399 8.158 0.241 1
1 1205 . 2 1 1 A 108 108 GLU HA H 108 4.631 4.513 0.118 1
1 1210 . 2 1 1 A 108 108 GLU C C 108 177.127 178.490 -1.363 1
1 1211 . 2 1 1 A 108 108 GLU CA C 108 55.847 57.394 -1.547 1
1 1212 . 2 1 1 A 108 108 GLU CB C 108 32.135 30.212 1.923 1
1 1214 . 2 1 1 A 108 108 GLU N N 108 114.661 116.799 -2.138 1
1 1215 . 2 1 1 A 109 109 ARG H H 109 7.412 8.503 -1.091 1
1 1216 . 2 1 1 A 109 109 ARG HA H 109 3.682 4.096 -0.414 1
1 1223 . 2 1 1 A 109 109 ARG C C 109 176.917 179.177 -2.260 1
1 1224 . 2 1 1 A 109 109 ARG CA C 109 61.600 59.919 1.681 1
1 1225 . 2 1 1 A 109 109 ARG CB C 109 28.845 30.075 -1.230 1
1 1228 . 2 1 1 A 109 109 ARG N N 109 120.954 121.315 -0.361 1
1 1229 . 2 1 1 A 110 110 GLY H H 110 8.833 8.453 0.380 1
1 1230 . 2 1 1 A 110 110 GLY HA2 H 110 3.872 3.795 0.077 1
1 1231 . 2 1 1 A 110 110 GLY HA3 H 110 3.685 3.808 -0.123 1
1 1232 . 2 1 1 A 110 110 GLY C C 110 175.997 175.562 0.435 1
1 1233 . 2 1 1 A 110 110 GLY CA C 110 47.323 47.578 -0.255 1
1 1234 . 2 1 1 A 110 110 GLY N N 110 106.563 107.192 -0.629 1
1 1235 . 2 1 1 A 111 111 ASP H H 111 7.882 8.134 -0.252 1
1 1236 . 2 1 1 A 111 111 ASP HA H 111 4.312 4.258 0.054 1
1 1239 . 2 1 1 A 111 111 ASP C C 111 179.467 178.400 1.067 1
1 1240 . 2 1 1 A 111 111 ASP CA C 111 56.976 56.568 0.408 1
1 1241 . 2 1 1 A 111 111 ASP CB C 111 40.648 40.373 0.275 1
1 1242 . 2 1 1 A 111 111 ASP N N 111 121.402 121.703 -0.301 1
1 1243 . 2 1 1 A 112 112 TRP H H 112 7.804 8.211 -0.407 1
1 1244 . 2 1 1 A 112 112 TRP HA H 112 3.831 4.184 -0.353 1
1 1253 . 2 1 1 A 112 112 TRP C C 112 177.547 178.705 -1.158 1
1 1254 . 2 1 1 A 112 112 TRP CA C 112 62.006 59.992 2.014 1
1 1255 . 2 1 1 A 112 112 TRP CB C 112 29.421 29.353 0.068 1
1 1261 . 2 1 1 A 112 112 TRP N N 112 119.904 119.747 0.157 1
1 1263 . 2 1 1 A 113 113 VAL H H 113 7.982 8.138 -0.156 1
1 1264 . 2 1 1 A 113 113 VAL HA H 113 3.072 3.627 -0.555 1
1 1272 . 2 1 1 A 113 113 VAL C C 113 178.015 178.291 -0.276 1
1 1273 . 2 1 1 A 113 113 VAL CA C 113 67.407 66.614 0.793 1
1 1274 . 2 1 1 A 113 113 VAL CB C 113 31.724 31.529 0.195 1
1 1277 . 2 1 1 A 113 113 VAL N N 113 117.575 119.353 -1.778 1
1 1278 . 2 1 1 A 114 114 GLN H H 114 8.268 8.023 0.245 1
1 1279 . 2 1 1 A 114 114 GLN HA H 114 3.994 4.004 -0.010 1
1 1286 . 2 1 1 A 114 114 GLN C C 114 178.021 177.900 0.121 1
1 1287 . 2 1 1 A 114 114 GLN CA C 114 59.112 58.878 0.234 1
1 1288 . 2 1 1 A 114 114 GLN CB C 114 28.685 28.841 -0.156 1
1 1290 . 2 1 1 A 114 114 GLN N N 114 117.479 120.096 -2.617 1
1 1292 . 2 1 1 A 115 115 ALA H H 115 7.915 8.484 -0.569 1
1 1293 . 2 1 1 A 115 115 ALA HA H 115 3.972 4.059 -0.087 1
1 1297 . 2 1 1 A 115 115 ALA C C 115 180.030 180.028 0.002 1
1 1298 . 2 1 1 A 115 115 ALA CA C 115 55.142 55.173 -0.031 1
1 1299 . 2 1 1 A 115 115 ALA CB C 115 18.152 18.524 -0.372 1
1 1300 . 2 1 1 A 115 115 ALA N N 115 120.858 120.686 0.172 1
1 1301 . 2 1 1 A 116 116 ILE H H 116 8.172 8.305 -0.133 1
1 1302 . 2 1 1 A 116 116 ILE HA H 116 3.482 3.699 -0.217 1
1 1312 . 2 1 1 A 116 116 ILE C C 116 177.739 177.855 -0.116 1
1 1313 . 2 1 1 A 116 116 ILE CA C 116 66.119 65.129 0.990 1
1 1314 . 2 1 1 A 116 116 ILE CB C 116 38.222 37.764 0.458 1
1 1318 . 2 1 1 A 116 116 ILE N N 116 115.977 117.404 -1.427 1
1 1319 . 2 1 1 A 117 117 CYS H H 117 8.449 8.500 -0.051 1
1 1320 . 2 1 1 A 117 117 CYS HA H 117 4.032 4.659 -0.627 1
1 1323 . 2 1 1 A 117 117 CYS C C 117 177.321 176.484 0.837 1
1 1324 . 2 1 1 A 117 117 CYS CA C 117 64.777 61.968 2.809 1
1 1325 . 2 1 1 A 117 117 CYS CB C 117 26.871 27.261 -0.390 1
1 1326 . 2 1 1 A 117 117 CYS N N 117 117.253 120.979 -3.726 1
1 1327 . 2 1 1 A 118 118 LEU H H 118 8.182 8.285 -0.103 1
1 1328 . 2 1 1 A 118 118 LEU HA H 118 4.052 4.176 -0.124 1
1 1338 . 2 1 1 A 118 118 LEU C C 118 179.217 178.150 1.067 1
1 1339 . 2 1 1 A 118 118 LEU CA C 118 57.877 57.286 0.591 1
1 1340 . 2 1 1 A 118 118 LEU CB C 118 42.088 41.792 0.296 1
1 1344 . 2 1 1 A 118 118 LEU N N 118 119.665 120.347 -0.682 1
1 1345 . 2 1 1 A 119 119 LEU H H 119 7.142 7.864 -0.722 1
1 1346 . 2 1 1 A 119 119 LEU HA H 119 4.192 4.321 -0.129 1
1 1356 . 2 1 1 A 119 119 LEU C C 119 178.492 178.565 -0.073 1
1 1357 . 2 1 1 A 119 119 LEU CA C 119 56.259 57.017 -0.758 1
1 1358 . 2 1 1 A 119 119 LEU CB C 119 43.568 42.712 0.856 1
1 1362 . 2 1 1 A 119 119 LEU N N 119 116.244 118.905 -2.661 1
1 1363 . 2 1 1 A 120 120 ALA H H 120 8.513 8.382 0.131 1
1 1364 . 2 1 1 A 120 120 ALA HA H 120 3.878 3.955 -0.077 1
1 1368 . 2 1 1 A 120 120 ALA C C 120 178.358 177.896 0.462 1
1 1369 . 2 1 1 A 120 120 ALA CA C 120 53.765 54.528 -0.763 1
1 1370 . 2 1 1 A 120 120 ALA CB C 120 18.687 18.515 0.172 1
1 1371 . 2 1 1 A 120 120 ALA N N 120 120.009 120.131 -0.122 1
1 1372 . 2 1 1 A 121 121 PHE H H 121 7.822 8.154 -0.332 1
1 1373 . 2 1 1 A 121 121 PHE HA H 121 5.156 4.845 0.311 1
1 1381 . 2 1 1 A 121 121 PHE C C 121 176.273 174.915 1.358 1
1 1382 . 2 1 1 A 121 121 PHE CA C 121 55.741 57.202 -1.461 1
1 1383 . 2 1 1 A 121 121 PHE CB C 121 39.455 38.816 0.639 1
1 1389 . 2 1 1 A 121 121 PHE N N 121 113.981 114.859 -0.878 1
1 1390 . 2 1 1 A 122 122 SER H H 122 7.765 7.984 -0.219 1
1 1391 . 2 1 1 A 122 122 SER HA H 122 4.579 4.540 0.039 1
1 1394 . 2 1 1 A 122 122 SER C C 122 174.595 174.819 -0.224 1
1 1395 . 2 1 1 A 122 122 SER CA C 122 58.777 58.787 -0.010 1
1 1396 . 2 1 1 A 122 122 SER CB C 122 63.719 62.324 1.395 1
1 1397 . 2 1 1 A 122 122 SER N N 122 115.069 113.646 1.423 1
1 1398 . 2 1 1 A 123 123 GLY H H 123 8.223 8.544 -0.321 1
1 1399 . 2 1 1 A 123 123 GLY HA2 H 123 4.174 4.152 0.022 1
1 1400 . 2 1 1 A 123 123 GLY HA3 H 123 4.100 4.160 -0.060 1
1 1401 . 2 1 1 A 123 123 GLY C C 123 171.678 173.390 -1.712 1
1 1402 . 2 1 1 A 123 123 GLY CA C 123 44.815 44.803 0.012 1
1 1403 . 2 1 1 A 123 123 GLY N N 123 110.151 111.993 -1.842 1
1 1404 . 2 1 1 A 124 124 PRO HA H 124 4.482 4.611 -0.129 1
1 1411 . 2 1 1 A 124 124 PRO C C 124 177.314 176.305 1.009 1
1 1412 . 2 1 1 A 124 124 PRO CA C 124 63.206 62.513 0.693 1
1 1413 . 2 1 1 A 124 124 PRO CB C 124 32.176 33.221 -1.045 1
1 1416 . 2 1 1 A 125 125 SER H H 125 8.485 8.835 -0.350 1
1 1417 . 2 1 1 A 125 125 SER HA H 125 4.472 4.613 -0.141 1
1 1420 . 2 1 1 A 125 125 SER C C 125 174.728 173.798 0.930 1
1 1421 . 2 1 1 A 125 125 SER CA C 125 58.353 59.631 -1.278 1
1 1422 . 2 1 1 A 125 125 SER CB C 125 64.048 64.767 -0.719 1
1 1423 . 2 1 1 A 125 125 SER N N 125 116.081 115.200 0.881 1
1 1424 . 2 1 1 A 126 126 SER H H 126 8.332 8.071 0.261 1
1 1425 . 2 1 1 A 126 126 SER HA H 126 4.464 4.812 -0.348 1
1 1428 . 2 1 1 A 126 126 SER C C 126 173.980 174.151 -0.171 1
1 1429 . 2 1 1 A 126 126 SER CA C 126 58.336 56.991 1.345 1
1 1430 . 2 1 1 A 126 126 SER CB C 126 63.925 66.195 -2.270 1
1 1431 . 2 1 1 A 126 126 SER N N 126 118.037 112.939 5.098 1
1 1 . 3 1 1 A 6 6 SER HA H 6 4.458 4.926 -0.468 1
1 3 . 3 1 1 A 6 6 SER C C 6 175.108 173.523 1.585 1
1 4 . 3 1 1 A 6 6 SER CA C 6 58.689 56.939 1.750 1
1 5 . 3 1 1 A 6 6 SER CB C 6 63.678 64.413 -0.735 1
1 6 . 3 1 1 A 7 7 GLY H H 7 8.449 8.254 0.195 1
1 7 . 3 1 1 A 7 7 GLY HA2 H 7 3.965 4.181 -0.216 1
1 8 . 3 1 1 A 7 7 GLY HA3 H 7 3.965 4.184 -0.219 1
1 9 . 3 1 1 A 7 7 GLY C C 7 174.380 173.889 0.491 1
1 10 . 3 1 1 A 7 7 GLY CA C 7 45.435 45.743 -0.308 1
1 11 . 3 1 1 A 7 7 GLY N N 7 110.792 113.129 -2.337 1
1 12 . 3 1 1 A 8 8 MET H H 8 8.259 8.751 -0.492 1
1 13 . 3 1 1 A 8 8 MET HA H 8 4.487 4.190 0.297 1
1 21 . 3 1 1 A 8 8 MET C C 8 176.961 175.125 1.836 1
1 22 . 3 1 1 A 8 8 MET CA C 8 55.565 56.215 -0.650 1
1 23 . 3 1 1 A 8 8 MET CB C 8 32.835 30.505 2.330 1
1 26 . 3 1 1 A 8 8 MET N N 8 119.639 119.987 -0.348 1
1 27 . 3 1 1 A 9 9 GLY H H 9 8.472 7.781 0.691 1
1 28 . 3 1 1 A 9 9 GLY HA2 H 9 3.946 4.131 -0.185 1
1 29 . 3 1 1 A 9 9 GLY HA3 H 9 3.946 4.132 -0.186 1
1 30 . 3 1 1 A 9 9 GLY C C 9 174.005 173.742 0.263 1
1 31 . 3 1 1 A 9 9 GLY CA C 9 45.488 44.966 0.522 1
1 32 . 3 1 1 A 9 9 GLY N N 9 110.107 107.633 2.474 1
1 33 . 3 1 1 A 10 10 ASP H H 10 8.292 8.727 -0.435 1
1 34 . 3 1 1 A 10 10 ASP HA H 10 4.636 4.831 -0.195 1
1 37 . 3 1 1 A 10 10 ASP C C 10 176.768 177.150 -0.382 1
1 38 . 3 1 1 A 10 10 ASP CA C 10 54.206 54.854 -0.648 1
1 39 . 3 1 1 A 10 10 ASP CB C 10 41.306 42.086 -0.780 1
1 40 . 3 1 1 A 10 10 ASP N N 10 120.370 121.211 -0.841 1
1 41 . 3 1 1 A 11 11 GLY H H 11 8.452 7.869 0.583 1
1 42 . 3 1 1 A 11 11 GLY HA2 H 11 3.980 4.138 -0.158 1
1 43 . 3 1 1 A 11 11 GLY HA3 H 11 4.022 4.169 -0.147 1
1 44 . 3 1 1 A 11 11 GLY C C 11 174.102 173.429 0.673 1
1 45 . 3 1 1 A 11 11 GLY CA C 11 45.170 44.905 0.265 1
1 46 . 3 1 1 A 11 11 GLY N N 11 108.391 107.844 0.547 1
1 47 . 3 1 1 A 12 12 ALA H H 12 8.293 8.028 0.265 1
1 48 . 3 1 1 A 12 12 ALA HA H 12 3.777 3.904 -0.127 1
1 52 . 3 1 1 A 12 12 ALA C C 12 178.193 178.561 -0.368 1
1 53 . 3 1 1 A 12 12 ALA CA C 12 52.759 52.366 0.393 1
1 54 . 3 1 1 A 12 12 ALA CB C 12 17.855 18.955 -1.100 1
1 55 . 3 1 1 A 12 12 ALA N N 12 124.185 125.365 -1.180 1
1 56 . 3 1 1 A 13 13 VAL H H 13 8.822 8.317 0.505 1
1 57 . 3 1 1 A 13 13 VAL HA H 13 3.912 3.726 0.186 1
1 65 . 3 1 1 A 13 13 VAL C C 13 176.073 175.620 0.453 1
1 66 . 3 1 1 A 13 13 VAL CA C 13 63.100 66.240 -3.140 1
1 67 . 3 1 1 A 13 13 VAL CB C 13 32.711 31.790 0.921 1
1 70 . 3 1 1 A 13 13 VAL N N 13 120.877 122.165 -1.288 1
1 71 . 3 1 1 A 14 14 LYS H H 14 7.093 7.572 -0.479 1
1 72 . 3 1 1 A 14 14 LYS HA H 14 4.169 4.698 -0.529 1
1 81 . 3 1 1 A 14 14 LYS C C 14 173.291 174.140 -0.849 1
1 82 . 3 1 1 A 14 14 LYS CA C 14 56.465 55.163 1.302 1
1 83 . 3 1 1 A 14 14 LYS CB C 14 35.960 35.701 0.259 1
1 87 . 3 1 1 A 14 14 LYS N N 14 118.693 119.243 -0.550 1
1 88 . 3 1 1 A 15 15 GLN H H 15 8.522 8.496 0.026 1
1 89 . 3 1 1 A 15 15 GLN HA H 15 5.542 5.176 0.366 1
1 96 . 3 1 1 A 15 15 GLN C C 15 174.992 175.832 -0.840 1
1 97 . 3 1 1 A 15 15 GLN CA C 15 54.312 54.052 0.260 1
1 98 . 3 1 1 A 15 15 GLN CB C 15 33.585 31.980 1.605 1
1 100 . 3 1 1 A 15 15 GLN N N 15 124.024 124.105 -0.081 1
1 102 . 3 1 1 A 16 16 GLY H H 16 8.740 8.047 0.693 1
1 103 . 3 1 1 A 16 16 GLY HA2 H 16 4.511 4.038 0.473 1
1 104 . 3 1 1 A 16 16 GLY HA3 H 16 4.064 4.429 -0.365 1
1 105 . 3 1 1 A 16 16 GLY C C 16 171.431 171.429 0.002 1
1 106 . 3 1 1 A 16 16 GLY CA C 16 46.106 45.594 0.512 1
1 107 . 3 1 1 A 16 16 GLY N N 16 109.611 109.540 0.071 1
1 108 . 3 1 1 A 17 17 PHE H H 17 8.886 8.403 0.483 1
1 109 . 3 1 1 A 17 17 PHE HA H 17 5.466 5.081 0.385 1
1 114 . 3 1 1 A 17 17 PHE C C 17 174.795 174.841 -0.046 1
1 115 . 3 1 1 A 17 17 PHE CA C 17 57.788 57.230 0.558 1
1 116 . 3 1 1 A 17 17 PHE CB C 17 41.315 40.945 0.370 1
1 119 . 3 1 1 A 17 17 PHE N N 17 122.684 119.278 3.406 1
1 120 . 3 1 1 A 18 18 LEU H H 18 8.762 8.864 -0.102 1
1 121 . 3 1 1 A 18 18 LEU HA H 18 4.946 4.775 0.171 1
1 131 . 3 1 1 A 18 18 LEU C C 18 175.461 175.215 0.246 1
1 132 . 3 1 1 A 18 18 LEU CA C 18 52.970 53.334 -0.364 1
1 133 . 3 1 1 A 18 18 LEU CB C 18 47.945 44.386 3.559 1
1 137 . 3 1 1 A 18 18 LEU N N 18 119.045 123.869 -4.824 1
1 138 . 3 1 1 A 19 19 TYR H H 19 9.272 8.226 1.046 1
1 139 . 3 1 1 A 19 19 TYR HA H 19 5.682 5.567 0.115 1
1 146 . 3 1 1 A 19 19 TYR C C 19 174.829 174.655 0.174 1
1 147 . 3 1 1 A 19 19 TYR CA C 19 56.482 56.483 -0.001 1
1 148 . 3 1 1 A 19 19 TYR CB C 19 41.717 41.353 0.364 1
1 153 . 3 1 1 A 19 19 TYR N N 19 118.024 123.212 -5.188 1
1 154 . 3 1 1 A 20 20 LEU H H 20 9.441 8.725 0.716 1
1 155 . 3 1 1 A 20 20 LEU HA H 20 5.283 5.201 0.082 1
1 165 . 3 1 1 A 20 20 LEU C C 20 175.935 175.450 0.485 1
1 166 . 3 1 1 A 20 20 LEU CA C 20 53.464 53.826 -0.362 1
1 167 . 3 1 1 A 20 20 LEU CB C 20 46.570 44.665 1.905 1
1 171 . 3 1 1 A 20 20 LEU N N 20 122.838 125.266 -2.428 1
1 172 . 3 1 1 A 21 21 GLN H H 21 8.391 8.285 0.106 1
1 173 . 3 1 1 A 21 21 GLN HA H 21 3.791 4.066 -0.275 1
1 180 . 3 1 1 A 21 21 GLN C C 21 175.157 174.187 0.970 1
1 181 . 3 1 1 A 21 21 GLN CA C 21 56.094 55.582 0.512 1
1 182 . 3 1 1 A 21 21 GLN CB C 21 28.434 28.195 0.239 1
1 184 . 3 1 1 A 21 21 GLN N N 21 129.943 127.788 2.155 1
1 186 . 3 1 1 A 22 22 GLN H H 22 8.829 8.705 0.124 1
1 187 . 3 1 1 A 22 22 GLN HA H 22 4.553 4.606 -0.053 1
1 194 . 3 1 1 A 22 22 GLN C C 22 174.998 175.869 -0.871 1
1 195 . 3 1 1 A 22 22 GLN CA C 22 54.912 54.037 0.875 1
1 196 . 3 1 1 A 22 22 GLN CB C 22 31.930 28.264 3.666 1
1 198 . 3 1 1 A 22 22 GLN N N 22 127.199 126.477 0.722 1
1 200 . 3 1 1 A 23 23 GLN HA H 23 4.142 4.506 -0.364 1
1 207 . 3 1 1 A 23 23 GLN CA C 23 56.427 54.952 1.475 1
1 208 . 3 1 1 A 23 23 GLN CB C 23 29.227 28.109 1.118 1
1 211 . 3 1 1 A 24 24 GLN HA H 24 4.523 4.455 0.068 1
1 218 . 3 1 1 A 24 24 GLN CB C 24 29.759 30.218 -0.459 1
1 221 . 3 1 1 A 25 25 THR HA H 25 3.870 4.009 -0.139 1
1 226 . 3 1 1 A 25 25 THR CA C 25 65.096 64.548 0.548 1
1 227 . 3 1 1 A 25 25 THR CB C 25 68.924 69.264 -0.340 1
1 229 . 3 1 1 A 26 26 PHE HA H 26 4.690 4.765 -0.075 1
1 236 . 3 1 1 A 26 26 PHE C C 26 175.523 175.104 0.419 1
1 237 . 3 1 1 A 26 26 PHE CA C 26 57.312 56.828 0.484 1
1 238 . 3 1 1 A 26 26 PHE CB C 26 39.003 42.285 -3.282 1
1 243 . 3 1 1 A 27 27 GLY H H 27 7.755 8.817 -1.062 1
1 244 . 3 1 1 A 27 27 GLY HA2 H 27 4.172 3.965 0.207 1
1 245 . 3 1 1 A 27 27 GLY HA3 H 27 3.783 3.970 -0.187 1
1 246 . 3 1 1 A 27 27 GLY C C 27 172.557 173.865 -1.308 1
1 247 . 3 1 1 A 27 27 GLY CA C 27 44.924 45.942 -1.018 1
1 248 . 3 1 1 A 27 27 GLY N N 27 109.216 110.939 -1.723 1
1 249 . 3 1 1 A 28 28 LYS H H 28 8.241 8.383 -0.142 1
1 250 . 3 1 1 A 28 28 LYS HA H 28 4.530 4.582 -0.052 1
1 259 . 3 1 1 A 28 28 LYS C C 28 176.204 175.097 1.107 1
1 260 . 3 1 1 A 28 28 LYS CA C 28 55.741 55.488 0.253 1
1 261 . 3 1 1 A 28 28 LYS CB C 28 33.904 32.973 0.931 1
1 265 . 3 1 1 A 28 28 LYS N N 28 118.743 121.731 -2.988 1
1 266 . 3 1 1 A 29 29 LYS H H 29 8.356 8.481 -0.125 1
1 267 . 3 1 1 A 29 29 LYS HA H 29 4.559 4.732 -0.173 1
1 274 . 3 1 1 A 29 29 LYS C C 29 175.420 175.120 0.300 1
1 275 . 3 1 1 A 29 29 LYS CA C 29 55.406 54.990 0.416 1
1 276 . 3 1 1 A 29 29 LYS CB C 29 35.618 36.337 -0.719 1
1 280 . 3 1 1 A 29 29 LYS N N 29 121.198 124.166 -2.968 1
1 281 . 3 1 1 A 30 30 TRP H H 30 8.891 8.555 0.336 1
1 282 . 3 1 1 A 30 30 TRP HA H 30 4.951 4.593 0.358 1
1 291 . 3 1 1 A 30 30 TRP C C 30 175.902 175.955 -0.053 1
1 292 . 3 1 1 A 30 30 TRP CA C 30 56.677 58.757 -2.080 1
1 293 . 3 1 1 A 30 30 TRP CB C 30 30.614 29.983 0.631 1
1 299 . 3 1 1 A 30 30 TRP N N 30 123.304 127.560 -4.256 1
1 301 . 3 1 1 A 31 31 ARG H H 31 8.712 8.899 -0.187 1
1 302 . 3 1 1 A 31 31 ARG HA H 31 4.820 4.779 0.041 1
1 309 . 3 1 1 A 31 31 ARG C C 31 174.026 175.060 -1.034 1
1 310 . 3 1 1 A 31 31 ARG CA C 31 54.895 53.825 1.070 1
1 311 . 3 1 1 A 31 31 ARG CB C 31 34.045 33.159 0.886 1
1 314 . 3 1 1 A 31 31 ARG N N 31 123.973 124.899 -0.926 1
1 315 . 3 1 1 A 32 32 ARG H H 32 8.820 8.522 0.298 1
1 316 . 3 1 1 A 32 32 ARG HA H 32 3.965 4.713 -0.748 1
1 323 . 3 1 1 A 32 32 ARG C C 32 174.785 174.779 0.006 1
1 324 . 3 1 1 A 32 32 ARG CA C 32 56.924 56.128 0.796 1
1 325 . 3 1 1 A 32 32 ARG CB C 32 31.806 31.008 0.798 1
1 328 . 3 1 1 A 32 32 ARG N N 32 127.041 127.890 -0.849 1
1 329 . 3 1 1 A 33 33 PHE H H 33 9.372 8.557 0.815 1
1 330 . 3 1 1 A 33 33 PHE HA H 33 4.863 4.961 -0.098 1
1 338 . 3 1 1 A 33 33 PHE C C 33 176.359 175.249 1.110 1
1 339 . 3 1 1 A 33 33 PHE CA C 33 57.224 56.653 0.571 1
1 340 . 3 1 1 A 33 33 PHE CB C 33 43.385 42.566 0.819 1
1 346 . 3 1 1 A 33 33 PHE N N 33 125.882 124.642 1.240 1
1 347 . 3 1 1 A 34 34 GLY H H 34 9.160 8.918 0.242 1
1 348 . 3 1 1 A 34 34 GLY HA2 H 34 4.182 4.156 0.026 1
1 349 . 3 1 1 A 34 34 GLY HA3 H 34 3.714 4.292 -0.578 1
1 350 . 3 1 1 A 34 34 GLY C C 34 172.920 173.286 -0.366 1
1 351 . 3 1 1 A 34 34 GLY CA C 34 46.247 46.156 0.091 1
1 352 . 3 1 1 A 34 34 GLY N N 34 108.654 111.294 -2.640 1
1 353 . 3 1 1 A 35 35 ALA H H 35 8.982 8.588 0.394 1
1 354 . 3 1 1 A 35 35 ALA HA H 35 5.660 5.622 0.038 1
1 358 . 3 1 1 A 35 35 ALA C C 35 176.547 176.435 0.112 1
1 359 . 3 1 1 A 35 35 ALA CA C 35 50.500 50.907 -0.407 1
1 360 . 3 1 1 A 35 35 ALA CB C 35 24.034 21.573 2.461 1
1 361 . 3 1 1 A 35 35 ALA N N 35 130.076 127.991 2.085 1
1 362 . 3 1 1 A 36 36 SER H H 36 8.852 8.521 0.331 1
1 363 . 3 1 1 A 36 36 SER HA H 36 5.203 5.092 0.111 1
1 366 . 3 1 1 A 36 36 SER C C 36 170.939 172.473 -1.534 1
1 367 . 3 1 1 A 36 36 SER CA C 36 57.806 57.626 0.180 1
1 368 . 3 1 1 A 36 36 SER CB C 36 66.986 65.829 1.157 1
1 369 . 3 1 1 A 36 36 SER N N 36 116.620 116.573 0.047 1
1 370 . 3 1 1 A 37 37 LEU H H 37 8.862 8.591 0.271 1
1 371 . 3 1 1 A 37 37 LEU HA H 37 5.163 4.935 0.228 1
1 381 . 3 1 1 A 37 37 LEU C C 37 173.525 174.300 -0.775 1
1 382 . 3 1 1 A 37 37 LEU CA C 37 53.112 53.624 -0.512 1
1 383 . 3 1 1 A 37 37 LEU CB C 37 46.077 43.397 2.680 1
1 387 . 3 1 1 A 37 37 LEU N N 37 127.638 129.186 -1.548 1
1 388 . 3 1 1 A 38 38 TYR H H 38 9.280 8.874 0.406 1
1 389 . 3 1 1 A 38 38 TYR HA H 38 4.820 5.329 -0.509 1
1 396 . 3 1 1 A 38 38 TYR C C 38 175.430 175.218 0.212 1
1 397 . 3 1 1 A 38 38 TYR CA C 38 57.436 56.009 1.427 1
1 398 . 3 1 1 A 38 38 TYR CB C 38 42.128 41.406 0.722 1
1 403 . 3 1 1 A 38 38 TYR N N 38 125.215 126.958 -1.743 1
1 404 . 3 1 1 A 39 39 GLY H H 39 8.532 8.455 0.077 1
1 405 . 3 1 1 A 39 39 GLY HA2 H 39 4.220 4.209 0.011 1
1 406 . 3 1 1 A 39 39 GLY HA3 H 39 3.941 4.218 -0.277 1
1 407 . 3 1 1 A 39 39 GLY C C 39 172.950 171.597 1.353 1
1 408 . 3 1 1 A 39 39 GLY CA C 39 44.817 45.003 -0.186 1
1 409 . 3 1 1 A 39 39 GLY N N 39 106.424 109.376 -2.952 1
1 410 . 3 1 1 A 40 40 GLY H H 40 8.477 8.299 0.178 1
1 411 . 3 1 1 A 40 40 GLY HA2 H 40 4.102 4.281 -0.179 1
1 412 . 3 1 1 A 40 40 GLY HA3 H 40 3.927 4.287 -0.360 1
1 413 . 3 1 1 A 40 40 GLY C C 40 174.002 173.440 0.562 1
1 414 . 3 1 1 A 40 40 GLY CA C 40 44.694 46.012 -1.318 1
1 415 . 3 1 1 A 40 40 GLY N N 40 106.881 109.830 -2.949 1
1 416 . 3 1 1 A 41 41 SER H H 41 8.600 8.359 0.241 1
1 417 . 3 1 1 A 41 41 SER HA H 41 4.520 4.674 -0.154 1
1 420 . 3 1 1 A 41 41 SER C C 41 174.355 174.871 -0.516 1
1 421 . 3 1 1 A 41 41 SER CA C 41 58.565 59.438 -0.873 1
1 422 . 3 1 1 A 41 41 SER CB C 41 64.413 65.433 -1.020 1
1 423 . 3 1 1 A 41 41 SER N N 41 115.751 118.912 -3.161 1
1 424 . 3 1 1 A 42 42 ASP H H 42 8.533 8.033 0.500 1
1 425 . 3 1 1 A 42 42 ASP HA H 42 4.560 4.552 0.008 1
1 428 . 3 1 1 A 42 42 ASP CA C 42 55.230 53.307 1.923 1
1 429 . 3 1 1 A 42 42 ASP CB C 42 40.648 39.658 0.990 1
1 430 . 3 1 1 A 42 42 ASP N N 42 119.037 116.815 2.222 1
1 431 . 3 1 1 A 43 43 CYS H H 43 8.152 8.105 0.047 1
1 432 . 3 1 1 A 43 43 CYS HA H 43 4.541 4.025 0.516 1
1 435 . 3 1 1 A 43 43 CYS C C 43 173.975 174.511 -0.536 1
1 436 . 3 1 1 A 43 43 CYS CA C 43 58.265 60.310 -2.045 1
1 437 . 3 1 1 A 43 43 CYS CB C 43 28.393 26.386 2.007 1
1 438 . 3 1 1 A 43 43 CYS N N 43 116.881 113.283 3.598 1
1 439 . 3 1 1 A 44 44 ALA H H 44 8.047 7.868 0.179 1
1 440 . 3 1 1 A 44 44 ALA HA H 44 4.395 4.492 -0.097 1
1 444 . 3 1 1 A 44 44 ALA C C 44 176.472 176.930 -0.458 1
1 445 . 3 1 1 A 44 44 ALA CA C 44 52.688 51.734 0.954 1
1 446 . 3 1 1 A 44 44 ALA CB C 44 20.579 20.876 -0.297 1
1 447 . 3 1 1 A 44 44 ALA N N 44 125.989 120.187 5.802 1
1 448 . 3 1 1 A 45 45 LEU H H 45 8.052 8.564 -0.512 1
1 449 . 3 1 1 A 45 45 LEU HA H 45 4.452 4.347 0.105 1
1 459 . 3 1 1 A 45 45 LEU C C 45 176.196 175.825 0.371 1
1 460 . 3 1 1 A 45 45 LEU CA C 45 53.771 54.322 -0.551 1
1 461 . 3 1 1 A 45 45 LEU CB C 45 43.116 40.663 2.453 1
1 465 . 3 1 1 A 45 45 LEU N N 45 119.889 121.326 -1.437 1
1 466 . 3 1 1 A 46 46 ALA H H 46 8.381 8.339 0.042 1
1 467 . 3 1 1 A 46 46 ALA HA H 46 4.449 5.696 -1.247 1
1 471 . 3 1 1 A 46 46 ALA C C 46 179.093 176.505 2.588 1
1 472 . 3 1 1 A 46 46 ALA CA C 46 52.829 50.569 2.260 1
1 473 . 3 1 1 A 46 46 ALA CB C 46 18.687 21.014 -2.327 1
1 474 . 3 1 1 A 46 46 ALA N N 46 125.635 128.798 -3.163 1
1 475 . 3 1 1 A 47 47 ARG H H 47 9.012 8.463 0.549 1
1 476 . 3 1 1 A 47 47 ARG HA H 47 5.192 5.104 0.088 1
1 484 . 3 1 1 A 47 47 ARG C C 47 171.524 173.866 -2.342 1
1 485 . 3 1 1 A 47 47 ARG CA C 47 55.265 54.981 0.284 1
1 486 . 3 1 1 A 47 47 ARG CB C 47 30.970 33.312 -2.342 1
1 489 . 3 1 1 A 47 47 ARG N N 47 120.048 119.850 0.198 1
1 491 . 3 1 1 A 48 48 LEU H H 48 9.029 8.694 0.335 1
1 492 . 3 1 1 A 48 48 LEU HA H 48 5.221 5.217 0.004 1
1 502 . 3 1 1 A 48 48 LEU C C 48 174.348 175.048 -0.700 1
1 503 . 3 1 1 A 48 48 LEU CA C 48 53.253 53.914 -0.661 1
1 504 . 3 1 1 A 48 48 LEU CB C 48 45.419 44.191 1.228 1
1 508 . 3 1 1 A 48 48 LEU N N 48 123.315 122.673 0.642 1
1 509 . 3 1 1 A 49 49 GLU H H 49 9.473 8.918 0.555 1
1 510 . 3 1 1 A 49 49 GLU HA H 49 5.222 4.772 0.450 1
1 515 . 3 1 1 A 49 49 GLU C C 49 175.507 175.677 -0.170 1
1 516 . 3 1 1 A 49 49 GLU CA C 49 55.159 55.982 -0.823 1
1 517 . 3 1 1 A 49 49 GLU CB C 49 32.341 30.872 1.469 1
1 519 . 3 1 1 A 49 49 GLU N N 49 124.751 126.926 -2.175 1
1 520 . 3 1 1 A 50 50 LEU H H 50 9.088 8.934 0.154 1
1 521 . 3 1 1 A 50 50 LEU HA H 50 5.382 5.318 0.064 1
1 531 . 3 1 1 A 50 50 LEU C C 50 175.474 175.292 0.182 1
1 532 . 3 1 1 A 50 50 LEU CA C 50 52.865 53.433 -0.568 1
1 533 . 3 1 1 A 50 50 LEU CB C 50 43.239 45.981 -2.742 1
1 537 . 3 1 1 A 50 50 LEU N N 50 124.221 126.008 -1.787 1
1 538 . 3 1 1 A 51 51 GLN H H 51 9.602 8.852 0.750 1
1 539 . 3 1 1 A 51 51 GLN HA H 51 5.095 4.997 0.098 1
1 546 . 3 1 1 A 51 51 GLN C C 51 175.306 174.993 0.313 1
1 547 . 3 1 1 A 51 51 GLN CA C 51 54.576 54.087 0.489 1
1 548 . 3 1 1 A 51 51 GLN CB C 51 32.177 32.572 -0.395 1
1 550 . 3 1 1 A 51 51 GLN N N 51 123.268 120.427 2.841 1
1 552 . 3 1 1 A 52 52 GLU H H 52 9.172 8.830 0.342 1
1 553 . 3 1 1 A 52 52 GLU HA H 52 4.092 4.443 -0.351 1
1 558 . 3 1 1 A 52 52 GLU C C 52 176.523 177.265 -0.742 1
1 559 . 3 1 1 A 52 52 GLU CA C 52 57.500 57.844 -0.344 1
1 560 . 3 1 1 A 52 52 GLU CB C 52 30.696 29.966 0.730 1
1 562 . 3 1 1 A 52 52 GLU N N 52 128.982 121.776 7.206 1
1 563 . 3 1 1 A 53 53 GLY H H 53 8.644 8.144 0.500 1
1 564 . 3 1 1 A 53 53 GLY HA2 H 53 4.261 3.911 0.350 1
1 565 . 3 1 1 A 53 53 GLY HA3 H 53 3.993 3.929 0.064 1
1 566 . 3 1 1 A 53 53 GLY C C 53 172.550 175.577 -3.027 1
1 567 . 3 1 1 A 53 53 GLY CA C 53 45.911 47.108 -1.197 1
1 568 . 3 1 1 A 53 53 GLY N N 53 110.844 108.607 2.237 1
1 569 . 3 1 1 A 54 54 PRO HA H 54 4.392 4.537 -0.145 1
1 576 . 3 1 1 A 54 54 PRO C C 54 176.828 175.889 0.939 1
1 577 . 3 1 1 A 54 54 PRO CA C 54 63.665 64.279 -0.614 1
1 578 . 3 1 1 A 54 54 PRO CB C 54 32.012 31.643 0.369 1
1 581 . 3 1 1 A 55 55 GLU H H 55 8.934 7.627 1.307 1
1 582 . 3 1 1 A 55 55 GLU HA H 55 4.193 4.720 -0.527 1
1 587 . 3 1 1 A 55 55 GLU C C 55 176.189 174.690 1.499 1
1 588 . 3 1 1 A 55 55 GLU CA C 55 57.383 54.956 2.427 1
1 589 . 3 1 1 A 55 55 GLU CB C 55 28.945 33.377 -4.432 1
1 591 . 3 1 1 A 55 55 GLU N N 55 120.312 117.199 3.113 1
1 592 . 3 1 1 A 56 56 LYS H H 56 7.937 8.281 -0.344 1
1 593 . 3 1 1 A 56 56 LYS HA H 56 4.578 4.274 0.304 1
1 602 . 3 1 1 A 56 56 LYS C C 56 174.295 177.031 -2.736 1
1 603 . 3 1 1 A 56 56 LYS CA C 56 54.171 55.542 -1.371 1
1 604 . 3 1 1 A 56 56 LYS CB C 56 32.555 32.556 -0.001 1
1 608 . 3 1 1 A 56 56 LYS N N 56 122.008 122.413 -0.405 1
1 609 . 3 1 1 A 57 57 PRO HA H 57 4.370 4.503 -0.133 1
1 616 . 3 1 1 A 57 57 PRO CA C 57 63.431 64.471 -1.040 1
1 617 . 3 1 1 A 57 57 PRO CB C 57 32.072 31.974 0.098 1
1 620 . 3 1 1 A 58 58 ARG H H 58 8.310 8.249 0.061 1
1 621 . 3 1 1 A 58 58 ARG HA H 58 4.295 4.000 0.295 1
1 628 . 3 1 1 A 58 58 ARG CA C 58 56.570 59.322 -2.752 1
1 629 . 3 1 1 A 58 58 ARG CB C 58 30.860 30.009 0.851 1
1 632 . 3 1 1 A 58 58 ARG N N 58 120.045 118.185 1.860 1
1 633 . 3 1 1 A 60 60 CYS HA H 60 4.482 4.961 -0.479 1
1 636 . 3 1 1 A 60 60 CYS CA C 60 58.621 57.786 0.835 1
1 637 . 3 1 1 A 60 60 CYS CB C 60 28.267 31.406 -3.139 1
1 638 . 3 1 1 A 61 61 GLU HA H 61 4.226 3.825 0.401 1
1 643 . 3 1 1 A 61 61 GLU C C 61 176.299 175.445 0.854 1
1 644 . 3 1 1 A 61 61 GLU CA C 61 57.100 57.229 -0.129 1
1 645 . 3 1 1 A 61 61 GLU CB C 61 29.873 27.748 2.125 1
1 647 . 3 1 1 A 62 62 ALA H H 62 8.282 7.700 0.582 1
1 648 . 3 1 1 A 62 62 ALA HA H 62 4.302 4.373 -0.071 1
1 652 . 3 1 1 A 62 62 ALA C C 62 177.277 177.123 0.154 1
1 653 . 3 1 1 A 62 62 ALA CA C 62 52.512 52.084 0.428 1
1 654 . 3 1 1 A 62 62 ALA CB C 62 19.592 19.628 -0.036 1
1 655 . 3 1 1 A 62 62 ALA N N 62 124.386 120.410 3.976 1
1 656 . 3 1 1 A 63 63 ALA H H 63 8.399 8.207 0.192 1
1 657 . 3 1 1 A 63 63 ALA HA H 63 4.375 4.255 0.120 1
1 661 . 3 1 1 A 63 63 ALA C C 63 176.843 177.819 -0.976 1
1 662 . 3 1 1 A 63 63 ALA CA C 63 52.658 53.132 -0.474 1
1 663 . 3 1 1 A 63 63 ALA CB C 63 19.592 19.170 0.422 1
1 664 . 3 1 1 A 63 63 ALA N N 63 123.892 124.446 -0.554 1
1 665 . 3 1 1 A 64 64 ARG H H 64 8.152 8.718 -0.566 1
1 666 . 3 1 1 A 64 64 ARG HA H 64 5.008 5.078 -0.070 1
1 673 . 3 1 1 A 64 64 ARG C C 64 175.594 174.398 1.196 1
1 674 . 3 1 1 A 64 64 ARG CA C 64 55.282 54.311 0.971 1
1 675 . 3 1 1 A 64 64 ARG CB C 64 32.506 33.885 -1.379 1
1 678 . 3 1 1 A 64 64 ARG N N 64 119.787 120.963 -1.176 1
1 679 . 3 1 1 A 65 65 LYS H H 65 8.945 8.634 0.311 1
1 680 . 3 1 1 A 65 65 LYS HA H 65 4.602 4.963 -0.361 1
1 689 . 3 1 1 A 65 65 LYS C C 65 174.657 174.278 0.379 1
1 690 . 3 1 1 A 65 65 LYS CA C 65 54.948 54.718 0.230 1
1 691 . 3 1 1 A 65 65 LYS CB C 65 34.068 34.171 -0.103 1
1 695 . 3 1 1 A 65 65 LYS N N 65 124.171 124.184 -0.013 1
1 696 . 3 1 1 A 66 66 VAL H H 66 8.672 9.001 -0.329 1
1 697 . 3 1 1 A 66 66 VAL HA H 66 4.532 5.257 -0.725 1
1 705 . 3 1 1 A 66 66 VAL C C 66 175.078 174.043 1.035 1
1 706 . 3 1 1 A 66 66 VAL CA C 66 61.865 59.531 2.334 1
1 707 . 3 1 1 A 66 66 VAL CB C 66 33.835 34.874 -1.039 1
1 710 . 3 1 1 A 66 66 VAL N N 66 124.380 126.641 -2.261 1
1 711 . 3 1 1 A 67 67 ILE H H 67 9.071 9.389 -0.318 1
1 712 . 3 1 1 A 67 67 ILE HA H 67 4.142 4.701 -0.559 1
1 722 . 3 1 1 A 67 67 ILE C C 67 175.819 175.663 0.156 1
1 723 . 3 1 1 A 67 67 ILE CA C 67 60.383 60.555 -0.172 1
1 724 . 3 1 1 A 67 67 ILE CB C 67 39.908 39.478 0.430 1
1 728 . 3 1 1 A 67 67 ILE N N 67 129.537 128.063 1.474 1
1 729 . 3 1 1 A 68 68 ARG H H 68 9.203 8.556 0.647 1
1 730 . 3 1 1 A 68 68 ARG HA H 68 4.198 4.276 -0.078 1
1 737 . 3 1 1 A 68 68 ARG C C 68 177.769 177.025 0.744 1
1 738 . 3 1 1 A 68 68 ARG CA C 68 56.835 57.015 -0.180 1
1 739 . 3 1 1 A 68 68 ARG CB C 68 29.832 30.493 -0.661 1
1 742 . 3 1 1 A 68 68 ARG N N 68 128.484 127.683 0.801 1
1 743 . 3 1 1 A 69 69 LEU H H 69 8.212 8.645 -0.433 1
1 744 . 3 1 1 A 69 69 LEU HA H 69 4.221 4.014 0.207 1
1 754 . 3 1 1 A 69 69 LEU C C 69 178.996 178.439 0.557 1
1 755 . 3 1 1 A 69 69 LEU CA C 69 57.136 57.879 -0.743 1
1 756 . 3 1 1 A 69 69 LEU CB C 69 39.455 41.706 -2.251 1
1 760 . 3 1 1 A 69 69 LEU N N 69 123.807 123.787 0.020 1
1 761 . 3 1 1 A 70 70 SER H H 70 8.823 7.988 0.835 1
1 762 . 3 1 1 A 70 70 SER HA H 70 4.331 4.146 0.185 1
1 765 . 3 1 1 A 70 70 SER C C 70 175.076 175.787 -0.711 1
1 766 . 3 1 1 A 70 70 SER CA C 70 60.329 61.929 -1.600 1
1 767 . 3 1 1 A 70 70 SER CB C 70 62.362 62.931 -0.569 1
1 768 . 3 1 1 A 70 70 SER N N 70 115.162 114.072 1.090 1
1 769 . 3 1 1 A 71 71 ASP H H 71 7.602 7.774 -0.172 1
1 770 . 3 1 1 A 71 71 ASP HA H 71 4.820 4.474 0.346 1
1 773 . 3 1 1 A 71 71 ASP C C 71 176.478 177.136 -0.658 1
1 774 . 3 1 1 A 71 71 ASP CA C 71 54.241 56.584 -2.343 1
1 775 . 3 1 1 A 71 71 ASP CB C 71 41.347 40.719 0.628 1
1 776 . 3 1 1 A 71 71 ASP N N 71 119.590 118.742 0.848 1
1 777 . 3 1 1 A 72 72 CYS H H 72 7.715 7.912 -0.197 1
1 778 . 3 1 1 A 72 72 CYS HA H 72 4.372 4.615 -0.243 1
1 781 . 3 1 1 A 72 72 CYS C C 72 173.690 174.578 -0.888 1
1 782 . 3 1 1 A 72 72 CYS CA C 72 60.836 59.640 1.196 1
1 783 . 3 1 1 A 72 72 CYS CB C 72 27.655 27.551 0.104 1
1 784 . 3 1 1 A 72 72 CYS N N 72 118.346 118.185 0.161 1
1 785 . 3 1 1 A 73 73 LEU H H 73 9.472 9.001 0.471 1
1 786 . 3 1 1 A 73 73 LEU HA H 73 4.593 4.083 0.510 1
1 796 . 3 1 1 A 73 73 LEU C C 73 177.562 176.773 0.789 1
1 797 . 3 1 1 A 73 73 LEU CA C 73 55.724 56.863 -1.139 1
1 798 . 3 1 1 A 73 73 LEU CB C 73 43.774 42.244 1.530 1
1 802 . 3 1 1 A 73 73 LEU N N 73 124.752 128.891 -4.139 1
1 803 . 3 1 1 A 74 74 ARG H H 74 7.658 7.289 0.369 1
1 804 . 3 1 1 A 74 74 ARG HA H 74 4.592 5.067 -0.475 1
1 811 . 3 1 1 A 74 74 ARG C C 74 173.605 174.344 -0.739 1
1 812 . 3 1 1 A 74 74 ARG CA C 74 56.465 55.899 0.566 1
1 813 . 3 1 1 A 74 74 ARG CB C 74 34.068 33.823 0.245 1
1 816 . 3 1 1 A 74 74 ARG N N 74 115.565 115.655 -0.090 1
1 817 . 3 1 1 A 75 75 VAL H H 75 8.622 8.821 -0.199 1
1 818 . 3 1 1 A 75 75 VAL HA H 75 5.170 5.301 -0.131 1
1 826 . 3 1 1 A 75 75 VAL C C 75 173.985 174.255 -0.270 1
1 827 . 3 1 1 A 75 75 VAL CA C 75 60.930 59.257 1.673 1
1 828 . 3 1 1 A 75 75 VAL CB C 75 35.073 36.584 -1.511 1
1 831 . 3 1 1 A 75 75 VAL N N 75 124.278 118.913 5.365 1
1 832 . 3 1 1 A 76 76 ALA H H 76 8.272 8.557 -0.285 1
1 833 . 3 1 1 A 76 76 ALA HA H 76 4.648 4.922 -0.274 1
1 837 . 3 1 1 A 76 76 ALA C C 76 175.630 175.508 0.122 1
1 838 . 3 1 1 A 76 76 ALA CA C 76 51.294 51.355 -0.061 1
1 839 . 3 1 1 A 76 76 ALA CB C 76 22.759 23.620 -0.861 1
1 840 . 3 1 1 A 76 76 ALA N N 76 126.015 123.260 2.755 1
1 841 . 3 1 1 A 77 77 GLU H H 77 9.184 8.593 0.591 1
1 842 . 3 1 1 A 77 77 GLU HA H 77 4.060 5.242 -1.182 1
1 847 . 3 1 1 A 77 77 GLU C C 77 174.949 176.164 -1.215 1
1 848 . 3 1 1 A 77 77 GLU CA C 77 58.424 54.908 3.516 1
1 849 . 3 1 1 A 77 77 GLU CB C 77 30.161 32.942 -2.781 1
1 851 . 3 1 1 A 77 77 GLU N N 77 120.223 118.271 1.952 1
1 852 . 3 1 1 A 78 78 ALA H H 78 7.985 9.385 -1.400 1
1 853 . 3 1 1 A 78 78 ALA HA H 78 4.776 5.315 -0.539 1
1 857 . 3 1 1 A 78 78 ALA C C 78 177.250 176.539 0.711 1
1 858 . 3 1 1 A 78 78 ALA CA C 78 50.888 51.012 -0.124 1
1 859 . 3 1 1 A 78 78 ALA CB C 78 20.851 23.808 -2.957 1
1 860 . 3 1 1 A 78 78 ALA N N 78 125.143 124.593 0.550 1
1 861 . 3 1 1 A 79 79 GLY H H 79 8.604 8.508 0.096 1
1 862 . 3 1 1 A 79 79 GLY HA2 H 79 4.327 4.259 0.068 1
1 863 . 3 1 1 A 79 79 GLY HA3 H 79 3.963 4.276 -0.313 1
1 864 . 3 1 1 A 79 79 GLY C C 79 175.360 174.372 0.988 1
1 865 . 3 1 1 A 79 79 GLY CA C 79 44.925 46.064 -1.139 1
1 866 . 3 1 1 A 79 79 GLY N N 79 109.420 105.484 3.936 1
1 867 . 3 1 1 A 80 80 GLY H H 80 8.649 8.760 -0.111 1
1 868 . 3 1 1 A 80 80 GLY HA2 H 80 3.962 3.901 0.061 1
1 869 . 3 1 1 A 80 80 GLY HA3 H 80 3.962 3.906 0.056 1
1 870 . 3 1 1 A 80 80 GLY C C 80 175.052 175.233 -0.181 1
1 871 . 3 1 1 A 80 80 GLY CA C 80 45.955 47.325 -1.370 1
1 872 . 3 1 1 A 80 80 GLY N N 80 108.295 108.864 -0.569 1
1 873 . 3 1 1 A 81 81 GLU H H 81 8.921 9.110 -0.189 1
1 874 . 3 1 1 A 81 81 GLU HA H 81 4.298 4.173 0.125 1
1 879 . 3 1 1 A 81 81 GLU C C 81 176.532 177.072 -0.540 1
1 880 . 3 1 1 A 81 81 GLU CA C 81 57.118 58.977 -1.859 1
1 881 . 3 1 1 A 81 81 GLU CB C 81 28.599 29.290 -0.691 1
1 883 . 3 1 1 A 81 81 GLU N N 81 121.170 122.814 -1.644 1
1 884 . 3 1 1 A 82 82 ALA H H 82 8.032 7.494 0.538 1
1 885 . 3 1 1 A 82 82 ALA HA H 82 4.371 4.384 -0.013 1
1 889 . 3 1 1 A 82 82 ALA C C 82 177.160 177.542 -0.382 1
1 890 . 3 1 1 A 82 82 ALA CA C 82 52.653 52.246 0.407 1
1 891 . 3 1 1 A 82 82 ALA CB C 82 19.304 20.297 -0.993 1
1 892 . 3 1 1 A 82 82 ALA N N 82 124.988 123.584 1.404 1
1 893 . 3 1 1 A 83 83 SER H H 83 8.319 8.901 -0.582 1
1 894 . 3 1 1 A 83 83 SER HA H 83 4.331 4.306 0.025 1
1 897 . 3 1 1 A 83 83 SER C C 83 174.045 174.637 -0.592 1
1 898 . 3 1 1 A 83 83 SER CA C 83 58.053 61.508 -3.455 1
1 899 . 3 1 1 A 83 83 SER CB C 83 63.184 62.716 0.468 1
1 900 . 3 1 1 A 83 83 SER N N 83 114.181 116.473 -2.292 1
1 901 . 3 1 1 A 84 84 SER H H 84 7.823 7.874 -0.051 1
1 902 . 3 1 1 A 84 84 SER HA H 84 3.194 4.314 -1.120 1
1 905 . 3 1 1 A 84 84 SER C C 84 171.072 174.012 -2.940 1
1 906 . 3 1 1 A 84 84 SER CA C 84 57.206 57.174 0.032 1
1 907 . 3 1 1 A 84 84 SER CB C 84 61.622 63.241 -1.619 1
1 908 . 3 1 1 A 84 84 SER N N 84 117.302 114.152 3.150 1
1 909 . 3 1 1 A 85 85 PRO HA H 85 3.922 4.521 -0.599 1
1 916 . 3 1 1 A 85 85 PRO CA C 85 62.691 62.659 0.032 1
1 917 . 3 1 1 A 85 85 PRO CB C 85 31.515 32.382 -0.867 1
1 920 . 3 1 1 A 86 86 ARG HA H 86 3.882 3.946 -0.064 1
1 927 . 3 1 1 A 86 86 ARG C C 86 175.712 177.473 -1.761 1
1 928 . 3 1 1 A 86 86 ARG CA C 86 57.877 58.715 -0.838 1
1 929 . 3 1 1 A 86 86 ARG CB C 86 29.791 29.736 0.055 1
1 932 . 3 1 1 A 87 87 ASP H H 87 8.903 7.666 1.237 1
1 933 . 3 1 1 A 87 87 ASP HA H 87 4.342 4.631 -0.289 1
1 936 . 3 1 1 A 87 87 ASP C C 87 175.723 175.789 -0.066 1
1 937 . 3 1 1 A 87 87 ASP CA C 87 56.377 54.613 1.764 1
1 938 . 3 1 1 A 87 87 ASP CB C 87 39.208 41.007 -1.799 1
1 939 . 3 1 1 A 87 87 ASP N N 87 117.520 119.550 -2.030 1
1 940 . 3 1 1 A 88 88 THR H H 88 7.776 7.462 0.314 1
1 941 . 3 1 1 A 88 88 THR HA H 88 5.101 5.084 0.017 1
1 946 . 3 1 1 A 88 88 THR C C 88 173.825 172.487 1.338 1
1 947 . 3 1 1 A 88 88 THR CA C 88 60.154 60.489 -0.335 1
1 948 . 3 1 1 A 88 88 THR CB C 88 72.702 72.470 0.232 1
1 950 . 3 1 1 A 88 88 THR N N 88 108.770 111.736 -2.966 1
1 951 . 3 1 1 A 89 89 SER H H 89 9.006 8.966 0.040 1
1 952 . 3 1 1 A 89 89 SER HA H 89 4.718 5.310 -0.592 1
1 955 . 3 1 1 A 89 89 SER C C 89 173.728 173.185 0.543 1
1 956 . 3 1 1 A 89 89 SER CA C 89 57.453 56.593 0.860 1
1 957 . 3 1 1 A 89 89 SER CB C 89 65.611 65.269 0.342 1
1 958 . 3 1 1 A 89 89 SER N N 89 114.151 116.757 -2.606 1
1 959 . 3 1 1 A 90 90 ALA H H 90 9.001 8.757 0.244 1
1 960 . 3 1 1 A 90 90 ALA HA H 90 5.660 5.250 0.410 1
1 964 . 3 1 1 A 90 90 ALA C C 90 177.669 177.173 0.496 1
1 965 . 3 1 1 A 90 90 ALA CA C 90 51.670 50.550 1.120 1
1 966 . 3 1 1 A 90 90 ALA CB C 90 22.265 21.482 0.783 1
1 967 . 3 1 1 A 90 90 ALA N N 90 126.177 127.062 -0.885 1
1 968 . 3 1 1 A 91 91 PHE H H 91 9.672 8.335 1.337 1
1 969 . 3 1 1 A 91 91 PHE HA H 91 5.039 5.702 -0.663 1
1 977 . 3 1 1 A 91 91 PHE C C 91 170.731 173.812 -3.081 1
1 978 . 3 1 1 A 91 91 PHE CA C 91 56.271 55.029 1.242 1
1 979 . 3 1 1 A 91 91 PHE CB C 91 41.553 42.470 -0.917 1
1 985 . 3 1 1 A 91 91 PHE N N 91 118.968 116.733 2.235 1
1 986 . 3 1 1 A 92 92 PHE H H 92 9.422 9.672 -0.250 1
1 987 . 3 1 1 A 92 92 PHE HA H 92 5.674 5.042 0.632 1
1 995 . 3 1 1 A 92 92 PHE C C 92 174.570 175.309 -0.739 1
1 996 . 3 1 1 A 92 92 PHE CA C 92 55.917 57.615 -1.698 1
1 997 . 3 1 1 A 92 92 PHE CB C 92 42.787 41.216 1.571 1
1 1003 . 3 1 1 A 92 92 PHE N N 92 117.543 118.551 -1.008 1
1 1004 . 3 1 1 A 93 93 LEU H H 93 9.021 8.870 0.151 1
1 1005 . 3 1 1 A 93 93 LEU HA H 93 5.122 5.054 0.068 1
1 1015 . 3 1 1 A 93 93 LEU C C 93 174.799 174.220 0.579 1
1 1016 . 3 1 1 A 93 93 LEU CA C 93 54.912 54.670 0.242 1
1 1017 . 3 1 1 A 93 93 LEU CB C 93 45.254 44.773 0.481 1
1 1021 . 3 1 1 A 93 93 LEU N N 93 121.719 121.806 -0.087 1
1 1022 . 3 1 1 A 94 94 GLU H H 94 9.294 9.677 -0.383 1
1 1023 . 3 1 1 A 94 94 GLU HA H 94 5.043 5.209 -0.166 1
1 1028 . 3 1 1 A 94 94 GLU C C 94 175.754 175.575 0.179 1
1 1029 . 3 1 1 A 94 94 GLU CA C 94 56.018 54.992 1.026 1
1 1030 . 3 1 1 A 94 94 GLU CB C 94 32.752 32.367 0.385 1
1 1032 . 3 1 1 A 94 94 GLU N N 94 127.032 128.718 -1.686 1
1 1033 . 3 1 1 A 95 95 THR H H 95 8.822 8.589 0.233 1
1 1034 . 3 1 1 A 95 95 THR HA H 95 5.398 5.072 0.326 1
1 1039 . 3 1 1 A 95 95 THR C C 95 173.860 175.343 -1.483 1
1 1040 . 3 1 1 A 95 95 THR CA C 95 59.588 59.634 -0.046 1
1 1041 . 3 1 1 A 95 95 THR CB C 95 72.191 72.265 -0.074 1
1 1043 . 3 1 1 A 95 95 THR N N 95 118.685 117.685 1.000 1
1 1044 . 3 1 1 A 96 96 LYS H H 96 8.823 9.080 -0.257 1
1 1045 . 3 1 1 A 96 96 LYS HA H 96 4.022 3.951 0.071 1
1 1054 . 3 1 1 A 96 96 LYS C C 96 177.330 178.838 -1.508 1
1 1055 . 3 1 1 A 96 96 LYS CA C 96 59.588 59.876 -0.288 1
1 1056 . 3 1 1 A 96 96 LYS CB C 96 32.588 32.038 0.550 1
1 1060 . 3 1 1 A 96 96 LYS N N 96 118.801 122.391 -3.590 1
1 1061 . 3 1 1 A 97 97 GLU H H 97 8.092 7.788 0.304 1
1 1062 . 3 1 1 A 97 97 GLU HA H 97 4.282 4.236 0.046 1
1 1067 . 3 1 1 A 97 97 GLU C C 97 176.290 176.129 0.161 1
1 1068 . 3 1 1 A 97 97 GLU CA C 97 57.365 58.641 -1.276 1
1 1069 . 3 1 1 A 97 97 GLU CB C 97 31.559 30.868 0.691 1
1 1071 . 3 1 1 A 97 97 GLU N N 97 113.992 118.916 -4.924 1
1 1072 . 3 1 1 A 98 98 ARG H H 98 7.482 7.240 0.242 1
1 1073 . 3 1 1 A 98 98 ARG HA H 98 4.397 4.553 -0.156 1
1 1080 . 3 1 1 A 98 98 ARG C C 98 172.792 173.087 -0.295 1
1 1081 . 3 1 1 A 98 98 ARG CA C 98 55.689 54.734 0.955 1
1 1082 . 3 1 1 A 98 98 ARG CB C 98 32.711 31.435 1.276 1
1 1085 . 3 1 1 A 98 98 ARG N N 98 116.022 114.647 1.375 1
1 1086 . 3 1 1 A 99 99 LEU H H 99 8.423 8.228 0.195 1
1 1087 . 3 1 1 A 99 99 LEU HA H 99 4.807 4.776 0.031 1
1 1097 . 3 1 1 A 99 99 LEU C C 99 175.903 174.053 1.850 1
1 1098 . 3 1 1 A 99 99 LEU CA C 99 54.383 53.764 0.619 1
1 1099 . 3 1 1 A 99 99 LEU CB C 99 43.362 44.480 -1.118 1
1 1103 . 3 1 1 A 99 99 LEU N N 99 124.983 121.578 3.405 1
1 1104 . 3 1 1 A 100 100 TYR H H 100 9.144 9.699 -0.555 1
1 1105 . 3 1 1 A 100 100 TYR HA H 100 4.542 5.249 -0.707 1
1 1112 . 3 1 1 A 100 100 TYR C C 100 173.479 174.162 -0.683 1
1 1113 . 3 1 1 A 100 100 TYR CA C 100 57.735 56.188 1.547 1
1 1114 . 3 1 1 A 100 100 TYR CB C 100 39.291 41.957 -2.666 1
1 1119 . 3 1 1 A 100 100 TYR N N 100 126.679 125.830 0.849 1
1 1120 . 3 1 1 A 101 101 LEU H H 101 9.043 8.828 0.215 1
1 1121 . 3 1 1 A 101 101 LEU HA H 101 4.747 4.962 -0.215 1
1 1131 . 3 1 1 A 101 101 LEU C C 101 173.530 174.980 -1.450 1
1 1132 . 3 1 1 A 101 101 LEU CA C 101 54.524 53.579 0.945 1
1 1133 . 3 1 1 A 101 101 LEU CB C 101 42.499 44.019 -1.520 1
1 1137 . 3 1 1 A 101 101 LEU N N 101 127.422 125.228 2.194 1
1 1138 . 3 1 1 A 102 102 LEU H H 102 8.493 8.639 -0.146 1
1 1139 . 3 1 1 A 102 102 LEU HA H 102 5.612 5.565 0.047 1
1 1149 . 3 1 1 A 102 102 LEU C C 102 175.794 175.807 -0.013 1
1 1150 . 3 1 1 A 102 102 LEU CA C 102 53.076 53.230 -0.154 1
1 1151 . 3 1 1 A 102 102 LEU CB C 102 45.994 44.934 1.060 1
1 1155 . 3 1 1 A 102 102 LEU N N 102 126.021 129.366 -3.345 1
1 1156 . 3 1 1 A 103 103 ALA H H 103 9.073 8.992 0.081 1
1 1157 . 3 1 1 A 103 103 ALA HA H 103 5.081 5.267 -0.186 1
1 1161 . 3 1 1 A 103 103 ALA C C 103 175.133 175.795 -0.662 1
1 1162 . 3 1 1 A 103 103 ALA CA C 103 51.688 49.764 1.924 1
1 1163 . 3 1 1 A 103 103 ALA CB C 103 21.689 22.273 -0.584 1
1 1164 . 3 1 1 A 103 103 ALA N N 103 117.679 123.000 -5.321 1
1 1165 . 3 1 1 A 104 104 ALA H H 104 8.582 8.447 0.135 1
1 1166 . 3 1 1 A 104 104 ALA HA H 104 5.220 4.755 0.465 1
1 1170 . 3 1 1 A 104 104 ALA C C 104 173.471 174.109 -0.638 1
1 1171 . 3 1 1 A 104 104 ALA CA C 104 47.959 49.870 -1.911 1
1 1172 . 3 1 1 A 104 104 ALA CB C 104 21.359 22.282 -0.923 1
1 1173 . 3 1 1 A 104 104 ALA N N 104 123.419 121.211 2.208 1
1 1174 . 3 1 1 A 105 105 PRO HA H 105 4.542 4.740 -0.198 1
1 1181 . 3 1 1 A 105 105 PRO C C 105 178.409 177.890 0.519 1
1 1182 . 3 1 1 A 105 105 PRO CA C 105 64.301 62.854 1.447 1
1 1183 . 3 1 1 A 105 105 PRO CB C 105 32.094 31.609 0.485 1
1 1186 . 3 1 1 A 106 106 ALA H H 106 8.302 8.673 -0.371 1
1 1187 . 3 1 1 A 106 106 ALA HA H 106 4.022 4.029 -0.007 1
1 1191 . 3 1 1 A 106 106 ALA C C 106 179.641 179.702 -0.061 1
1 1192 . 3 1 1 A 106 106 ALA CA C 106 56.341 55.181 1.160 1
1 1193 . 3 1 1 A 106 106 ALA CB C 106 18.523 18.217 0.306 1
1 1194 . 3 1 1 A 106 106 ALA N N 106 127.733 128.228 -0.495 1
1 1195 . 3 1 1 A 107 107 ALA H H 107 9.035 8.104 0.931 1
1 1196 . 3 1 1 A 107 107 ALA HA H 107 4.331 4.021 0.310 1
1 1200 . 3 1 1 A 107 107 ALA C C 107 178.586 179.323 -0.737 1
1 1201 . 3 1 1 A 107 107 ALA CA C 107 53.765 55.286 -1.521 1
1 1202 . 3 1 1 A 107 107 ALA CB C 107 18.728 18.348 0.380 1
1 1203 . 3 1 1 A 107 107 ALA N N 107 118.203 120.205 -2.002 1
1 1204 . 3 1 1 A 108 108 GLU H H 108 8.399 8.176 0.223 1
1 1205 . 3 1 1 A 108 108 GLU HA H 108 4.631 4.135 0.496 1
1 1210 . 3 1 1 A 108 108 GLU C C 108 177.127 178.573 -1.446 1
1 1211 . 3 1 1 A 108 108 GLU CA C 108 55.847 58.031 -2.184 1
1 1212 . 3 1 1 A 108 108 GLU CB C 108 32.135 29.822 2.313 1
1 1214 . 3 1 1 A 108 108 GLU N N 108 114.661 118.111 -3.450 1
1 1215 . 3 1 1 A 109 109 ARG H H 109 7.412 8.600 -1.188 1
1 1216 . 3 1 1 A 109 109 ARG HA H 109 3.682 4.114 -0.432 1
1 1223 . 3 1 1 A 109 109 ARG C C 109 176.917 179.187 -2.270 1
1 1224 . 3 1 1 A 109 109 ARG CA C 109 61.600 59.803 1.797 1
1 1225 . 3 1 1 A 109 109 ARG CB C 109 28.845 30.440 -1.595 1
1 1228 . 3 1 1 A 109 109 ARG N N 109 120.954 120.955 -0.001 1
1 1229 . 3 1 1 A 110 110 GLY H H 110 8.833 8.455 0.378 1
1 1230 . 3 1 1 A 110 110 GLY HA2 H 110 3.872 3.821 0.051 1
1 1231 . 3 1 1 A 110 110 GLY HA3 H 110 3.685 3.832 -0.147 1
1 1232 . 3 1 1 A 110 110 GLY C C 110 175.997 175.944 0.053 1
1 1233 . 3 1 1 A 110 110 GLY CA C 110 47.323 47.372 -0.049 1
1 1234 . 3 1 1 A 110 110 GLY N N 110 106.563 107.265 -0.702 1
1 1235 . 3 1 1 A 111 111 ASP H H 111 7.882 8.237 -0.355 1
1 1236 . 3 1 1 A 111 111 ASP HA H 111 4.312 4.388 -0.076 1
1 1239 . 3 1 1 A 111 111 ASP C C 111 179.467 178.609 0.858 1
1 1240 . 3 1 1 A 111 111 ASP CA C 111 56.976 56.765 0.211 1
1 1241 . 3 1 1 A 111 111 ASP CB C 111 40.648 40.879 -0.231 1
1 1242 . 3 1 1 A 111 111 ASP N N 111 121.402 121.644 -0.242 1
1 1243 . 3 1 1 A 112 112 TRP H H 112 7.804 8.391 -0.587 1
1 1244 . 3 1 1 A 112 112 TRP HA H 112 3.831 4.210 -0.379 1
1 1253 . 3 1 1 A 112 112 TRP C C 112 177.547 178.560 -1.013 1
1 1254 . 3 1 1 A 112 112 TRP CA C 112 62.006 60.035 1.971 1
1 1255 . 3 1 1 A 112 112 TRP CB C 112 29.421 29.243 0.178 1
1 1261 . 3 1 1 A 112 112 TRP N N 112 119.904 120.069 -0.165 1
1 1263 . 3 1 1 A 113 113 VAL H H 113 7.982 8.004 -0.022 1
1 1264 . 3 1 1 A 113 113 VAL HA H 113 3.072 3.582 -0.510 1
1 1272 . 3 1 1 A 113 113 VAL C C 113 178.015 178.491 -0.476 1
1 1273 . 3 1 1 A 113 113 VAL CA C 113 67.407 66.830 0.577 1
1 1274 . 3 1 1 A 113 113 VAL CB C 113 31.724 31.495 0.229 1
1 1277 . 3 1 1 A 113 113 VAL N N 113 117.575 119.329 -1.754 1
1 1278 . 3 1 1 A 114 114 GLN H H 114 8.268 8.206 0.062 1
1 1279 . 3 1 1 A 114 114 GLN HA H 114 3.994 3.978 0.016 1
1 1286 . 3 1 1 A 114 114 GLN C C 114 178.021 177.827 0.194 1
1 1287 . 3 1 1 A 114 114 GLN CA C 114 59.112 59.018 0.094 1
1 1288 . 3 1 1 A 114 114 GLN CB C 114 28.685 28.765 -0.080 1
1 1290 . 3 1 1 A 114 114 GLN N N 114 117.479 119.930 -2.451 1
1 1292 . 3 1 1 A 115 115 ALA H H 115 7.915 8.474 -0.559 1
1 1293 . 3 1 1 A 115 115 ALA HA H 115 3.972 4.048 -0.076 1
1 1297 . 3 1 1 A 115 115 ALA C C 115 180.030 180.040 -0.010 1
1 1298 . 3 1 1 A 115 115 ALA CA C 115 55.142 55.109 0.033 1
1 1299 . 3 1 1 A 115 115 ALA CB C 115 18.152 18.487 -0.335 1
1 1300 . 3 1 1 A 115 115 ALA N N 115 120.858 120.466 0.392 1
1 1301 . 3 1 1 A 116 116 ILE H H 116 8.172 8.394 -0.222 1
1 1302 . 3 1 1 A 116 116 ILE HA H 116 3.482 3.804 -0.322 1
1 1312 . 3 1 1 A 116 116 ILE C C 116 177.739 177.949 -0.210 1
1 1313 . 3 1 1 A 116 116 ILE CA C 116 66.119 65.010 1.109 1
1 1314 . 3 1 1 A 116 116 ILE CB C 116 38.222 37.732 0.490 1
1 1318 . 3 1 1 A 116 116 ILE N N 116 115.977 117.304 -1.327 1
1 1319 . 3 1 1 A 117 117 CYS H H 117 8.449 8.325 0.124 1
1 1320 . 3 1 1 A 117 117 CYS HA H 117 4.032 4.480 -0.448 1
1 1323 . 3 1 1 A 117 117 CYS C C 117 177.321 177.378 -0.057 1
1 1324 . 3 1 1 A 117 117 CYS CA C 117 64.777 62.546 2.231 1
1 1325 . 3 1 1 A 117 117 CYS CB C 117 26.871 27.302 -0.431 1
1 1326 . 3 1 1 A 117 117 CYS N N 117 117.253 121.271 -4.018 1
1 1327 . 3 1 1 A 118 118 LEU H H 118 8.182 8.175 0.007 1
1 1328 . 3 1 1 A 118 118 LEU HA H 118 4.052 4.093 -0.041 1
1 1338 . 3 1 1 A 118 118 LEU C C 118 179.217 179.365 -0.148 1
1 1339 . 3 1 1 A 118 118 LEU CA C 118 57.877 57.559 0.318 1
1 1340 . 3 1 1 A 118 118 LEU CB C 118 42.088 41.777 0.311 1
1 1344 . 3 1 1 A 118 118 LEU N N 118 119.665 121.915 -2.250 1
1 1345 . 3 1 1 A 119 119 LEU H H 119 7.142 8.125 -0.983 1
1 1346 . 3 1 1 A 119 119 LEU HA H 119 4.192 3.972 0.220 1
1 1356 . 3 1 1 A 119 119 LEU C C 119 178.492 178.784 -0.292 1
1 1357 . 3 1 1 A 119 119 LEU CA C 119 56.259 58.008 -1.749 1
1 1358 . 3 1 1 A 119 119 LEU CB C 119 43.568 42.044 1.524 1
1 1362 . 3 1 1 A 119 119 LEU N N 119 116.244 119.159 -2.915 1
1 1363 . 3 1 1 A 120 120 ALA H H 120 8.513 8.387 0.126 1
1 1364 . 3 1 1 A 120 120 ALA HA H 120 3.878 3.997 -0.119 1
1 1368 . 3 1 1 A 120 120 ALA C C 120 178.358 178.688 -0.330 1
1 1369 . 3 1 1 A 120 120 ALA CA C 120 53.765 55.170 -1.405 1
1 1370 . 3 1 1 A 120 120 ALA CB C 120 18.687 18.895 -0.208 1
1 1371 . 3 1 1 A 120 120 ALA N N 120 120.009 120.725 -0.716 1
1 1372 . 3 1 1 A 121 121 PHE H H 121 7.822 7.962 -0.140 1
1 1373 . 3 1 1 A 121 121 PHE HA H 121 5.156 4.878 0.278 1
1 1381 . 3 1 1 A 121 121 PHE C C 121 176.273 175.343 0.930 1
1 1382 . 3 1 1 A 121 121 PHE CA C 121 55.741 56.773 -1.032 1
1 1383 . 3 1 1 A 121 121 PHE CB C 121 39.455 38.178 1.277 1
1 1389 . 3 1 1 A 121 121 PHE N N 121 113.981 113.963 0.018 1
1 1390 . 3 1 1 A 122 122 SER H H 122 7.765 8.023 -0.258 1
1 1391 . 3 1 1 A 122 122 SER HA H 122 4.579 4.690 -0.111 1
1 1394 . 3 1 1 A 122 122 SER C C 122 174.595 173.666 0.929 1
1 1395 . 3 1 1 A 122 122 SER CA C 122 58.777 57.734 1.043 1
1 1396 . 3 1 1 A 122 122 SER CB C 122 63.719 63.138 0.581 1
1 1397 . 3 1 1 A 122 122 SER N N 122 115.069 117.127 -2.058 1
1 1398 . 3 1 1 A 123 123 GLY H H 123 8.223 8.812 -0.589 1
1 1399 . 3 1 1 A 123 123 GLY HA2 H 123 4.174 4.288 -0.114 1
1 1400 . 3 1 1 A 123 123 GLY HA3 H 123 4.100 4.297 -0.197 1
1 1401 . 3 1 1 A 123 123 GLY C C 123 171.678 174.205 -2.527 1
1 1402 . 3 1 1 A 123 123 GLY CA C 123 44.815 43.939 0.876 1
1 1403 . 3 1 1 A 123 123 GLY N N 123 110.151 114.962 -4.811 1
1 1404 . 3 1 1 A 124 124 PRO HA H 124 4.482 4.561 -0.079 1
1 1411 . 3 1 1 A 124 124 PRO C C 124 177.314 176.780 0.534 1
1 1412 . 3 1 1 A 124 124 PRO CA C 124 63.206 63.461 -0.255 1
1 1413 . 3 1 1 A 124 124 PRO CB C 124 32.176 32.126 0.050 1
1 1416 . 3 1 1 A 125 125 SER H H 125 8.485 7.709 0.776 1
1 1417 . 3 1 1 A 125 125 SER HA H 125 4.472 4.426 0.046 1
1 1420 . 3 1 1 A 125 125 SER C C 125 174.728 174.557 0.171 1
1 1421 . 3 1 1 A 125 125 SER CA C 125 58.353 59.117 -0.764 1
1 1422 . 3 1 1 A 125 125 SER CB C 125 64.048 63.541 0.507 1
1 1423 . 3 1 1 A 125 125 SER N N 125 116.081 113.932 2.149 1
1 1424 . 3 1 1 A 126 126 SER H H 126 8.332 8.668 -0.336 1
1 1425 . 3 1 1 A 126 126 SER HA H 126 4.464 4.664 -0.200 1
1 1428 . 3 1 1 A 126 126 SER C C 126 173.980 174.513 -0.533 1
1 1429 . 3 1 1 A 126 126 SER CA C 126 58.336 58.760 -0.424 1
1 1430 . 3 1 1 A 126 126 SER CB C 126 63.925 63.764 0.161 1
1 1431 . 3 1 1 A 126 126 SER N N 126 118.037 121.698 -3.661 1
1 1 . 4 1 1 A 6 6 SER HA H 6 4.458 4.734 -0.276 1
1 3 . 4 1 1 A 6 6 SER C C 6 175.108 174.570 0.538 1
1 4 . 4 1 1 A 6 6 SER CA C 6 58.689 57.015 1.674 1
1 5 . 4 1 1 A 6 6 SER CB C 6 63.678 65.748 -2.070 1
1 6 . 4 1 1 A 7 7 GLY H H 7 8.449 8.285 0.164 1
1 7 . 4 1 1 A 7 7 GLY HA2 H 7 3.965 4.202 -0.237 1
1 8 . 4 1 1 A 7 7 GLY HA3 H 7 3.965 4.204 -0.239 1
1 9 . 4 1 1 A 7 7 GLY C C 7 174.380 172.920 1.460 1
1 10 . 4 1 1 A 7 7 GLY CA C 7 45.435 44.566 0.869 1
1 11 . 4 1 1 A 7 7 GLY N N 7 110.792 107.598 3.194 1
1 12 . 4 1 1 A 8 8 MET H H 8 8.259 8.625 -0.366 1
1 13 . 4 1 1 A 8 8 MET HA H 8 4.487 4.943 -0.456 1
1 21 . 4 1 1 A 8 8 MET C C 8 176.961 176.075 0.886 1
1 22 . 4 1 1 A 8 8 MET CA C 8 55.565 54.041 1.524 1
1 23 . 4 1 1 A 8 8 MET CB C 8 32.835 32.556 0.279 1
1 26 . 4 1 1 A 8 8 MET N N 8 119.639 121.957 -2.318 1
1 27 . 4 1 1 A 9 9 GLY H H 9 8.472 8.901 -0.429 1
1 28 . 4 1 1 A 9 9 GLY HA2 H 9 3.946 4.108 -0.162 1
1 29 . 4 1 1 A 9 9 GLY HA3 H 9 3.946 4.115 -0.169 1
1 30 . 4 1 1 A 9 9 GLY C C 9 174.005 172.654 1.351 1
1 31 . 4 1 1 A 9 9 GLY CA C 9 45.488 44.213 1.275 1
1 32 . 4 1 1 A 9 9 GLY N N 9 110.107 112.276 -2.169 1
1 33 . 4 1 1 A 10 10 ASP H H 10 8.292 8.607 -0.315 1
1 34 . 4 1 1 A 10 10 ASP HA H 10 4.636 5.530 -0.894 1
1 37 . 4 1 1 A 10 10 ASP C C 10 176.768 175.050 1.718 1
1 38 . 4 1 1 A 10 10 ASP CA C 10 54.206 53.235 0.971 1
1 39 . 4 1 1 A 10 10 ASP CB C 10 41.306 44.913 -3.607 1
1 40 . 4 1 1 A 10 10 ASP N N 10 120.370 119.861 0.509 1
1 41 . 4 1 1 A 11 11 GLY H H 11 8.452 8.616 -0.164 1
1 42 . 4 1 1 A 11 11 GLY HA2 H 11 3.980 4.295 -0.315 1
1 43 . 4 1 1 A 11 11 GLY HA3 H 11 4.022 4.308 -0.286 1
1 44 . 4 1 1 A 11 11 GLY C C 11 174.102 172.837 1.265 1
1 45 . 4 1 1 A 11 11 GLY CA C 11 45.170 45.921 -0.751 1
1 46 . 4 1 1 A 11 11 GLY N N 11 108.391 109.458 -1.067 1
1 47 . 4 1 1 A 12 12 ALA H H 12 8.293 8.105 0.188 1
1 48 . 4 1 1 A 12 12 ALA HA H 12 3.777 4.551 -0.774 1
1 52 . 4 1 1 A 12 12 ALA C C 12 178.193 178.031 0.162 1
1 53 . 4 1 1 A 12 12 ALA CA C 12 52.759 50.658 2.101 1
1 54 . 4 1 1 A 12 12 ALA CB C 12 17.855 20.168 -2.313 1
1 55 . 4 1 1 A 12 12 ALA N N 12 124.185 123.892 0.293 1
1 56 . 4 1 1 A 13 13 VAL H H 13 8.822 8.167 0.655 1
1 57 . 4 1 1 A 13 13 VAL HA H 13 3.912 3.661 0.251 1
1 65 . 4 1 1 A 13 13 VAL C C 13 176.073 175.705 0.368 1
1 66 . 4 1 1 A 13 13 VAL CA C 13 63.100 66.788 -3.688 1
1 67 . 4 1 1 A 13 13 VAL CB C 13 32.711 31.866 0.845 1
1 70 . 4 1 1 A 13 13 VAL N N 13 120.877 124.988 -4.111 1
1 71 . 4 1 1 A 14 14 LYS H H 14 7.093 7.643 -0.550 1
1 72 . 4 1 1 A 14 14 LYS HA H 14 4.169 4.734 -0.565 1
1 81 . 4 1 1 A 14 14 LYS C C 14 173.291 174.444 -1.153 1
1 82 . 4 1 1 A 14 14 LYS CA C 14 56.465 54.923 1.542 1
1 83 . 4 1 1 A 14 14 LYS CB C 14 35.960 35.929 0.031 1
1 87 . 4 1 1 A 14 14 LYS N N 14 118.693 119.260 -0.567 1
1 88 . 4 1 1 A 15 15 GLN H H 15 8.522 8.546 -0.024 1
1 89 . 4 1 1 A 15 15 GLN HA H 15 5.542 5.183 0.359 1
1 96 . 4 1 1 A 15 15 GLN C C 15 174.992 175.206 -0.214 1
1 97 . 4 1 1 A 15 15 GLN CA C 15 54.312 54.043 0.269 1
1 98 . 4 1 1 A 15 15 GLN CB C 15 33.585 32.110 1.475 1
1 100 . 4 1 1 A 15 15 GLN N N 15 124.024 124.410 -0.386 1
1 102 . 4 1 1 A 16 16 GLY H H 16 8.740 7.843 0.897 1
1 103 . 4 1 1 A 16 16 GLY HA2 H 16 4.511 3.814 0.697 1
1 104 . 4 1 1 A 16 16 GLY HA3 H 16 4.064 4.260 -0.196 1
1 105 . 4 1 1 A 16 16 GLY C C 16 171.431 171.306 0.125 1
1 106 . 4 1 1 A 16 16 GLY CA C 16 46.106 45.576 0.530 1
1 107 . 4 1 1 A 16 16 GLY N N 16 109.611 108.580 1.031 1
1 108 . 4 1 1 A 17 17 PHE H H 17 8.886 8.325 0.561 1
1 109 . 4 1 1 A 17 17 PHE HA H 17 5.466 5.098 0.368 1
1 114 . 4 1 1 A 17 17 PHE C C 17 174.795 174.938 -0.143 1
1 115 . 4 1 1 A 17 17 PHE CA C 17 57.788 57.001 0.787 1
1 116 . 4 1 1 A 17 17 PHE CB C 17 41.315 40.684 0.631 1
1 119 . 4 1 1 A 17 17 PHE N N 17 122.684 119.298 3.386 1
1 120 . 4 1 1 A 18 18 LEU H H 18 8.762 8.645 0.117 1
1 121 . 4 1 1 A 18 18 LEU HA H 18 4.946 4.727 0.219 1
1 131 . 4 1 1 A 18 18 LEU C C 18 175.461 175.333 0.128 1
1 132 . 4 1 1 A 18 18 LEU CA C 18 52.970 53.044 -0.074 1
1 133 . 4 1 1 A 18 18 LEU CB C 18 47.945 44.852 3.093 1
1 137 . 4 1 1 A 18 18 LEU N N 18 119.045 124.064 -5.019 1
1 138 . 4 1 1 A 19 19 TYR H H 19 9.272 8.248 1.024 1
1 139 . 4 1 1 A 19 19 TYR HA H 19 5.682 5.750 -0.068 1
1 146 . 4 1 1 A 19 19 TYR C C 19 174.829 174.454 0.375 1
1 147 . 4 1 1 A 19 19 TYR CA C 19 56.482 56.321 0.161 1
1 148 . 4 1 1 A 19 19 TYR CB C 19 41.717 41.581 0.136 1
1 153 . 4 1 1 A 19 19 TYR N N 19 118.024 119.987 -1.963 1
1 154 . 4 1 1 A 20 20 LEU H H 20 9.441 8.643 0.798 1
1 155 . 4 1 1 A 20 20 LEU HA H 20 5.283 5.197 0.086 1
1 165 . 4 1 1 A 20 20 LEU C C 20 175.935 175.182 0.753 1
1 166 . 4 1 1 A 20 20 LEU CA C 20 53.464 53.802 -0.338 1
1 167 . 4 1 1 A 20 20 LEU CB C 20 46.570 45.812 0.758 1
1 171 . 4 1 1 A 20 20 LEU N N 20 122.838 125.008 -2.170 1
1 172 . 4 1 1 A 21 21 GLN H H 21 8.391 8.399 -0.008 1
1 173 . 4 1 1 A 21 21 GLN HA H 21 3.791 4.202 -0.411 1
1 180 . 4 1 1 A 21 21 GLN C C 21 175.157 174.496 0.661 1
1 181 . 4 1 1 A 21 21 GLN CA C 21 56.094 55.051 1.043 1
1 182 . 4 1 1 A 21 21 GLN CB C 21 28.434 28.688 -0.254 1
1 184 . 4 1 1 A 21 21 GLN N N 21 129.943 127.818 2.125 1
1 186 . 4 1 1 A 22 22 GLN H H 22 8.829 8.630 0.199 1
1 187 . 4 1 1 A 22 22 GLN HA H 22 4.553 4.765 -0.212 1
1 194 . 4 1 1 A 22 22 GLN C C 22 174.998 176.023 -1.025 1
1 195 . 4 1 1 A 22 22 GLN CA C 22 54.912 54.265 0.647 1
1 196 . 4 1 1 A 22 22 GLN CB C 22 31.930 30.361 1.569 1
1 198 . 4 1 1 A 22 22 GLN N N 22 127.199 125.975 1.224 1
1 200 . 4 1 1 A 23 23 GLN HA H 23 4.142 4.106 0.036 1
1 207 . 4 1 1 A 23 23 GLN CA C 23 56.427 58.660 -2.233 1
1 208 . 4 1 1 A 23 23 GLN CB C 23 29.227 28.588 0.639 1
1 211 . 4 1 1 A 24 24 GLN HA H 24 4.523 3.976 0.547 1
1 218 . 4 1 1 A 24 24 GLN CB C 24 29.759 28.696 1.063 1
1 221 . 4 1 1 A 25 25 THR HA H 25 3.870 3.963 -0.093 1
1 226 . 4 1 1 A 25 25 THR CA C 25 65.096 63.102 1.994 1
1 227 . 4 1 1 A 25 25 THR CB C 25 68.924 69.278 -0.354 1
1 229 . 4 1 1 A 26 26 PHE HA H 26 4.690 4.038 0.652 1
1 236 . 4 1 1 A 26 26 PHE C C 26 175.523 176.416 -0.893 1
1 237 . 4 1 1 A 26 26 PHE CA C 26 57.312 60.428 -3.116 1
1 238 . 4 1 1 A 26 26 PHE CB C 26 39.003 38.614 0.389 1
1 243 . 4 1 1 A 27 27 GLY H H 27 7.755 8.813 -1.058 1
1 244 . 4 1 1 A 27 27 GLY HA2 H 27 4.172 4.104 0.068 1
1 245 . 4 1 1 A 27 27 GLY HA3 H 27 3.783 4.126 -0.343 1
1 246 . 4 1 1 A 27 27 GLY C C 27 172.557 173.300 -0.743 1
1 247 . 4 1 1 A 27 27 GLY CA C 27 44.924 44.700 0.224 1
1 248 . 4 1 1 A 27 27 GLY N N 27 109.216 112.633 -3.417 1
1 249 . 4 1 1 A 28 28 LYS H H 28 8.241 8.357 -0.116 1
1 250 . 4 1 1 A 28 28 LYS HA H 28 4.530 5.179 -0.649 1
1 259 . 4 1 1 A 28 28 LYS C C 28 176.204 174.626 1.578 1
1 260 . 4 1 1 A 28 28 LYS CA C 28 55.741 55.249 0.492 1
1 261 . 4 1 1 A 28 28 LYS CB C 28 33.904 33.705 0.199 1
1 265 . 4 1 1 A 28 28 LYS N N 28 118.743 119.489 -0.746 1
1 266 . 4 1 1 A 29 29 LYS H H 29 8.356 8.777 -0.421 1
1 267 . 4 1 1 A 29 29 LYS HA H 29 4.559 4.954 -0.395 1
1 274 . 4 1 1 A 29 29 LYS C C 29 175.420 175.040 0.380 1
1 275 . 4 1 1 A 29 29 LYS CA C 29 55.406 54.863 0.543 1
1 276 . 4 1 1 A 29 29 LYS CB C 29 35.618 36.038 -0.420 1
1 280 . 4 1 1 A 29 29 LYS N N 29 121.198 124.542 -3.344 1
1 281 . 4 1 1 A 30 30 TRP H H 30 8.891 8.616 0.275 1
1 282 . 4 1 1 A 30 30 TRP HA H 30 4.951 4.744 0.207 1
1 291 . 4 1 1 A 30 30 TRP C C 30 175.902 176.819 -0.917 1
1 292 . 4 1 1 A 30 30 TRP CA C 30 56.677 58.093 -1.416 1
1 293 . 4 1 1 A 30 30 TRP CB C 30 30.614 30.560 0.054 1
1 299 . 4 1 1 A 30 30 TRP N N 30 123.304 125.056 -1.752 1
1 301 . 4 1 1 A 31 31 ARG H H 31 8.712 9.234 -0.522 1
1 302 . 4 1 1 A 31 31 ARG HA H 31 4.820 4.973 -0.153 1
1 309 . 4 1 1 A 31 31 ARG C C 31 174.026 174.170 -0.144 1
1 310 . 4 1 1 A 31 31 ARG CA C 31 54.895 53.511 1.384 1
1 311 . 4 1 1 A 31 31 ARG CB C 31 34.045 33.366 0.679 1
1 314 . 4 1 1 A 31 31 ARG N N 31 123.973 121.813 2.160 1
1 315 . 4 1 1 A 32 32 ARG H H 32 8.820 8.457 0.363 1
1 316 . 4 1 1 A 32 32 ARG HA H 32 3.965 5.152 -1.187 1
1 323 . 4 1 1 A 32 32 ARG C C 32 174.785 174.727 0.058 1
1 324 . 4 1 1 A 32 32 ARG CA C 32 56.924 54.462 2.462 1
1 325 . 4 1 1 A 32 32 ARG CB C 32 31.806 32.724 -0.918 1
1 328 . 4 1 1 A 32 32 ARG N N 32 127.041 122.604 4.437 1
1 329 . 4 1 1 A 33 33 PHE H H 33 9.372 8.681 0.691 1
1 330 . 4 1 1 A 33 33 PHE HA H 33 4.863 5.024 -0.161 1
1 338 . 4 1 1 A 33 33 PHE C C 33 176.359 175.223 1.136 1
1 339 . 4 1 1 A 33 33 PHE CA C 33 57.224 56.546 0.678 1
1 340 . 4 1 1 A 33 33 PHE CB C 33 43.385 43.279 0.106 1
1 346 . 4 1 1 A 33 33 PHE N N 33 125.882 123.412 2.470 1
1 347 . 4 1 1 A 34 34 GLY H H 34 9.160 9.067 0.093 1
1 348 . 4 1 1 A 34 34 GLY HA2 H 34 4.182 4.161 0.021 1
1 349 . 4 1 1 A 34 34 GLY HA3 H 34 3.714 4.245 -0.531 1
1 350 . 4 1 1 A 34 34 GLY C C 34 172.920 172.843 0.077 1
1 351 . 4 1 1 A 34 34 GLY CA C 34 46.247 45.629 0.618 1
1 352 . 4 1 1 A 34 34 GLY N N 34 108.654 110.298 -1.644 1
1 353 . 4 1 1 A 35 35 ALA H H 35 8.982 8.588 0.394 1
1 354 . 4 1 1 A 35 35 ALA HA H 35 5.660 5.582 0.078 1
1 358 . 4 1 1 A 35 35 ALA C C 35 176.547 176.151 0.396 1
1 359 . 4 1 1 A 35 35 ALA CA C 35 50.500 50.589 -0.089 1
1 360 . 4 1 1 A 35 35 ALA CB C 35 24.034 21.494 2.540 1
1 361 . 4 1 1 A 35 35 ALA N N 35 130.076 127.819 2.257 1
1 362 . 4 1 1 A 36 36 SER H H 36 8.852 8.582 0.270 1
1 363 . 4 1 1 A 36 36 SER HA H 36 5.203 4.930 0.273 1
1 366 . 4 1 1 A 36 36 SER C C 36 170.939 172.295 -1.356 1
1 367 . 4 1 1 A 36 36 SER CA C 36 57.806 57.399 0.407 1
1 368 . 4 1 1 A 36 36 SER CB C 36 66.986 65.607 1.379 1
1 369 . 4 1 1 A 36 36 SER N N 36 116.620 116.952 -0.332 1
1 370 . 4 1 1 A 37 37 LEU H H 37 8.862 8.694 0.168 1
1 371 . 4 1 1 A 37 37 LEU HA H 37 5.163 4.776 0.387 1
1 381 . 4 1 1 A 37 37 LEU C C 37 173.525 174.073 -0.548 1
1 382 . 4 1 1 A 37 37 LEU CA C 37 53.112 53.565 -0.453 1
1 383 . 4 1 1 A 37 37 LEU CB C 37 46.077 43.212 2.865 1
1 387 . 4 1 1 A 37 37 LEU N N 37 127.638 129.109 -1.471 1
1 388 . 4 1 1 A 38 38 TYR H H 38 9.280 8.584 0.696 1
1 389 . 4 1 1 A 38 38 TYR HA H 38 4.820 5.382 -0.562 1
1 396 . 4 1 1 A 38 38 TYR C C 38 175.430 175.005 0.425 1
1 397 . 4 1 1 A 38 38 TYR CA C 38 57.436 56.252 1.184 1
1 398 . 4 1 1 A 38 38 TYR CB C 38 42.128 41.477 0.651 1
1 403 . 4 1 1 A 38 38 TYR N N 38 125.215 126.926 -1.711 1
1 404 . 4 1 1 A 39 39 GLY H H 39 8.532 8.659 -0.127 1
1 405 . 4 1 1 A 39 39 GLY HA2 H 39 4.220 4.199 0.021 1
1 406 . 4 1 1 A 39 39 GLY HA3 H 39 3.941 4.202 -0.261 1
1 407 . 4 1 1 A 39 39 GLY C C 39 172.950 173.888 -0.938 1
1 408 . 4 1 1 A 39 39 GLY CA C 39 44.817 44.539 0.278 1
1 409 . 4 1 1 A 39 39 GLY N N 39 106.424 110.204 -3.780 1
1 410 . 4 1 1 A 40 40 GLY H H 40 8.477 8.531 -0.054 1
1 411 . 4 1 1 A 40 40 GLY HA2 H 40 4.102 4.034 0.068 1
1 412 . 4 1 1 A 40 40 GLY HA3 H 40 3.927 4.035 -0.108 1
1 413 . 4 1 1 A 40 40 GLY C C 40 174.002 173.522 0.480 1
1 414 . 4 1 1 A 40 40 GLY CA C 40 44.694 45.553 -0.859 1
1 415 . 4 1 1 A 40 40 GLY N N 40 106.881 107.889 -1.008 1
1 416 . 4 1 1 A 41 41 SER H H 41 8.600 7.782 0.818 1
1 417 . 4 1 1 A 41 41 SER HA H 41 4.520 4.844 -0.324 1
1 420 . 4 1 1 A 41 41 SER C C 41 174.355 172.829 1.526 1
1 421 . 4 1 1 A 41 41 SER CA C 41 58.565 56.946 1.619 1
1 422 . 4 1 1 A 41 41 SER CB C 41 64.413 65.986 -1.573 1
1 423 . 4 1 1 A 41 41 SER N N 41 115.751 114.422 1.329 1
1 424 . 4 1 1 A 42 42 ASP H H 42 8.533 8.796 -0.263 1
1 425 . 4 1 1 A 42 42 ASP HA H 42 4.560 4.258 0.302 1
1 428 . 4 1 1 A 42 42 ASP CA C 42 55.230 55.583 -0.353 1
1 429 . 4 1 1 A 42 42 ASP CB C 42 40.648 40.646 0.002 1
1 430 . 4 1 1 A 42 42 ASP N N 42 119.037 122.294 -3.257 1
1 431 . 4 1 1 A 43 43 CYS H H 43 8.152 8.784 -0.632 1
1 432 . 4 1 1 A 43 43 CYS HA H 43 4.541 3.997 0.544 1
1 435 . 4 1 1 A 43 43 CYS C C 43 173.975 173.361 0.614 1
1 436 . 4 1 1 A 43 43 CYS CA C 43 58.265 60.353 -2.088 1
1 437 . 4 1 1 A 43 43 CYS CB C 43 28.393 26.353 2.040 1
1 438 . 4 1 1 A 43 43 CYS N N 43 116.881 119.043 -2.162 1
1 439 . 4 1 1 A 44 44 ALA H H 44 8.047 7.485 0.562 1
1 440 . 4 1 1 A 44 44 ALA HA H 44 4.395 4.753 -0.358 1
1 444 . 4 1 1 A 44 44 ALA C C 44 176.472 176.373 0.099 1
1 445 . 4 1 1 A 44 44 ALA CA C 44 52.688 50.448 2.240 1
1 446 . 4 1 1 A 44 44 ALA CB C 44 20.579 21.513 -0.934 1
1 447 . 4 1 1 A 44 44 ALA N N 44 125.989 121.207 4.782 1
1 448 . 4 1 1 A 45 45 LEU H H 45 8.052 8.861 -0.809 1
1 449 . 4 1 1 A 45 45 LEU HA H 45 4.452 4.283 0.169 1
1 459 . 4 1 1 A 45 45 LEU C C 45 176.196 176.523 -0.327 1
1 460 . 4 1 1 A 45 45 LEU CA C 45 53.771 55.188 -1.417 1
1 461 . 4 1 1 A 45 45 LEU CB C 45 43.116 42.312 0.804 1
1 465 . 4 1 1 A 45 45 LEU N N 45 119.889 124.293 -4.404 1
1 466 . 4 1 1 A 46 46 ALA H H 46 8.381 8.629 -0.248 1
1 467 . 4 1 1 A 46 46 ALA HA H 46 4.449 5.915 -1.466 1
1 471 . 4 1 1 A 46 46 ALA C C 46 179.093 176.366 2.727 1
1 472 . 4 1 1 A 46 46 ALA CA C 46 52.829 50.045 2.784 1
1 473 . 4 1 1 A 46 46 ALA CB C 46 18.687 22.577 -3.890 1
1 474 . 4 1 1 A 46 46 ALA N N 46 125.635 125.758 -0.123 1
1 475 . 4 1 1 A 47 47 ARG H H 47 9.012 8.768 0.244 1
1 476 . 4 1 1 A 47 47 ARG HA H 47 5.192 5.111 0.081 1
1 484 . 4 1 1 A 47 47 ARG C C 47 171.524 174.093 -2.569 1
1 485 . 4 1 1 A 47 47 ARG CA C 47 55.265 54.415 0.850 1
1 486 . 4 1 1 A 47 47 ARG CB C 47 30.970 34.177 -3.207 1
1 489 . 4 1 1 A 47 47 ARG N N 47 120.048 118.679 1.369 1
1 491 . 4 1 1 A 48 48 LEU H H 48 9.029 8.664 0.365 1
1 492 . 4 1 1 A 48 48 LEU HA H 48 5.221 4.920 0.301 1
1 502 . 4 1 1 A 48 48 LEU C C 48 174.348 175.103 -0.755 1
1 503 . 4 1 1 A 48 48 LEU CA C 48 53.253 53.920 -0.667 1
1 504 . 4 1 1 A 48 48 LEU CB C 48 45.419 43.863 1.556 1
1 508 . 4 1 1 A 48 48 LEU N N 48 123.315 124.001 -0.686 1
1 509 . 4 1 1 A 49 49 GLU H H 49 9.473 8.960 0.513 1
1 510 . 4 1 1 A 49 49 GLU HA H 49 5.222 4.898 0.324 1
1 515 . 4 1 1 A 49 49 GLU C C 49 175.507 175.168 0.339 1
1 516 . 4 1 1 A 49 49 GLU CA C 49 55.159 55.866 -0.707 1
1 517 . 4 1 1 A 49 49 GLU CB C 49 32.341 31.331 1.010 1
1 519 . 4 1 1 A 49 49 GLU N N 49 124.751 128.319 -3.568 1
1 520 . 4 1 1 A 50 50 LEU H H 50 9.088 8.911 0.177 1
1 521 . 4 1 1 A 50 50 LEU HA H 50 5.382 5.397 -0.015 1
1 531 . 4 1 1 A 50 50 LEU C C 50 175.474 175.550 -0.076 1
1 532 . 4 1 1 A 50 50 LEU CA C 50 52.865 53.527 -0.662 1
1 533 . 4 1 1 A 50 50 LEU CB C 50 43.239 45.980 -2.741 1
1 537 . 4 1 1 A 50 50 LEU N N 50 124.221 125.913 -1.692 1
1 538 . 4 1 1 A 51 51 GLN H H 51 9.602 8.807 0.795 1
1 539 . 4 1 1 A 51 51 GLN HA H 51 5.095 5.074 0.021 1
1 546 . 4 1 1 A 51 51 GLN C C 51 175.306 174.268 1.038 1
1 547 . 4 1 1 A 51 51 GLN CA C 51 54.576 54.278 0.298 1
1 548 . 4 1 1 A 51 51 GLN CB C 51 32.177 32.408 -0.231 1
1 550 . 4 1 1 A 51 51 GLN N N 51 123.268 120.803 2.465 1
1 552 . 4 1 1 A 52 52 GLU H H 52 9.172 8.771 0.401 1
1 553 . 4 1 1 A 52 52 GLU HA H 52 4.092 4.595 -0.503 1
1 558 . 4 1 1 A 52 52 GLU C C 52 176.523 177.317 -0.794 1
1 559 . 4 1 1 A 52 52 GLU CA C 52 57.500 56.499 1.001 1
1 560 . 4 1 1 A 52 52 GLU CB C 52 30.696 31.514 -0.818 1
1 562 . 4 1 1 A 52 52 GLU N N 52 128.982 125.106 3.876 1
1 563 . 4 1 1 A 53 53 GLY H H 53 8.644 8.794 -0.150 1
1 564 . 4 1 1 A 53 53 GLY HA2 H 53 4.261 3.944 0.317 1
1 565 . 4 1 1 A 53 53 GLY HA3 H 53 3.993 3.951 0.042 1
1 566 . 4 1 1 A 53 53 GLY C C 53 172.550 174.845 -2.295 1
1 567 . 4 1 1 A 53 53 GLY CA C 53 45.911 47.662 -1.751 1
1 568 . 4 1 1 A 53 53 GLY N N 53 110.844 112.463 -1.619 1
1 569 . 4 1 1 A 54 54 PRO HA H 54 4.392 4.614 -0.222 1
1 576 . 4 1 1 A 54 54 PRO C C 54 176.828 176.308 0.520 1
1 577 . 4 1 1 A 54 54 PRO CA C 54 63.665 63.031 0.634 1
1 578 . 4 1 1 A 54 54 PRO CB C 54 32.012 32.524 -0.512 1
1 581 . 4 1 1 A 55 55 GLU H H 55 8.934 8.631 0.303 1
1 582 . 4 1 1 A 55 55 GLU HA H 55 4.193 4.690 -0.497 1
1 587 . 4 1 1 A 55 55 GLU C C 55 176.189 176.455 -0.266 1
1 588 . 4 1 1 A 55 55 GLU CA C 55 57.383 55.824 1.559 1
1 589 . 4 1 1 A 55 55 GLU CB C 55 28.945 31.026 -2.081 1
1 591 . 4 1 1 A 55 55 GLU N N 55 120.312 121.131 -0.819 1
1 592 . 4 1 1 A 56 56 LYS H H 56 7.937 8.468 -0.531 1
1 593 . 4 1 1 A 56 56 LYS HA H 56 4.578 4.348 0.230 1
1 602 . 4 1 1 A 56 56 LYS C C 56 174.295 174.789 -0.494 1
1 603 . 4 1 1 A 56 56 LYS CA C 56 54.171 55.280 -1.109 1
1 604 . 4 1 1 A 56 56 LYS CB C 56 32.555 31.885 0.670 1
1 608 . 4 1 1 A 56 56 LYS N N 56 122.008 123.957 -1.949 1
1 609 . 4 1 1 A 57 57 PRO HA H 57 4.370 4.405 -0.035 1
1 616 . 4 1 1 A 57 57 PRO CA C 57 63.431 63.424 0.007 1
1 617 . 4 1 1 A 57 57 PRO CB C 57 32.072 32.046 0.026 1
1 620 . 4 1 1 A 58 58 ARG H H 58 8.310 8.887 -0.577 1
1 621 . 4 1 1 A 58 58 ARG HA H 58 4.295 3.952 0.343 1
1 628 . 4 1 1 A 58 58 ARG CA C 58 56.570 57.122 -0.552 1
1 629 . 4 1 1 A 58 58 ARG CB C 58 30.860 28.864 1.996 1
1 632 . 4 1 1 A 58 58 ARG N N 58 120.045 121.966 -1.921 1
1 633 . 4 1 1 A 60 60 CYS HA H 60 4.482 4.831 -0.349 1
1 636 . 4 1 1 A 60 60 CYS CA C 60 58.621 57.987 0.634 1
1 637 . 4 1 1 A 60 60 CYS CB C 60 28.267 27.847 0.420 1
1 638 . 4 1 1 A 61 61 GLU HA H 61 4.226 4.803 -0.577 1
1 643 . 4 1 1 A 61 61 GLU C C 61 176.299 175.943 0.356 1
1 644 . 4 1 1 A 61 61 GLU CA C 61 57.100 54.819 2.281 1
1 645 . 4 1 1 A 61 61 GLU CB C 61 29.873 33.165 -3.292 1
1 647 . 4 1 1 A 62 62 ALA H H 62 8.282 8.671 -0.389 1
1 648 . 4 1 1 A 62 62 ALA HA H 62 4.302 4.261 0.041 1
1 652 . 4 1 1 A 62 62 ALA C C 62 177.277 176.381 0.896 1
1 653 . 4 1 1 A 62 62 ALA CA C 62 52.512 51.966 0.546 1
1 654 . 4 1 1 A 62 62 ALA CB C 62 19.592 18.472 1.120 1
1 655 . 4 1 1 A 62 62 ALA N N 62 124.386 125.974 -1.588 1
1 656 . 4 1 1 A 63 63 ALA H H 63 8.399 8.107 0.292 1
1 657 . 4 1 1 A 63 63 ALA HA H 63 4.375 4.328 0.047 1
1 661 . 4 1 1 A 63 63 ALA C C 63 176.843 176.481 0.362 1
1 662 . 4 1 1 A 63 63 ALA CA C 63 52.658 51.845 0.813 1
1 663 . 4 1 1 A 63 63 ALA CB C 63 19.592 17.981 1.611 1
1 664 . 4 1 1 A 63 63 ALA N N 63 123.892 126.961 -3.069 1
1 665 . 4 1 1 A 64 64 ARG H H 64 8.152 8.394 -0.242 1
1 666 . 4 1 1 A 64 64 ARG HA H 64 5.008 5.023 -0.015 1
1 673 . 4 1 1 A 64 64 ARG C C 64 175.594 173.996 1.598 1
1 674 . 4 1 1 A 64 64 ARG CA C 64 55.282 54.486 0.796 1
1 675 . 4 1 1 A 64 64 ARG CB C 64 32.506 33.403 -0.897 1
1 678 . 4 1 1 A 64 64 ARG N N 64 119.787 123.482 -3.695 1
1 679 . 4 1 1 A 65 65 LYS H H 65 8.945 8.578 0.367 1
1 680 . 4 1 1 A 65 65 LYS HA H 65 4.602 5.080 -0.478 1
1 689 . 4 1 1 A 65 65 LYS C C 65 174.657 174.750 -0.093 1
1 690 . 4 1 1 A 65 65 LYS CA C 65 54.948 54.673 0.275 1
1 691 . 4 1 1 A 65 65 LYS CB C 65 34.068 35.179 -1.111 1
1 695 . 4 1 1 A 65 65 LYS N N 65 124.171 128.324 -4.153 1
1 696 . 4 1 1 A 66 66 VAL H H 66 8.672 8.942 -0.270 1
1 697 . 4 1 1 A 66 66 VAL HA H 66 4.532 5.246 -0.714 1
1 705 . 4 1 1 A 66 66 VAL C C 66 175.078 173.782 1.296 1
1 706 . 4 1 1 A 66 66 VAL CA C 66 61.865 59.781 2.084 1
1 707 . 4 1 1 A 66 66 VAL CB C 66 33.835 35.384 -1.549 1
1 710 . 4 1 1 A 66 66 VAL N N 66 124.380 125.400 -1.020 1
1 711 . 4 1 1 A 67 67 ILE H H 67 9.071 9.290 -0.219 1
1 712 . 4 1 1 A 67 67 ILE HA H 67 4.142 4.589 -0.447 1
1 722 . 4 1 1 A 67 67 ILE C C 67 175.819 175.726 0.093 1
1 723 . 4 1 1 A 67 67 ILE CA C 67 60.383 60.408 -0.025 1
1 724 . 4 1 1 A 67 67 ILE CB C 67 39.908 38.606 1.302 1
1 728 . 4 1 1 A 67 67 ILE N N 67 129.537 128.706 0.831 1
1 729 . 4 1 1 A 68 68 ARG H H 68 9.203 8.665 0.538 1
1 730 . 4 1 1 A 68 68 ARG HA H 68 4.198 4.253 -0.055 1
1 737 . 4 1 1 A 68 68 ARG C C 68 177.769 177.381 0.388 1
1 738 . 4 1 1 A 68 68 ARG CA C 68 56.835 57.138 -0.303 1
1 739 . 4 1 1 A 68 68 ARG CB C 68 29.832 30.673 -0.841 1
1 742 . 4 1 1 A 68 68 ARG N N 68 128.484 127.831 0.653 1
1 743 . 4 1 1 A 69 69 LEU H H 69 8.212 8.295 -0.083 1
1 744 . 4 1 1 A 69 69 LEU HA H 69 4.221 4.050 0.171 1
1 754 . 4 1 1 A 69 69 LEU C C 69 178.996 178.830 0.166 1
1 755 . 4 1 1 A 69 69 LEU CA C 69 57.136 57.236 -0.100 1
1 756 . 4 1 1 A 69 69 LEU CB C 69 39.455 41.340 -1.885 1
1 760 . 4 1 1 A 69 69 LEU N N 69 123.807 123.503 0.304 1
1 761 . 4 1 1 A 70 70 SER H H 70 8.823 8.028 0.795 1
1 762 . 4 1 1 A 70 70 SER HA H 70 4.331 4.123 0.208 1
1 765 . 4 1 1 A 70 70 SER C C 70 175.076 176.219 -1.143 1
1 766 . 4 1 1 A 70 70 SER CA C 70 60.329 60.962 -0.633 1
1 767 . 4 1 1 A 70 70 SER CB C 70 62.362 63.109 -0.747 1
1 768 . 4 1 1 A 70 70 SER N N 70 115.162 114.466 0.696 1
1 769 . 4 1 1 A 71 71 ASP H H 71 7.602 7.458 0.144 1
1 770 . 4 1 1 A 71 71 ASP HA H 71 4.820 4.500 0.320 1
1 773 . 4 1 1 A 71 71 ASP C C 71 176.478 177.345 -0.867 1
1 774 . 4 1 1 A 71 71 ASP CA C 71 54.241 56.806 -2.565 1
1 775 . 4 1 1 A 71 71 ASP CB C 71 41.347 40.605 0.742 1
1 776 . 4 1 1 A 71 71 ASP N N 71 119.590 118.797 0.793 1
1 777 . 4 1 1 A 72 72 CYS H H 72 7.715 7.661 0.054 1
1 778 . 4 1 1 A 72 72 CYS HA H 72 4.372 4.483 -0.111 1
1 781 . 4 1 1 A 72 72 CYS C C 72 173.690 174.327 -0.637 1
1 782 . 4 1 1 A 72 72 CYS CA C 72 60.836 59.851 0.985 1
1 783 . 4 1 1 A 72 72 CYS CB C 72 27.655 27.729 -0.074 1
1 784 . 4 1 1 A 72 72 CYS N N 72 118.346 118.374 -0.028 1
1 785 . 4 1 1 A 73 73 LEU H H 73 9.472 9.139 0.333 1
1 786 . 4 1 1 A 73 73 LEU HA H 73 4.593 4.268 0.325 1
1 796 . 4 1 1 A 73 73 LEU C C 73 177.562 176.840 0.722 1
1 797 . 4 1 1 A 73 73 LEU CA C 73 55.724 56.746 -1.022 1
1 798 . 4 1 1 A 73 73 LEU CB C 73 43.774 42.548 1.226 1
1 802 . 4 1 1 A 73 73 LEU N N 73 124.752 128.516 -3.764 1
1 803 . 4 1 1 A 74 74 ARG H H 74 7.658 7.201 0.457 1
1 804 . 4 1 1 A 74 74 ARG HA H 74 4.592 5.051 -0.459 1
1 811 . 4 1 1 A 74 74 ARG C C 74 173.605 174.610 -1.005 1
1 812 . 4 1 1 A 74 74 ARG CA C 74 56.465 55.985 0.480 1
1 813 . 4 1 1 A 74 74 ARG CB C 74 34.068 33.731 0.337 1
1 816 . 4 1 1 A 74 74 ARG N N 74 115.565 115.881 -0.316 1
1 817 . 4 1 1 A 75 75 VAL H H 75 8.622 8.792 -0.170 1
1 818 . 4 1 1 A 75 75 VAL HA H 75 5.170 5.412 -0.242 1
1 826 . 4 1 1 A 75 75 VAL C C 75 173.985 174.501 -0.516 1
1 827 . 4 1 1 A 75 75 VAL CA C 75 60.930 59.936 0.994 1
1 828 . 4 1 1 A 75 75 VAL CB C 75 35.073 36.104 -1.031 1
1 831 . 4 1 1 A 75 75 VAL N N 75 124.278 119.539 4.739 1
1 832 . 4 1 1 A 76 76 ALA H H 76 8.272 8.815 -0.543 1
1 833 . 4 1 1 A 76 76 ALA HA H 76 4.648 5.155 -0.507 1
1 837 . 4 1 1 A 76 76 ALA C C 76 175.630 175.882 -0.252 1
1 838 . 4 1 1 A 76 76 ALA CA C 76 51.294 51.136 0.158 1
1 839 . 4 1 1 A 76 76 ALA CB C 76 22.759 24.386 -1.627 1
1 840 . 4 1 1 A 76 76 ALA N N 76 126.015 124.641 1.374 1
1 841 . 4 1 1 A 77 77 GLU H H 77 9.184 8.746 0.438 1
1 842 . 4 1 1 A 77 77 GLU HA H 77 4.060 5.295 -1.235 1
1 847 . 4 1 1 A 77 77 GLU C C 77 174.949 175.628 -0.679 1
1 848 . 4 1 1 A 77 77 GLU CA C 77 58.424 55.188 3.236 1
1 849 . 4 1 1 A 77 77 GLU CB C 77 30.161 31.676 -1.515 1
1 851 . 4 1 1 A 77 77 GLU N N 77 120.223 118.309 1.914 1
1 852 . 4 1 1 A 78 78 ALA H H 78 7.985 9.079 -1.094 1
1 853 . 4 1 1 A 78 78 ALA HA H 78 4.776 4.855 -0.079 1
1 857 . 4 1 1 A 78 78 ALA C C 78 177.250 176.173 1.077 1
1 858 . 4 1 1 A 78 78 ALA CA C 78 50.888 50.765 0.123 1
1 859 . 4 1 1 A 78 78 ALA CB C 78 20.851 19.850 1.001 1
1 860 . 4 1 1 A 78 78 ALA N N 78 125.143 126.895 -1.752 1
1 861 . 4 1 1 A 79 79 GLY H H 79 8.604 8.838 -0.234 1
1 862 . 4 1 1 A 79 79 GLY HA2 H 79 4.327 4.234 0.093 1
1 863 . 4 1 1 A 79 79 GLY HA3 H 79 3.963 4.250 -0.287 1
1 864 . 4 1 1 A 79 79 GLY C C 79 175.360 174.464 0.896 1
1 865 . 4 1 1 A 79 79 GLY CA C 79 44.925 44.849 0.076 1
1 866 . 4 1 1 A 79 79 GLY N N 79 109.420 110.302 -0.882 1
1 867 . 4 1 1 A 80 80 GLY H H 80 8.649 8.210 0.439 1
1 868 . 4 1 1 A 80 80 GLY HA2 H 80 3.962 4.114 -0.152 1
1 869 . 4 1 1 A 80 80 GLY HA3 H 80 3.962 4.123 -0.161 1
1 870 . 4 1 1 A 80 80 GLY C C 80 175.052 174.853 0.199 1
1 871 . 4 1 1 A 80 80 GLY CA C 80 45.955 44.780 1.175 1
1 872 . 4 1 1 A 80 80 GLY N N 80 108.295 112.688 -4.393 1
1 873 . 4 1 1 A 81 81 GLU H H 81 8.921 8.752 0.169 1
1 874 . 4 1 1 A 81 81 GLU HA H 81 4.298 4.064 0.234 1
1 879 . 4 1 1 A 81 81 GLU C C 81 176.532 177.845 -1.313 1
1 880 . 4 1 1 A 81 81 GLU CA C 81 57.118 59.665 -2.547 1
1 881 . 4 1 1 A 81 81 GLU CB C 81 28.599 29.651 -1.052 1
1 883 . 4 1 1 A 81 81 GLU N N 81 121.170 126.461 -5.291 1
1 884 . 4 1 1 A 82 82 ALA H H 82 8.032 7.418 0.614 1
1 885 . 4 1 1 A 82 82 ALA HA H 82 4.371 4.201 0.170 1
1 889 . 4 1 1 A 82 82 ALA C C 82 177.160 178.647 -1.487 1
1 890 . 4 1 1 A 82 82 ALA CA C 82 52.653 53.013 -0.360 1
1 891 . 4 1 1 A 82 82 ALA CB C 82 19.304 19.968 -0.664 1
1 892 . 4 1 1 A 82 82 ALA N N 82 124.988 122.364 2.624 1
1 893 . 4 1 1 A 83 83 SER H H 83 8.319 8.877 -0.558 1
1 894 . 4 1 1 A 83 83 SER HA H 83 4.331 4.258 0.073 1
1 897 . 4 1 1 A 83 83 SER C C 83 174.045 175.294 -1.249 1
1 898 . 4 1 1 A 83 83 SER CA C 83 58.053 62.095 -4.042 1
1 899 . 4 1 1 A 83 83 SER CB C 83 63.184 62.951 0.233 1
1 900 . 4 1 1 A 83 83 SER N N 83 114.181 117.020 -2.839 1
1 901 . 4 1 1 A 84 84 SER H H 84 7.823 7.698 0.125 1
1 902 . 4 1 1 A 84 84 SER HA H 84 3.194 4.189 -0.995 1
1 905 . 4 1 1 A 84 84 SER C C 84 171.072 174.130 -3.058 1
1 906 . 4 1 1 A 84 84 SER CA C 84 57.206 57.077 0.129 1
1 907 . 4 1 1 A 84 84 SER CB C 84 61.622 63.499 -1.877 1
1 908 . 4 1 1 A 84 84 SER N N 84 117.302 114.853 2.449 1
1 909 . 4 1 1 A 85 85 PRO HA H 85 3.922 4.525 -0.603 1
1 916 . 4 1 1 A 85 85 PRO CA C 85 62.691 62.152 0.539 1
1 917 . 4 1 1 A 85 85 PRO CB C 85 31.515 32.877 -1.362 1
1 920 . 4 1 1 A 86 86 ARG HA H 86 3.882 4.292 -0.410 1
1 927 . 4 1 1 A 86 86 ARG C C 86 175.712 176.390 -0.678 1
1 928 . 4 1 1 A 86 86 ARG CA C 86 57.877 56.185 1.692 1
1 929 . 4 1 1 A 86 86 ARG CB C 86 29.791 31.105 -1.314 1
1 932 . 4 1 1 A 87 87 ASP H H 87 8.903 9.095 -0.192 1
1 933 . 4 1 1 A 87 87 ASP HA H 87 4.342 4.240 0.102 1
1 936 . 4 1 1 A 87 87 ASP C C 87 175.723 174.868 0.855 1
1 937 . 4 1 1 A 87 87 ASP CA C 87 56.377 55.377 1.000 1
1 938 . 4 1 1 A 87 87 ASP CB C 87 39.208 40.261 -1.053 1
1 939 . 4 1 1 A 87 87 ASP N N 87 117.520 125.372 -7.852 1
1 940 . 4 1 1 A 88 88 THR H H 88 7.776 7.474 0.302 1
1 941 . 4 1 1 A 88 88 THR HA H 88 5.101 5.104 -0.003 1
1 946 . 4 1 1 A 88 88 THR C C 88 173.825 172.967 0.858 1
1 947 . 4 1 1 A 88 88 THR CA C 88 60.154 59.493 0.661 1
1 948 . 4 1 1 A 88 88 THR CB C 88 72.702 72.946 -0.244 1
1 950 . 4 1 1 A 88 88 THR N N 88 108.770 108.773 -0.003 1
1 951 . 4 1 1 A 89 89 SER H H 89 9.006 9.366 -0.360 1
1 952 . 4 1 1 A 89 89 SER HA H 89 4.718 5.186 -0.468 1
1 955 . 4 1 1 A 89 89 SER C C 89 173.728 173.243 0.485 1
1 956 . 4 1 1 A 89 89 SER CA C 89 57.453 57.872 -0.419 1
1 957 . 4 1 1 A 89 89 SER CB C 89 65.611 65.476 0.135 1
1 958 . 4 1 1 A 89 89 SER N N 89 114.151 116.878 -2.727 1
1 959 . 4 1 1 A 90 90 ALA H H 90 9.001 8.526 0.475 1
1 960 . 4 1 1 A 90 90 ALA HA H 90 5.660 4.719 0.941 1
1 964 . 4 1 1 A 90 90 ALA C C 90 177.669 177.210 0.459 1
1 965 . 4 1 1 A 90 90 ALA CA C 90 51.670 51.895 -0.225 1
1 966 . 4 1 1 A 90 90 ALA CB C 90 22.265 20.245 2.020 1
1 967 . 4 1 1 A 90 90 ALA N N 90 126.177 129.069 -2.892 1
1 968 . 4 1 1 A 91 91 PHE H H 91 9.672 8.352 1.320 1
1 969 . 4 1 1 A 91 91 PHE HA H 91 5.039 5.512 -0.473 1
1 977 . 4 1 1 A 91 91 PHE C C 91 170.731 172.598 -1.867 1
1 978 . 4 1 1 A 91 91 PHE CA C 91 56.271 55.456 0.815 1
1 979 . 4 1 1 A 91 91 PHE CB C 91 41.553 42.041 -0.488 1
1 985 . 4 1 1 A 91 91 PHE N N 91 118.968 115.720 3.248 1
1 986 . 4 1 1 A 92 92 PHE H H 92 9.422 9.450 -0.028 1
1 987 . 4 1 1 A 92 92 PHE HA H 92 5.674 5.169 0.505 1
1 995 . 4 1 1 A 92 92 PHE C C 92 174.570 174.846 -0.276 1
1 996 . 4 1 1 A 92 92 PHE CA C 92 55.917 56.983 -1.066 1
1 997 . 4 1 1 A 92 92 PHE CB C 92 42.787 41.132 1.655 1
1 1003 . 4 1 1 A 92 92 PHE N N 92 117.543 118.081 -0.538 1
1 1004 . 4 1 1 A 93 93 LEU H H 93 9.021 8.605 0.416 1
1 1005 . 4 1 1 A 93 93 LEU HA H 93 5.122 5.132 -0.010 1
1 1015 . 4 1 1 A 93 93 LEU C C 93 174.799 174.207 0.592 1
1 1016 . 4 1 1 A 93 93 LEU CA C 93 54.912 54.316 0.596 1
1 1017 . 4 1 1 A 93 93 LEU CB C 93 45.254 45.414 -0.160 1
1 1021 . 4 1 1 A 93 93 LEU N N 93 121.719 124.123 -2.404 1
1 1022 . 4 1 1 A 94 94 GLU H H 94 9.294 9.031 0.263 1
1 1023 . 4 1 1 A 94 94 GLU HA H 94 5.043 5.246 -0.203 1
1 1028 . 4 1 1 A 94 94 GLU C C 94 175.754 175.389 0.365 1
1 1029 . 4 1 1 A 94 94 GLU CA C 94 56.018 54.943 1.075 1
1 1030 . 4 1 1 A 94 94 GLU CB C 94 32.752 32.873 -0.121 1
1 1032 . 4 1 1 A 94 94 GLU N N 94 127.032 128.711 -1.679 1
1 1033 . 4 1 1 A 95 95 THR H H 95 8.822 8.630 0.192 1
1 1034 . 4 1 1 A 95 95 THR HA H 95 5.398 5.080 0.318 1
1 1039 . 4 1 1 A 95 95 THR C C 95 173.860 175.424 -1.564 1
1 1040 . 4 1 1 A 95 95 THR CA C 95 59.588 59.458 0.130 1
1 1041 . 4 1 1 A 95 95 THR CB C 95 72.191 72.373 -0.182 1
1 1043 . 4 1 1 A 95 95 THR N N 95 118.685 118.289 0.396 1
1 1044 . 4 1 1 A 96 96 LYS H H 96 8.823 9.145 -0.322 1
1 1045 . 4 1 1 A 96 96 LYS HA H 96 4.022 4.012 0.010 1
1 1054 . 4 1 1 A 96 96 LYS C C 96 177.330 178.807 -1.477 1
1 1055 . 4 1 1 A 96 96 LYS CA C 96 59.588 60.373 -0.785 1
1 1056 . 4 1 1 A 96 96 LYS CB C 96 32.588 32.165 0.423 1
1 1060 . 4 1 1 A 96 96 LYS N N 96 118.801 122.510 -3.709 1
1 1061 . 4 1 1 A 97 97 GLU H H 97 8.092 7.935 0.157 1
1 1062 . 4 1 1 A 97 97 GLU HA H 97 4.282 4.151 0.131 1
1 1067 . 4 1 1 A 97 97 GLU C C 97 176.290 176.204 0.086 1
1 1068 . 4 1 1 A 97 97 GLU CA C 97 57.365 59.324 -1.959 1
1 1069 . 4 1 1 A 97 97 GLU CB C 97 31.559 30.400 1.159 1
1 1071 . 4 1 1 A 97 97 GLU N N 97 113.992 119.150 -5.158 1
1 1072 . 4 1 1 A 98 98 ARG H H 98 7.482 7.045 0.437 1
1 1073 . 4 1 1 A 98 98 ARG HA H 98 4.397 4.531 -0.134 1
1 1080 . 4 1 1 A 98 98 ARG C C 98 172.792 173.070 -0.278 1
1 1081 . 4 1 1 A 98 98 ARG CA C 98 55.689 54.712 0.977 1
1 1082 . 4 1 1 A 98 98 ARG CB C 98 32.711 31.517 1.194 1
1 1085 . 4 1 1 A 98 98 ARG N N 98 116.022 114.130 1.892 1
1 1086 . 4 1 1 A 99 99 LEU H H 99 8.423 8.249 0.174 1
1 1087 . 4 1 1 A 99 99 LEU HA H 99 4.807 4.743 0.064 1
1 1097 . 4 1 1 A 99 99 LEU C C 99 175.903 174.172 1.731 1
1 1098 . 4 1 1 A 99 99 LEU CA C 99 54.383 53.523 0.860 1
1 1099 . 4 1 1 A 99 99 LEU CB C 99 43.362 43.520 -0.158 1
1 1103 . 4 1 1 A 99 99 LEU N N 99 124.983 121.437 3.546 1
1 1104 . 4 1 1 A 100 100 TYR H H 100 9.144 9.353 -0.209 1
1 1105 . 4 1 1 A 100 100 TYR HA H 100 4.542 5.109 -0.567 1
1 1112 . 4 1 1 A 100 100 TYR C C 100 173.479 174.556 -1.077 1
1 1113 . 4 1 1 A 100 100 TYR CA C 100 57.735 56.837 0.898 1
1 1114 . 4 1 1 A 100 100 TYR CB C 100 39.291 41.127 -1.836 1
1 1119 . 4 1 1 A 100 100 TYR N N 100 126.679 127.644 -0.965 1
1 1120 . 4 1 1 A 101 101 LEU H H 101 9.043 8.827 0.216 1
1 1121 . 4 1 1 A 101 101 LEU HA H 101 4.747 4.946 -0.199 1
1 1131 . 4 1 1 A 101 101 LEU C C 101 173.530 175.146 -1.616 1
1 1132 . 4 1 1 A 101 101 LEU CA C 101 54.524 53.631 0.893 1
1 1133 . 4 1 1 A 101 101 LEU CB C 101 42.499 43.759 -1.260 1
1 1137 . 4 1 1 A 101 101 LEU N N 101 127.422 125.579 1.843 1
1 1138 . 4 1 1 A 102 102 LEU H H 102 8.493 8.560 -0.067 1
1 1139 . 4 1 1 A 102 102 LEU HA H 102 5.612 5.550 0.062 1
1 1149 . 4 1 1 A 102 102 LEU C C 102 175.794 175.947 -0.153 1
1 1150 . 4 1 1 A 102 102 LEU CA C 102 53.076 53.197 -0.121 1
1 1151 . 4 1 1 A 102 102 LEU CB C 102 45.994 44.603 1.391 1
1 1155 . 4 1 1 A 102 102 LEU N N 102 126.021 128.656 -2.635 1
1 1156 . 4 1 1 A 103 103 ALA H H 103 9.073 8.779 0.294 1
1 1157 . 4 1 1 A 103 103 ALA HA H 103 5.081 5.313 -0.232 1
1 1161 . 4 1 1 A 103 103 ALA C C 103 175.133 175.796 -0.663 1
1 1162 . 4 1 1 A 103 103 ALA CA C 103 51.688 49.890 1.798 1
1 1163 . 4 1 1 A 103 103 ALA CB C 103 21.689 22.477 -0.788 1
1 1164 . 4 1 1 A 103 103 ALA N N 103 117.679 123.142 -5.463 1
1 1165 . 4 1 1 A 104 104 ALA H H 104 8.582 8.617 -0.035 1
1 1166 . 4 1 1 A 104 104 ALA HA H 104 5.220 4.823 0.397 1
1 1170 . 4 1 1 A 104 104 ALA C C 104 173.471 174.056 -0.585 1
1 1171 . 4 1 1 A 104 104 ALA CA C 104 47.959 50.046 -2.087 1
1 1172 . 4 1 1 A 104 104 ALA CB C 104 21.359 22.264 -0.905 1
1 1173 . 4 1 1 A 104 104 ALA N N 104 123.419 120.965 2.454 1
1 1174 . 4 1 1 A 105 105 PRO HA H 105 4.542 4.795 -0.253 1
1 1181 . 4 1 1 A 105 105 PRO C C 105 178.409 177.976 0.433 1
1 1182 . 4 1 1 A 105 105 PRO CA C 105 64.301 62.897 1.404 1
1 1183 . 4 1 1 A 105 105 PRO CB C 105 32.094 31.670 0.424 1
1 1186 . 4 1 1 A 106 106 ALA H H 106 8.302 8.676 -0.374 1
1 1187 . 4 1 1 A 106 106 ALA HA H 106 4.022 4.025 -0.003 1
1 1191 . 4 1 1 A 106 106 ALA C C 106 179.641 179.594 0.047 1
1 1192 . 4 1 1 A 106 106 ALA CA C 106 56.341 55.272 1.069 1
1 1193 . 4 1 1 A 106 106 ALA CB C 106 18.523 18.389 0.134 1
1 1194 . 4 1 1 A 106 106 ALA N N 106 127.733 127.908 -0.175 1
1 1195 . 4 1 1 A 107 107 ALA H H 107 9.035 8.309 0.726 1
1 1196 . 4 1 1 A 107 107 ALA HA H 107 4.331 4.004 0.327 1
1 1200 . 4 1 1 A 107 107 ALA C C 107 178.586 179.643 -1.057 1
1 1201 . 4 1 1 A 107 107 ALA CA C 107 53.765 55.272 -1.507 1
1 1202 . 4 1 1 A 107 107 ALA CB C 107 18.728 18.243 0.485 1
1 1203 . 4 1 1 A 107 107 ALA N N 107 118.203 119.816 -1.613 1
1 1204 . 4 1 1 A 108 108 GLU H H 108 8.399 8.116 0.283 1
1 1205 . 4 1 1 A 108 108 GLU HA H 108 4.631 4.090 0.541 1
1 1210 . 4 1 1 A 108 108 GLU C C 108 177.127 178.836 -1.709 1
1 1211 . 4 1 1 A 108 108 GLU CA C 108 55.847 58.690 -2.843 1
1 1212 . 4 1 1 A 108 108 GLU CB C 108 32.135 30.070 2.065 1
1 1214 . 4 1 1 A 108 108 GLU N N 108 114.661 118.045 -3.384 1
1 1215 . 4 1 1 A 109 109 ARG H H 109 7.412 8.672 -1.260 1
1 1216 . 4 1 1 A 109 109 ARG HA H 109 3.682 4.175 -0.493 1
1 1223 . 4 1 1 A 109 109 ARG C C 109 176.917 179.243 -2.326 1
1 1224 . 4 1 1 A 109 109 ARG CA C 109 61.600 59.813 1.787 1
1 1225 . 4 1 1 A 109 109 ARG CB C 109 28.845 30.425 -1.580 1
1 1228 . 4 1 1 A 109 109 ARG N N 109 120.954 120.991 -0.037 1
1 1229 . 4 1 1 A 110 110 GLY H H 110 8.833 8.155 0.678 1
1 1230 . 4 1 1 A 110 110 GLY HA2 H 110 3.872 3.790 0.082 1
1 1231 . 4 1 1 A 110 110 GLY HA3 H 110 3.685 3.811 -0.126 1
1 1232 . 4 1 1 A 110 110 GLY C C 110 175.997 175.875 0.122 1
1 1233 . 4 1 1 A 110 110 GLY CA C 110 47.323 47.584 -0.261 1
1 1234 . 4 1 1 A 110 110 GLY N N 110 106.563 107.148 -0.585 1
1 1235 . 4 1 1 A 111 111 ASP H H 111 7.882 8.002 -0.120 1
1 1236 . 4 1 1 A 111 111 ASP HA H 111 4.312 4.354 -0.042 1
1 1239 . 4 1 1 A 111 111 ASP C C 111 179.467 178.896 0.571 1
1 1240 . 4 1 1 A 111 111 ASP CA C 111 56.976 56.822 0.154 1
1 1241 . 4 1 1 A 111 111 ASP CB C 111 40.648 40.868 -0.220 1
1 1242 . 4 1 1 A 111 111 ASP N N 111 121.402 121.471 -0.069 1
1 1243 . 4 1 1 A 112 112 TRP H H 112 7.804 8.488 -0.684 1
1 1244 . 4 1 1 A 112 112 TRP HA H 112 3.831 4.200 -0.369 1
1 1253 . 4 1 1 A 112 112 TRP C C 112 177.547 178.735 -1.188 1
1 1254 . 4 1 1 A 112 112 TRP CA C 112 62.006 60.052 1.954 1
1 1255 . 4 1 1 A 112 112 TRP CB C 112 29.421 29.380 0.041 1
1 1261 . 4 1 1 A 112 112 TRP N N 112 119.904 120.242 -0.338 1
1 1263 . 4 1 1 A 113 113 VAL H H 113 7.982 8.078 -0.096 1
1 1264 . 4 1 1 A 113 113 VAL HA H 113 3.072 3.637 -0.565 1
1 1272 . 4 1 1 A 113 113 VAL C C 113 178.015 178.708 -0.693 1
1 1273 . 4 1 1 A 113 113 VAL CA C 113 67.407 66.766 0.641 1
1 1274 . 4 1 1 A 113 113 VAL CB C 113 31.724 31.520 0.204 1
1 1277 . 4 1 1 A 113 113 VAL N N 113 117.575 119.359 -1.784 1
1 1278 . 4 1 1 A 114 114 GLN H H 114 8.268 8.062 0.206 1
1 1279 . 4 1 1 A 114 114 GLN HA H 114 3.994 4.038 -0.044 1
1 1286 . 4 1 1 A 114 114 GLN C C 114 178.021 177.760 0.261 1
1 1287 . 4 1 1 A 114 114 GLN CA C 114 59.112 58.911 0.201 1
1 1288 . 4 1 1 A 114 114 GLN CB C 114 28.685 28.851 -0.166 1
1 1290 . 4 1 1 A 114 114 GLN N N 114 117.479 120.133 -2.654 1
1 1292 . 4 1 1 A 115 115 ALA H H 115 7.915 8.508 -0.593 1
1 1293 . 4 1 1 A 115 115 ALA HA H 115 3.972 4.067 -0.095 1
1 1297 . 4 1 1 A 115 115 ALA C C 115 180.030 180.038 -0.008 1
1 1298 . 4 1 1 A 115 115 ALA CA C 115 55.142 55.126 0.016 1
1 1299 . 4 1 1 A 115 115 ALA CB C 115 18.152 18.516 -0.364 1
1 1300 . 4 1 1 A 115 115 ALA N N 115 120.858 120.698 0.160 1
1 1301 . 4 1 1 A 116 116 ILE H H 116 8.172 8.437 -0.265 1
1 1302 . 4 1 1 A 116 116 ILE HA H 116 3.482 3.769 -0.287 1
1 1312 . 4 1 1 A 116 116 ILE C C 116 177.739 178.128 -0.389 1
1 1313 . 4 1 1 A 116 116 ILE CA C 116 66.119 64.958 1.161 1
1 1314 . 4 1 1 A 116 116 ILE CB C 116 38.222 37.755 0.467 1
1 1318 . 4 1 1 A 116 116 ILE N N 116 115.977 117.736 -1.759 1
1 1319 . 4 1 1 A 117 117 CYS H H 117 8.449 8.224 0.225 1
1 1320 . 4 1 1 A 117 117 CYS HA H 117 4.032 4.607 -0.575 1
1 1323 . 4 1 1 A 117 117 CYS C C 117 177.321 177.173 0.148 1
1 1324 . 4 1 1 A 117 117 CYS CA C 117 64.777 62.379 2.398 1
1 1325 . 4 1 1 A 117 117 CYS CB C 117 26.871 27.234 -0.363 1
1 1326 . 4 1 1 A 117 117 CYS N N 117 117.253 120.900 -3.647 1
1 1327 . 4 1 1 A 118 118 LEU H H 118 8.182 8.200 -0.018 1
1 1328 . 4 1 1 A 118 118 LEU HA H 118 4.052 4.049 0.003 1
1 1338 . 4 1 1 A 118 118 LEU C C 118 179.217 179.279 -0.062 1
1 1339 . 4 1 1 A 118 118 LEU CA C 118 57.877 57.874 0.003 1
1 1340 . 4 1 1 A 118 118 LEU CB C 118 42.088 41.637 0.451 1
1 1344 . 4 1 1 A 118 118 LEU N N 118 119.665 121.140 -1.475 1
1 1345 . 4 1 1 A 119 119 LEU H H 119 7.142 7.749 -0.607 1
1 1346 . 4 1 1 A 119 119 LEU HA H 119 4.192 4.152 0.040 1
1 1356 . 4 1 1 A 119 119 LEU C C 119 178.492 178.458 0.034 1
1 1357 . 4 1 1 A 119 119 LEU CA C 119 56.259 57.947 -1.688 1
1 1358 . 4 1 1 A 119 119 LEU CB C 119 43.568 42.020 1.548 1
1 1362 . 4 1 1 A 119 119 LEU N N 119 116.244 119.171 -2.927 1
1 1363 . 4 1 1 A 120 120 ALA H H 120 8.513 8.546 -0.033 1
1 1364 . 4 1 1 A 120 120 ALA HA H 120 3.878 3.922 -0.044 1
1 1368 . 4 1 1 A 120 120 ALA C C 120 178.358 178.716 -0.358 1
1 1369 . 4 1 1 A 120 120 ALA CA C 120 53.765 55.085 -1.320 1
1 1370 . 4 1 1 A 120 120 ALA CB C 120 18.687 18.534 0.153 1
1 1371 . 4 1 1 A 120 120 ALA N N 120 120.009 120.686 -0.677 1
1 1372 . 4 1 1 A 121 121 PHE H H 121 7.822 7.803 0.019 1
1 1373 . 4 1 1 A 121 121 PHE HA H 121 5.156 4.842 0.314 1
1 1381 . 4 1 1 A 121 121 PHE C C 121 176.273 176.237 0.036 1
1 1382 . 4 1 1 A 121 121 PHE CA C 121 55.741 57.010 -1.269 1
1 1383 . 4 1 1 A 121 121 PHE CB C 121 39.455 38.527 0.928 1
1 1389 . 4 1 1 A 121 121 PHE N N 121 113.981 114.366 -0.385 1
1 1390 . 4 1 1 A 122 122 SER H H 122 7.765 8.435 -0.670 1
1 1391 . 4 1 1 A 122 122 SER HA H 122 4.579 4.594 -0.015 1
1 1394 . 4 1 1 A 122 122 SER C C 122 174.595 174.870 -0.275 1
1 1395 . 4 1 1 A 122 122 SER CA C 122 58.777 61.303 -2.526 1
1 1396 . 4 1 1 A 122 122 SER CB C 122 63.719 63.863 -0.144 1
1 1397 . 4 1 1 A 122 122 SER N N 122 115.069 116.010 -0.941 1
1 1398 . 4 1 1 A 123 123 GLY H H 123 8.223 7.311 0.912 1
1 1399 . 4 1 1 A 123 123 GLY HA2 H 123 4.174 4.132 0.042 1
1 1400 . 4 1 1 A 123 123 GLY HA3 H 123 4.100 4.147 -0.047 1
1 1401 . 4 1 1 A 123 123 GLY C C 123 171.678 171.761 -0.083 1
1 1402 . 4 1 1 A 123 123 GLY CA C 123 44.815 45.752 -0.937 1
1 1403 . 4 1 1 A 123 123 GLY N N 123 110.151 107.559 2.592 1
1 1404 . 4 1 1 A 124 124 PRO HA H 124 4.482 4.643 -0.161 1
1 1411 . 4 1 1 A 124 124 PRO C C 124 177.314 176.200 1.114 1
1 1412 . 4 1 1 A 124 124 PRO CA C 124 63.206 62.428 0.778 1
1 1413 . 4 1 1 A 124 124 PRO CB C 124 32.176 33.052 -0.876 1
1 1416 . 4 1 1 A 125 125 SER H H 125 8.485 8.427 0.058 1
1 1417 . 4 1 1 A 125 125 SER HA H 125 4.472 4.727 -0.255 1
1 1420 . 4 1 1 A 125 125 SER C C 125 174.728 174.070 0.658 1
1 1421 . 4 1 1 A 125 125 SER CA C 125 58.353 59.175 -0.822 1
1 1422 . 4 1 1 A 125 125 SER CB C 125 64.048 64.001 0.047 1
1 1423 . 4 1 1 A 125 125 SER N N 125 116.081 117.947 -1.866 1
1 1424 . 4 1 1 A 126 126 SER H H 126 8.332 8.767 -0.435 1
1 1425 . 4 1 1 A 126 126 SER HA H 126 4.464 4.545 -0.081 1
1 1428 . 4 1 1 A 126 126 SER C C 126 173.980 174.693 -0.713 1
1 1429 . 4 1 1 A 126 126 SER CA C 126 58.336 58.952 -0.616 1
1 1430 . 4 1 1 A 126 126 SER CB C 126 63.925 63.217 0.708 1
1 1431 . 4 1 1 A 126 126 SER N N 126 118.037 120.401 -2.364 1
1 1 . 5 1 1 A 6 6 SER HA H 6 4.458 4.681 -0.223 1
1 3 . 5 1 1 A 6 6 SER C C 6 175.108 175.037 0.071 1
1 4 . 5 1 1 A 6 6 SER CA C 6 58.689 57.192 1.497 1
1 5 . 5 1 1 A 6 6 SER CB C 6 63.678 63.130 0.548 1
1 6 . 5 1 1 A 7 7 GLY H H 7 8.449 8.710 -0.261 1
1 7 . 5 1 1 A 7 7 GLY HA2 H 7 3.965 3.877 0.088 1
1 8 . 5 1 1 A 7 7 GLY HA3 H 7 3.965 3.878 0.087 1
1 9 . 5 1 1 A 7 7 GLY C C 7 174.380 174.125 0.255 1
1 10 . 5 1 1 A 7 7 GLY CA C 7 45.435 46.644 -1.209 1
1 11 . 5 1 1 A 7 7 GLY N N 7 110.792 114.531 -3.739 1
1 12 . 5 1 1 A 8 8 MET H H 8 8.259 7.804 0.455 1
1 13 . 5 1 1 A 8 8 MET HA H 8 4.487 4.679 -0.192 1
1 21 . 5 1 1 A 8 8 MET C C 8 176.961 176.173 0.788 1
1 22 . 5 1 1 A 8 8 MET CA C 8 55.565 54.133 1.432 1
1 23 . 5 1 1 A 8 8 MET CB C 8 32.835 34.315 -1.480 1
1 26 . 5 1 1 A 8 8 MET N N 8 119.639 120.160 -0.521 1
1 27 . 5 1 1 A 9 9 GLY H H 9 8.472 8.593 -0.121 1
1 28 . 5 1 1 A 9 9 GLY HA2 H 9 3.946 4.077 -0.131 1
1 29 . 5 1 1 A 9 9 GLY HA3 H 9 3.946 4.087 -0.141 1
1 30 . 5 1 1 A 9 9 GLY C C 9 174.005 172.480 1.525 1
1 31 . 5 1 1 A 9 9 GLY CA C 9 45.488 45.477 0.011 1
1 32 . 5 1 1 A 9 9 GLY N N 9 110.107 113.839 -3.732 1
1 33 . 5 1 1 A 10 10 ASP H H 10 8.292 8.487 -0.195 1
1 34 . 5 1 1 A 10 10 ASP HA H 10 4.636 5.395 -0.759 1
1 37 . 5 1 1 A 10 10 ASP C C 10 176.768 175.127 1.641 1
1 38 . 5 1 1 A 10 10 ASP CA C 10 54.206 52.754 1.452 1
1 39 . 5 1 1 A 10 10 ASP CB C 10 41.306 42.441 -1.135 1
1 40 . 5 1 1 A 10 10 ASP N N 10 120.370 118.936 1.434 1
1 41 . 5 1 1 A 11 11 GLY H H 11 8.452 8.386 0.066 1
1 42 . 5 1 1 A 11 11 GLY HA2 H 11 3.980 4.104 -0.124 1
1 43 . 5 1 1 A 11 11 GLY HA3 H 11 4.022 4.171 -0.149 1
1 44 . 5 1 1 A 11 11 GLY C C 11 174.102 174.311 -0.209 1
1 45 . 5 1 1 A 11 11 GLY CA C 11 45.170 46.251 -1.081 1
1 46 . 5 1 1 A 11 11 GLY N N 11 108.391 108.973 -0.582 1
1 47 . 5 1 1 A 12 12 ALA H H 12 8.293 8.084 0.209 1
1 48 . 5 1 1 A 12 12 ALA HA H 12 3.777 4.441 -0.664 1
1 52 . 5 1 1 A 12 12 ALA C C 12 178.193 177.831 0.362 1
1 53 . 5 1 1 A 12 12 ALA CA C 12 52.759 51.889 0.870 1
1 54 . 5 1 1 A 12 12 ALA CB C 12 17.855 18.804 -0.949 1
1 55 . 5 1 1 A 12 12 ALA N N 12 124.185 123.949 0.236 1
1 56 . 5 1 1 A 13 13 VAL H H 13 8.822 8.593 0.229 1
1 57 . 5 1 1 A 13 13 VAL HA H 13 3.912 3.820 0.092 1
1 65 . 5 1 1 A 13 13 VAL C C 13 176.073 175.753 0.320 1
1 66 . 5 1 1 A 13 13 VAL CA C 13 63.100 65.648 -2.548 1
1 67 . 5 1 1 A 13 13 VAL CB C 13 32.711 31.883 0.828 1
1 70 . 5 1 1 A 13 13 VAL N N 13 120.877 124.016 -3.139 1
1 71 . 5 1 1 A 14 14 LYS H H 14 7.093 7.215 -0.122 1
1 72 . 5 1 1 A 14 14 LYS HA H 14 4.169 4.720 -0.551 1
1 81 . 5 1 1 A 14 14 LYS C C 14 173.291 174.391 -1.100 1
1 82 . 5 1 1 A 14 14 LYS CA C 14 56.465 54.893 1.572 1
1 83 . 5 1 1 A 14 14 LYS CB C 14 35.960 35.291 0.669 1
1 87 . 5 1 1 A 14 14 LYS N N 14 118.693 119.452 -0.759 1
1 88 . 5 1 1 A 15 15 GLN H H 15 8.522 8.519 0.003 1
1 89 . 5 1 1 A 15 15 GLN HA H 15 5.542 5.156 0.386 1
1 96 . 5 1 1 A 15 15 GLN C C 15 174.992 175.786 -0.794 1
1 97 . 5 1 1 A 15 15 GLN CA C 15 54.312 54.130 0.182 1
1 98 . 5 1 1 A 15 15 GLN CB C 15 33.585 31.481 2.104 1
1 100 . 5 1 1 A 15 15 GLN N N 15 124.024 125.087 -1.063 1
1 102 . 5 1 1 A 16 16 GLY H H 16 8.740 8.144 0.596 1
1 103 . 5 1 1 A 16 16 GLY HA2 H 16 4.511 3.785 0.726 1
1 104 . 5 1 1 A 16 16 GLY HA3 H 16 4.064 4.387 -0.323 1
1 105 . 5 1 1 A 16 16 GLY C C 16 171.431 171.288 0.143 1
1 106 . 5 1 1 A 16 16 GLY CA C 16 46.106 45.851 0.255 1
1 107 . 5 1 1 A 16 16 GLY N N 16 109.611 109.099 0.512 1
1 108 . 5 1 1 A 17 17 PHE H H 17 8.886 8.367 0.519 1
1 109 . 5 1 1 A 17 17 PHE HA H 17 5.466 5.119 0.347 1
1 114 . 5 1 1 A 17 17 PHE C C 17 174.795 174.283 0.512 1
1 115 . 5 1 1 A 17 17 PHE CA C 17 57.788 56.148 1.640 1
1 116 . 5 1 1 A 17 17 PHE CB C 17 41.315 41.771 -0.456 1
1 119 . 5 1 1 A 17 17 PHE N N 17 122.684 119.324 3.360 1
1 120 . 5 1 1 A 18 18 LEU H H 18 8.762 9.074 -0.312 1
1 121 . 5 1 1 A 18 18 LEU HA H 18 4.946 4.839 0.107 1
1 131 . 5 1 1 A 18 18 LEU C C 18 175.461 175.328 0.133 1
1 132 . 5 1 1 A 18 18 LEU CA C 18 52.970 53.626 -0.656 1
1 133 . 5 1 1 A 18 18 LEU CB C 18 47.945 44.054 3.891 1
1 137 . 5 1 1 A 18 18 LEU N N 18 119.045 124.156 -5.111 1
1 138 . 5 1 1 A 19 19 TYR H H 19 9.272 8.516 0.756 1
1 139 . 5 1 1 A 19 19 TYR HA H 19 5.682 5.505 0.177 1
1 146 . 5 1 1 A 19 19 TYR C C 19 174.829 174.894 -0.065 1
1 147 . 5 1 1 A 19 19 TYR CA C 19 56.482 56.988 -0.506 1
1 148 . 5 1 1 A 19 19 TYR CB C 19 41.717 40.769 0.948 1
1 153 . 5 1 1 A 19 19 TYR N N 19 118.024 123.563 -5.539 1
1 154 . 5 1 1 A 20 20 LEU H H 20 9.441 8.983 0.458 1
1 155 . 5 1 1 A 20 20 LEU HA H 20 5.283 5.446 -0.163 1
1 165 . 5 1 1 A 20 20 LEU C C 20 175.935 174.478 1.457 1
1 166 . 5 1 1 A 20 20 LEU CA C 20 53.464 54.028 -0.564 1
1 167 . 5 1 1 A 20 20 LEU CB C 20 46.570 46.230 0.340 1
1 171 . 5 1 1 A 20 20 LEU N N 20 122.838 125.038 -2.200 1
1 172 . 5 1 1 A 21 21 GLN H H 21 8.391 8.468 -0.077 1
1 173 . 5 1 1 A 21 21 GLN HA H 21 3.791 4.222 -0.431 1
1 180 . 5 1 1 A 21 21 GLN C C 21 175.157 174.965 0.192 1
1 181 . 5 1 1 A 21 21 GLN CA C 21 56.094 55.178 0.916 1
1 182 . 5 1 1 A 21 21 GLN CB C 21 28.434 29.204 -0.770 1
1 184 . 5 1 1 A 21 21 GLN N N 21 129.943 127.594 2.349 1
1 186 . 5 1 1 A 22 22 GLN H H 22 8.829 8.404 0.425 1
1 187 . 5 1 1 A 22 22 GLN HA H 22 4.553 4.787 -0.234 1
1 194 . 5 1 1 A 22 22 GLN C C 22 174.998 174.547 0.451 1
1 195 . 5 1 1 A 22 22 GLN CA C 22 54.912 54.208 0.704 1
1 196 . 5 1 1 A 22 22 GLN CB C 22 31.930 32.374 -0.444 1
1 198 . 5 1 1 A 22 22 GLN N N 22 127.199 124.431 2.768 1
1 200 . 5 1 1 A 23 23 GLN HA H 23 4.142 4.276 -0.134 1
1 207 . 5 1 1 A 23 23 GLN CA C 23 56.427 56.484 -0.057 1
1 208 . 5 1 1 A 23 23 GLN CB C 23 29.227 29.759 -0.532 1
1 211 . 5 1 1 A 24 24 GLN HA H 24 4.523 4.768 -0.245 1
1 218 . 5 1 1 A 24 24 GLN CB C 24 29.759 32.593 -2.834 1
1 221 . 5 1 1 A 25 25 THR HA H 25 3.870 3.802 0.068 1
1 226 . 5 1 1 A 25 25 THR CA C 25 65.096 66.662 -1.566 1
1 227 . 5 1 1 A 25 25 THR CB C 25 68.924 68.556 0.368 1
1 229 . 5 1 1 A 26 26 PHE HA H 26 4.690 4.261 0.429 1
1 236 . 5 1 1 A 26 26 PHE C C 26 175.523 175.955 -0.432 1
1 237 . 5 1 1 A 26 26 PHE CA C 26 57.312 60.689 -3.377 1
1 238 . 5 1 1 A 26 26 PHE CB C 26 39.003 39.635 -0.632 1
1 243 . 5 1 1 A 27 27 GLY H H 27 7.755 7.587 0.168 1
1 244 . 5 1 1 A 27 27 GLY HA2 H 27 4.172 4.102 0.070 1
1 245 . 5 1 1 A 27 27 GLY HA3 H 27 3.783 4.120 -0.337 1
1 246 . 5 1 1 A 27 27 GLY C C 27 172.557 171.760 0.797 1
1 247 . 5 1 1 A 27 27 GLY CA C 27 44.924 46.192 -1.268 1
1 248 . 5 1 1 A 27 27 GLY N N 27 109.216 104.214 5.002 1
1 249 . 5 1 1 A 28 28 LYS H H 28 8.241 8.321 -0.080 1
1 250 . 5 1 1 A 28 28 LYS HA H 28 4.530 4.930 -0.400 1
1 259 . 5 1 1 A 28 28 LYS C C 28 176.204 174.457 1.747 1
1 260 . 5 1 1 A 28 28 LYS CA C 28 55.741 54.578 1.163 1
1 261 . 5 1 1 A 28 28 LYS CB C 28 33.904 35.236 -1.332 1
1 265 . 5 1 1 A 28 28 LYS N N 28 118.743 122.843 -4.100 1
1 266 . 5 1 1 A 29 29 LYS H H 29 8.356 8.261 0.095 1
1 267 . 5 1 1 A 29 29 LYS HA H 29 4.559 4.993 -0.434 1
1 274 . 5 1 1 A 29 29 LYS C C 29 175.420 175.366 0.054 1
1 275 . 5 1 1 A 29 29 LYS CA C 29 55.406 54.835 0.571 1
1 276 . 5 1 1 A 29 29 LYS CB C 29 35.618 36.193 -0.575 1
1 280 . 5 1 1 A 29 29 LYS N N 29 121.198 123.019 -1.821 1
1 281 . 5 1 1 A 30 30 TRP H H 30 8.891 8.649 0.242 1
1 282 . 5 1 1 A 30 30 TRP HA H 30 4.951 4.965 -0.014 1
1 291 . 5 1 1 A 30 30 TRP C C 30 175.902 176.454 -0.552 1
1 292 . 5 1 1 A 30 30 TRP CA C 30 56.677 57.329 -0.652 1
1 293 . 5 1 1 A 30 30 TRP CB C 30 30.614 30.807 -0.193 1
1 299 . 5 1 1 A 30 30 TRP N N 30 123.304 127.203 -3.899 1
1 301 . 5 1 1 A 31 31 ARG H H 31 8.712 8.821 -0.109 1
1 302 . 5 1 1 A 31 31 ARG HA H 31 4.820 5.072 -0.252 1
1 309 . 5 1 1 A 31 31 ARG C C 31 174.026 174.463 -0.437 1
1 310 . 5 1 1 A 31 31 ARG CA C 31 54.895 54.019 0.876 1
1 311 . 5 1 1 A 31 31 ARG CB C 31 34.045 34.194 -0.149 1
1 314 . 5 1 1 A 31 31 ARG N N 31 123.973 120.794 3.179 1
1 315 . 5 1 1 A 32 32 ARG H H 32 8.820 8.181 0.639 1
1 316 . 5 1 1 A 32 32 ARG HA H 32 3.965 4.834 -0.869 1
1 323 . 5 1 1 A 32 32 ARG C C 32 174.785 174.959 -0.174 1
1 324 . 5 1 1 A 32 32 ARG CA C 32 56.924 55.084 1.840 1
1 325 . 5 1 1 A 32 32 ARG CB C 32 31.806 32.742 -0.936 1
1 328 . 5 1 1 A 32 32 ARG N N 32 127.041 121.108 5.933 1
1 329 . 5 1 1 A 33 33 PHE H H 33 9.372 8.887 0.485 1
1 330 . 5 1 1 A 33 33 PHE HA H 33 4.863 4.945 -0.082 1
1 338 . 5 1 1 A 33 33 PHE C C 33 176.359 175.125 1.234 1
1 339 . 5 1 1 A 33 33 PHE CA C 33 57.224 56.799 0.425 1
1 340 . 5 1 1 A 33 33 PHE CB C 33 43.385 43.281 0.104 1
1 346 . 5 1 1 A 33 33 PHE N N 33 125.882 119.672 6.210 1
1 347 . 5 1 1 A 34 34 GLY H H 34 9.160 9.078 0.082 1
1 348 . 5 1 1 A 34 34 GLY HA2 H 34 4.182 4.178 0.004 1
1 349 . 5 1 1 A 34 34 GLY HA3 H 34 3.714 4.285 -0.571 1
1 350 . 5 1 1 A 34 34 GLY C C 34 172.920 172.887 0.033 1
1 351 . 5 1 1 A 34 34 GLY CA C 34 46.247 45.618 0.629 1
1 352 . 5 1 1 A 34 34 GLY N N 34 108.654 110.374 -1.720 1
1 353 . 5 1 1 A 35 35 ALA H H 35 8.982 8.693 0.289 1
1 354 . 5 1 1 A 35 35 ALA HA H 35 5.660 5.623 0.037 1
1 358 . 5 1 1 A 35 35 ALA C C 35 176.547 176.010 0.537 1
1 359 . 5 1 1 A 35 35 ALA CA C 35 50.500 50.567 -0.067 1
1 360 . 5 1 1 A 35 35 ALA CB C 35 24.034 21.776 2.258 1
1 361 . 5 1 1 A 35 35 ALA N N 35 130.076 127.862 2.214 1
1 362 . 5 1 1 A 36 36 SER H H 36 8.852 8.381 0.471 1
1 363 . 5 1 1 A 36 36 SER HA H 36 5.203 4.957 0.246 1
1 366 . 5 1 1 A 36 36 SER C C 36 170.939 172.391 -1.452 1
1 367 . 5 1 1 A 36 36 SER CA C 36 57.806 57.478 0.328 1
1 368 . 5 1 1 A 36 36 SER CB C 36 66.986 65.651 1.335 1
1 369 . 5 1 1 A 36 36 SER N N 36 116.620 116.958 -0.338 1
1 370 . 5 1 1 A 37 37 LEU H H 37 8.862 8.828 0.034 1
1 371 . 5 1 1 A 37 37 LEU HA H 37 5.163 4.820 0.343 1
1 381 . 5 1 1 A 37 37 LEU C C 37 173.525 174.009 -0.484 1
1 382 . 5 1 1 A 37 37 LEU CA C 37 53.112 53.614 -0.502 1
1 383 . 5 1 1 A 37 37 LEU CB C 37 46.077 43.671 2.406 1
1 387 . 5 1 1 A 37 37 LEU N N 37 127.638 129.079 -1.441 1
1 388 . 5 1 1 A 38 38 TYR H H 38 9.280 9.012 0.268 1
1 389 . 5 1 1 A 38 38 TYR HA H 38 4.820 5.261 -0.441 1
1 396 . 5 1 1 A 38 38 TYR C C 38 175.430 175.296 0.134 1
1 397 . 5 1 1 A 38 38 TYR CA C 38 57.436 56.266 1.170 1
1 398 . 5 1 1 A 38 38 TYR CB C 38 42.128 41.582 0.546 1
1 403 . 5 1 1 A 38 38 TYR N N 38 125.215 126.022 -0.807 1
1 404 . 5 1 1 A 39 39 GLY H H 39 8.532 8.556 -0.024 1
1 405 . 5 1 1 A 39 39 GLY HA2 H 39 4.220 4.142 0.078 1
1 406 . 5 1 1 A 39 39 GLY HA3 H 39 3.941 4.143 -0.202 1
1 407 . 5 1 1 A 39 39 GLY C C 39 172.950 174.019 -1.069 1
1 408 . 5 1 1 A 39 39 GLY CA C 39 44.817 44.541 0.276 1
1 409 . 5 1 1 A 39 39 GLY N N 39 106.424 109.782 -3.358 1
1 410 . 5 1 1 A 40 40 GLY H H 40 8.477 8.514 -0.037 1
1 411 . 5 1 1 A 40 40 GLY HA2 H 40 4.102 3.961 0.141 1
1 412 . 5 1 1 A 40 40 GLY HA3 H 40 3.927 3.966 -0.039 1
1 413 . 5 1 1 A 40 40 GLY C C 40 174.002 175.868 -1.866 1
1 414 . 5 1 1 A 40 40 GLY CA C 40 44.694 46.435 -1.741 1
1 415 . 5 1 1 A 40 40 GLY N N 40 106.881 109.278 -2.397 1
1 416 . 5 1 1 A 41 41 SER H H 41 8.600 8.735 -0.135 1
1 417 . 5 1 1 A 41 41 SER HA H 41 4.520 4.142 0.378 1
1 420 . 5 1 1 A 41 41 SER C C 41 174.355 175.155 -0.800 1
1 421 . 5 1 1 A 41 41 SER CA C 41 58.565 62.670 -4.105 1
1 422 . 5 1 1 A 41 41 SER CB C 41 64.413 62.949 1.464 1
1 423 . 5 1 1 A 41 41 SER N N 41 115.751 121.365 -5.614 1
1 424 . 5 1 1 A 42 42 ASP H H 42 8.533 8.004 0.529 1
1 425 . 5 1 1 A 42 42 ASP HA H 42 4.560 4.540 0.020 1
1 428 . 5 1 1 A 42 42 ASP CA C 42 55.230 55.178 0.052 1
1 429 . 5 1 1 A 42 42 ASP CB C 42 40.648 41.017 -0.369 1
1 430 . 5 1 1 A 42 42 ASP N N 42 119.037 119.734 -0.697 1
1 431 . 5 1 1 A 43 43 CYS H H 43 8.152 8.531 -0.379 1
1 432 . 5 1 1 A 43 43 CYS HA H 43 4.541 4.459 0.082 1
1 435 . 5 1 1 A 43 43 CYS C C 43 173.975 173.858 0.117 1
1 436 . 5 1 1 A 43 43 CYS CA C 43 58.265 59.130 -0.865 1
1 437 . 5 1 1 A 43 43 CYS CB C 43 28.393 27.043 1.350 1
1 438 . 5 1 1 A 43 43 CYS N N 43 116.881 123.458 -6.577 1
1 439 . 5 1 1 A 44 44 ALA H H 44 8.047 8.010 0.037 1
1 440 . 5 1 1 A 44 44 ALA HA H 44 4.395 4.773 -0.378 1
1 444 . 5 1 1 A 44 44 ALA C C 44 176.472 176.048 0.424 1
1 445 . 5 1 1 A 44 44 ALA CA C 44 52.688 51.129 1.559 1
1 446 . 5 1 1 A 44 44 ALA CB C 44 20.579 23.221 -2.642 1
1 447 . 5 1 1 A 44 44 ALA N N 44 125.989 129.273 -3.284 1
1 448 . 5 1 1 A 45 45 LEU H H 45 8.052 8.764 -0.712 1
1 449 . 5 1 1 A 45 45 LEU HA H 45 4.452 4.701 -0.249 1
1 459 . 5 1 1 A 45 45 LEU C C 45 176.196 176.607 -0.411 1
1 460 . 5 1 1 A 45 45 LEU CA C 45 53.771 54.182 -0.411 1
1 461 . 5 1 1 A 45 45 LEU CB C 45 43.116 42.204 0.912 1
1 465 . 5 1 1 A 45 45 LEU N N 45 119.889 119.968 -0.079 1
1 466 . 5 1 1 A 46 46 ALA H H 46 8.381 8.481 -0.100 1
1 467 . 5 1 1 A 46 46 ALA HA H 46 4.449 4.519 -0.070 1
1 471 . 5 1 1 A 46 46 ALA C C 46 179.093 177.016 2.077 1
1 472 . 5 1 1 A 46 46 ALA CA C 46 52.829 52.290 0.539 1
1 473 . 5 1 1 A 46 46 ALA CB C 46 18.687 19.698 -1.011 1
1 474 . 5 1 1 A 46 46 ALA N N 46 125.635 128.600 -2.965 1
1 475 . 5 1 1 A 47 47 ARG H H 47 9.012 8.902 0.110 1
1 476 . 5 1 1 A 47 47 ARG HA H 47 5.192 5.070 0.122 1
1 484 . 5 1 1 A 47 47 ARG C C 47 171.524 173.847 -2.323 1
1 485 . 5 1 1 A 47 47 ARG CA C 47 55.265 54.957 0.308 1
1 486 . 5 1 1 A 47 47 ARG CB C 47 30.970 34.045 -3.075 1
1 489 . 5 1 1 A 47 47 ARG N N 47 120.048 118.031 2.017 1
1 491 . 5 1 1 A 48 48 LEU H H 48 9.029 8.634 0.395 1
1 492 . 5 1 1 A 48 48 LEU HA H 48 5.221 5.007 0.214 1
1 502 . 5 1 1 A 48 48 LEU C C 48 174.348 175.008 -0.660 1
1 503 . 5 1 1 A 48 48 LEU CA C 48 53.253 53.979 -0.726 1
1 504 . 5 1 1 A 48 48 LEU CB C 48 45.419 43.804 1.615 1
1 508 . 5 1 1 A 48 48 LEU N N 48 123.315 123.725 -0.410 1
1 509 . 5 1 1 A 49 49 GLU H H 49 9.473 8.635 0.838 1
1 510 . 5 1 1 A 49 49 GLU HA H 49 5.222 4.840 0.382 1
1 515 . 5 1 1 A 49 49 GLU C C 49 175.507 175.559 -0.052 1
1 516 . 5 1 1 A 49 49 GLU CA C 49 55.159 55.487 -0.328 1
1 517 . 5 1 1 A 49 49 GLU CB C 49 32.341 31.482 0.859 1
1 519 . 5 1 1 A 49 49 GLU N N 49 124.751 126.901 -2.150 1
1 520 . 5 1 1 A 50 50 LEU H H 50 9.088 9.457 -0.369 1
1 521 . 5 1 1 A 50 50 LEU HA H 50 5.382 5.279 0.103 1
1 531 . 5 1 1 A 50 50 LEU C C 50 175.474 175.726 -0.252 1
1 532 . 5 1 1 A 50 50 LEU CA C 50 52.865 53.222 -0.357 1
1 533 . 5 1 1 A 50 50 LEU CB C 50 43.239 45.016 -1.777 1
1 537 . 5 1 1 A 50 50 LEU N N 50 124.221 125.396 -1.175 1
1 538 . 5 1 1 A 51 51 GLN H H 51 9.602 8.796 0.806 1
1 539 . 5 1 1 A 51 51 GLN HA H 51 5.095 5.035 0.060 1
1 546 . 5 1 1 A 51 51 GLN C C 51 175.306 173.883 1.423 1
1 547 . 5 1 1 A 51 51 GLN CA C 51 54.576 53.734 0.842 1
1 548 . 5 1 1 A 51 51 GLN CB C 51 32.177 32.624 -0.447 1
1 550 . 5 1 1 A 51 51 GLN N N 51 123.268 121.003 2.265 1
1 552 . 5 1 1 A 52 52 GLU H H 52 9.172 8.895 0.277 1
1 553 . 5 1 1 A 52 52 GLU HA H 52 4.092 5.140 -1.048 1
1 558 . 5 1 1 A 52 52 GLU C C 52 176.523 175.892 0.631 1
1 559 . 5 1 1 A 52 52 GLU CA C 52 57.500 55.320 2.180 1
1 560 . 5 1 1 A 52 52 GLU CB C 52 30.696 32.225 -1.529 1
1 562 . 5 1 1 A 52 52 GLU N N 52 128.982 122.590 6.392 1
1 563 . 5 1 1 A 53 53 GLY H H 53 8.644 8.838 -0.194 1
1 564 . 5 1 1 A 53 53 GLY HA2 H 53 4.261 4.419 -0.158 1
1 565 . 5 1 1 A 53 53 GLY HA3 H 53 3.993 4.446 -0.453 1
1 566 . 5 1 1 A 53 53 GLY C C 53 172.550 172.127 0.423 1
1 567 . 5 1 1 A 53 53 GLY CA C 53 45.911 46.654 -0.743 1
1 568 . 5 1 1 A 53 53 GLY N N 53 110.844 112.504 -1.660 1
1 569 . 5 1 1 A 54 54 PRO HA H 54 4.392 4.659 -0.267 1
1 576 . 5 1 1 A 54 54 PRO C C 54 176.828 176.564 0.264 1
1 577 . 5 1 1 A 54 54 PRO CA C 54 63.665 62.455 1.210 1
1 578 . 5 1 1 A 54 54 PRO CB C 54 32.012 33.261 -1.249 1
1 581 . 5 1 1 A 55 55 GLU H H 55 8.934 9.073 -0.139 1
1 582 . 5 1 1 A 55 55 GLU HA H 55 4.193 4.191 0.002 1
1 587 . 5 1 1 A 55 55 GLU C C 55 176.189 176.110 0.079 1
1 588 . 5 1 1 A 55 55 GLU CA C 55 57.383 59.927 -2.544 1
1 589 . 5 1 1 A 55 55 GLU CB C 55 28.945 30.812 -1.867 1
1 591 . 5 1 1 A 55 55 GLU N N 55 120.312 119.332 0.980 1
1 592 . 5 1 1 A 56 56 LYS H H 56 7.937 7.750 0.187 1
1 593 . 5 1 1 A 56 56 LYS HA H 56 4.578 4.755 -0.177 1
1 602 . 5 1 1 A 56 56 LYS C C 56 174.295 174.244 0.051 1
1 603 . 5 1 1 A 56 56 LYS CA C 56 54.171 52.735 1.436 1
1 604 . 5 1 1 A 56 56 LYS CB C 56 32.555 36.136 -3.581 1
1 608 . 5 1 1 A 56 56 LYS N N 56 122.008 118.516 3.492 1
1 609 . 5 1 1 A 57 57 PRO HA H 57 4.370 4.732 -0.362 1
1 616 . 5 1 1 A 57 57 PRO CA C 57 63.431 62.667 0.764 1
1 617 . 5 1 1 A 57 57 PRO CB C 57 32.072 30.704 1.368 1
1 620 . 5 1 1 A 58 58 ARG H H 58 8.310 8.484 -0.174 1
1 621 . 5 1 1 A 58 58 ARG HA H 58 4.295 4.728 -0.433 1
1 628 . 5 1 1 A 58 58 ARG CA C 58 56.570 55.306 1.264 1
1 629 . 5 1 1 A 58 58 ARG CB C 58 30.860 31.757 -0.897 1
1 632 . 5 1 1 A 58 58 ARG N N 58 120.045 123.670 -3.625 1
1 633 . 5 1 1 A 60 60 CYS HA H 60 4.482 4.339 0.143 1
1 636 . 5 1 1 A 60 60 CYS CA C 60 58.621 62.277 -3.656 1
1 637 . 5 1 1 A 60 60 CYS CB C 60 28.267 27.926 0.341 1
1 638 . 5 1 1 A 61 61 GLU HA H 61 4.226 4.836 -0.610 1
1 643 . 5 1 1 A 61 61 GLU C C 61 176.299 175.002 1.297 1
1 644 . 5 1 1 A 61 61 GLU CA C 61 57.100 55.220 1.880 1
1 645 . 5 1 1 A 61 61 GLU CB C 61 29.873 31.458 -1.585 1
1 647 . 5 1 1 A 62 62 ALA H H 62 8.282 8.805 -0.523 1
1 648 . 5 1 1 A 62 62 ALA HA H 62 4.302 4.947 -0.645 1
1 652 . 5 1 1 A 62 62 ALA C C 62 177.277 175.600 1.677 1
1 653 . 5 1 1 A 62 62 ALA CA C 62 52.512 51.316 1.196 1
1 654 . 5 1 1 A 62 62 ALA CB C 62 19.592 23.808 -4.216 1
1 655 . 5 1 1 A 62 62 ALA N N 62 124.386 125.804 -1.418 1
1 656 . 5 1 1 A 63 63 ALA H H 63 8.399 8.573 -0.174 1
1 657 . 5 1 1 A 63 63 ALA HA H 63 4.375 4.904 -0.529 1
1 661 . 5 1 1 A 63 63 ALA C C 63 176.843 175.582 1.261 1
1 662 . 5 1 1 A 63 63 ALA CA C 63 52.658 51.757 0.901 1
1 663 . 5 1 1 A 63 63 ALA CB C 63 19.592 22.999 -3.407 1
1 664 . 5 1 1 A 63 63 ALA N N 63 123.892 119.224 4.668 1
1 665 . 5 1 1 A 64 64 ARG H H 64 8.152 8.888 -0.736 1
1 666 . 5 1 1 A 64 64 ARG HA H 64 5.008 5.150 -0.142 1
1 673 . 5 1 1 A 64 64 ARG C C 64 175.594 175.072 0.522 1
1 674 . 5 1 1 A 64 64 ARG CA C 64 55.282 54.557 0.725 1
1 675 . 5 1 1 A 64 64 ARG CB C 64 32.506 33.619 -1.113 1
1 678 . 5 1 1 A 64 64 ARG N N 64 119.787 123.133 -3.346 1
1 679 . 5 1 1 A 65 65 LYS H H 65 8.945 8.487 0.458 1
1 680 . 5 1 1 A 65 65 LYS HA H 65 4.602 5.119 -0.517 1
1 689 . 5 1 1 A 65 65 LYS C C 65 174.657 174.508 0.149 1
1 690 . 5 1 1 A 65 65 LYS CA C 65 54.948 54.818 0.130 1
1 691 . 5 1 1 A 65 65 LYS CB C 65 34.068 34.823 -0.755 1
1 695 . 5 1 1 A 65 65 LYS N N 65 124.171 122.054 2.117 1
1 696 . 5 1 1 A 66 66 VAL H H 66 8.672 8.970 -0.298 1
1 697 . 5 1 1 A 66 66 VAL HA H 66 4.532 5.306 -0.774 1
1 705 . 5 1 1 A 66 66 VAL C C 66 175.078 174.126 0.952 1
1 706 . 5 1 1 A 66 66 VAL CA C 66 61.865 59.596 2.269 1
1 707 . 5 1 1 A 66 66 VAL CB C 66 33.835 35.217 -1.382 1
1 710 . 5 1 1 A 66 66 VAL N N 66 124.380 122.807 1.573 1
1 711 . 5 1 1 A 67 67 ILE H H 67 9.071 9.177 -0.106 1
1 712 . 5 1 1 A 67 67 ILE HA H 67 4.142 4.697 -0.555 1
1 722 . 5 1 1 A 67 67 ILE C C 67 175.819 175.582 0.237 1
1 723 . 5 1 1 A 67 67 ILE CA C 67 60.383 60.570 -0.187 1
1 724 . 5 1 1 A 67 67 ILE CB C 67 39.908 39.714 0.194 1
1 728 . 5 1 1 A 67 67 ILE N N 67 129.537 128.230 1.307 1
1 729 . 5 1 1 A 68 68 ARG H H 68 9.203 8.658 0.545 1
1 730 . 5 1 1 A 68 68 ARG HA H 68 4.198 4.296 -0.098 1
1 737 . 5 1 1 A 68 68 ARG C C 68 177.769 176.957 0.812 1
1 738 . 5 1 1 A 68 68 ARG CA C 68 56.835 57.036 -0.201 1
1 739 . 5 1 1 A 68 68 ARG CB C 68 29.832 30.610 -0.778 1
1 742 . 5 1 1 A 68 68 ARG N N 68 128.484 127.578 0.906 1
1 743 . 5 1 1 A 69 69 LEU H H 69 8.212 8.593 -0.381 1
1 744 . 5 1 1 A 69 69 LEU HA H 69 4.221 4.253 -0.032 1
1 754 . 5 1 1 A 69 69 LEU C C 69 178.996 178.372 0.624 1
1 755 . 5 1 1 A 69 69 LEU CA C 69 57.136 55.826 1.310 1
1 756 . 5 1 1 A 69 69 LEU CB C 69 39.455 42.002 -2.547 1
1 760 . 5 1 1 A 69 69 LEU N N 69 123.807 123.223 0.584 1
1 761 . 5 1 1 A 70 70 SER H H 70 8.823 7.987 0.836 1
1 762 . 5 1 1 A 70 70 SER HA H 70 4.331 4.267 0.064 1
1 765 . 5 1 1 A 70 70 SER C C 70 175.076 174.851 0.225 1
1 766 . 5 1 1 A 70 70 SER CA C 70 60.329 60.132 0.197 1
1 767 . 5 1 1 A 70 70 SER CB C 70 62.362 63.167 -0.805 1
1 768 . 5 1 1 A 70 70 SER N N 70 115.162 113.262 1.900 1
1 769 . 5 1 1 A 71 71 ASP H H 71 7.602 8.307 -0.705 1
1 770 . 5 1 1 A 71 71 ASP HA H 71 4.820 4.629 0.191 1
1 773 . 5 1 1 A 71 71 ASP C C 71 176.478 176.443 0.035 1
1 774 . 5 1 1 A 71 71 ASP CA C 71 54.241 53.955 0.286 1
1 775 . 5 1 1 A 71 71 ASP CB C 71 41.347 41.513 -0.166 1
1 776 . 5 1 1 A 71 71 ASP N N 71 119.590 118.959 0.631 1
1 777 . 5 1 1 A 72 72 CYS H H 72 7.715 7.483 0.232 1
1 778 . 5 1 1 A 72 72 CYS HA H 72 4.372 4.560 -0.188 1
1 781 . 5 1 1 A 72 72 CYS C C 72 173.690 174.696 -1.006 1
1 782 . 5 1 1 A 72 72 CYS CA C 72 60.836 58.802 2.034 1
1 783 . 5 1 1 A 72 72 CYS CB C 72 27.655 27.446 0.209 1
1 784 . 5 1 1 A 72 72 CYS N N 72 118.346 120.426 -2.080 1
1 785 . 5 1 1 A 73 73 LEU H H 73 9.472 8.743 0.729 1
1 786 . 5 1 1 A 73 73 LEU HA H 73 4.593 4.002 0.591 1
1 796 . 5 1 1 A 73 73 LEU C C 73 177.562 176.771 0.791 1
1 797 . 5 1 1 A 73 73 LEU CA C 73 55.724 57.735 -2.011 1
1 798 . 5 1 1 A 73 73 LEU CB C 73 43.774 42.049 1.725 1
1 802 . 5 1 1 A 73 73 LEU N N 73 124.752 129.050 -4.298 1
1 803 . 5 1 1 A 74 74 ARG H H 74 7.658 7.274 0.384 1
1 804 . 5 1 1 A 74 74 ARG HA H 74 4.592 5.137 -0.545 1
1 811 . 5 1 1 A 74 74 ARG C C 74 173.605 174.342 -0.737 1
1 812 . 5 1 1 A 74 74 ARG CA C 74 56.465 55.884 0.581 1
1 813 . 5 1 1 A 74 74 ARG CB C 74 34.068 33.764 0.304 1
1 816 . 5 1 1 A 74 74 ARG N N 74 115.565 115.252 0.313 1
1 817 . 5 1 1 A 75 75 VAL H H 75 8.622 8.798 -0.176 1
1 818 . 5 1 1 A 75 75 VAL HA H 75 5.170 5.274 -0.104 1
1 826 . 5 1 1 A 75 75 VAL C C 75 173.985 174.379 -0.394 1
1 827 . 5 1 1 A 75 75 VAL CA C 75 60.930 59.282 1.648 1
1 828 . 5 1 1 A 75 75 VAL CB C 75 35.073 36.403 -1.330 1
1 831 . 5 1 1 A 75 75 VAL N N 75 124.278 119.169 5.109 1
1 832 . 5 1 1 A 76 76 ALA H H 76 8.272 8.887 -0.615 1
1 833 . 5 1 1 A 76 76 ALA HA H 76 4.648 4.908 -0.260 1
1 837 . 5 1 1 A 76 76 ALA C C 76 175.630 175.927 -0.297 1
1 838 . 5 1 1 A 76 76 ALA CA C 76 51.294 51.400 -0.106 1
1 839 . 5 1 1 A 76 76 ALA CB C 76 22.759 23.527 -0.768 1
1 840 . 5 1 1 A 76 76 ALA N N 76 126.015 123.068 2.947 1
1 841 . 5 1 1 A 77 77 GLU H H 77 9.184 8.624 0.560 1
1 842 . 5 1 1 A 77 77 GLU HA H 77 4.060 5.193 -1.133 1
1 847 . 5 1 1 A 77 77 GLU C C 77 174.949 176.070 -1.121 1
1 848 . 5 1 1 A 77 77 GLU CA C 77 58.424 55.515 2.909 1
1 849 . 5 1 1 A 77 77 GLU CB C 77 30.161 31.525 -1.364 1
1 851 . 5 1 1 A 77 77 GLU N N 77 120.223 118.524 1.699 1
1 852 . 5 1 1 A 78 78 ALA H H 78 7.985 9.025 -1.040 1
1 853 . 5 1 1 A 78 78 ALA HA H 78 4.776 5.401 -0.625 1
1 857 . 5 1 1 A 78 78 ALA C C 78 177.250 177.671 -0.421 1
1 858 . 5 1 1 A 78 78 ALA CA C 78 50.888 50.487 0.401 1
1 859 . 5 1 1 A 78 78 ALA CB C 78 20.851 22.487 -1.636 1
1 860 . 5 1 1 A 78 78 ALA N N 78 125.143 125.059 0.084 1
1 861 . 5 1 1 A 79 79 GLY H H 79 8.604 8.833 -0.229 1
1 862 . 5 1 1 A 79 79 GLY HA2 H 79 4.327 4.185 0.142 1
1 863 . 5 1 1 A 79 79 GLY HA3 H 79 3.963 4.188 -0.225 1
1 864 . 5 1 1 A 79 79 GLY C C 79 175.360 175.087 0.273 1
1 865 . 5 1 1 A 79 79 GLY CA C 79 44.925 44.587 0.338 1
1 866 . 5 1 1 A 79 79 GLY N N 79 109.420 106.484 2.936 1
1 867 . 5 1 1 A 80 80 GLY H H 80 8.649 8.877 -0.228 1
1 868 . 5 1 1 A 80 80 GLY HA2 H 80 3.962 3.826 0.136 1
1 869 . 5 1 1 A 80 80 GLY HA3 H 80 3.962 3.835 0.127 1
1 870 . 5 1 1 A 80 80 GLY C C 80 175.052 175.623 -0.571 1
1 871 . 5 1 1 A 80 80 GLY CA C 80 45.955 47.075 -1.120 1
1 872 . 5 1 1 A 80 80 GLY N N 80 108.295 107.842 0.453 1
1 873 . 5 1 1 A 81 81 GLU H H 81 8.921 8.382 0.539 1
1 874 . 5 1 1 A 81 81 GLU HA H 81 4.298 4.045 0.253 1
1 879 . 5 1 1 A 81 81 GLU C C 81 176.532 178.016 -1.484 1
1 880 . 5 1 1 A 81 81 GLU CA C 81 57.118 59.680 -2.562 1
1 881 . 5 1 1 A 81 81 GLU CB C 81 28.599 29.646 -1.047 1
1 883 . 5 1 1 A 81 81 GLU N N 81 121.170 121.645 -0.475 1
1 884 . 5 1 1 A 82 82 ALA H H 82 8.032 7.365 0.667 1
1 885 . 5 1 1 A 82 82 ALA HA H 82 4.371 4.218 0.153 1
1 889 . 5 1 1 A 82 82 ALA C C 82 177.160 178.492 -1.332 1
1 890 . 5 1 1 A 82 82 ALA CA C 82 52.653 52.760 -0.107 1
1 891 . 5 1 1 A 82 82 ALA CB C 82 19.304 19.973 -0.669 1
1 892 . 5 1 1 A 82 82 ALA N N 82 124.988 122.225 2.763 1
1 893 . 5 1 1 A 83 83 SER H H 83 8.319 8.929 -0.610 1
1 894 . 5 1 1 A 83 83 SER HA H 83 4.331 4.267 0.064 1
1 897 . 5 1 1 A 83 83 SER C C 83 174.045 175.184 -1.139 1
1 898 . 5 1 1 A 83 83 SER CA C 83 58.053 62.092 -4.039 1
1 899 . 5 1 1 A 83 83 SER CB C 83 63.184 62.805 0.379 1
1 900 . 5 1 1 A 83 83 SER N N 83 114.181 115.450 -1.269 1
1 901 . 5 1 1 A 84 84 SER H H 84 7.823 7.649 0.174 1
1 902 . 5 1 1 A 84 84 SER HA H 84 3.194 4.175 -0.981 1
1 905 . 5 1 1 A 84 84 SER C C 84 171.072 174.029 -2.957 1
1 906 . 5 1 1 A 84 84 SER CA C 84 57.206 56.907 0.299 1
1 907 . 5 1 1 A 84 84 SER CB C 84 61.622 63.190 -1.568 1
1 908 . 5 1 1 A 84 84 SER N N 84 117.302 115.091 2.211 1
1 909 . 5 1 1 A 85 85 PRO HA H 85 3.922 4.540 -0.618 1
1 916 . 5 1 1 A 85 85 PRO CA C 85 62.691 62.144 0.547 1
1 917 . 5 1 1 A 85 85 PRO CB C 85 31.515 32.829 -1.314 1
1 920 . 5 1 1 A 86 86 ARG HA H 86 3.882 4.328 -0.446 1
1 927 . 5 1 1 A 86 86 ARG C C 86 175.712 176.426 -0.714 1
1 928 . 5 1 1 A 86 86 ARG CA C 86 57.877 55.731 2.146 1
1 929 . 5 1 1 A 86 86 ARG CB C 86 29.791 31.454 -1.663 1
1 932 . 5 1 1 A 87 87 ASP H H 87 8.903 8.833 0.070 1
1 933 . 5 1 1 A 87 87 ASP HA H 87 4.342 4.205 0.137 1
1 936 . 5 1 1 A 87 87 ASP C C 87 175.723 174.878 0.845 1
1 937 . 5 1 1 A 87 87 ASP CA C 87 56.377 55.325 1.052 1
1 938 . 5 1 1 A 87 87 ASP CB C 87 39.208 39.851 -0.643 1
1 939 . 5 1 1 A 87 87 ASP N N 87 117.520 120.286 -2.766 1
1 940 . 5 1 1 A 88 88 THR H H 88 7.776 7.482 0.294 1
1 941 . 5 1 1 A 88 88 THR HA H 88 5.101 5.138 -0.037 1
1 946 . 5 1 1 A 88 88 THR C C 88 173.825 173.137 0.688 1
1 947 . 5 1 1 A 88 88 THR CA C 88 60.154 59.513 0.641 1
1 948 . 5 1 1 A 88 88 THR CB C 88 72.702 72.916 -0.214 1
1 950 . 5 1 1 A 88 88 THR N N 88 108.770 108.329 0.441 1
1 951 . 5 1 1 A 89 89 SER H H 89 9.006 9.393 -0.387 1
1 952 . 5 1 1 A 89 89 SER HA H 89 4.718 5.172 -0.454 1
1 955 . 5 1 1 A 89 89 SER C C 89 173.728 173.079 0.649 1
1 956 . 5 1 1 A 89 89 SER CA C 89 57.453 57.796 -0.343 1
1 957 . 5 1 1 A 89 89 SER CB C 89 65.611 65.705 -0.094 1
1 958 . 5 1 1 A 89 89 SER N N 89 114.151 117.517 -3.366 1
1 959 . 5 1 1 A 90 90 ALA H H 90 9.001 8.803 0.198 1
1 960 . 5 1 1 A 90 90 ALA HA H 90 5.660 4.683 0.977 1
1 964 . 5 1 1 A 90 90 ALA C C 90 177.669 177.271 0.398 1
1 965 . 5 1 1 A 90 90 ALA CA C 90 51.670 51.965 -0.295 1
1 966 . 5 1 1 A 90 90 ALA CB C 90 22.265 20.037 2.228 1
1 967 . 5 1 1 A 90 90 ALA N N 90 126.177 129.262 -3.085 1
1 968 . 5 1 1 A 91 91 PHE H H 91 9.672 8.298 1.374 1
1 969 . 5 1 1 A 91 91 PHE HA H 91 5.039 5.486 -0.447 1
1 977 . 5 1 1 A 91 91 PHE C C 91 170.731 172.961 -2.230 1
1 978 . 5 1 1 A 91 91 PHE CA C 91 56.271 55.182 1.089 1
1 979 . 5 1 1 A 91 91 PHE CB C 91 41.553 41.940 -0.387 1
1 985 . 5 1 1 A 91 91 PHE N N 91 118.968 116.414 2.554 1
1 986 . 5 1 1 A 92 92 PHE H H 92 9.422 9.347 0.075 1
1 987 . 5 1 1 A 92 92 PHE HA H 92 5.674 5.273 0.401 1
1 995 . 5 1 1 A 92 92 PHE C C 92 174.570 175.282 -0.712 1
1 996 . 5 1 1 A 92 92 PHE CA C 92 55.917 57.004 -1.087 1
1 997 . 5 1 1 A 92 92 PHE CB C 92 42.787 42.044 0.743 1
1 1003 . 5 1 1 A 92 92 PHE N N 92 117.543 117.524 0.019 1
1 1004 . 5 1 1 A 93 93 LEU H H 93 9.021 8.871 0.150 1
1 1005 . 5 1 1 A 93 93 LEU HA H 93 5.122 5.049 0.073 1
1 1015 . 5 1 1 A 93 93 LEU C C 93 174.799 174.234 0.565 1
1 1016 . 5 1 1 A 93 93 LEU CA C 93 54.912 54.672 0.240 1
1 1017 . 5 1 1 A 93 93 LEU CB C 93 45.254 45.206 0.048 1
1 1021 . 5 1 1 A 93 93 LEU N N 93 121.719 122.816 -1.097 1
1 1022 . 5 1 1 A 94 94 GLU H H 94 9.294 9.450 -0.156 1
1 1023 . 5 1 1 A 94 94 GLU HA H 94 5.043 5.176 -0.133 1
1 1028 . 5 1 1 A 94 94 GLU C C 94 175.754 175.513 0.241 1
1 1029 . 5 1 1 A 94 94 GLU CA C 94 56.018 55.071 0.947 1
1 1030 . 5 1 1 A 94 94 GLU CB C 94 32.752 32.330 0.422 1
1 1032 . 5 1 1 A 94 94 GLU N N 94 127.032 128.668 -1.636 1
1 1033 . 5 1 1 A 95 95 THR H H 95 8.822 8.486 0.336 1
1 1034 . 5 1 1 A 95 95 THR HA H 95 5.398 5.118 0.280 1
1 1039 . 5 1 1 A 95 95 THR C C 95 173.860 175.329 -1.469 1
1 1040 . 5 1 1 A 95 95 THR CA C 95 59.588 59.578 0.010 1
1 1041 . 5 1 1 A 95 95 THR CB C 95 72.191 72.057 0.134 1
1 1043 . 5 1 1 A 95 95 THR N N 95 118.685 117.972 0.713 1
1 1044 . 5 1 1 A 96 96 LYS H H 96 8.823 9.079 -0.256 1
1 1045 . 5 1 1 A 96 96 LYS HA H 96 4.022 3.950 0.072 1
1 1054 . 5 1 1 A 96 96 LYS C C 96 177.330 178.765 -1.435 1
1 1055 . 5 1 1 A 96 96 LYS CA C 96 59.588 60.000 -0.412 1
1 1056 . 5 1 1 A 96 96 LYS CB C 96 32.588 32.058 0.530 1
1 1060 . 5 1 1 A 96 96 LYS N N 96 118.801 122.362 -3.561 1
1 1061 . 5 1 1 A 97 97 GLU H H 97 8.092 7.760 0.332 1
1 1062 . 5 1 1 A 97 97 GLU HA H 97 4.282 4.203 0.079 1
1 1067 . 5 1 1 A 97 97 GLU C C 97 176.290 176.073 0.217 1
1 1068 . 5 1 1 A 97 97 GLU CA C 97 57.365 58.713 -1.348 1
1 1069 . 5 1 1 A 97 97 GLU CB C 97 31.559 30.973 0.586 1
1 1071 . 5 1 1 A 97 97 GLU N N 97 113.992 118.687 -4.695 1
1 1072 . 5 1 1 A 98 98 ARG H H 98 7.482 7.407 0.075 1
1 1073 . 5 1 1 A 98 98 ARG HA H 98 4.397 4.518 -0.121 1
1 1080 . 5 1 1 A 98 98 ARG C C 98 172.792 173.045 -0.253 1
1 1081 . 5 1 1 A 98 98 ARG CA C 98 55.689 54.814 0.875 1
1 1082 . 5 1 1 A 98 98 ARG CB C 98 32.711 31.768 0.943 1
1 1085 . 5 1 1 A 98 98 ARG N N 98 116.022 114.510 1.512 1
1 1086 . 5 1 1 A 99 99 LEU H H 99 8.423 8.286 0.137 1
1 1087 . 5 1 1 A 99 99 LEU HA H 99 4.807 4.764 0.043 1
1 1097 . 5 1 1 A 99 99 LEU C C 99 175.903 173.963 1.940 1
1 1098 . 5 1 1 A 99 99 LEU CA C 99 54.383 53.658 0.725 1
1 1099 . 5 1 1 A 99 99 LEU CB C 99 43.362 43.868 -0.506 1
1 1103 . 5 1 1 A 99 99 LEU N N 99 124.983 122.206 2.777 1
1 1104 . 5 1 1 A 100 100 TYR H H 100 9.144 9.330 -0.186 1
1 1105 . 5 1 1 A 100 100 TYR HA H 100 4.542 5.238 -0.696 1
1 1112 . 5 1 1 A 100 100 TYR C C 100 173.479 174.407 -0.928 1
1 1113 . 5 1 1 A 100 100 TYR CA C 100 57.735 56.095 1.640 1
1 1114 . 5 1 1 A 100 100 TYR CB C 100 39.291 40.680 -1.389 1
1 1119 . 5 1 1 A 100 100 TYR N N 100 126.679 127.191 -0.512 1
1 1120 . 5 1 1 A 101 101 LEU H H 101 9.043 8.866 0.177 1
1 1121 . 5 1 1 A 101 101 LEU HA H 101 4.747 5.018 -0.271 1
1 1131 . 5 1 1 A 101 101 LEU C C 101 173.530 175.100 -1.570 1
1 1132 . 5 1 1 A 101 101 LEU CA C 101 54.524 53.611 0.913 1
1 1133 . 5 1 1 A 101 101 LEU CB C 101 42.499 44.283 -1.784 1
1 1137 . 5 1 1 A 101 101 LEU N N 101 127.422 125.640 1.782 1
1 1138 . 5 1 1 A 102 102 LEU H H 102 8.493 8.599 -0.106 1
1 1139 . 5 1 1 A 102 102 LEU HA H 102 5.612 5.454 0.158 1
1 1149 . 5 1 1 A 102 102 LEU C C 102 175.794 175.940 -0.146 1
1 1150 . 5 1 1 A 102 102 LEU CA C 102 53.076 53.208 -0.132 1
1 1151 . 5 1 1 A 102 102 LEU CB C 102 45.994 44.976 1.018 1
1 1155 . 5 1 1 A 102 102 LEU N N 102 126.021 129.027 -3.006 1
1 1156 . 5 1 1 A 103 103 ALA H H 103 9.073 9.088 -0.015 1
1 1157 . 5 1 1 A 103 103 ALA HA H 103 5.081 5.372 -0.291 1
1 1161 . 5 1 1 A 103 103 ALA C C 103 175.133 175.935 -0.802 1
1 1162 . 5 1 1 A 103 103 ALA CA C 103 51.688 49.805 1.883 1
1 1163 . 5 1 1 A 103 103 ALA CB C 103 21.689 22.620 -0.931 1
1 1164 . 5 1 1 A 103 103 ALA N N 103 117.679 122.831 -5.152 1
1 1165 . 5 1 1 A 104 104 ALA H H 104 8.582 8.401 0.181 1
1 1166 . 5 1 1 A 104 104 ALA HA H 104 5.220 4.925 0.295 1
1 1170 . 5 1 1 A 104 104 ALA C C 104 173.471 174.306 -0.835 1
1 1171 . 5 1 1 A 104 104 ALA CA C 104 47.959 49.878 -1.919 1
1 1172 . 5 1 1 A 104 104 ALA CB C 104 21.359 22.495 -1.136 1
1 1173 . 5 1 1 A 104 104 ALA N N 104 123.419 121.352 2.067 1
1 1174 . 5 1 1 A 105 105 PRO HA H 105 4.542 4.769 -0.227 1
1 1181 . 5 1 1 A 105 105 PRO C C 105 178.409 177.947 0.462 1
1 1182 . 5 1 1 A 105 105 PRO CA C 105 64.301 62.869 1.432 1
1 1183 . 5 1 1 A 105 105 PRO CB C 105 32.094 31.689 0.405 1
1 1186 . 5 1 1 A 106 106 ALA H H 106 8.302 8.694 -0.392 1
1 1187 . 5 1 1 A 106 106 ALA HA H 106 4.022 4.027 -0.005 1
1 1191 . 5 1 1 A 106 106 ALA C C 106 179.641 179.615 0.026 1
1 1192 . 5 1 1 A 106 106 ALA CA C 106 56.341 55.267 1.074 1
1 1193 . 5 1 1 A 106 106 ALA CB C 106 18.523 18.241 0.282 1
1 1194 . 5 1 1 A 106 106 ALA N N 106 127.733 128.067 -0.334 1
1 1195 . 5 1 1 A 107 107 ALA H H 107 9.035 8.270 0.765 1
1 1196 . 5 1 1 A 107 107 ALA HA H 107 4.331 4.013 0.318 1
1 1200 . 5 1 1 A 107 107 ALA C C 107 178.586 179.871 -1.285 1
1 1201 . 5 1 1 A 107 107 ALA CA C 107 53.765 55.358 -1.593 1
1 1202 . 5 1 1 A 107 107 ALA CB C 107 18.728 18.270 0.458 1
1 1203 . 5 1 1 A 107 107 ALA N N 107 118.203 119.862 -1.659 1
1 1204 . 5 1 1 A 108 108 GLU H H 108 8.399 8.177 0.222 1
1 1205 . 5 1 1 A 108 108 GLU HA H 108 4.631 4.056 0.575 1
1 1210 . 5 1 1 A 108 108 GLU C C 108 177.127 178.767 -1.640 1
1 1211 . 5 1 1 A 108 108 GLU CA C 108 55.847 58.773 -2.926 1
1 1212 . 5 1 1 A 108 108 GLU CB C 108 32.135 29.450 2.685 1
1 1214 . 5 1 1 A 108 108 GLU N N 108 114.661 117.925 -3.264 1
1 1215 . 5 1 1 A 109 109 ARG H H 109 7.412 8.612 -1.200 1
1 1216 . 5 1 1 A 109 109 ARG HA H 109 3.682 4.115 -0.433 1
1 1223 . 5 1 1 A 109 109 ARG C C 109 176.917 179.161 -2.244 1
1 1224 . 5 1 1 A 109 109 ARG CA C 109 61.600 59.768 1.832 1
1 1225 . 5 1 1 A 109 109 ARG CB C 109 28.845 30.411 -1.566 1
1 1228 . 5 1 1 A 109 109 ARG N N 109 120.954 121.001 -0.047 1
1 1229 . 5 1 1 A 110 110 GLY H H 110 8.833 8.003 0.830 1
1 1230 . 5 1 1 A 110 110 GLY HA2 H 110 3.872 3.813 0.059 1
1 1231 . 5 1 1 A 110 110 GLY HA3 H 110 3.685 3.828 -0.143 1
1 1232 . 5 1 1 A 110 110 GLY C C 110 175.997 175.937 0.060 1
1 1233 . 5 1 1 A 110 110 GLY CA C 110 47.323 47.502 -0.179 1
1 1234 . 5 1 1 A 110 110 GLY N N 110 106.563 107.330 -0.767 1
1 1235 . 5 1 1 A 111 111 ASP H H 111 7.882 8.123 -0.241 1
1 1236 . 5 1 1 A 111 111 ASP HA H 111 4.312 4.366 -0.054 1
1 1239 . 5 1 1 A 111 111 ASP C C 111 179.467 178.665 0.802 1
1 1240 . 5 1 1 A 111 111 ASP CA C 111 56.976 56.744 0.232 1
1 1241 . 5 1 1 A 111 111 ASP CB C 111 40.648 40.837 -0.189 1
1 1242 . 5 1 1 A 111 111 ASP N N 111 121.402 121.613 -0.211 1
1 1243 . 5 1 1 A 112 112 TRP H H 112 7.804 8.474 -0.670 1
1 1244 . 5 1 1 A 112 112 TRP HA H 112 3.831 4.201 -0.370 1
1 1253 . 5 1 1 A 112 112 TRP C C 112 177.547 178.639 -1.092 1
1 1254 . 5 1 1 A 112 112 TRP CA C 112 62.006 59.939 2.067 1
1 1255 . 5 1 1 A 112 112 TRP CB C 112 29.421 29.382 0.039 1
1 1261 . 5 1 1 A 112 112 TRP N N 112 119.904 120.146 -0.242 1
1 1263 . 5 1 1 A 113 113 VAL H H 113 7.982 7.775 0.207 1
1 1264 . 5 1 1 A 113 113 VAL HA H 113 3.072 3.614 -0.542 1
1 1272 . 5 1 1 A 113 113 VAL C C 113 178.015 178.651 -0.636 1
1 1273 . 5 1 1 A 113 113 VAL CA C 113 67.407 66.916 0.491 1
1 1274 . 5 1 1 A 113 113 VAL CB C 113 31.724 31.548 0.176 1
1 1277 . 5 1 1 A 113 113 VAL N N 113 117.575 118.940 -1.365 1
1 1278 . 5 1 1 A 114 114 GLN H H 114 8.268 8.240 0.028 1
1 1279 . 5 1 1 A 114 114 GLN HA H 114 3.994 3.992 0.002 1
1 1286 . 5 1 1 A 114 114 GLN C C 114 178.021 177.978 0.043 1
1 1287 . 5 1 1 A 114 114 GLN CA C 114 59.112 58.893 0.219 1
1 1288 . 5 1 1 A 114 114 GLN CB C 114 28.685 28.867 -0.182 1
1 1290 . 5 1 1 A 114 114 GLN N N 114 117.479 120.018 -2.539 1
1 1292 . 5 1 1 A 115 115 ALA H H 115 7.915 8.437 -0.522 1
1 1293 . 5 1 1 A 115 115 ALA HA H 115 3.972 4.082 -0.110 1
1 1297 . 5 1 1 A 115 115 ALA C C 115 180.030 180.027 0.003 1
1 1298 . 5 1 1 A 115 115 ALA CA C 115 55.142 55.083 0.059 1
1 1299 . 5 1 1 A 115 115 ALA CB C 115 18.152 18.453 -0.301 1
1 1300 . 5 1 1 A 115 115 ALA N N 115 120.858 120.689 0.169 1
1 1301 . 5 1 1 A 116 116 ILE H H 116 8.172 8.562 -0.390 1
1 1302 . 5 1 1 A 116 116 ILE HA H 116 3.482 3.775 -0.293 1
1 1312 . 5 1 1 A 116 116 ILE C C 116 177.739 178.201 -0.462 1
1 1313 . 5 1 1 A 116 116 ILE CA C 116 66.119 65.007 1.112 1
1 1314 . 5 1 1 A 116 116 ILE CB C 116 38.222 37.725 0.497 1
1 1318 . 5 1 1 A 116 116 ILE N N 116 115.977 117.499 -1.522 1
1 1319 . 5 1 1 A 117 117 CYS H H 117 8.449 8.467 -0.018 1
1 1320 . 5 1 1 A 117 117 CYS HA H 117 4.032 4.535 -0.503 1
1 1323 . 5 1 1 A 117 117 CYS C C 117 177.321 177.375 -0.054 1
1 1324 . 5 1 1 A 117 117 CYS CA C 117 64.777 62.165 2.612 1
1 1325 . 5 1 1 A 117 117 CYS CB C 117 26.871 27.250 -0.379 1
1 1326 . 5 1 1 A 117 117 CYS N N 117 117.253 121.238 -3.985 1
1 1327 . 5 1 1 A 118 118 LEU H H 118 8.182 8.206 -0.024 1
1 1328 . 5 1 1 A 118 118 LEU HA H 118 4.052 4.115 -0.063 1
1 1338 . 5 1 1 A 118 118 LEU C C 118 179.217 179.229 -0.012 1
1 1339 . 5 1 1 A 118 118 LEU CA C 118 57.877 57.622 0.255 1
1 1340 . 5 1 1 A 118 118 LEU CB C 118 42.088 42.050 0.038 1
1 1344 . 5 1 1 A 118 118 LEU N N 118 119.665 122.320 -2.655 1
1 1345 . 5 1 1 A 119 119 LEU H H 119 7.142 8.279 -1.137 1
1 1346 . 5 1 1 A 119 119 LEU HA H 119 4.192 4.029 0.163 1
1 1356 . 5 1 1 A 119 119 LEU C C 119 178.492 178.622 -0.130 1
1 1357 . 5 1 1 A 119 119 LEU CA C 119 56.259 57.927 -1.668 1
1 1358 . 5 1 1 A 119 119 LEU CB C 119 43.568 41.792 1.776 1
1 1362 . 5 1 1 A 119 119 LEU N N 119 116.244 118.654 -2.410 1
1 1363 . 5 1 1 A 120 120 ALA H H 120 8.513 8.261 0.252 1
1 1364 . 5 1 1 A 120 120 ALA HA H 120 3.878 3.988 -0.110 1
1 1368 . 5 1 1 A 120 120 ALA C C 120 178.358 178.609 -0.251 1
1 1369 . 5 1 1 A 120 120 ALA CA C 120 53.765 55.099 -1.334 1
1 1370 . 5 1 1 A 120 120 ALA CB C 120 18.687 18.726 -0.039 1
1 1371 . 5 1 1 A 120 120 ALA N N 120 120.009 120.251 -0.242 1
1 1372 . 5 1 1 A 121 121 PHE H H 121 7.822 8.355 -0.533 1
1 1373 . 5 1 1 A 121 121 PHE HA H 121 5.156 4.885 0.271 1
1 1381 . 5 1 1 A 121 121 PHE C C 121 176.273 174.690 1.583 1
1 1382 . 5 1 1 A 121 121 PHE CA C 121 55.741 57.015 -1.274 1
1 1383 . 5 1 1 A 121 121 PHE CB C 121 39.455 38.183 1.272 1
1 1389 . 5 1 1 A 121 121 PHE N N 121 113.981 114.026 -0.045 1
1 1390 . 5 1 1 A 122 122 SER H H 122 7.765 7.981 -0.216 1
1 1391 . 5 1 1 A 122 122 SER HA H 122 4.579 4.611 -0.032 1
1 1394 . 5 1 1 A 122 122 SER C C 122 174.595 174.562 0.033 1
1 1395 . 5 1 1 A 122 122 SER CA C 122 58.777 59.870 -1.093 1
1 1396 . 5 1 1 A 122 122 SER CB C 122 63.719 62.978 0.741 1
1 1397 . 5 1 1 A 122 122 SER N N 122 115.069 114.503 0.566 1
1 1398 . 5 1 1 A 123 123 GLY H H 123 8.223 8.333 -0.110 1
1 1399 . 5 1 1 A 123 123 GLY HA2 H 123 4.174 4.171 0.003 1
1 1400 . 5 1 1 A 123 123 GLY HA3 H 123 4.100 4.185 -0.085 1
1 1401 . 5 1 1 A 123 123 GLY C C 123 171.678 170.993 0.685 1
1 1402 . 5 1 1 A 123 123 GLY CA C 123 44.815 45.193 -0.378 1
1 1403 . 5 1 1 A 123 123 GLY N N 123 110.151 110.029 0.122 1
1 1404 . 5 1 1 A 124 124 PRO HA H 124 4.482 4.714 -0.232 1
1 1411 . 5 1 1 A 124 124 PRO C C 124 177.314 175.028 2.286 1
1 1412 . 5 1 1 A 124 124 PRO CA C 124 63.206 62.700 0.506 1
1 1413 . 5 1 1 A 124 124 PRO CB C 124 32.176 32.540 -0.364 1
1 1416 . 5 1 1 A 125 125 SER H H 125 8.485 8.614 -0.129 1
1 1417 . 5 1 1 A 125 125 SER HA H 125 4.472 4.951 -0.479 1
1 1420 . 5 1 1 A 125 125 SER C C 125 174.728 172.482 2.246 1
1 1421 . 5 1 1 A 125 125 SER CA C 125 58.353 56.768 1.585 1
1 1422 . 5 1 1 A 125 125 SER CB C 125 64.048 65.554 -1.506 1
1 1423 . 5 1 1 A 125 125 SER N N 125 116.081 116.910 -0.829 1
1 1424 . 5 1 1 A 126 126 SER H H 126 8.332 8.714 -0.382 1
1 1425 . 5 1 1 A 126 126 SER HA H 126 4.464 4.676 -0.212 1
1 1428 . 5 1 1 A 126 126 SER C C 126 173.980 174.635 -0.655 1
1 1429 . 5 1 1 A 126 126 SER CA C 126 58.336 58.025 0.311 1
1 1430 . 5 1 1 A 126 126 SER CB C 126 63.925 64.103 -0.178 1
1 1431 . 5 1 1 A 126 126 SER N N 126 118.037 120.593 -2.556 1
1 1 . 6 1 1 A 6 6 SER HA H 6 4.458 4.287 0.171 1
1 3 . 6 1 1 A 6 6 SER C C 6 175.108 174.695 0.413 1
1 4 . 6 1 1 A 6 6 SER CA C 6 58.689 58.849 -0.160 1
1 5 . 6 1 1 A 6 6 SER CB C 6 63.678 63.851 -0.173 1
1 6 . 6 1 1 A 7 7 GLY H H 7 8.449 8.612 -0.163 1
1 7 . 6 1 1 A 7 7 GLY HA2 H 7 3.965 4.019 -0.054 1
1 8 . 6 1 1 A 7 7 GLY HA3 H 7 3.965 4.025 -0.060 1
1 9 . 6 1 1 A 7 7 GLY C C 7 174.380 174.890 -0.510 1
1 10 . 6 1 1 A 7 7 GLY CA C 7 45.435 44.591 0.844 1
1 11 . 6 1 1 A 7 7 GLY N N 7 110.792 112.912 -2.120 1
1 12 . 6 1 1 A 8 8 MET H H 8 8.259 9.155 -0.896 1
1 13 . 6 1 1 A 8 8 MET HA H 8 4.487 4.075 0.412 1
1 21 . 6 1 1 A 8 8 MET C C 8 176.961 175.396 1.565 1
1 22 . 6 1 1 A 8 8 MET CA C 8 55.565 56.268 -0.703 1
1 23 . 6 1 1 A 8 8 MET CB C 8 32.835 31.526 1.309 1
1 26 . 6 1 1 A 8 8 MET N N 8 119.639 121.091 -1.452 1
1 27 . 6 1 1 A 9 9 GLY H H 9 8.472 8.529 -0.057 1
1 28 . 6 1 1 A 9 9 GLY HA2 H 9 3.946 4.037 -0.091 1
1 29 . 6 1 1 A 9 9 GLY HA3 H 9 3.946 4.040 -0.094 1
1 30 . 6 1 1 A 9 9 GLY C C 9 174.005 173.264 0.741 1
1 31 . 6 1 1 A 9 9 GLY CA C 9 45.488 44.753 0.735 1
1 32 . 6 1 1 A 9 9 GLY N N 9 110.107 105.297 4.810 1
1 33 . 6 1 1 A 10 10 ASP H H 10 8.292 8.473 -0.181 1
1 34 . 6 1 1 A 10 10 ASP HA H 10 4.636 4.827 -0.191 1
1 37 . 6 1 1 A 10 10 ASP C C 10 176.768 175.774 0.994 1
1 38 . 6 1 1 A 10 10 ASP CA C 10 54.206 53.637 0.569 1
1 39 . 6 1 1 A 10 10 ASP CB C 10 41.306 39.856 1.450 1
1 40 . 6 1 1 A 10 10 ASP N N 10 120.370 119.728 0.642 1
1 41 . 6 1 1 A 11 11 GLY H H 11 8.452 7.991 0.461 1
1 42 . 6 1 1 A 11 11 GLY HA2 H 11 3.980 4.227 -0.247 1
1 43 . 6 1 1 A 11 11 GLY HA3 H 11 4.022 4.228 -0.206 1
1 44 . 6 1 1 A 11 11 GLY C C 11 174.102 172.622 1.480 1
1 45 . 6 1 1 A 11 11 GLY CA C 11 45.170 45.841 -0.671 1
1 46 . 6 1 1 A 11 11 GLY N N 11 108.391 110.208 -1.817 1
1 47 . 6 1 1 A 12 12 ALA H H 12 8.293 8.346 -0.053 1
1 48 . 6 1 1 A 12 12 ALA HA H 12 3.777 4.198 -0.421 1
1 52 . 6 1 1 A 12 12 ALA C C 12 178.193 177.823 0.370 1
1 53 . 6 1 1 A 12 12 ALA CA C 12 52.759 51.767 0.992 1
1 54 . 6 1 1 A 12 12 ALA CB C 12 17.855 18.299 -0.444 1
1 55 . 6 1 1 A 12 12 ALA N N 12 124.185 126.932 -2.747 1
1 56 . 6 1 1 A 13 13 VAL H H 13 8.822 8.178 0.644 1
1 57 . 6 1 1 A 13 13 VAL HA H 13 3.912 3.640 0.272 1
1 65 . 6 1 1 A 13 13 VAL C C 13 176.073 175.786 0.287 1
1 66 . 6 1 1 A 13 13 VAL CA C 13 63.100 66.475 -3.375 1
1 67 . 6 1 1 A 13 13 VAL CB C 13 32.711 31.678 1.033 1
1 70 . 6 1 1 A 13 13 VAL N N 13 120.877 125.417 -4.540 1
1 71 . 6 1 1 A 14 14 LYS H H 14 7.093 7.149 -0.056 1
1 72 . 6 1 1 A 14 14 LYS HA H 14 4.169 4.729 -0.560 1
1 81 . 6 1 1 A 14 14 LYS C C 14 173.291 173.997 -0.706 1
1 82 . 6 1 1 A 14 14 LYS CA C 14 56.465 55.390 1.075 1
1 83 . 6 1 1 A 14 14 LYS CB C 14 35.960 35.736 0.224 1
1 87 . 6 1 1 A 14 14 LYS N N 14 118.693 118.914 -0.221 1
1 88 . 6 1 1 A 15 15 GLN H H 15 8.522 8.456 0.066 1
1 89 . 6 1 1 A 15 15 GLN HA H 15 5.542 5.149 0.393 1
1 96 . 6 1 1 A 15 15 GLN C C 15 174.992 175.473 -0.481 1
1 97 . 6 1 1 A 15 15 GLN CA C 15 54.312 54.037 0.275 1
1 98 . 6 1 1 A 15 15 GLN CB C 15 33.585 32.531 1.054 1
1 100 . 6 1 1 A 15 15 GLN N N 15 124.024 123.918 0.106 1
1 102 . 6 1 1 A 16 16 GLY H H 16 8.740 8.107 0.633 1
1 103 . 6 1 1 A 16 16 GLY HA2 H 16 4.511 3.955 0.556 1
1 104 . 6 1 1 A 16 16 GLY HA3 H 16 4.064 4.334 -0.270 1
1 105 . 6 1 1 A 16 16 GLY C C 16 171.431 171.393 0.038 1
1 106 . 6 1 1 A 16 16 GLY CA C 16 46.106 45.704 0.402 1
1 107 . 6 1 1 A 16 16 GLY N N 16 109.611 108.880 0.731 1
1 108 . 6 1 1 A 17 17 PHE H H 17 8.886 8.406 0.480 1
1 109 . 6 1 1 A 17 17 PHE HA H 17 5.466 4.855 0.611 1
1 114 . 6 1 1 A 17 17 PHE C C 17 174.795 175.503 -0.708 1
1 115 . 6 1 1 A 17 17 PHE CA C 17 57.788 58.007 -0.219 1
1 116 . 6 1 1 A 17 17 PHE CB C 17 41.315 40.502 0.813 1
1 119 . 6 1 1 A 17 17 PHE N N 17 122.684 119.528 3.156 1
1 120 . 6 1 1 A 18 18 LEU H H 18 8.762 8.446 0.316 1
1 121 . 6 1 1 A 18 18 LEU HA H 18 4.946 4.741 0.205 1
1 131 . 6 1 1 A 18 18 LEU C C 18 175.461 175.093 0.368 1
1 132 . 6 1 1 A 18 18 LEU CA C 18 52.970 53.343 -0.373 1
1 133 . 6 1 1 A 18 18 LEU CB C 18 47.945 44.639 3.306 1
1 137 . 6 1 1 A 18 18 LEU N N 18 119.045 123.631 -4.586 1
1 138 . 6 1 1 A 19 19 TYR H H 19 9.272 8.021 1.251 1
1 139 . 6 1 1 A 19 19 TYR HA H 19 5.682 5.609 0.073 1
1 146 . 6 1 1 A 19 19 TYR C C 19 174.829 174.749 0.080 1
1 147 . 6 1 1 A 19 19 TYR CA C 19 56.482 56.524 -0.042 1
1 148 . 6 1 1 A 19 19 TYR CB C 19 41.717 40.247 1.470 1
1 153 . 6 1 1 A 19 19 TYR N N 19 118.024 122.835 -4.811 1
1 154 . 6 1 1 A 20 20 LEU H H 20 9.441 9.045 0.396 1
1 155 . 6 1 1 A 20 20 LEU HA H 20 5.283 5.453 -0.170 1
1 165 . 6 1 1 A 20 20 LEU C C 20 175.935 175.388 0.547 1
1 166 . 6 1 1 A 20 20 LEU CA C 20 53.464 53.987 -0.523 1
1 167 . 6 1 1 A 20 20 LEU CB C 20 46.570 46.178 0.392 1
1 171 . 6 1 1 A 20 20 LEU N N 20 122.838 125.618 -2.780 1
1 172 . 6 1 1 A 21 21 GLN H H 21 8.391 9.067 -0.676 1
1 173 . 6 1 1 A 21 21 GLN HA H 21 3.791 4.698 -0.907 1
1 180 . 6 1 1 A 21 21 GLN C C 21 175.157 174.622 0.535 1
1 181 . 6 1 1 A 21 21 GLN CA C 21 56.094 54.999 1.095 1
1 182 . 6 1 1 A 21 21 GLN CB C 21 28.434 28.856 -0.422 1
1 184 . 6 1 1 A 21 21 GLN N N 21 129.943 127.249 2.694 1
1 186 . 6 1 1 A 22 22 GLN H H 22 8.829 8.120 0.709 1
1 187 . 6 1 1 A 22 22 GLN HA H 22 4.553 4.909 -0.356 1
1 194 . 6 1 1 A 22 22 GLN C C 22 174.998 173.930 1.068 1
1 195 . 6 1 1 A 22 22 GLN CA C 22 54.912 55.093 -0.181 1
1 196 . 6 1 1 A 22 22 GLN CB C 22 31.930 32.633 -0.703 1
1 198 . 6 1 1 A 22 22 GLN N N 22 127.199 124.461 2.738 1
1 200 . 6 1 1 A 23 23 GLN HA H 23 4.142 4.622 -0.480 1
1 207 . 6 1 1 A 23 23 GLN CA C 23 56.427 55.138 1.289 1
1 208 . 6 1 1 A 23 23 GLN CB C 23 29.227 30.722 -1.495 1
1 211 . 6 1 1 A 24 24 GLN HA H 24 4.523 4.076 0.447 1
1 218 . 6 1 1 A 24 24 GLN CB C 24 29.759 28.227 1.532 1
1 221 . 6 1 1 A 25 25 THR HA H 25 3.870 4.448 -0.578 1
1 226 . 6 1 1 A 25 25 THR CA C 25 65.096 61.540 3.556 1
1 227 . 6 1 1 A 25 25 THR CB C 25 68.924 70.162 -1.238 1
1 229 . 6 1 1 A 26 26 PHE HA H 26 4.690 4.262 0.428 1
1 236 . 6 1 1 A 26 26 PHE C C 26 175.523 176.118 -0.595 1
1 237 . 6 1 1 A 26 26 PHE CA C 26 57.312 59.001 -1.689 1
1 238 . 6 1 1 A 26 26 PHE CB C 26 39.003 38.480 0.523 1
1 243 . 6 1 1 A 27 27 GLY H H 27 7.755 8.847 -1.092 1
1 244 . 6 1 1 A 27 27 GLY HA2 H 27 4.172 3.804 0.368 1
1 245 . 6 1 1 A 27 27 GLY HA3 H 27 3.783 3.965 -0.182 1
1 246 . 6 1 1 A 27 27 GLY C C 27 172.557 174.654 -2.097 1
1 247 . 6 1 1 A 27 27 GLY CA C 27 44.924 45.389 -0.465 1
1 248 . 6 1 1 A 27 27 GLY N N 27 109.216 112.541 -3.325 1
1 249 . 6 1 1 A 28 28 LYS H H 28 8.241 7.629 0.612 1
1 250 . 6 1 1 A 28 28 LYS HA H 28 4.530 4.110 0.420 1
1 259 . 6 1 1 A 28 28 LYS C C 28 176.204 175.646 0.558 1
1 260 . 6 1 1 A 28 28 LYS CA C 28 55.741 56.725 -0.984 1
1 261 . 6 1 1 A 28 28 LYS CB C 28 33.904 32.961 0.943 1
1 265 . 6 1 1 A 28 28 LYS N N 28 118.743 119.810 -1.067 1
1 266 . 6 1 1 A 29 29 LYS H H 29 8.356 8.613 -0.257 1
1 267 . 6 1 1 A 29 29 LYS HA H 29 4.559 4.573 -0.014 1
1 274 . 6 1 1 A 29 29 LYS C C 29 175.420 176.629 -1.209 1
1 275 . 6 1 1 A 29 29 LYS CA C 29 55.406 54.255 1.151 1
1 276 . 6 1 1 A 29 29 LYS CB C 29 35.618 35.216 0.402 1
1 280 . 6 1 1 A 29 29 LYS N N 29 121.198 123.921 -2.723 1
1 281 . 6 1 1 A 30 30 TRP H H 30 8.891 8.399 0.492 1
1 282 . 6 1 1 A 30 30 TRP HA H 30 4.951 4.843 0.108 1
1 291 . 6 1 1 A 30 30 TRP C C 30 175.902 176.547 -0.645 1
1 292 . 6 1 1 A 30 30 TRP CA C 30 56.677 57.978 -1.301 1
1 293 . 6 1 1 A 30 30 TRP CB C 30 30.614 30.469 0.145 1
1 299 . 6 1 1 A 30 30 TRP N N 30 123.304 121.571 1.733 1
1 301 . 6 1 1 A 31 31 ARG H H 31 8.712 9.215 -0.503 1
1 302 . 6 1 1 A 31 31 ARG HA H 31 4.820 4.816 0.004 1
1 309 . 6 1 1 A 31 31 ARG C C 31 174.026 174.422 -0.396 1
1 310 . 6 1 1 A 31 31 ARG CA C 31 54.895 54.120 0.775 1
1 311 . 6 1 1 A 31 31 ARG CB C 31 34.045 33.628 0.417 1
1 314 . 6 1 1 A 31 31 ARG N N 31 123.973 120.956 3.017 1
1 315 . 6 1 1 A 32 32 ARG H H 32 8.820 8.523 0.297 1
1 316 . 6 1 1 A 32 32 ARG HA H 32 3.965 4.570 -0.605 1
1 323 . 6 1 1 A 32 32 ARG C C 32 174.785 174.629 0.156 1
1 324 . 6 1 1 A 32 32 ARG CA C 32 56.924 56.322 0.602 1
1 325 . 6 1 1 A 32 32 ARG CB C 32 31.806 30.930 0.876 1
1 328 . 6 1 1 A 32 32 ARG N N 32 127.041 124.974 2.067 1
1 329 . 6 1 1 A 33 33 PHE H H 33 9.372 8.615 0.757 1
1 330 . 6 1 1 A 33 33 PHE HA H 33 4.863 4.987 -0.124 1
1 338 . 6 1 1 A 33 33 PHE C C 33 176.359 175.146 1.213 1
1 339 . 6 1 1 A 33 33 PHE CA C 33 57.224 56.595 0.629 1
1 340 . 6 1 1 A 33 33 PHE CB C 33 43.385 41.814 1.571 1
1 346 . 6 1 1 A 33 33 PHE N N 33 125.882 124.668 1.214 1
1 347 . 6 1 1 A 34 34 GLY H H 34 9.160 8.878 0.282 1
1 348 . 6 1 1 A 34 34 GLY HA2 H 34 4.182 4.152 0.030 1
1 349 . 6 1 1 A 34 34 GLY HA3 H 34 3.714 4.266 -0.552 1
1 350 . 6 1 1 A 34 34 GLY C C 34 172.920 173.215 -0.295 1
1 351 . 6 1 1 A 34 34 GLY CA C 34 46.247 46.573 -0.326 1
1 352 . 6 1 1 A 34 34 GLY N N 34 108.654 111.543 -2.889 1
1 353 . 6 1 1 A 35 35 ALA H H 35 8.982 8.359 0.623 1
1 354 . 6 1 1 A 35 35 ALA HA H 35 5.660 5.343 0.317 1
1 358 . 6 1 1 A 35 35 ALA C C 35 176.547 176.212 0.335 1
1 359 . 6 1 1 A 35 35 ALA CA C 35 50.500 50.518 -0.018 1
1 360 . 6 1 1 A 35 35 ALA CB C 35 24.034 20.851 3.183 1
1 361 . 6 1 1 A 35 35 ALA N N 35 130.076 128.649 1.427 1
1 362 . 6 1 1 A 36 36 SER H H 36 8.852 8.681 0.171 1
1 363 . 6 1 1 A 36 36 SER HA H 36 5.203 5.007 0.196 1
1 366 . 6 1 1 A 36 36 SER C C 36 170.939 172.515 -1.576 1
1 367 . 6 1 1 A 36 36 SER CA C 36 57.806 57.542 0.264 1
1 368 . 6 1 1 A 36 36 SER CB C 36 66.986 64.650 2.336 1
1 369 . 6 1 1 A 36 36 SER N N 36 116.620 118.502 -1.882 1
1 370 . 6 1 1 A 37 37 LEU H H 37 8.862 8.985 -0.123 1
1 371 . 6 1 1 A 37 37 LEU HA H 37 5.163 4.850 0.313 1
1 381 . 6 1 1 A 37 37 LEU C C 37 173.525 174.062 -0.537 1
1 382 . 6 1 1 A 37 37 LEU CA C 37 53.112 53.512 -0.400 1
1 383 . 6 1 1 A 37 37 LEU CB C 37 46.077 43.319 2.758 1
1 387 . 6 1 1 A 37 37 LEU N N 37 127.638 128.627 -0.989 1
1 388 . 6 1 1 A 38 38 TYR H H 38 9.280 9.081 0.199 1
1 389 . 6 1 1 A 38 38 TYR HA H 38 4.820 5.457 -0.637 1
1 396 . 6 1 1 A 38 38 TYR C C 38 175.430 176.133 -0.703 1
1 397 . 6 1 1 A 38 38 TYR CA C 38 57.436 55.741 1.695 1
1 398 . 6 1 1 A 38 38 TYR CB C 38 42.128 41.094 1.034 1
1 403 . 6 1 1 A 38 38 TYR N N 38 125.215 127.106 -1.891 1
1 404 . 6 1 1 A 39 39 GLY H H 39 8.532 8.418 0.114 1
1 405 . 6 1 1 A 39 39 GLY HA2 H 39 4.220 4.352 -0.132 1
1 406 . 6 1 1 A 39 39 GLY HA3 H 39 3.941 4.365 -0.424 1
1 407 . 6 1 1 A 39 39 GLY C C 39 172.950 172.700 0.250 1
1 408 . 6 1 1 A 39 39 GLY CA C 39 44.817 45.936 -1.119 1
1 409 . 6 1 1 A 39 39 GLY N N 39 106.424 110.309 -3.885 1
1 410 . 6 1 1 A 40 40 GLY H H 40 8.477 8.493 -0.016 1
1 411 . 6 1 1 A 40 40 GLY HA2 H 40 4.102 4.121 -0.019 1
1 412 . 6 1 1 A 40 40 GLY HA3 H 40 3.927 4.123 -0.196 1
1 413 . 6 1 1 A 40 40 GLY C C 40 174.002 173.297 0.705 1
1 414 . 6 1 1 A 40 40 GLY CA C 40 44.694 44.691 0.003 1
1 415 . 6 1 1 A 40 40 GLY N N 40 106.881 108.212 -1.331 1
1 416 . 6 1 1 A 41 41 SER H H 41 8.600 8.431 0.169 1
1 417 . 6 1 1 A 41 41 SER HA H 41 4.520 4.654 -0.134 1
1 420 . 6 1 1 A 41 41 SER C C 41 174.355 174.529 -0.174 1
1 421 . 6 1 1 A 41 41 SER CA C 41 58.565 57.093 1.472 1
1 422 . 6 1 1 A 41 41 SER CB C 41 64.413 62.182 2.231 1
1 423 . 6 1 1 A 41 41 SER N N 41 115.751 115.369 0.382 1
1 424 . 6 1 1 A 42 42 ASP H H 42 8.533 8.017 0.516 1
1 425 . 6 1 1 A 42 42 ASP HA H 42 4.560 4.783 -0.223 1
1 428 . 6 1 1 A 42 42 ASP CA C 42 55.230 53.727 1.503 1
1 429 . 6 1 1 A 42 42 ASP CB C 42 40.648 40.678 -0.030 1
1 430 . 6 1 1 A 42 42 ASP N N 42 119.037 122.984 -3.947 1
1 431 . 6 1 1 A 43 43 CYS H H 43 8.152 8.031 0.121 1
1 432 . 6 1 1 A 43 43 CYS HA H 43 4.541 4.051 0.490 1
1 435 . 6 1 1 A 43 43 CYS C C 43 173.975 173.198 0.777 1
1 436 . 6 1 1 A 43 43 CYS CA C 43 58.265 60.069 -1.804 1
1 437 . 6 1 1 A 43 43 CYS CB C 43 28.393 26.464 1.929 1
1 438 . 6 1 1 A 43 43 CYS N N 43 116.881 116.741 0.140 1
1 439 . 6 1 1 A 44 44 ALA H H 44 8.047 7.358 0.689 1
1 440 . 6 1 1 A 44 44 ALA HA H 44 4.395 4.801 -0.406 1
1 444 . 6 1 1 A 44 44 ALA C C 44 176.472 175.528 0.944 1
1 445 . 6 1 1 A 44 44 ALA CA C 44 52.688 51.598 1.090 1
1 446 . 6 1 1 A 44 44 ALA CB C 44 20.579 22.871 -2.292 1
1 447 . 6 1 1 A 44 44 ALA N N 44 125.989 119.556 6.433 1
1 448 . 6 1 1 A 45 45 LEU H H 45 8.052 8.715 -0.663 1
1 449 . 6 1 1 A 45 45 LEU HA H 45 4.452 4.918 -0.466 1
1 459 . 6 1 1 A 45 45 LEU C C 45 176.196 176.673 -0.477 1
1 460 . 6 1 1 A 45 45 LEU CA C 45 53.771 53.542 0.229 1
1 461 . 6 1 1 A 45 45 LEU CB C 45 43.116 43.528 -0.412 1
1 465 . 6 1 1 A 45 45 LEU N N 45 119.889 120.292 -0.403 1
1 466 . 6 1 1 A 46 46 ALA H H 46 8.381 8.485 -0.104 1
1 467 . 6 1 1 A 46 46 ALA HA H 46 4.449 4.909 -0.460 1
1 471 . 6 1 1 A 46 46 ALA C C 46 179.093 176.977 2.116 1
1 472 . 6 1 1 A 46 46 ALA CA C 46 52.829 52.023 0.806 1
1 473 . 6 1 1 A 46 46 ALA CB C 46 18.687 19.525 -0.838 1
1 474 . 6 1 1 A 46 46 ALA N N 46 125.635 125.699 -0.064 1
1 475 . 6 1 1 A 47 47 ARG H H 47 9.012 8.557 0.455 1
1 476 . 6 1 1 A 47 47 ARG HA H 47 5.192 5.086 0.106 1
1 484 . 6 1 1 A 47 47 ARG C C 47 171.524 173.784 -2.260 1
1 485 . 6 1 1 A 47 47 ARG CA C 47 55.265 55.349 -0.084 1
1 486 . 6 1 1 A 47 47 ARG CB C 47 30.970 33.687 -2.717 1
1 489 . 6 1 1 A 47 47 ARG N N 47 120.048 118.603 1.445 1
1 491 . 6 1 1 A 48 48 LEU H H 48 9.029 8.381 0.648 1
1 492 . 6 1 1 A 48 48 LEU HA H 48 5.221 4.975 0.246 1
1 502 . 6 1 1 A 48 48 LEU C C 48 174.348 175.241 -0.893 1
1 503 . 6 1 1 A 48 48 LEU CA C 48 53.253 53.956 -0.703 1
1 504 . 6 1 1 A 48 48 LEU CB C 48 45.419 43.972 1.447 1
1 508 . 6 1 1 A 48 48 LEU N N 48 123.315 124.645 -1.330 1
1 509 . 6 1 1 A 49 49 GLU H H 49 9.473 8.544 0.929 1
1 510 . 6 1 1 A 49 49 GLU HA H 49 5.222 4.980 0.242 1
1 515 . 6 1 1 A 49 49 GLU C C 49 175.507 175.760 -0.253 1
1 516 . 6 1 1 A 49 49 GLU CA C 49 55.159 55.502 -0.343 1
1 517 . 6 1 1 A 49 49 GLU CB C 49 32.341 31.913 0.428 1
1 519 . 6 1 1 A 49 49 GLU N N 49 124.751 126.958 -2.207 1
1 520 . 6 1 1 A 50 50 LEU H H 50 9.088 8.566 0.522 1
1 521 . 6 1 1 A 50 50 LEU HA H 50 5.382 5.070 0.312 1
1 531 . 6 1 1 A 50 50 LEU C C 50 175.474 175.798 -0.324 1
1 532 . 6 1 1 A 50 50 LEU CA C 50 52.865 53.674 -0.809 1
1 533 . 6 1 1 A 50 50 LEU CB C 50 43.239 46.092 -2.853 1
1 537 . 6 1 1 A 50 50 LEU N N 50 124.221 120.978 3.243 1
1 538 . 6 1 1 A 51 51 GLN H H 51 9.602 8.891 0.711 1
1 539 . 6 1 1 A 51 51 GLN HA H 51 5.095 5.097 -0.002 1
1 546 . 6 1 1 A 51 51 GLN C C 51 175.306 175.236 0.070 1
1 547 . 6 1 1 A 51 51 GLN CA C 51 54.576 54.049 0.527 1
1 548 . 6 1 1 A 51 51 GLN CB C 51 32.177 31.913 0.264 1
1 550 . 6 1 1 A 51 51 GLN N N 51 123.268 120.513 2.755 1
1 552 . 6 1 1 A 52 52 GLU H H 52 9.172 8.752 0.420 1
1 553 . 6 1 1 A 52 52 GLU HA H 52 4.092 4.365 -0.273 1
1 558 . 6 1 1 A 52 52 GLU C C 52 176.523 176.922 -0.399 1
1 559 . 6 1 1 A 52 52 GLU CA C 52 57.500 57.188 0.312 1
1 560 . 6 1 1 A 52 52 GLU CB C 52 30.696 30.089 0.607 1
1 562 . 6 1 1 A 52 52 GLU N N 52 128.982 124.773 4.209 1
1 563 . 6 1 1 A 53 53 GLY H H 53 8.644 8.890 -0.246 1
1 564 . 6 1 1 A 53 53 GLY HA2 H 53 4.261 3.990 0.271 1
1 565 . 6 1 1 A 53 53 GLY HA3 H 53 3.993 4.008 -0.015 1
1 566 . 6 1 1 A 53 53 GLY C C 53 172.550 174.495 -1.945 1
1 567 . 6 1 1 A 53 53 GLY CA C 53 45.911 47.354 -1.443 1
1 568 . 6 1 1 A 53 53 GLY N N 53 110.844 112.192 -1.348 1
1 569 . 6 1 1 A 54 54 PRO HA H 54 4.392 4.629 -0.237 1
1 576 . 6 1 1 A 54 54 PRO C C 54 176.828 176.103 0.725 1
1 577 . 6 1 1 A 54 54 PRO CA C 54 63.665 62.925 0.740 1
1 578 . 6 1 1 A 54 54 PRO CB C 54 32.012 32.669 -0.657 1
1 581 . 6 1 1 A 55 55 GLU H H 55 8.934 8.493 0.441 1
1 582 . 6 1 1 A 55 55 GLU HA H 55 4.193 5.144 -0.951 1
1 587 . 6 1 1 A 55 55 GLU C C 55 176.189 175.300 0.889 1
1 588 . 6 1 1 A 55 55 GLU CA C 55 57.383 54.782 2.601 1
1 589 . 6 1 1 A 55 55 GLU CB C 55 28.945 32.286 -3.341 1
1 591 . 6 1 1 A 55 55 GLU N N 55 120.312 118.534 1.778 1
1 592 . 6 1 1 A 56 56 LYS H H 56 7.937 8.705 -0.768 1
1 593 . 6 1 1 A 56 56 LYS HA H 56 4.578 4.781 -0.203 1
1 602 . 6 1 1 A 56 56 LYS C C 56 174.295 174.163 0.132 1
1 603 . 6 1 1 A 56 56 LYS CA C 56 54.171 52.751 1.420 1
1 604 . 6 1 1 A 56 56 LYS CB C 56 32.555 33.568 -1.013 1
1 608 . 6 1 1 A 56 56 LYS N N 56 122.008 125.266 -3.258 1
1 609 . 6 1 1 A 57 57 PRO HA H 57 4.370 4.525 -0.155 1
1 616 . 6 1 1 A 57 57 PRO CA C 57 63.431 62.568 0.863 1
1 617 . 6 1 1 A 57 57 PRO CB C 57 32.072 32.612 -0.540 1
1 620 . 6 1 1 A 58 58 ARG H H 58 8.310 8.777 -0.467 1
1 621 . 6 1 1 A 58 58 ARG HA H 58 4.295 3.805 0.490 1
1 628 . 6 1 1 A 58 58 ARG CA C 58 56.570 56.905 -0.335 1
1 629 . 6 1 1 A 58 58 ARG CB C 58 30.860 28.188 2.672 1
1 632 . 6 1 1 A 58 58 ARG N N 58 120.045 116.336 3.709 1
1 633 . 6 1 1 A 60 60 CYS HA H 60 4.482 4.260 0.222 1
1 636 . 6 1 1 A 60 60 CYS CA C 60 58.621 62.590 -3.969 1
1 637 . 6 1 1 A 60 60 CYS CB C 60 28.267 28.133 0.134 1
1 638 . 6 1 1 A 61 61 GLU HA H 61 4.226 4.670 -0.444 1
1 643 . 6 1 1 A 61 61 GLU C C 61 176.299 174.047 2.252 1
1 644 . 6 1 1 A 61 61 GLU CA C 61 57.100 55.822 1.278 1
1 645 . 6 1 1 A 61 61 GLU CB C 61 29.873 33.386 -3.513 1
1 647 . 6 1 1 A 62 62 ALA H H 62 8.282 8.421 -0.139 1
1 648 . 6 1 1 A 62 62 ALA HA H 62 4.302 4.737 -0.435 1
1 652 . 6 1 1 A 62 62 ALA C C 62 177.277 177.407 -0.130 1
1 653 . 6 1 1 A 62 62 ALA CA C 62 52.512 51.404 1.108 1
1 654 . 6 1 1 A 62 62 ALA CB C 62 19.592 20.390 -0.798 1
1 655 . 6 1 1 A 62 62 ALA N N 62 124.386 126.174 -1.788 1
1 656 . 6 1 1 A 63 63 ALA H H 63 8.399 8.919 -0.520 1
1 657 . 6 1 1 A 63 63 ALA HA H 63 4.375 4.894 -0.519 1
1 661 . 6 1 1 A 63 63 ALA C C 63 176.843 176.261 0.582 1
1 662 . 6 1 1 A 63 63 ALA CA C 63 52.658 50.485 2.173 1
1 663 . 6 1 1 A 63 63 ALA CB C 63 19.592 21.951 -2.359 1
1 664 . 6 1 1 A 63 63 ALA N N 63 123.892 122.473 1.419 1
1 665 . 6 1 1 A 64 64 ARG H H 64 8.152 8.768 -0.616 1
1 666 . 6 1 1 A 64 64 ARG HA H 64 5.008 5.066 -0.058 1
1 673 . 6 1 1 A 64 64 ARG C C 64 175.594 174.945 0.649 1
1 674 . 6 1 1 A 64 64 ARG CA C 64 55.282 54.420 0.862 1
1 675 . 6 1 1 A 64 64 ARG CB C 64 32.506 34.040 -1.534 1
1 678 . 6 1 1 A 64 64 ARG N N 64 119.787 115.770 4.017 1
1 679 . 6 1 1 A 65 65 LYS H H 65 8.945 8.634 0.311 1
1 680 . 6 1 1 A 65 65 LYS HA H 65 4.602 4.918 -0.316 1
1 689 . 6 1 1 A 65 65 LYS C C 65 174.657 174.520 0.137 1
1 690 . 6 1 1 A 65 65 LYS CA C 65 54.948 55.008 -0.060 1
1 691 . 6 1 1 A 65 65 LYS CB C 65 34.068 34.176 -0.108 1
1 695 . 6 1 1 A 65 65 LYS N N 65 124.171 122.869 1.302 1
1 696 . 6 1 1 A 66 66 VAL H H 66 8.672 9.026 -0.354 1
1 697 . 6 1 1 A 66 66 VAL HA H 66 4.532 5.427 -0.895 1
1 705 . 6 1 1 A 66 66 VAL C C 66 175.078 173.895 1.183 1
1 706 . 6 1 1 A 66 66 VAL CA C 66 61.865 59.674 2.191 1
1 707 . 6 1 1 A 66 66 VAL CB C 66 33.835 34.426 -0.591 1
1 710 . 6 1 1 A 66 66 VAL N N 66 124.380 124.436 -0.056 1
1 711 . 6 1 1 A 67 67 ILE H H 67 9.071 9.089 -0.018 1
1 712 . 6 1 1 A 67 67 ILE HA H 67 4.142 4.658 -0.516 1
1 722 . 6 1 1 A 67 67 ILE C C 67 175.819 175.777 0.042 1
1 723 . 6 1 1 A 67 67 ILE CA C 67 60.383 60.562 -0.179 1
1 724 . 6 1 1 A 67 67 ILE CB C 67 39.908 38.605 1.303 1
1 728 . 6 1 1 A 67 67 ILE N N 67 129.537 129.387 0.150 1
1 729 . 6 1 1 A 68 68 ARG H H 68 9.203 8.617 0.586 1
1 730 . 6 1 1 A 68 68 ARG HA H 68 4.198 4.274 -0.076 1
1 737 . 6 1 1 A 68 68 ARG C C 68 177.769 177.219 0.550 1
1 738 . 6 1 1 A 68 68 ARG CA C 68 56.835 57.015 -0.180 1
1 739 . 6 1 1 A 68 68 ARG CB C 68 29.832 30.477 -0.645 1
1 742 . 6 1 1 A 68 68 ARG N N 68 128.484 127.951 0.533 1
1 743 . 6 1 1 A 69 69 LEU H H 69 8.212 8.666 -0.454 1
1 744 . 6 1 1 A 69 69 LEU HA H 69 4.221 4.093 0.128 1
1 754 . 6 1 1 A 69 69 LEU C C 69 178.996 178.533 0.463 1
1 755 . 6 1 1 A 69 69 LEU CA C 69 57.136 57.523 -0.387 1
1 756 . 6 1 1 A 69 69 LEU CB C 69 39.455 41.296 -1.841 1
1 760 . 6 1 1 A 69 69 LEU N N 69 123.807 123.998 -0.191 1
1 761 . 6 1 1 A 70 70 SER H H 70 8.823 8.043 0.780 1
1 762 . 6 1 1 A 70 70 SER HA H 70 4.331 4.203 0.128 1
1 765 . 6 1 1 A 70 70 SER C C 70 175.076 174.733 0.343 1
1 766 . 6 1 1 A 70 70 SER CA C 70 60.329 60.869 -0.540 1
1 767 . 6 1 1 A 70 70 SER CB C 70 62.362 62.722 -0.360 1
1 768 . 6 1 1 A 70 70 SER N N 70 115.162 114.241 0.921 1
1 769 . 6 1 1 A 71 71 ASP H H 71 7.602 7.676 -0.074 1
1 770 . 6 1 1 A 71 71 ASP HA H 71 4.820 4.618 0.202 1
1 773 . 6 1 1 A 71 71 ASP C C 71 176.478 176.756 -0.278 1
1 774 . 6 1 1 A 71 71 ASP CA C 71 54.241 54.808 -0.567 1
1 775 . 6 1 1 A 71 71 ASP CB C 71 41.347 41.798 -0.451 1
1 776 . 6 1 1 A 71 71 ASP N N 71 119.590 119.071 0.519 1
1 777 . 6 1 1 A 72 72 CYS H H 72 7.715 7.150 0.565 1
1 778 . 6 1 1 A 72 72 CYS HA H 72 4.372 4.491 -0.119 1
1 781 . 6 1 1 A 72 72 CYS C C 72 173.690 174.644 -0.954 1
1 782 . 6 1 1 A 72 72 CYS CA C 72 60.836 58.952 1.884 1
1 783 . 6 1 1 A 72 72 CYS CB C 72 27.655 27.604 0.051 1
1 784 . 6 1 1 A 72 72 CYS N N 72 118.346 118.341 0.005 1
1 785 . 6 1 1 A 73 73 LEU H H 73 9.472 8.731 0.741 1
1 786 . 6 1 1 A 73 73 LEU HA H 73 4.593 3.993 0.600 1
1 796 . 6 1 1 A 73 73 LEU C C 73 177.562 176.864 0.698 1
1 797 . 6 1 1 A 73 73 LEU CA C 73 55.724 57.780 -2.056 1
1 798 . 6 1 1 A 73 73 LEU CB C 73 43.774 42.059 1.715 1
1 802 . 6 1 1 A 73 73 LEU N N 73 124.752 129.019 -4.267 1
1 803 . 6 1 1 A 74 74 ARG H H 74 7.658 7.258 0.400 1
1 804 . 6 1 1 A 74 74 ARG HA H 74 4.592 5.074 -0.482 1
1 811 . 6 1 1 A 74 74 ARG C C 74 173.605 174.404 -0.799 1
1 812 . 6 1 1 A 74 74 ARG CA C 74 56.465 56.074 0.391 1
1 813 . 6 1 1 A 74 74 ARG CB C 74 34.068 34.160 -0.092 1
1 816 . 6 1 1 A 74 74 ARG N N 74 115.565 115.213 0.352 1
1 817 . 6 1 1 A 75 75 VAL H H 75 8.622 9.012 -0.390 1
1 818 . 6 1 1 A 75 75 VAL HA H 75 5.170 5.291 -0.121 1
1 826 . 6 1 1 A 75 75 VAL C C 75 173.985 174.496 -0.511 1
1 827 . 6 1 1 A 75 75 VAL CA C 75 60.930 59.653 1.277 1
1 828 . 6 1 1 A 75 75 VAL CB C 75 35.073 36.224 -1.151 1
1 831 . 6 1 1 A 75 75 VAL N N 75 124.278 119.914 4.364 1
1 832 . 6 1 1 A 76 76 ALA H H 76 8.272 8.504 -0.232 1
1 833 . 6 1 1 A 76 76 ALA HA H 76 4.648 4.892 -0.244 1
1 837 . 6 1 1 A 76 76 ALA C C 76 175.630 175.735 -0.105 1
1 838 . 6 1 1 A 76 76 ALA CA C 76 51.294 51.299 -0.005 1
1 839 . 6 1 1 A 76 76 ALA CB C 76 22.759 23.442 -0.683 1
1 840 . 6 1 1 A 76 76 ALA N N 76 126.015 123.616 2.399 1
1 841 . 6 1 1 A 77 77 GLU H H 77 9.184 8.733 0.451 1
1 842 . 6 1 1 A 77 77 GLU HA H 77 4.060 5.220 -1.160 1
1 847 . 6 1 1 A 77 77 GLU C C 77 174.949 176.265 -1.316 1
1 848 . 6 1 1 A 77 77 GLU CA C 77 58.424 55.185 3.239 1
1 849 . 6 1 1 A 77 77 GLU CB C 77 30.161 31.849 -1.688 1
1 851 . 6 1 1 A 77 77 GLU N N 77 120.223 118.568 1.655 1
1 852 . 6 1 1 A 78 78 ALA H H 78 7.985 8.870 -0.885 1
1 853 . 6 1 1 A 78 78 ALA HA H 78 4.776 5.246 -0.470 1
1 857 . 6 1 1 A 78 78 ALA C C 78 177.250 176.761 0.489 1
1 858 . 6 1 1 A 78 78 ALA CA C 78 50.888 50.876 0.012 1
1 859 . 6 1 1 A 78 78 ALA CB C 78 20.851 20.976 -0.125 1
1 860 . 6 1 1 A 78 78 ALA N N 78 125.143 127.832 -2.689 1
1 861 . 6 1 1 A 79 79 GLY H H 79 8.604 8.645 -0.041 1
1 862 . 6 1 1 A 79 79 GLY HA2 H 79 4.327 4.243 0.084 1
1 863 . 6 1 1 A 79 79 GLY HA3 H 79 3.963 4.260 -0.297 1
1 864 . 6 1 1 A 79 79 GLY C C 79 175.360 174.193 1.167 1
1 865 . 6 1 1 A 79 79 GLY CA C 79 44.925 45.688 -0.763 1
1 866 . 6 1 1 A 79 79 GLY N N 79 109.420 106.848 2.572 1
1 867 . 6 1 1 A 80 80 GLY H H 80 8.649 8.435 0.214 1
1 868 . 6 1 1 A 80 80 GLY HA2 H 80 3.962 4.023 -0.061 1
1 869 . 6 1 1 A 80 80 GLY HA3 H 80 3.962 4.034 -0.072 1
1 870 . 6 1 1 A 80 80 GLY C C 80 175.052 174.229 0.823 1
1 871 . 6 1 1 A 80 80 GLY CA C 80 45.955 45.408 0.547 1
1 872 . 6 1 1 A 80 80 GLY N N 80 108.295 107.664 0.631 1
1 873 . 6 1 1 A 81 81 GLU H H 81 8.921 8.265 0.656 1
1 874 . 6 1 1 A 81 81 GLU HA H 81 4.298 4.645 -0.347 1
1 879 . 6 1 1 A 81 81 GLU C C 81 176.532 175.179 1.353 1
1 880 . 6 1 1 A 81 81 GLU CA C 81 57.118 55.357 1.761 1
1 881 . 6 1 1 A 81 81 GLU CB C 81 28.599 30.550 -1.951 1
1 883 . 6 1 1 A 81 81 GLU N N 81 121.170 120.168 1.002 1
1 884 . 6 1 1 A 82 82 ALA H H 82 8.032 8.074 -0.042 1
1 885 . 6 1 1 A 82 82 ALA HA H 82 4.371 4.613 -0.242 1
1 889 . 6 1 1 A 82 82 ALA C C 82 177.160 177.061 0.099 1
1 890 . 6 1 1 A 82 82 ALA CA C 82 52.653 51.151 1.502 1
1 891 . 6 1 1 A 82 82 ALA CB C 82 19.304 22.370 -3.066 1
1 892 . 6 1 1 A 82 82 ALA N N 82 124.988 124.657 0.331 1
1 893 . 6 1 1 A 83 83 SER H H 83 8.319 8.857 -0.538 1
1 894 . 6 1 1 A 83 83 SER HA H 83 4.331 4.328 0.003 1
1 897 . 6 1 1 A 83 83 SER C C 83 174.045 175.334 -1.289 1
1 898 . 6 1 1 A 83 83 SER CA C 83 58.053 61.898 -3.845 1
1 899 . 6 1 1 A 83 83 SER CB C 83 63.184 63.112 0.072 1
1 900 . 6 1 1 A 83 83 SER N N 83 114.181 116.116 -1.935 1
1 901 . 6 1 1 A 84 84 SER H H 84 7.823 7.838 -0.015 1
1 902 . 6 1 1 A 84 84 SER HA H 84 3.194 4.430 -1.236 1
1 905 . 6 1 1 A 84 84 SER C C 84 171.072 174.096 -3.024 1
1 906 . 6 1 1 A 84 84 SER CA C 84 57.206 56.989 0.217 1
1 907 . 6 1 1 A 84 84 SER CB C 84 61.622 63.245 -1.623 1
1 908 . 6 1 1 A 84 84 SER N N 84 117.302 114.751 2.551 1
1 909 . 6 1 1 A 85 85 PRO HA H 85 3.922 4.566 -0.644 1
1 916 . 6 1 1 A 85 85 PRO CA C 85 62.691 62.359 0.332 1
1 917 . 6 1 1 A 85 85 PRO CB C 85 31.515 33.175 -1.660 1
1 920 . 6 1 1 A 86 86 ARG HA H 86 3.882 4.034 -0.152 1
1 927 . 6 1 1 A 86 86 ARG C C 86 175.712 177.147 -1.435 1
1 928 . 6 1 1 A 86 86 ARG CA C 86 57.877 59.084 -1.207 1
1 929 . 6 1 1 A 86 86 ARG CB C 86 29.791 29.980 -0.189 1
1 932 . 6 1 1 A 87 87 ASP H H 87 8.903 7.848 1.055 1
1 933 . 6 1 1 A 87 87 ASP HA H 87 4.342 4.721 -0.379 1
1 936 . 6 1 1 A 87 87 ASP C C 87 175.723 175.322 0.401 1
1 937 . 6 1 1 A 87 87 ASP CA C 87 56.377 54.061 2.316 1
1 938 . 6 1 1 A 87 87 ASP CB C 87 39.208 41.261 -2.053 1
1 939 . 6 1 1 A 87 87 ASP N N 87 117.520 116.762 0.758 1
1 940 . 6 1 1 A 88 88 THR H H 88 7.776 7.561 0.215 1
1 941 . 6 1 1 A 88 88 THR HA H 88 5.101 5.015 0.086 1
1 946 . 6 1 1 A 88 88 THR C C 88 173.825 172.849 0.976 1
1 947 . 6 1 1 A 88 88 THR CA C 88 60.154 60.028 0.126 1
1 948 . 6 1 1 A 88 88 THR CB C 88 72.702 72.824 -0.122 1
1 950 . 6 1 1 A 88 88 THR N N 88 108.770 111.561 -2.791 1
1 951 . 6 1 1 A 89 89 SER H H 89 9.006 9.125 -0.119 1
1 952 . 6 1 1 A 89 89 SER HA H 89 4.718 5.182 -0.464 1
1 955 . 6 1 1 A 89 89 SER C C 89 173.728 173.035 0.693 1
1 956 . 6 1 1 A 89 89 SER CA C 89 57.453 57.898 -0.445 1
1 957 . 6 1 1 A 89 89 SER CB C 89 65.611 65.304 0.307 1
1 958 . 6 1 1 A 89 89 SER N N 89 114.151 116.671 -2.520 1
1 959 . 6 1 1 A 90 90 ALA H H 90 9.001 8.867 0.134 1
1 960 . 6 1 1 A 90 90 ALA HA H 90 5.660 4.609 1.051 1
1 964 . 6 1 1 A 90 90 ALA C C 90 177.669 177.492 0.177 1
1 965 . 6 1 1 A 90 90 ALA CA C 90 51.670 51.935 -0.265 1
1 966 . 6 1 1 A 90 90 ALA CB C 90 22.265 19.948 2.317 1
1 967 . 6 1 1 A 90 90 ALA N N 90 126.177 128.973 -2.796 1
1 968 . 6 1 1 A 91 91 PHE H H 91 9.672 8.337 1.335 1
1 969 . 6 1 1 A 91 91 PHE HA H 91 5.039 5.598 -0.559 1
1 977 . 6 1 1 A 91 91 PHE C C 91 170.731 173.631 -2.900 1
1 978 . 6 1 1 A 91 91 PHE CA C 91 56.271 55.026 1.245 1
1 979 . 6 1 1 A 91 91 PHE CB C 91 41.553 42.222 -0.669 1
1 985 . 6 1 1 A 91 91 PHE N N 91 118.968 116.814 2.154 1
1 986 . 6 1 1 A 92 92 PHE H H 92 9.422 9.347 0.075 1
1 987 . 6 1 1 A 92 92 PHE HA H 92 5.674 5.217 0.457 1
1 995 . 6 1 1 A 92 92 PHE C C 92 174.570 175.267 -0.697 1
1 996 . 6 1 1 A 92 92 PHE CA C 92 55.917 56.665 -0.748 1
1 997 . 6 1 1 A 92 92 PHE CB C 92 42.787 41.880 0.907 1
1 1003 . 6 1 1 A 92 92 PHE N N 92 117.543 117.851 -0.308 1
1 1004 . 6 1 1 A 93 93 LEU H H 93 9.021 8.420 0.601 1
1 1005 . 6 1 1 A 93 93 LEU HA H 93 5.122 5.113 0.009 1
1 1015 . 6 1 1 A 93 93 LEU C C 93 174.799 174.101 0.698 1
1 1016 . 6 1 1 A 93 93 LEU CA C 93 54.912 54.516 0.396 1
1 1017 . 6 1 1 A 93 93 LEU CB C 93 45.254 45.537 -0.283 1
1 1021 . 6 1 1 A 93 93 LEU N N 93 121.719 123.398 -1.679 1
1 1022 . 6 1 1 A 94 94 GLU H H 94 9.294 9.277 0.017 1
1 1023 . 6 1 1 A 94 94 GLU HA H 94 5.043 5.176 -0.133 1
1 1028 . 6 1 1 A 94 94 GLU C C 94 175.754 175.536 0.218 1
1 1029 . 6 1 1 A 94 94 GLU CA C 94 56.018 55.170 0.848 1
1 1030 . 6 1 1 A 94 94 GLU CB C 94 32.752 32.354 0.398 1
1 1032 . 6 1 1 A 94 94 GLU N N 94 127.032 128.702 -1.670 1
1 1033 . 6 1 1 A 95 95 THR H H 95 8.822 8.585 0.237 1
1 1034 . 6 1 1 A 95 95 THR HA H 95 5.398 5.019 0.379 1
1 1039 . 6 1 1 A 95 95 THR C C 95 173.860 175.579 -1.719 1
1 1040 . 6 1 1 A 95 95 THR CA C 95 59.588 59.216 0.372 1
1 1041 . 6 1 1 A 95 95 THR CB C 95 72.191 72.113 0.078 1
1 1043 . 6 1 1 A 95 95 THR N N 95 118.685 118.055 0.630 1
1 1044 . 6 1 1 A 96 96 LYS H H 96 8.823 9.042 -0.219 1
1 1045 . 6 1 1 A 96 96 LYS HA H 96 4.022 3.961 0.061 1
1 1054 . 6 1 1 A 96 96 LYS C C 96 177.330 178.357 -1.027 1
1 1055 . 6 1 1 A 96 96 LYS CA C 96 59.588 60.044 -0.456 1
1 1056 . 6 1 1 A 96 96 LYS CB C 96 32.588 32.154 0.434 1
1 1060 . 6 1 1 A 96 96 LYS N N 96 118.801 122.630 -3.829 1
1 1061 . 6 1 1 A 97 97 GLU H H 97 8.092 7.752 0.340 1
1 1062 . 6 1 1 A 97 97 GLU HA H 97 4.282 4.239 0.043 1
1 1067 . 6 1 1 A 97 97 GLU C C 97 176.290 176.698 -0.408 1
1 1068 . 6 1 1 A 97 97 GLU CA C 97 57.365 58.815 -1.450 1
1 1069 . 6 1 1 A 97 97 GLU CB C 97 31.559 30.361 1.198 1
1 1071 . 6 1 1 A 97 97 GLU N N 97 113.992 118.936 -4.944 1
1 1072 . 6 1 1 A 98 98 ARG H H 98 7.482 7.357 0.125 1
1 1073 . 6 1 1 A 98 98 ARG HA H 98 4.397 4.512 -0.115 1
1 1080 . 6 1 1 A 98 98 ARG C C 98 172.792 173.055 -0.263 1
1 1081 . 6 1 1 A 98 98 ARG CA C 98 55.689 54.800 0.889 1
1 1082 . 6 1 1 A 98 98 ARG CB C 98 32.711 31.760 0.951 1
1 1085 . 6 1 1 A 98 98 ARG N N 98 116.022 113.170 2.852 1
1 1086 . 6 1 1 A 99 99 LEU H H 99 8.423 8.254 0.169 1
1 1087 . 6 1 1 A 99 99 LEU HA H 99 4.807 4.737 0.070 1
1 1097 . 6 1 1 A 99 99 LEU C C 99 175.903 174.122 1.781 1
1 1098 . 6 1 1 A 99 99 LEU CA C 99 54.383 53.836 0.547 1
1 1099 . 6 1 1 A 99 99 LEU CB C 99 43.362 43.489 -0.127 1
1 1103 . 6 1 1 A 99 99 LEU N N 99 124.983 122.181 2.802 1
1 1104 . 6 1 1 A 100 100 TYR H H 100 9.144 9.346 -0.202 1
1 1105 . 6 1 1 A 100 100 TYR HA H 100 4.542 5.191 -0.649 1
1 1112 . 6 1 1 A 100 100 TYR C C 100 173.479 174.583 -1.104 1
1 1113 . 6 1 1 A 100 100 TYR CA C 100 57.735 56.336 1.399 1
1 1114 . 6 1 1 A 100 100 TYR CB C 100 39.291 40.716 -1.425 1
1 1119 . 6 1 1 A 100 100 TYR N N 100 126.679 127.342 -0.663 1
1 1120 . 6 1 1 A 101 101 LEU H H 101 9.043 8.909 0.134 1
1 1121 . 6 1 1 A 101 101 LEU HA H 101 4.747 4.969 -0.222 1
1 1131 . 6 1 1 A 101 101 LEU C C 101 173.530 175.065 -1.535 1
1 1132 . 6 1 1 A 101 101 LEU CA C 101 54.524 53.627 0.897 1
1 1133 . 6 1 1 A 101 101 LEU CB C 101 42.499 44.044 -1.545 1
1 1137 . 6 1 1 A 101 101 LEU N N 101 127.422 125.696 1.726 1
1 1138 . 6 1 1 A 102 102 LEU H H 102 8.493 8.459 0.034 1
1 1139 . 6 1 1 A 102 102 LEU HA H 102 5.612 5.278 0.334 1
1 1149 . 6 1 1 A 102 102 LEU C C 102 175.794 176.058 -0.264 1
1 1150 . 6 1 1 A 102 102 LEU CA C 102 53.076 53.205 -0.129 1
1 1151 . 6 1 1 A 102 102 LEU CB C 102 45.994 44.302 1.692 1
1 1155 . 6 1 1 A 102 102 LEU N N 102 126.021 128.820 -2.799 1
1 1156 . 6 1 1 A 103 103 ALA H H 103 9.073 8.714 0.359 1
1 1157 . 6 1 1 A 103 103 ALA HA H 103 5.081 5.299 -0.218 1
1 1161 . 6 1 1 A 103 103 ALA C C 103 175.133 175.821 -0.688 1
1 1162 . 6 1 1 A 103 103 ALA CA C 103 51.688 49.736 1.952 1
1 1163 . 6 1 1 A 103 103 ALA CB C 103 21.689 22.329 -0.640 1
1 1164 . 6 1 1 A 103 103 ALA N N 103 117.679 123.052 -5.373 1
1 1165 . 6 1 1 A 104 104 ALA H H 104 8.582 8.507 0.075 1
1 1166 . 6 1 1 A 104 104 ALA HA H 104 5.220 4.894 0.326 1
1 1170 . 6 1 1 A 104 104 ALA C C 104 173.471 174.271 -0.800 1
1 1171 . 6 1 1 A 104 104 ALA CA C 104 47.959 49.768 -1.809 1
1 1172 . 6 1 1 A 104 104 ALA CB C 104 21.359 22.471 -1.112 1
1 1173 . 6 1 1 A 104 104 ALA N N 104 123.419 121.294 2.125 1
1 1174 . 6 1 1 A 105 105 PRO HA H 105 4.542 4.789 -0.247 1
1 1181 . 6 1 1 A 105 105 PRO C C 105 178.409 177.922 0.487 1
1 1182 . 6 1 1 A 105 105 PRO CA C 105 64.301 62.820 1.481 1
1 1183 . 6 1 1 A 105 105 PRO CB C 105 32.094 31.674 0.420 1
1 1186 . 6 1 1 A 106 106 ALA H H 106 8.302 8.683 -0.381 1
1 1187 . 6 1 1 A 106 106 ALA HA H 106 4.022 4.029 -0.007 1
1 1191 . 6 1 1 A 106 106 ALA C C 106 179.641 179.694 -0.053 1
1 1192 . 6 1 1 A 106 106 ALA CA C 106 56.341 55.187 1.154 1
1 1193 . 6 1 1 A 106 106 ALA CB C 106 18.523 18.261 0.262 1
1 1194 . 6 1 1 A 106 106 ALA N N 106 127.733 127.930 -0.197 1
1 1195 . 6 1 1 A 107 107 ALA H H 107 9.035 8.148 0.887 1
1 1196 . 6 1 1 A 107 107 ALA HA H 107 4.331 4.045 0.286 1
1 1200 . 6 1 1 A 107 107 ALA C C 107 178.586 179.875 -1.289 1
1 1201 . 6 1 1 A 107 107 ALA CA C 107 53.765 55.332 -1.567 1
1 1202 . 6 1 1 A 107 107 ALA CB C 107 18.728 18.187 0.541 1
1 1203 . 6 1 1 A 107 107 ALA N N 107 118.203 120.291 -2.088 1
1 1204 . 6 1 1 A 108 108 GLU H H 108 8.399 8.148 0.251 1
1 1205 . 6 1 1 A 108 108 GLU HA H 108 4.631 4.116 0.515 1
1 1210 . 6 1 1 A 108 108 GLU C C 108 177.127 178.737 -1.610 1
1 1211 . 6 1 1 A 108 108 GLU CA C 108 55.847 58.844 -2.997 1
1 1212 . 6 1 1 A 108 108 GLU CB C 108 32.135 29.976 2.159 1
1 1214 . 6 1 1 A 108 108 GLU N N 108 114.661 117.944 -3.283 1
1 1215 . 6 1 1 A 109 109 ARG H H 109 7.412 8.732 -1.320 1
1 1216 . 6 1 1 A 109 109 ARG HA H 109 3.682 4.183 -0.501 1
1 1223 . 6 1 1 A 109 109 ARG C C 109 176.917 179.168 -2.251 1
1 1224 . 6 1 1 A 109 109 ARG CA C 109 61.600 59.888 1.712 1
1 1225 . 6 1 1 A 109 109 ARG CB C 109 28.845 30.115 -1.270 1
1 1228 . 6 1 1 A 109 109 ARG N N 109 120.954 121.021 -0.067 1
1 1229 . 6 1 1 A 110 110 GLY H H 110 8.833 8.079 0.754 1
1 1230 . 6 1 1 A 110 110 GLY HA2 H 110 3.872 3.787 0.085 1
1 1231 . 6 1 1 A 110 110 GLY HA3 H 110 3.685 3.803 -0.118 1
1 1232 . 6 1 1 A 110 110 GLY C C 110 175.997 175.803 0.194 1
1 1233 . 6 1 1 A 110 110 GLY CA C 110 47.323 47.581 -0.258 1
1 1234 . 6 1 1 A 110 110 GLY N N 110 106.563 107.153 -0.590 1
1 1235 . 6 1 1 A 111 111 ASP H H 111 7.882 8.201 -0.319 1
1 1236 . 6 1 1 A 111 111 ASP HA H 111 4.312 4.403 -0.091 1
1 1239 . 6 1 1 A 111 111 ASP C C 111 179.467 178.774 0.693 1
1 1240 . 6 1 1 A 111 111 ASP CA C 111 56.976 56.676 0.300 1
1 1241 . 6 1 1 A 111 111 ASP CB C 111 40.648 40.985 -0.337 1
1 1242 . 6 1 1 A 111 111 ASP N N 111 121.402 121.490 -0.088 1
1 1243 . 6 1 1 A 112 112 TRP H H 112 7.804 8.378 -0.574 1
1 1244 . 6 1 1 A 112 112 TRP HA H 112 3.831 4.202 -0.371 1
1 1253 . 6 1 1 A 112 112 TRP C C 112 177.547 178.709 -1.162 1
1 1254 . 6 1 1 A 112 112 TRP CA C 112 62.006 60.012 1.994 1
1 1255 . 6 1 1 A 112 112 TRP CB C 112 29.421 29.395 0.026 1
1 1261 . 6 1 1 A 112 112 TRP N N 112 119.904 120.080 -0.176 1
1 1263 . 6 1 1 A 113 113 VAL H H 113 7.982 8.043 -0.061 1
1 1264 . 6 1 1 A 113 113 VAL HA H 113 3.072 3.636 -0.564 1
1 1272 . 6 1 1 A 113 113 VAL C C 113 178.015 178.252 -0.237 1
1 1273 . 6 1 1 A 113 113 VAL CA C 113 67.407 66.685 0.722 1
1 1274 . 6 1 1 A 113 113 VAL CB C 113 31.724 31.516 0.208 1
1 1277 . 6 1 1 A 113 113 VAL N N 113 117.575 119.318 -1.743 1
1 1278 . 6 1 1 A 114 114 GLN H H 114 8.268 8.243 0.025 1
1 1279 . 6 1 1 A 114 114 GLN HA H 114 3.994 3.985 0.009 1
1 1286 . 6 1 1 A 114 114 GLN C C 114 178.021 177.951 0.070 1
1 1287 . 6 1 1 A 114 114 GLN CA C 114 59.112 59.065 0.047 1
1 1288 . 6 1 1 A 114 114 GLN CB C 114 28.685 28.709 -0.024 1
1 1290 . 6 1 1 A 114 114 GLN N N 114 117.479 119.960 -2.481 1
1 1292 . 6 1 1 A 115 115 ALA H H 115 7.915 8.462 -0.547 1
1 1293 . 6 1 1 A 115 115 ALA HA H 115 3.972 4.067 -0.095 1
1 1297 . 6 1 1 A 115 115 ALA C C 115 180.030 180.124 -0.094 1
1 1298 . 6 1 1 A 115 115 ALA CA C 115 55.142 55.044 0.098 1
1 1299 . 6 1 1 A 115 115 ALA CB C 115 18.152 18.492 -0.340 1
1 1300 . 6 1 1 A 115 115 ALA N N 115 120.858 120.486 0.372 1
1 1301 . 6 1 1 A 116 116 ILE H H 116 8.172 8.319 -0.147 1
1 1302 . 6 1 1 A 116 116 ILE HA H 116 3.482 3.818 -0.336 1
1 1312 . 6 1 1 A 116 116 ILE C C 116 177.739 178.340 -0.601 1
1 1313 . 6 1 1 A 116 116 ILE CA C 116 66.119 64.990 1.129 1
1 1314 . 6 1 1 A 116 116 ILE CB C 116 38.222 37.883 0.339 1
1 1318 . 6 1 1 A 116 116 ILE N N 116 115.977 117.671 -1.694 1
1 1319 . 6 1 1 A 117 117 CYS H H 117 8.449 8.209 0.240 1
1 1320 . 6 1 1 A 117 117 CYS HA H 117 4.032 4.397 -0.365 1
1 1323 . 6 1 1 A 117 117 CYS C C 117 177.321 177.357 -0.036 1
1 1324 . 6 1 1 A 117 117 CYS CA C 117 64.777 62.175 2.602 1
1 1325 . 6 1 1 A 117 117 CYS CB C 117 26.871 27.174 -0.303 1
1 1326 . 6 1 1 A 117 117 CYS N N 117 117.253 120.798 -3.545 1
1 1327 . 6 1 1 A 118 118 LEU H H 118 8.182 8.198 -0.016 1
1 1328 . 6 1 1 A 118 118 LEU HA H 118 4.052 4.119 -0.067 1
1 1338 . 6 1 1 A 118 118 LEU C C 118 179.217 179.407 -0.190 1
1 1339 . 6 1 1 A 118 118 LEU CA C 118 57.877 57.607 0.270 1
1 1340 . 6 1 1 A 118 118 LEU CB C 118 42.088 41.451 0.637 1
1 1344 . 6 1 1 A 118 118 LEU N N 118 119.665 121.515 -1.850 1
1 1345 . 6 1 1 A 119 119 LEU H H 119 7.142 7.757 -0.615 1
1 1346 . 6 1 1 A 119 119 LEU HA H 119 4.192 4.245 -0.053 1
1 1356 . 6 1 1 A 119 119 LEU C C 119 178.492 178.495 -0.003 1
1 1357 . 6 1 1 A 119 119 LEU CA C 119 56.259 57.464 -1.205 1
1 1358 . 6 1 1 A 119 119 LEU CB C 119 43.568 42.100 1.468 1
1 1362 . 6 1 1 A 119 119 LEU N N 119 116.244 119.521 -3.277 1
1 1363 . 6 1 1 A 120 120 ALA H H 120 8.513 8.457 0.056 1
1 1364 . 6 1 1 A 120 120 ALA HA H 120 3.878 4.042 -0.164 1
1 1368 . 6 1 1 A 120 120 ALA C C 120 178.358 178.472 -0.114 1
1 1369 . 6 1 1 A 120 120 ALA CA C 120 53.765 55.064 -1.299 1
1 1370 . 6 1 1 A 120 120 ALA CB C 120 18.687 18.771 -0.084 1
1 1371 . 6 1 1 A 120 120 ALA N N 120 120.009 120.256 -0.247 1
1 1372 . 6 1 1 A 121 121 PHE H H 121 7.822 8.064 -0.242 1
1 1373 . 6 1 1 A 121 121 PHE HA H 121 5.156 4.842 0.314 1
1 1381 . 6 1 1 A 121 121 PHE C C 121 176.273 175.316 0.957 1
1 1382 . 6 1 1 A 121 121 PHE CA C 121 55.741 57.164 -1.423 1
1 1383 . 6 1 1 A 121 121 PHE CB C 121 39.455 39.039 0.416 1
1 1389 . 6 1 1 A 121 121 PHE N N 121 113.981 113.882 0.099 1
1 1390 . 6 1 1 A 122 122 SER H H 122 7.765 7.855 -0.090 1
1 1391 . 6 1 1 A 122 122 SER HA H 122 4.579 4.640 -0.061 1
1 1394 . 6 1 1 A 122 122 SER C C 122 174.595 173.963 0.632 1
1 1395 . 6 1 1 A 122 122 SER CA C 122 58.777 59.642 -0.865 1
1 1396 . 6 1 1 A 122 122 SER CB C 122 63.719 62.978 0.741 1
1 1397 . 6 1 1 A 122 122 SER N N 122 115.069 117.111 -2.042 1
1 1398 . 6 1 1 A 123 123 GLY H H 123 8.223 8.215 0.008 1
1 1399 . 6 1 1 A 123 123 GLY HA2 H 123 4.174 4.193 -0.019 1
1 1400 . 6 1 1 A 123 123 GLY HA3 H 123 4.100 4.206 -0.106 1
1 1401 . 6 1 1 A 123 123 GLY C C 123 171.678 174.132 -2.454 1
1 1402 . 6 1 1 A 123 123 GLY CA C 123 44.815 45.690 -0.875 1
1 1403 . 6 1 1 A 123 123 GLY N N 123 110.151 113.905 -3.754 1
1 1404 . 6 1 1 A 124 124 PRO HA H 124 4.482 4.482 0.000 1
1 1411 . 6 1 1 A 124 124 PRO C C 124 177.314 177.163 0.151 1
1 1412 . 6 1 1 A 124 124 PRO CA C 124 63.206 64.116 -0.910 1
1 1413 . 6 1 1 A 124 124 PRO CB C 124 32.176 31.752 0.424 1
1 1416 . 6 1 1 A 125 125 SER H H 125 8.485 8.169 0.316 1
1 1417 . 6 1 1 A 125 125 SER HA H 125 4.472 4.710 -0.238 1
1 1420 . 6 1 1 A 125 125 SER C C 125 174.728 173.053 1.675 1
1 1421 . 6 1 1 A 125 125 SER CA C 125 58.353 57.275 1.078 1
1 1422 . 6 1 1 A 125 125 SER CB C 125 64.048 62.676 1.372 1
1 1423 . 6 1 1 A 125 125 SER N N 125 116.081 113.308 2.773 1
1 1424 . 6 1 1 A 126 126 SER H H 126 8.332 7.671 0.661 1
1 1425 . 6 1 1 A 126 126 SER HA H 126 4.464 5.186 -0.722 1
1 1428 . 6 1 1 A 126 126 SER C C 126 173.980 173.504 0.476 1
1 1429 . 6 1 1 A 126 126 SER CA C 126 58.336 57.162 1.174 1
1 1430 . 6 1 1 A 126 126 SER CB C 126 63.925 65.751 -1.826 1
1 1431 . 6 1 1 A 126 126 SER N N 126 118.037 118.448 -0.411 1
1 1 . 7 1 1 A 6 6 SER HA H 6 4.458 4.176 0.282 1
1 3 . 7 1 1 A 6 6 SER C C 6 175.108 174.653 0.455 1
1 4 . 7 1 1 A 6 6 SER CA C 6 58.689 59.309 -0.620 1
1 5 . 7 1 1 A 6 6 SER CB C 6 63.678 61.849 1.829 1
1 6 . 7 1 1 A 7 7 GLY H H 7 8.449 8.483 -0.034 1
1 7 . 7 1 1 A 7 7 GLY HA2 H 7 3.965 3.854 0.111 1
1 8 . 7 1 1 A 7 7 GLY HA3 H 7 3.965 3.855 0.110 1
1 9 . 7 1 1 A 7 7 GLY C C 7 174.380 173.922 0.458 1
1 10 . 7 1 1 A 7 7 GLY CA C 7 45.435 47.271 -1.836 1
1 11 . 7 1 1 A 7 7 GLY N N 7 110.792 105.410 5.382 1
1 12 . 7 1 1 A 8 8 MET H H 8 8.259 8.347 -0.088 1
1 13 . 7 1 1 A 8 8 MET HA H 8 4.487 5.093 -0.606 1
1 21 . 7 1 1 A 8 8 MET C C 8 176.961 175.698 1.263 1
1 22 . 7 1 1 A 8 8 MET CA C 8 55.565 53.999 1.566 1
1 23 . 7 1 1 A 8 8 MET CB C 8 32.835 34.002 -1.167 1
1 26 . 7 1 1 A 8 8 MET N N 8 119.639 122.639 -3.000 1
1 27 . 7 1 1 A 9 9 GLY H H 9 8.472 8.669 -0.197 1
1 28 . 7 1 1 A 9 9 GLY HA2 H 9 3.946 3.901 0.045 1
1 29 . 7 1 1 A 9 9 GLY HA3 H 9 3.946 3.903 0.043 1
1 30 . 7 1 1 A 9 9 GLY C C 9 174.005 174.349 -0.344 1
1 31 . 7 1 1 A 9 9 GLY CA C 9 45.488 46.837 -1.349 1
1 32 . 7 1 1 A 9 9 GLY N N 9 110.107 110.496 -0.389 1
1 33 . 7 1 1 A 10 10 ASP H H 10 8.292 7.751 0.541 1
1 34 . 7 1 1 A 10 10 ASP HA H 10 4.636 5.143 -0.507 1
1 37 . 7 1 1 A 10 10 ASP C C 10 176.768 174.549 2.219 1
1 38 . 7 1 1 A 10 10 ASP CA C 10 54.206 52.923 1.283 1
1 39 . 7 1 1 A 10 10 ASP CB C 10 41.306 43.693 -2.387 1
1 40 . 7 1 1 A 10 10 ASP N N 10 120.370 113.483 6.887 1
1 41 . 7 1 1 A 11 11 GLY H H 11 8.452 8.975 -0.523 1
1 42 . 7 1 1 A 11 11 GLY HA2 H 11 3.980 4.261 -0.281 1
1 43 . 7 1 1 A 11 11 GLY HA3 H 11 4.022 4.262 -0.240 1
1 44 . 7 1 1 A 11 11 GLY C C 11 174.102 172.109 1.993 1
1 45 . 7 1 1 A 11 11 GLY CA C 11 45.170 45.530 -0.360 1
1 46 . 7 1 1 A 11 11 GLY N N 11 108.391 109.729 -1.338 1
1 47 . 7 1 1 A 12 12 ALA H H 12 8.293 8.542 -0.249 1
1 48 . 7 1 1 A 12 12 ALA HA H 12 3.777 4.887 -1.110 1
1 52 . 7 1 1 A 12 12 ALA C C 12 178.193 177.629 0.564 1
1 53 . 7 1 1 A 12 12 ALA CA C 12 52.759 50.644 2.115 1
1 54 . 7 1 1 A 12 12 ALA CB C 12 17.855 20.946 -3.091 1
1 55 . 7 1 1 A 12 12 ALA N N 12 124.185 126.899 -2.714 1
1 56 . 7 1 1 A 13 13 VAL H H 13 8.822 8.099 0.723 1
1 57 . 7 1 1 A 13 13 VAL HA H 13 3.912 3.850 0.062 1
1 65 . 7 1 1 A 13 13 VAL C C 13 176.073 175.645 0.428 1
1 66 . 7 1 1 A 13 13 VAL CA C 13 63.100 64.933 -1.833 1
1 67 . 7 1 1 A 13 13 VAL CB C 13 32.711 31.925 0.786 1
1 70 . 7 1 1 A 13 13 VAL N N 13 120.877 123.165 -2.288 1
1 71 . 7 1 1 A 14 14 LYS H H 14 7.093 7.305 -0.212 1
1 72 . 7 1 1 A 14 14 LYS HA H 14 4.169 4.756 -0.587 1
1 81 . 7 1 1 A 14 14 LYS C C 14 173.291 174.170 -0.879 1
1 82 . 7 1 1 A 14 14 LYS CA C 14 56.465 55.006 1.459 1
1 83 . 7 1 1 A 14 14 LYS CB C 14 35.960 35.871 0.089 1
1 87 . 7 1 1 A 14 14 LYS N N 14 118.693 118.912 -0.219 1
1 88 . 7 1 1 A 15 15 GLN H H 15 8.522 8.460 0.062 1
1 89 . 7 1 1 A 15 15 GLN HA H 15 5.542 5.134 0.408 1
1 96 . 7 1 1 A 15 15 GLN C C 15 174.992 175.238 -0.246 1
1 97 . 7 1 1 A 15 15 GLN CA C 15 54.312 54.165 0.147 1
1 98 . 7 1 1 A 15 15 GLN CB C 15 33.585 33.008 0.577 1
1 100 . 7 1 1 A 15 15 GLN N N 15 124.024 123.724 0.300 1
1 102 . 7 1 1 A 16 16 GLY H H 16 8.740 7.875 0.865 1
1 103 . 7 1 1 A 16 16 GLY HA2 H 16 4.511 3.888 0.623 1
1 104 . 7 1 1 A 16 16 GLY HA3 H 16 4.064 4.319 -0.255 1
1 105 . 7 1 1 A 16 16 GLY C C 16 171.431 171.331 0.100 1
1 106 . 7 1 1 A 16 16 GLY CA C 16 46.106 45.646 0.460 1
1 107 . 7 1 1 A 16 16 GLY N N 16 109.611 108.394 1.217 1
1 108 . 7 1 1 A 17 17 PHE H H 17 8.886 8.382 0.504 1
1 109 . 7 1 1 A 17 17 PHE HA H 17 5.466 5.024 0.442 1
1 114 . 7 1 1 A 17 17 PHE C C 17 174.795 174.882 -0.087 1
1 115 . 7 1 1 A 17 17 PHE CA C 17 57.788 57.094 0.694 1
1 116 . 7 1 1 A 17 17 PHE CB C 17 41.315 40.556 0.759 1
1 119 . 7 1 1 A 17 17 PHE N N 17 122.684 119.452 3.232 1
1 120 . 7 1 1 A 18 18 LEU H H 18 8.762 8.928 -0.166 1
1 121 . 7 1 1 A 18 18 LEU HA H 18 4.946 4.599 0.347 1
1 131 . 7 1 1 A 18 18 LEU C C 18 175.461 174.792 0.669 1
1 132 . 7 1 1 A 18 18 LEU CA C 18 52.970 52.647 0.323 1
1 133 . 7 1 1 A 18 18 LEU CB C 18 47.945 45.055 2.890 1
1 137 . 7 1 1 A 18 18 LEU N N 18 119.045 123.996 -4.951 1
1 138 . 7 1 1 A 19 19 TYR H H 19 9.272 8.203 1.069 1
1 139 . 7 1 1 A 19 19 TYR HA H 19 5.682 5.647 0.035 1
1 146 . 7 1 1 A 19 19 TYR C C 19 174.829 174.466 0.363 1
1 147 . 7 1 1 A 19 19 TYR CA C 19 56.482 56.345 0.137 1
1 148 . 7 1 1 A 19 19 TYR CB C 19 41.717 43.059 -1.342 1
1 153 . 7 1 1 A 19 19 TYR N N 19 118.024 117.755 0.269 1
1 154 . 7 1 1 A 20 20 LEU H H 20 9.441 8.996 0.445 1
1 155 . 7 1 1 A 20 20 LEU HA H 20 5.283 5.141 0.142 1
1 165 . 7 1 1 A 20 20 LEU C C 20 175.935 175.828 0.107 1
1 166 . 7 1 1 A 20 20 LEU CA C 20 53.464 53.813 -0.349 1
1 167 . 7 1 1 A 20 20 LEU CB C 20 46.570 45.292 1.278 1
1 171 . 7 1 1 A 20 20 LEU N N 20 122.838 124.871 -2.033 1
1 172 . 7 1 1 A 21 21 GLN H H 21 8.391 8.622 -0.231 1
1 173 . 7 1 1 A 21 21 GLN HA H 21 3.791 4.196 -0.405 1
1 180 . 7 1 1 A 21 21 GLN C C 21 175.157 174.561 0.596 1
1 181 . 7 1 1 A 21 21 GLN CA C 21 56.094 55.982 0.112 1
1 182 . 7 1 1 A 21 21 GLN CB C 21 28.434 28.775 -0.341 1
1 184 . 7 1 1 A 21 21 GLN N N 21 129.943 127.900 2.043 1
1 186 . 7 1 1 A 22 22 GLN H H 22 8.829 8.665 0.164 1
1 187 . 7 1 1 A 22 22 GLN HA H 22 4.553 4.623 -0.070 1
1 194 . 7 1 1 A 22 22 GLN C C 22 174.998 176.192 -1.194 1
1 195 . 7 1 1 A 22 22 GLN CA C 22 54.912 54.148 0.764 1
1 196 . 7 1 1 A 22 22 GLN CB C 22 31.930 28.826 3.104 1
1 198 . 7 1 1 A 22 22 GLN N N 22 127.199 126.617 0.582 1
1 200 . 7 1 1 A 23 23 GLN HA H 23 4.142 4.059 0.083 1
1 207 . 7 1 1 A 23 23 GLN CA C 23 56.427 57.215 -0.788 1
1 208 . 7 1 1 A 23 23 GLN CB C 23 29.227 28.645 0.582 1
1 211 . 7 1 1 A 24 24 GLN HA H 24 4.523 4.504 0.019 1
1 218 . 7 1 1 A 24 24 GLN CB C 24 29.759 28.544 1.215 1
1 221 . 7 1 1 A 25 25 THR HA H 25 3.870 4.424 -0.554 1
1 226 . 7 1 1 A 25 25 THR CA C 25 65.096 60.141 4.955 1
1 227 . 7 1 1 A 25 25 THR CB C 25 68.924 69.702 -0.778 1
1 229 . 7 1 1 A 26 26 PHE HA H 26 4.690 4.197 0.493 1
1 236 . 7 1 1 A 26 26 PHE C C 26 175.523 176.021 -0.498 1
1 237 . 7 1 1 A 26 26 PHE CA C 26 57.312 60.285 -2.973 1
1 238 . 7 1 1 A 26 26 PHE CB C 26 39.003 38.694 0.309 1
1 243 . 7 1 1 A 27 27 GLY H H 27 7.755 7.708 0.047 1
1 244 . 7 1 1 A 27 27 GLY HA2 H 27 4.172 4.076 0.096 1
1 245 . 7 1 1 A 27 27 GLY HA3 H 27 3.783 4.097 -0.314 1
1 246 . 7 1 1 A 27 27 GLY C C 27 172.557 172.497 0.060 1
1 247 . 7 1 1 A 27 27 GLY CA C 27 44.924 45.616 -0.692 1
1 248 . 7 1 1 A 27 27 GLY N N 27 109.216 103.747 5.469 1
1 249 . 7 1 1 A 28 28 LYS H H 28 8.241 8.501 -0.260 1
1 250 . 7 1 1 A 28 28 LYS HA H 28 4.530 4.426 0.104 1
1 259 . 7 1 1 A 28 28 LYS C C 28 176.204 175.299 0.905 1
1 260 . 7 1 1 A 28 28 LYS CA C 28 55.741 56.486 -0.745 1
1 261 . 7 1 1 A 28 28 LYS CB C 28 33.904 32.612 1.292 1
1 265 . 7 1 1 A 28 28 LYS N N 28 118.743 122.837 -4.094 1
1 266 . 7 1 1 A 29 29 LYS H H 29 8.356 8.129 0.227 1
1 267 . 7 1 1 A 29 29 LYS HA H 29 4.559 4.826 -0.267 1
1 274 . 7 1 1 A 29 29 LYS C C 29 175.420 175.196 0.224 1
1 275 . 7 1 1 A 29 29 LYS CA C 29 55.406 55.000 0.406 1
1 276 . 7 1 1 A 29 29 LYS CB C 29 35.618 35.975 -0.357 1
1 280 . 7 1 1 A 29 29 LYS N N 29 121.198 126.341 -5.143 1
1 281 . 7 1 1 A 30 30 TRP H H 30 8.891 8.506 0.385 1
1 282 . 7 1 1 A 30 30 TRP HA H 30 4.951 4.785 0.166 1
1 291 . 7 1 1 A 30 30 TRP C C 30 175.902 176.577 -0.675 1
1 292 . 7 1 1 A 30 30 TRP CA C 30 56.677 58.320 -1.643 1
1 293 . 7 1 1 A 30 30 TRP CB C 30 30.614 30.547 0.067 1
1 299 . 7 1 1 A 30 30 TRP N N 30 123.304 126.721 -3.417 1
1 301 . 7 1 1 A 31 31 ARG H H 31 8.712 9.143 -0.431 1
1 302 . 7 1 1 A 31 31 ARG HA H 31 4.820 5.148 -0.328 1
1 309 . 7 1 1 A 31 31 ARG C C 31 174.026 174.674 -0.648 1
1 310 . 7 1 1 A 31 31 ARG CA C 31 54.895 53.950 0.945 1
1 311 . 7 1 1 A 31 31 ARG CB C 31 34.045 34.448 -0.403 1
1 314 . 7 1 1 A 31 31 ARG N N 31 123.973 121.503 2.470 1
1 315 . 7 1 1 A 32 32 ARG H H 32 8.820 8.517 0.303 1
1 316 . 7 1 1 A 32 32 ARG HA H 32 3.965 5.420 -1.455 1
1 323 . 7 1 1 A 32 32 ARG C C 32 174.785 174.525 0.260 1
1 324 . 7 1 1 A 32 32 ARG CA C 32 56.924 54.156 2.768 1
1 325 . 7 1 1 A 32 32 ARG CB C 32 31.806 33.885 -2.079 1
1 328 . 7 1 1 A 32 32 ARG N N 32 127.041 119.876 7.165 1
1 329 . 7 1 1 A 33 33 PHE H H 33 9.372 8.439 0.933 1
1 330 . 7 1 1 A 33 33 PHE HA H 33 4.863 5.154 -0.291 1
1 338 . 7 1 1 A 33 33 PHE C C 33 176.359 175.509 0.850 1
1 339 . 7 1 1 A 33 33 PHE CA C 33 57.224 56.799 0.425 1
1 340 . 7 1 1 A 33 33 PHE CB C 33 43.385 43.036 0.349 1
1 346 . 7 1 1 A 33 33 PHE N N 33 125.882 118.175 7.707 1
1 347 . 7 1 1 A 34 34 GLY H H 34 9.160 8.888 0.272 1
1 348 . 7 1 1 A 34 34 GLY HA2 H 34 4.182 4.109 0.073 1
1 349 . 7 1 1 A 34 34 GLY HA3 H 34 3.714 4.182 -0.468 1
1 350 . 7 1 1 A 34 34 GLY C C 34 172.920 173.259 -0.339 1
1 351 . 7 1 1 A 34 34 GLY CA C 34 46.247 46.273 -0.026 1
1 352 . 7 1 1 A 34 34 GLY N N 34 108.654 111.427 -2.773 1
1 353 . 7 1 1 A 35 35 ALA H H 35 8.982 8.271 0.711 1
1 354 . 7 1 1 A 35 35 ALA HA H 35 5.660 5.533 0.127 1
1 358 . 7 1 1 A 35 35 ALA C C 35 176.547 175.669 0.878 1
1 359 . 7 1 1 A 35 35 ALA CA C 35 50.500 50.287 0.213 1
1 360 . 7 1 1 A 35 35 ALA CB C 35 24.034 21.802 2.232 1
1 361 . 7 1 1 A 35 35 ALA N N 35 130.076 128.365 1.711 1
1 362 . 7 1 1 A 36 36 SER H H 36 8.852 8.323 0.529 1
1 363 . 7 1 1 A 36 36 SER HA H 36 5.203 5.042 0.161 1
1 366 . 7 1 1 A 36 36 SER C C 36 170.939 171.937 -0.998 1
1 367 . 7 1 1 A 36 36 SER CA C 36 57.806 56.495 1.311 1
1 368 . 7 1 1 A 36 36 SER CB C 36 66.986 64.865 2.121 1
1 369 . 7 1 1 A 36 36 SER N N 36 116.620 115.902 0.718 1
1 370 . 7 1 1 A 37 37 LEU H H 37 8.862 8.858 0.004 1
1 371 . 7 1 1 A 37 37 LEU HA H 37 5.163 4.828 0.335 1
1 381 . 7 1 1 A 37 37 LEU C C 37 173.525 174.031 -0.506 1
1 382 . 7 1 1 A 37 37 LEU CA C 37 53.112 53.555 -0.443 1
1 383 . 7 1 1 A 37 37 LEU CB C 37 46.077 43.239 2.838 1
1 387 . 7 1 1 A 37 37 LEU N N 37 127.638 128.983 -1.345 1
1 388 . 7 1 1 A 38 38 TYR H H 38 9.280 8.458 0.822 1
1 389 . 7 1 1 A 38 38 TYR HA H 38 4.820 5.191 -0.371 1
1 396 . 7 1 1 A 38 38 TYR C C 38 175.430 175.492 -0.062 1
1 397 . 7 1 1 A 38 38 TYR CA C 38 57.436 56.485 0.951 1
1 398 . 7 1 1 A 38 38 TYR CB C 38 42.128 41.217 0.911 1
1 403 . 7 1 1 A 38 38 TYR N N 38 125.215 127.287 -2.072 1
1 404 . 7 1 1 A 39 39 GLY H H 39 8.532 8.492 0.040 1
1 405 . 7 1 1 A 39 39 GLY HA2 H 39 4.220 4.149 0.071 1
1 406 . 7 1 1 A 39 39 GLY HA3 H 39 3.941 4.151 -0.210 1
1 407 . 7 1 1 A 39 39 GLY C C 39 172.950 174.460 -1.510 1
1 408 . 7 1 1 A 39 39 GLY CA C 39 44.817 44.730 0.087 1
1 409 . 7 1 1 A 39 39 GLY N N 39 106.424 110.742 -4.318 1
1 410 . 7 1 1 A 40 40 GLY H H 40 8.477 8.656 -0.179 1
1 411 . 7 1 1 A 40 40 GLY HA2 H 40 4.102 3.832 0.270 1
1 412 . 7 1 1 A 40 40 GLY HA3 H 40 3.927 3.842 0.085 1
1 413 . 7 1 1 A 40 40 GLY C C 40 174.002 173.817 0.185 1
1 414 . 7 1 1 A 40 40 GLY CA C 40 44.694 47.134 -2.440 1
1 415 . 7 1 1 A 40 40 GLY N N 40 106.881 109.219 -2.338 1
1 416 . 7 1 1 A 41 41 SER H H 41 8.600 7.646 0.954 1
1 417 . 7 1 1 A 41 41 SER HA H 41 4.520 4.981 -0.461 1
1 420 . 7 1 1 A 41 41 SER C C 41 174.355 172.682 1.673 1
1 421 . 7 1 1 A 41 41 SER CA C 41 58.565 57.353 1.212 1
1 422 . 7 1 1 A 41 41 SER CB C 41 64.413 67.081 -2.668 1
1 423 . 7 1 1 A 41 41 SER N N 41 115.751 114.558 1.193 1
1 424 . 7 1 1 A 42 42 ASP H H 42 8.533 8.787 -0.254 1
1 425 . 7 1 1 A 42 42 ASP HA H 42 4.560 4.727 -0.167 1
1 428 . 7 1 1 A 42 42 ASP CA C 42 55.230 54.947 0.283 1
1 429 . 7 1 1 A 42 42 ASP CB C 42 40.648 40.238 0.410 1
1 430 . 7 1 1 A 42 42 ASP N N 42 119.037 121.837 -2.800 1
1 431 . 7 1 1 A 43 43 CYS H H 43 8.152 8.860 -0.708 1
1 432 . 7 1 1 A 43 43 CYS HA H 43 4.541 4.082 0.459 1
1 435 . 7 1 1 A 43 43 CYS C C 43 173.975 173.299 0.676 1
1 436 . 7 1 1 A 43 43 CYS CA C 43 58.265 60.078 -1.813 1
1 437 . 7 1 1 A 43 43 CYS CB C 43 28.393 26.465 1.928 1
1 438 . 7 1 1 A 43 43 CYS N N 43 116.881 121.699 -4.818 1
1 439 . 7 1 1 A 44 44 ALA H H 44 8.047 7.606 0.441 1
1 440 . 7 1 1 A 44 44 ALA HA H 44 4.395 4.928 -0.533 1
1 444 . 7 1 1 A 44 44 ALA C C 44 176.472 176.515 -0.043 1
1 445 . 7 1 1 A 44 44 ALA CA C 44 52.688 50.278 2.410 1
1 446 . 7 1 1 A 44 44 ALA CB C 44 20.579 22.897 -2.318 1
1 447 . 7 1 1 A 44 44 ALA N N 44 125.989 120.226 5.763 1
1 448 . 7 1 1 A 45 45 LEU H H 45 8.052 8.479 -0.427 1
1 449 . 7 1 1 A 45 45 LEU HA H 45 4.452 4.805 -0.353 1
1 459 . 7 1 1 A 45 45 LEU C C 45 176.196 175.949 0.247 1
1 460 . 7 1 1 A 45 45 LEU CA C 45 53.771 53.638 0.133 1
1 461 . 7 1 1 A 45 45 LEU CB C 45 43.116 43.512 -0.396 1
1 465 . 7 1 1 A 45 45 LEU N N 45 119.889 117.849 2.040 1
1 466 . 7 1 1 A 46 46 ALA H H 46 8.381 8.565 -0.184 1
1 467 . 7 1 1 A 46 46 ALA HA H 46 4.449 5.680 -1.231 1
1 471 . 7 1 1 A 46 46 ALA C C 46 179.093 175.795 3.298 1
1 472 . 7 1 1 A 46 46 ALA CA C 46 52.829 50.614 2.215 1
1 473 . 7 1 1 A 46 46 ALA CB C 46 18.687 22.353 -3.666 1
1 474 . 7 1 1 A 46 46 ALA N N 46 125.635 122.119 3.516 1
1 475 . 7 1 1 A 47 47 ARG H H 47 9.012 8.982 0.030 1
1 476 . 7 1 1 A 47 47 ARG HA H 47 5.192 5.178 0.014 1
1 484 . 7 1 1 A 47 47 ARG C C 47 171.524 174.076 -2.552 1
1 485 . 7 1 1 A 47 47 ARG CA C 47 55.265 54.782 0.483 1
1 486 . 7 1 1 A 47 47 ARG CB C 47 30.970 34.134 -3.164 1
1 489 . 7 1 1 A 47 47 ARG N N 47 120.048 119.319 0.729 1
1 491 . 7 1 1 A 48 48 LEU H H 48 9.029 8.937 0.092 1
1 492 . 7 1 1 A 48 48 LEU HA H 48 5.221 4.980 0.241 1
1 502 . 7 1 1 A 48 48 LEU C C 48 174.348 175.035 -0.687 1
1 503 . 7 1 1 A 48 48 LEU CA C 48 53.253 53.866 -0.613 1
1 504 . 7 1 1 A 48 48 LEU CB C 48 45.419 44.148 1.271 1
1 508 . 7 1 1 A 48 48 LEU N N 48 123.315 124.442 -1.127 1
1 509 . 7 1 1 A 49 49 GLU H H 49 9.473 8.657 0.816 1
1 510 . 7 1 1 A 49 49 GLU HA H 49 5.222 4.877 0.345 1
1 515 . 7 1 1 A 49 49 GLU C C 49 175.507 175.811 -0.304 1
1 516 . 7 1 1 A 49 49 GLU CA C 49 55.159 55.661 -0.502 1
1 517 . 7 1 1 A 49 49 GLU CB C 49 32.341 31.626 0.715 1
1 519 . 7 1 1 A 49 49 GLU N N 49 124.751 127.007 -2.256 1
1 520 . 7 1 1 A 50 50 LEU H H 50 9.088 8.764 0.324 1
1 521 . 7 1 1 A 50 50 LEU HA H 50 5.382 5.059 0.323 1
1 531 . 7 1 1 A 50 50 LEU C C 50 175.474 176.301 -0.827 1
1 532 . 7 1 1 A 50 50 LEU CA C 50 52.865 53.533 -0.668 1
1 533 . 7 1 1 A 50 50 LEU CB C 50 43.239 45.229 -1.990 1
1 537 . 7 1 1 A 50 50 LEU N N 50 124.221 124.259 -0.038 1
1 538 . 7 1 1 A 51 51 GLN H H 51 9.602 8.826 0.776 1
1 539 . 7 1 1 A 51 51 GLN HA H 51 5.095 5.100 -0.005 1
1 546 . 7 1 1 A 51 51 GLN C C 51 175.306 173.608 1.698 1
1 547 . 7 1 1 A 51 51 GLN CA C 51 54.576 53.932 0.644 1
1 548 . 7 1 1 A 51 51 GLN CB C 51 32.177 32.392 -0.215 1
1 550 . 7 1 1 A 51 51 GLN N N 51 123.268 119.469 3.799 1
1 552 . 7 1 1 A 52 52 GLU H H 52 9.172 8.920 0.252 1
1 553 . 7 1 1 A 52 52 GLU HA H 52 4.092 4.686 -0.594 1
1 558 . 7 1 1 A 52 52 GLU C C 52 176.523 175.978 0.545 1
1 559 . 7 1 1 A 52 52 GLU CA C 52 57.500 55.600 1.900 1
1 560 . 7 1 1 A 52 52 GLU CB C 52 30.696 32.474 -1.778 1
1 562 . 7 1 1 A 52 52 GLU N N 52 128.982 119.932 9.050 1
1 563 . 7 1 1 A 53 53 GLY H H 53 8.644 9.156 -0.512 1
1 564 . 7 1 1 A 53 53 GLY HA2 H 53 4.261 3.968 0.293 1
1 565 . 7 1 1 A 53 53 GLY HA3 H 53 3.993 4.000 -0.007 1
1 566 . 7 1 1 A 53 53 GLY C C 53 172.550 175.742 -3.192 1
1 567 . 7 1 1 A 53 53 GLY CA C 53 45.911 47.051 -1.140 1
1 568 . 7 1 1 A 53 53 GLY N N 53 110.844 114.440 -3.596 1
1 569 . 7 1 1 A 54 54 PRO HA H 54 4.392 4.527 -0.135 1
1 576 . 7 1 1 A 54 54 PRO C C 54 176.828 177.184 -0.356 1
1 577 . 7 1 1 A 54 54 PRO CA C 54 63.665 64.601 -0.936 1
1 578 . 7 1 1 A 54 54 PRO CB C 54 32.012 32.017 -0.005 1
1 581 . 7 1 1 A 55 55 GLU H H 55 8.934 8.563 0.371 1
1 582 . 7 1 1 A 55 55 GLU HA H 55 4.193 4.514 -0.321 1
1 587 . 7 1 1 A 55 55 GLU C C 55 176.189 175.832 0.357 1
1 588 . 7 1 1 A 55 55 GLU CA C 55 57.383 55.651 1.732 1
1 589 . 7 1 1 A 55 55 GLU CB C 55 28.945 29.442 -0.497 1
1 591 . 7 1 1 A 55 55 GLU N N 55 120.312 115.371 4.941 1
1 592 . 7 1 1 A 56 56 LYS H H 56 7.937 7.950 -0.013 1
1 593 . 7 1 1 A 56 56 LYS HA H 56 4.578 4.853 -0.275 1
1 602 . 7 1 1 A 56 56 LYS C C 56 174.295 176.001 -1.706 1
1 603 . 7 1 1 A 56 56 LYS CA C 56 54.171 52.923 1.248 1
1 604 . 7 1 1 A 56 56 LYS CB C 56 32.555 34.357 -1.802 1
1 608 . 7 1 1 A 56 56 LYS N N 56 122.008 121.889 0.119 1
1 609 . 7 1 1 A 57 57 PRO HA H 57 4.370 4.413 -0.043 1
1 616 . 7 1 1 A 57 57 PRO CA C 57 63.431 65.134 -1.703 1
1 617 . 7 1 1 A 57 57 PRO CB C 57 32.072 32.009 0.063 1
1 620 . 7 1 1 A 58 58 ARG H H 58 8.310 8.514 -0.204 1
1 621 . 7 1 1 A 58 58 ARG HA H 58 4.295 4.333 -0.038 1
1 628 . 7 1 1 A 58 58 ARG CA C 58 56.570 56.228 0.342 1
1 629 . 7 1 1 A 58 58 ARG CB C 58 30.860 30.445 0.415 1
1 632 . 7 1 1 A 58 58 ARG N N 58 120.045 116.667 3.378 1
1 633 . 7 1 1 A 60 60 CYS HA H 60 4.482 4.860 -0.378 1
1 636 . 7 1 1 A 60 60 CYS CA C 60 58.621 56.969 1.652 1
1 637 . 7 1 1 A 60 60 CYS CB C 60 28.267 30.555 -2.288 1
1 638 . 7 1 1 A 61 61 GLU HA H 61 4.226 3.794 0.432 1
1 643 . 7 1 1 A 61 61 GLU C C 61 176.299 175.678 0.621 1
1 644 . 7 1 1 A 61 61 GLU CA C 61 57.100 57.206 -0.106 1
1 645 . 7 1 1 A 61 61 GLU CB C 61 29.873 27.347 2.526 1
1 647 . 7 1 1 A 62 62 ALA H H 62 8.282 7.626 0.656 1
1 648 . 7 1 1 A 62 62 ALA HA H 62 4.302 4.213 0.089 1
1 652 . 7 1 1 A 62 62 ALA C C 62 177.277 177.313 -0.036 1
1 653 . 7 1 1 A 62 62 ALA CA C 62 52.512 53.023 -0.511 1
1 654 . 7 1 1 A 62 62 ALA CB C 62 19.592 19.380 0.212 1
1 655 . 7 1 1 A 62 62 ALA N N 62 124.386 120.757 3.629 1
1 656 . 7 1 1 A 63 63 ALA H H 63 8.399 8.385 0.014 1
1 657 . 7 1 1 A 63 63 ALA HA H 63 4.375 4.257 0.118 1
1 661 . 7 1 1 A 63 63 ALA C C 63 176.843 176.530 0.313 1
1 662 . 7 1 1 A 63 63 ALA CA C 63 52.658 51.862 0.796 1
1 663 . 7 1 1 A 63 63 ALA CB C 63 19.592 18.247 1.345 1
1 664 . 7 1 1 A 63 63 ALA N N 63 123.892 126.411 -2.519 1
1 665 . 7 1 1 A 64 64 ARG H H 64 8.152 8.521 -0.369 1
1 666 . 7 1 1 A 64 64 ARG HA H 64 5.008 4.778 0.230 1
1 673 . 7 1 1 A 64 64 ARG C C 64 175.594 175.035 0.559 1
1 674 . 7 1 1 A 64 64 ARG CA C 64 55.282 55.362 -0.080 1
1 675 . 7 1 1 A 64 64 ARG CB C 64 32.506 31.355 1.151 1
1 678 . 7 1 1 A 64 64 ARG N N 64 119.787 125.621 -5.834 1
1 679 . 7 1 1 A 65 65 LYS H H 65 8.945 8.708 0.237 1
1 680 . 7 1 1 A 65 65 LYS HA H 65 4.602 4.835 -0.233 1
1 689 . 7 1 1 A 65 65 LYS C C 65 174.657 174.566 0.091 1
1 690 . 7 1 1 A 65 65 LYS CA C 65 54.948 54.940 0.008 1
1 691 . 7 1 1 A 65 65 LYS CB C 65 34.068 33.722 0.346 1
1 695 . 7 1 1 A 65 65 LYS N N 65 124.171 128.205 -4.034 1
1 696 . 7 1 1 A 66 66 VAL H H 66 8.672 8.922 -0.250 1
1 697 . 7 1 1 A 66 66 VAL HA H 66 4.532 5.444 -0.912 1
1 705 . 7 1 1 A 66 66 VAL C C 66 175.078 173.872 1.206 1
1 706 . 7 1 1 A 66 66 VAL CA C 66 61.865 59.644 2.221 1
1 707 . 7 1 1 A 66 66 VAL CB C 66 33.835 34.464 -0.629 1
1 710 . 7 1 1 A 66 66 VAL N N 66 124.380 124.076 0.304 1
1 711 . 7 1 1 A 67 67 ILE H H 67 9.071 9.158 -0.087 1
1 712 . 7 1 1 A 67 67 ILE HA H 67 4.142 4.644 -0.502 1
1 722 . 7 1 1 A 67 67 ILE C C 67 175.819 175.755 0.064 1
1 723 . 7 1 1 A 67 67 ILE CA C 67 60.383 60.460 -0.077 1
1 724 . 7 1 1 A 67 67 ILE CB C 67 39.908 38.647 1.261 1
1 728 . 7 1 1 A 67 67 ILE N N 67 129.537 129.134 0.403 1
1 729 . 7 1 1 A 68 68 ARG H H 68 9.203 8.621 0.582 1
1 730 . 7 1 1 A 68 68 ARG HA H 68 4.198 4.283 -0.085 1
1 737 . 7 1 1 A 68 68 ARG C C 68 177.769 177.107 0.662 1
1 738 . 7 1 1 A 68 68 ARG CA C 68 56.835 56.992 -0.157 1
1 739 . 7 1 1 A 68 68 ARG CB C 68 29.832 30.413 -0.581 1
1 742 . 7 1 1 A 68 68 ARG N N 68 128.484 127.973 0.511 1
1 743 . 7 1 1 A 69 69 LEU H H 69 8.212 8.613 -0.401 1
1 744 . 7 1 1 A 69 69 LEU HA H 69 4.221 4.115 0.106 1
1 754 . 7 1 1 A 69 69 LEU C C 69 178.996 178.767 0.229 1
1 755 . 7 1 1 A 69 69 LEU CA C 69 57.136 57.897 -0.761 1
1 756 . 7 1 1 A 69 69 LEU CB C 69 39.455 41.473 -2.018 1
1 760 . 7 1 1 A 69 69 LEU N N 69 123.807 124.863 -1.056 1
1 761 . 7 1 1 A 70 70 SER H H 70 8.823 8.102 0.721 1
1 762 . 7 1 1 A 70 70 SER HA H 70 4.331 4.143 0.188 1
1 765 . 7 1 1 A 70 70 SER C C 70 175.076 176.188 -1.112 1
1 766 . 7 1 1 A 70 70 SER CA C 70 60.329 61.068 -0.739 1
1 767 . 7 1 1 A 70 70 SER CB C 70 62.362 63.083 -0.721 1
1 768 . 7 1 1 A 70 70 SER N N 70 115.162 114.071 1.091 1
1 769 . 7 1 1 A 71 71 ASP H H 71 7.602 7.818 -0.216 1
1 770 . 7 1 1 A 71 71 ASP HA H 71 4.820 4.482 0.338 1
1 773 . 7 1 1 A 71 71 ASP C C 71 176.478 177.262 -0.784 1
1 774 . 7 1 1 A 71 71 ASP CA C 71 54.241 56.838 -2.597 1
1 775 . 7 1 1 A 71 71 ASP CB C 71 41.347 40.799 0.548 1
1 776 . 7 1 1 A 71 71 ASP N N 71 119.590 118.810 0.780 1
1 777 . 7 1 1 A 72 72 CYS H H 72 7.715 7.560 0.155 1
1 778 . 7 1 1 A 72 72 CYS HA H 72 4.372 4.436 -0.064 1
1 781 . 7 1 1 A 72 72 CYS C C 72 173.690 174.390 -0.700 1
1 782 . 7 1 1 A 72 72 CYS CA C 72 60.836 59.562 1.274 1
1 783 . 7 1 1 A 72 72 CYS CB C 72 27.655 27.778 -0.123 1
1 784 . 7 1 1 A 72 72 CYS N N 72 118.346 117.975 0.371 1
1 785 . 7 1 1 A 73 73 LEU H H 73 9.472 9.088 0.384 1
1 786 . 7 1 1 A 73 73 LEU HA H 73 4.593 4.095 0.498 1
1 796 . 7 1 1 A 73 73 LEU C C 73 177.562 176.554 1.008 1
1 797 . 7 1 1 A 73 73 LEU CA C 73 55.724 56.628 -0.904 1
1 798 . 7 1 1 A 73 73 LEU CB C 73 43.774 42.399 1.375 1
1 802 . 7 1 1 A 73 73 LEU N N 73 124.752 128.772 -4.020 1
1 803 . 7 1 1 A 74 74 ARG H H 74 7.658 7.122 0.536 1
1 804 . 7 1 1 A 74 74 ARG HA H 74 4.592 4.947 -0.355 1
1 811 . 7 1 1 A 74 74 ARG C C 74 173.605 174.427 -0.822 1
1 812 . 7 1 1 A 74 74 ARG CA C 74 56.465 55.890 0.575 1
1 813 . 7 1 1 A 74 74 ARG CB C 74 34.068 33.919 0.149 1
1 816 . 7 1 1 A 74 74 ARG N N 74 115.565 115.899 -0.334 1
1 817 . 7 1 1 A 75 75 VAL H H 75 8.622 8.953 -0.331 1
1 818 . 7 1 1 A 75 75 VAL HA H 75 5.170 5.236 -0.066 1
1 826 . 7 1 1 A 75 75 VAL C C 75 173.985 174.564 -0.579 1
1 827 . 7 1 1 A 75 75 VAL CA C 75 60.930 59.694 1.236 1
1 828 . 7 1 1 A 75 75 VAL CB C 75 35.073 36.525 -1.452 1
1 831 . 7 1 1 A 75 75 VAL N N 75 124.278 119.115 5.163 1
1 832 . 7 1 1 A 76 76 ALA H H 76 8.272 8.915 -0.643 1
1 833 . 7 1 1 A 76 76 ALA HA H 76 4.648 4.951 -0.303 1
1 837 . 7 1 1 A 76 76 ALA C C 76 175.630 175.915 -0.285 1
1 838 . 7 1 1 A 76 76 ALA CA C 76 51.294 51.339 -0.045 1
1 839 . 7 1 1 A 76 76 ALA CB C 76 22.759 23.805 -1.046 1
1 840 . 7 1 1 A 76 76 ALA N N 76 126.015 124.300 1.715 1
1 841 . 7 1 1 A 77 77 GLU H H 77 9.184 8.791 0.393 1
1 842 . 7 1 1 A 77 77 GLU HA H 77 4.060 5.048 -0.988 1
1 847 . 7 1 1 A 77 77 GLU C C 77 174.949 176.312 -1.363 1
1 848 . 7 1 1 A 77 77 GLU CA C 77 58.424 55.261 3.163 1
1 849 . 7 1 1 A 77 77 GLU CB C 77 30.161 31.141 -0.980 1
1 851 . 7 1 1 A 77 77 GLU N N 77 120.223 118.666 1.557 1
1 852 . 7 1 1 A 78 78 ALA H H 78 7.985 8.530 -0.545 1
1 853 . 7 1 1 A 78 78 ALA HA H 78 4.776 4.388 0.388 1
1 857 . 7 1 1 A 78 78 ALA C C 78 177.250 177.938 -0.688 1
1 858 . 7 1 1 A 78 78 ALA CA C 78 50.888 53.742 -2.854 1
1 859 . 7 1 1 A 78 78 ALA CB C 78 20.851 19.624 1.227 1
1 860 . 7 1 1 A 78 78 ALA N N 78 125.143 128.762 -3.619 1
1 861 . 7 1 1 A 79 79 GLY H H 79 8.604 8.219 0.385 1
1 862 . 7 1 1 A 79 79 GLY HA2 H 79 4.327 4.122 0.205 1
1 863 . 7 1 1 A 79 79 GLY HA3 H 79 3.963 4.123 -0.160 1
1 864 . 7 1 1 A 79 79 GLY C C 79 175.360 175.025 0.335 1
1 865 . 7 1 1 A 79 79 GLY CA C 79 44.925 44.618 0.307 1
1 866 . 7 1 1 A 79 79 GLY N N 79 109.420 105.363 4.057 1
1 867 . 7 1 1 A 80 80 GLY H H 80 8.649 8.654 -0.005 1
1 868 . 7 1 1 A 80 80 GLY HA2 H 80 3.962 3.939 0.023 1
1 869 . 7 1 1 A 80 80 GLY HA3 H 80 3.962 3.940 0.022 1
1 870 . 7 1 1 A 80 80 GLY C C 80 175.052 174.640 0.412 1
1 871 . 7 1 1 A 80 80 GLY CA C 80 45.955 46.149 -0.194 1
1 872 . 7 1 1 A 80 80 GLY N N 80 108.295 113.044 -4.749 1
1 873 . 7 1 1 A 81 81 GLU H H 81 8.921 7.775 1.146 1
1 874 . 7 1 1 A 81 81 GLU HA H 81 4.298 4.552 -0.254 1
1 879 . 7 1 1 A 81 81 GLU C C 81 176.532 175.037 1.495 1
1 880 . 7 1 1 A 81 81 GLU CA C 81 57.118 55.952 1.166 1
1 881 . 7 1 1 A 81 81 GLU CB C 81 28.599 30.208 -1.609 1
1 883 . 7 1 1 A 81 81 GLU N N 81 121.170 119.834 1.336 1
1 884 . 7 1 1 A 82 82 ALA H H 82 8.032 7.426 0.606 1
1 885 . 7 1 1 A 82 82 ALA HA H 82 4.371 4.535 -0.164 1
1 889 . 7 1 1 A 82 82 ALA C C 82 177.160 177.114 0.046 1
1 890 . 7 1 1 A 82 82 ALA CA C 82 52.653 51.156 1.497 1
1 891 . 7 1 1 A 82 82 ALA CB C 82 19.304 21.447 -2.143 1
1 892 . 7 1 1 A 82 82 ALA N N 82 124.988 121.363 3.625 1
1 893 . 7 1 1 A 83 83 SER H H 83 8.319 8.752 -0.433 1
1 894 . 7 1 1 A 83 83 SER HA H 83 4.331 4.268 0.063 1
1 897 . 7 1 1 A 83 83 SER C C 83 174.045 175.406 -1.361 1
1 898 . 7 1 1 A 83 83 SER CA C 83 58.053 62.094 -4.041 1
1 899 . 7 1 1 A 83 83 SER CB C 83 63.184 62.918 0.266 1
1 900 . 7 1 1 A 83 83 SER N N 83 114.181 114.156 0.025 1
1 901 . 7 1 1 A 84 84 SER H H 84 7.823 7.929 -0.106 1
1 902 . 7 1 1 A 84 84 SER HA H 84 3.194 4.466 -1.272 1
1 905 . 7 1 1 A 84 84 SER C C 84 171.072 173.978 -2.906 1
1 906 . 7 1 1 A 84 84 SER CA C 84 57.206 56.906 0.300 1
1 907 . 7 1 1 A 84 84 SER CB C 84 61.622 63.205 -1.583 1
1 908 . 7 1 1 A 84 84 SER N N 84 117.302 114.596 2.706 1
1 909 . 7 1 1 A 85 85 PRO HA H 85 3.922 4.566 -0.644 1
1 916 . 7 1 1 A 85 85 PRO CA C 85 62.691 62.263 0.428 1
1 917 . 7 1 1 A 85 85 PRO CB C 85 31.515 33.226 -1.711 1
1 920 . 7 1 1 A 86 86 ARG HA H 86 3.882 4.043 -0.161 1
1 927 . 7 1 1 A 86 86 ARG C C 86 175.712 178.060 -2.348 1
1 928 . 7 1 1 A 86 86 ARG CA C 86 57.877 59.258 -1.381 1
1 929 . 7 1 1 A 86 86 ARG CB C 86 29.791 29.785 0.006 1
1 932 . 7 1 1 A 87 87 ASP H H 87 8.903 8.406 0.497 1
1 933 . 7 1 1 A 87 87 ASP HA H 87 4.342 4.502 -0.160 1
1 936 . 7 1 1 A 87 87 ASP C C 87 175.723 175.985 -0.262 1
1 937 . 7 1 1 A 87 87 ASP CA C 87 56.377 55.380 0.997 1
1 938 . 7 1 1 A 87 87 ASP CB C 87 39.208 39.964 -0.756 1
1 939 . 7 1 1 A 87 87 ASP N N 87 117.520 117.059 0.461 1
1 940 . 7 1 1 A 88 88 THR H H 88 7.776 7.618 0.158 1
1 941 . 7 1 1 A 88 88 THR HA H 88 5.101 4.989 0.112 1
1 946 . 7 1 1 A 88 88 THR C C 88 173.825 173.259 0.566 1
1 947 . 7 1 1 A 88 88 THR CA C 88 60.154 59.772 0.382 1
1 948 . 7 1 1 A 88 88 THR CB C 88 72.702 71.667 1.035 1
1 950 . 7 1 1 A 88 88 THR N N 88 108.770 109.307 -0.537 1
1 951 . 7 1 1 A 89 89 SER H H 89 9.006 9.190 -0.184 1
1 952 . 7 1 1 A 89 89 SER HA H 89 4.718 5.203 -0.485 1
1 955 . 7 1 1 A 89 89 SER C C 89 173.728 173.065 0.663 1
1 956 . 7 1 1 A 89 89 SER CA C 89 57.453 57.791 -0.338 1
1 957 . 7 1 1 A 89 89 SER CB C 89 65.611 65.617 -0.006 1
1 958 . 7 1 1 A 89 89 SER N N 89 114.151 117.596 -3.445 1
1 959 . 7 1 1 A 90 90 ALA H H 90 9.001 9.130 -0.129 1
1 960 . 7 1 1 A 90 90 ALA HA H 90 5.660 4.700 0.960 1
1 964 . 7 1 1 A 90 90 ALA C C 90 177.669 177.424 0.245 1
1 965 . 7 1 1 A 90 90 ALA CA C 90 51.670 52.068 -0.398 1
1 966 . 7 1 1 A 90 90 ALA CB C 90 22.265 19.967 2.298 1
1 967 . 7 1 1 A 90 90 ALA N N 90 126.177 129.108 -2.931 1
1 968 . 7 1 1 A 91 91 PHE H H 91 9.672 8.494 1.178 1
1 969 . 7 1 1 A 91 91 PHE HA H 91 5.039 5.503 -0.464 1
1 977 . 7 1 1 A 91 91 PHE C C 91 170.731 173.478 -2.747 1
1 978 . 7 1 1 A 91 91 PHE CA C 91 56.271 55.212 1.059 1
1 979 . 7 1 1 A 91 91 PHE CB C 91 41.553 42.040 -0.487 1
1 985 . 7 1 1 A 91 91 PHE N N 91 118.968 116.367 2.601 1
1 986 . 7 1 1 A 92 92 PHE H H 92 9.422 9.386 0.036 1
1 987 . 7 1 1 A 92 92 PHE HA H 92 5.674 5.148 0.526 1
1 995 . 7 1 1 A 92 92 PHE C C 92 174.570 175.270 -0.700 1
1 996 . 7 1 1 A 92 92 PHE CA C 92 55.917 57.503 -1.586 1
1 997 . 7 1 1 A 92 92 PHE CB C 92 42.787 41.610 1.177 1
1 1003 . 7 1 1 A 92 92 PHE N N 92 117.543 118.020 -0.477 1
1 1004 . 7 1 1 A 93 93 LEU H H 93 9.021 8.806 0.215 1
1 1005 . 7 1 1 A 93 93 LEU HA H 93 5.122 4.926 0.196 1
1 1015 . 7 1 1 A 93 93 LEU C C 93 174.799 174.265 0.534 1
1 1016 . 7 1 1 A 93 93 LEU CA C 93 54.912 54.733 0.179 1
1 1017 . 7 1 1 A 93 93 LEU CB C 93 45.254 44.728 0.526 1
1 1021 . 7 1 1 A 93 93 LEU N N 93 121.719 121.685 0.034 1
1 1022 . 7 1 1 A 94 94 GLU H H 94 9.294 9.227 0.067 1
1 1023 . 7 1 1 A 94 94 GLU HA H 94 5.043 5.211 -0.168 1
1 1028 . 7 1 1 A 94 94 GLU C C 94 175.754 175.332 0.422 1
1 1029 . 7 1 1 A 94 94 GLU CA C 94 56.018 54.901 1.117 1
1 1030 . 7 1 1 A 94 94 GLU CB C 94 32.752 33.087 -0.335 1
1 1032 . 7 1 1 A 94 94 GLU N N 94 127.032 128.621 -1.589 1
1 1033 . 7 1 1 A 95 95 THR H H 95 8.822 8.488 0.334 1
1 1034 . 7 1 1 A 95 95 THR HA H 95 5.398 5.026 0.372 1
1 1039 . 7 1 1 A 95 95 THR C C 95 173.860 175.561 -1.701 1
1 1040 . 7 1 1 A 95 95 THR CA C 95 59.588 59.569 0.019 1
1 1041 . 7 1 1 A 95 95 THR CB C 95 72.191 72.162 0.029 1
1 1043 . 7 1 1 A 95 95 THR N N 95 118.685 118.053 0.632 1
1 1044 . 7 1 1 A 96 96 LYS H H 96 8.823 9.166 -0.343 1
1 1045 . 7 1 1 A 96 96 LYS HA H 96 4.022 3.938 0.084 1
1 1054 . 7 1 1 A 96 96 LYS C C 96 177.330 178.956 -1.626 1
1 1055 . 7 1 1 A 96 96 LYS CA C 96 59.588 59.961 -0.373 1
1 1056 . 7 1 1 A 96 96 LYS CB C 96 32.588 32.074 0.514 1
1 1060 . 7 1 1 A 96 96 LYS N N 96 118.801 121.697 -2.896 1
1 1061 . 7 1 1 A 97 97 GLU H H 97 8.092 7.766 0.326 1
1 1062 . 7 1 1 A 97 97 GLU HA H 97 4.282 4.212 0.070 1
1 1067 . 7 1 1 A 97 97 GLU C C 97 176.290 176.127 0.163 1
1 1068 . 7 1 1 A 97 97 GLU CA C 97 57.365 58.792 -1.427 1
1 1069 . 7 1 1 A 97 97 GLU CB C 97 31.559 30.762 0.797 1
1 1071 . 7 1 1 A 97 97 GLU N N 97 113.992 118.956 -4.964 1
1 1072 . 7 1 1 A 98 98 ARG H H 98 7.482 7.156 0.326 1
1 1073 . 7 1 1 A 98 98 ARG HA H 98 4.397 4.563 -0.166 1
1 1080 . 7 1 1 A 98 98 ARG C C 98 172.792 173.026 -0.234 1
1 1081 . 7 1 1 A 98 98 ARG CA C 98 55.689 54.591 1.098 1
1 1082 . 7 1 1 A 98 98 ARG CB C 98 32.711 31.630 1.081 1
1 1085 . 7 1 1 A 98 98 ARG N N 98 116.022 114.600 1.422 1
1 1086 . 7 1 1 A 99 99 LEU H H 99 8.423 8.160 0.263 1
1 1087 . 7 1 1 A 99 99 LEU HA H 99 4.807 4.720 0.087 1
1 1097 . 7 1 1 A 99 99 LEU C C 99 175.903 173.988 1.915 1
1 1098 . 7 1 1 A 99 99 LEU CA C 99 54.383 53.787 0.596 1
1 1099 . 7 1 1 A 99 99 LEU CB C 99 43.362 44.136 -0.774 1
1 1103 . 7 1 1 A 99 99 LEU N N 99 124.983 121.644 3.339 1
1 1104 . 7 1 1 A 100 100 TYR H H 100 9.144 9.552 -0.408 1
1 1105 . 7 1 1 A 100 100 TYR HA H 100 4.542 5.175 -0.633 1
1 1112 . 7 1 1 A 100 100 TYR C C 100 173.479 174.610 -1.131 1
1 1113 . 7 1 1 A 100 100 TYR CA C 100 57.735 56.329 1.406 1
1 1114 . 7 1 1 A 100 100 TYR CB C 100 39.291 40.243 -0.952 1
1 1119 . 7 1 1 A 100 100 TYR N N 100 126.679 126.695 -0.016 1
1 1120 . 7 1 1 A 101 101 LEU H H 101 9.043 8.907 0.136 1
1 1121 . 7 1 1 A 101 101 LEU HA H 101 4.747 4.689 0.058 1
1 1131 . 7 1 1 A 101 101 LEU C C 101 173.530 175.000 -1.470 1
1 1132 . 7 1 1 A 101 101 LEU CA C 101 54.524 54.034 0.490 1
1 1133 . 7 1 1 A 101 101 LEU CB C 101 42.499 43.298 -0.799 1
1 1137 . 7 1 1 A 101 101 LEU N N 101 127.422 126.946 0.476 1
1 1138 . 7 1 1 A 102 102 LEU H H 102 8.493 8.513 -0.020 1
1 1139 . 7 1 1 A 102 102 LEU HA H 102 5.612 5.437 0.175 1
1 1149 . 7 1 1 A 102 102 LEU C C 102 175.794 176.270 -0.476 1
1 1150 . 7 1 1 A 102 102 LEU CA C 102 53.076 53.284 -0.208 1
1 1151 . 7 1 1 A 102 102 LEU CB C 102 45.994 44.269 1.725 1
1 1155 . 7 1 1 A 102 102 LEU N N 102 126.021 127.995 -1.974 1
1 1156 . 7 1 1 A 103 103 ALA H H 103 9.073 8.902 0.171 1
1 1157 . 7 1 1 A 103 103 ALA HA H 103 5.081 5.466 -0.385 1
1 1161 . 7 1 1 A 103 103 ALA C C 103 175.133 176.200 -1.067 1
1 1162 . 7 1 1 A 103 103 ALA CA C 103 51.688 49.941 1.747 1
1 1163 . 7 1 1 A 103 103 ALA CB C 103 21.689 22.420 -0.731 1
1 1164 . 7 1 1 A 103 103 ALA N N 103 117.679 123.680 -6.001 1
1 1165 . 7 1 1 A 104 104 ALA H H 104 8.582 8.411 0.171 1
1 1166 . 7 1 1 A 104 104 ALA HA H 104 5.220 4.927 0.293 1
1 1170 . 7 1 1 A 104 104 ALA C C 104 173.471 174.284 -0.813 1
1 1171 . 7 1 1 A 104 104 ALA CA C 104 47.959 49.837 -1.878 1
1 1172 . 7 1 1 A 104 104 ALA CB C 104 21.359 22.541 -1.182 1
1 1173 . 7 1 1 A 104 104 ALA N N 104 123.419 122.199 1.220 1
1 1174 . 7 1 1 A 105 105 PRO HA H 105 4.542 4.777 -0.235 1
1 1181 . 7 1 1 A 105 105 PRO C C 105 178.409 177.910 0.499 1
1 1182 . 7 1 1 A 105 105 PRO CA C 105 64.301 62.868 1.433 1
1 1183 . 7 1 1 A 105 105 PRO CB C 105 32.094 31.598 0.496 1
1 1186 . 7 1 1 A 106 106 ALA H H 106 8.302 8.670 -0.368 1
1 1187 . 7 1 1 A 106 106 ALA HA H 106 4.022 4.023 -0.001 1
1 1191 . 7 1 1 A 106 106 ALA C C 106 179.641 179.808 -0.167 1
1 1192 . 7 1 1 A 106 106 ALA CA C 106 56.341 55.161 1.180 1
1 1193 . 7 1 1 A 106 106 ALA CB C 106 18.523 18.198 0.325 1
1 1194 . 7 1 1 A 106 106 ALA N N 106 127.733 128.228 -0.495 1
1 1195 . 7 1 1 A 107 107 ALA H H 107 9.035 8.021 1.014 1
1 1196 . 7 1 1 A 107 107 ALA HA H 107 4.331 4.072 0.259 1
1 1200 . 7 1 1 A 107 107 ALA C C 107 178.586 179.500 -0.914 1
1 1201 . 7 1 1 A 107 107 ALA CA C 107 53.765 55.159 -1.394 1
1 1202 . 7 1 1 A 107 107 ALA CB C 107 18.728 18.256 0.472 1
1 1203 . 7 1 1 A 107 107 ALA N N 107 118.203 119.914 -1.711 1
1 1204 . 7 1 1 A 108 108 GLU H H 108 8.399 8.175 0.224 1
1 1205 . 7 1 1 A 108 108 GLU HA H 108 4.631 4.190 0.441 1
1 1210 . 7 1 1 A 108 108 GLU C C 108 177.127 178.927 -1.800 1
1 1211 . 7 1 1 A 108 108 GLU CA C 108 55.847 58.787 -2.940 1
1 1212 . 7 1 1 A 108 108 GLU CB C 108 32.135 30.217 1.918 1
1 1214 . 7 1 1 A 108 108 GLU N N 108 114.661 118.163 -3.502 1
1 1215 . 7 1 1 A 109 109 ARG H H 109 7.412 8.646 -1.234 1
1 1216 . 7 1 1 A 109 109 ARG HA H 109 3.682 4.077 -0.395 1
1 1223 . 7 1 1 A 109 109 ARG C C 109 176.917 179.153 -2.236 1
1 1224 . 7 1 1 A 109 109 ARG CA C 109 61.600 59.764 1.836 1
1 1225 . 7 1 1 A 109 109 ARG CB C 109 28.845 30.387 -1.542 1
1 1228 . 7 1 1 A 109 109 ARG N N 109 120.954 120.854 0.100 1
1 1229 . 7 1 1 A 110 110 GLY H H 110 8.833 8.496 0.337 1
1 1230 . 7 1 1 A 110 110 GLY HA2 H 110 3.872 3.790 0.082 1
1 1231 . 7 1 1 A 110 110 GLY HA3 H 110 3.685 3.800 -0.115 1
1 1232 . 7 1 1 A 110 110 GLY C C 110 175.997 175.800 0.197 1
1 1233 . 7 1 1 A 110 110 GLY CA C 110 47.323 47.528 -0.205 1
1 1234 . 7 1 1 A 110 110 GLY N N 110 106.563 107.331 -0.768 1
1 1235 . 7 1 1 A 111 111 ASP H H 111 7.882 8.123 -0.241 1
1 1236 . 7 1 1 A 111 111 ASP HA H 111 4.312 4.321 -0.009 1
1 1239 . 7 1 1 A 111 111 ASP C C 111 179.467 178.821 0.646 1
1 1240 . 7 1 1 A 111 111 ASP CA C 111 56.976 56.826 0.150 1
1 1241 . 7 1 1 A 111 111 ASP CB C 111 40.648 40.868 -0.220 1
1 1242 . 7 1 1 A 111 111 ASP N N 111 121.402 121.489 -0.087 1
1 1243 . 7 1 1 A 112 112 TRP H H 112 7.804 8.426 -0.622 1
1 1244 . 7 1 1 A 112 112 TRP HA H 112 3.831 4.215 -0.384 1
1 1253 . 7 1 1 A 112 112 TRP C C 112 177.547 178.739 -1.192 1
1 1254 . 7 1 1 A 112 112 TRP CA C 112 62.006 59.783 2.223 1
1 1255 . 7 1 1 A 112 112 TRP CB C 112 29.421 29.284 0.137 1
1 1261 . 7 1 1 A 112 112 TRP N N 112 119.904 120.353 -0.449 1
1 1263 . 7 1 1 A 113 113 VAL H H 113 7.982 7.873 0.109 1
1 1264 . 7 1 1 A 113 113 VAL HA H 113 3.072 3.665 -0.593 1
1 1272 . 7 1 1 A 113 113 VAL C C 113 178.015 178.502 -0.487 1
1 1273 . 7 1 1 A 113 113 VAL CA C 113 67.407 66.591 0.816 1
1 1274 . 7 1 1 A 113 113 VAL CB C 113 31.724 31.538 0.186 1
1 1277 . 7 1 1 A 113 113 VAL N N 113 117.575 118.937 -1.362 1
1 1278 . 7 1 1 A 114 114 GLN H H 114 8.268 8.032 0.236 1
1 1279 . 7 1 1 A 114 114 GLN HA H 114 3.994 4.014 -0.020 1
1 1286 . 7 1 1 A 114 114 GLN C C 114 178.021 178.010 0.011 1
1 1287 . 7 1 1 A 114 114 GLN CA C 114 59.112 58.566 0.546 1
1 1288 . 7 1 1 A 114 114 GLN CB C 114 28.685 28.928 -0.243 1
1 1290 . 7 1 1 A 114 114 GLN N N 114 117.479 120.256 -2.777 1
1 1292 . 7 1 1 A 115 115 ALA H H 115 7.915 8.261 -0.346 1
1 1293 . 7 1 1 A 115 115 ALA HA H 115 3.972 4.079 -0.107 1
1 1297 . 7 1 1 A 115 115 ALA C C 115 180.030 179.910 0.120 1
1 1298 . 7 1 1 A 115 115 ALA CA C 115 55.142 55.148 -0.006 1
1 1299 . 7 1 1 A 115 115 ALA CB C 115 18.152 18.474 -0.322 1
1 1300 . 7 1 1 A 115 115 ALA N N 115 120.858 120.645 0.213 1
1 1301 . 7 1 1 A 116 116 ILE H H 116 8.172 8.581 -0.409 1
1 1302 . 7 1 1 A 116 116 ILE HA H 116 3.482 3.726 -0.244 1
1 1312 . 7 1 1 A 116 116 ILE C C 116 177.739 178.065 -0.326 1
1 1313 . 7 1 1 A 116 116 ILE CA C 116 66.119 65.385 0.734 1
1 1314 . 7 1 1 A 116 116 ILE CB C 116 38.222 37.870 0.352 1
1 1318 . 7 1 1 A 116 116 ILE N N 116 115.977 117.884 -1.907 1
1 1319 . 7 1 1 A 117 117 CYS H H 117 8.449 8.363 0.086 1
1 1320 . 7 1 1 A 117 117 CYS HA H 117 4.032 4.306 -0.274 1
1 1323 . 7 1 1 A 117 117 CYS C C 117 177.321 177.008 0.313 1
1 1324 . 7 1 1 A 117 117 CYS CA C 117 64.777 62.542 2.235 1
1 1325 . 7 1 1 A 117 117 CYS CB C 117 26.871 27.198 -0.327 1
1 1326 . 7 1 1 A 117 117 CYS N N 117 117.253 120.757 -3.504 1
1 1327 . 7 1 1 A 118 118 LEU H H 118 8.182 8.178 0.004 1
1 1328 . 7 1 1 A 118 118 LEU HA H 118 4.052 3.969 0.083 1
1 1338 . 7 1 1 A 118 118 LEU C C 118 179.217 179.347 -0.130 1
1 1339 . 7 1 1 A 118 118 LEU CA C 118 57.877 57.832 0.045 1
1 1340 . 7 1 1 A 118 118 LEU CB C 118 42.088 41.519 0.569 1
1 1344 . 7 1 1 A 118 118 LEU N N 118 119.665 120.767 -1.102 1
1 1345 . 7 1 1 A 119 119 LEU H H 119 7.142 7.814 -0.672 1
1 1346 . 7 1 1 A 119 119 LEU HA H 119 4.192 4.145 0.047 1
1 1356 . 7 1 1 A 119 119 LEU C C 119 178.492 178.621 -0.129 1
1 1357 . 7 1 1 A 119 119 LEU CA C 119 56.259 57.984 -1.725 1
1 1358 . 7 1 1 A 119 119 LEU CB C 119 43.568 42.014 1.554 1
1 1362 . 7 1 1 A 119 119 LEU N N 119 116.244 119.286 -3.042 1
1 1363 . 7 1 1 A 120 120 ALA H H 120 8.513 8.607 -0.094 1
1 1364 . 7 1 1 A 120 120 ALA HA H 120 3.878 4.103 -0.225 1
1 1368 . 7 1 1 A 120 120 ALA C C 120 178.358 178.787 -0.429 1
1 1369 . 7 1 1 A 120 120 ALA CA C 120 53.765 55.179 -1.414 1
1 1370 . 7 1 1 A 120 120 ALA CB C 120 18.687 18.831 -0.144 1
1 1371 . 7 1 1 A 120 120 ALA N N 120 120.009 120.289 -0.280 1
1 1372 . 7 1 1 A 121 121 PHE H H 121 7.822 7.962 -0.140 1
1 1373 . 7 1 1 A 121 121 PHE HA H 121 5.156 4.835 0.321 1
1 1381 . 7 1 1 A 121 121 PHE C C 121 176.273 174.631 1.642 1
1 1382 . 7 1 1 A 121 121 PHE CA C 121 55.741 56.903 -1.162 1
1 1383 . 7 1 1 A 121 121 PHE CB C 121 39.455 37.854 1.601 1
1 1389 . 7 1 1 A 121 121 PHE N N 121 113.981 115.284 -1.303 1
1 1390 . 7 1 1 A 122 122 SER H H 122 7.765 8.045 -0.280 1
1 1391 . 7 1 1 A 122 122 SER HA H 122 4.579 5.238 -0.659 1
1 1394 . 7 1 1 A 122 122 SER C C 122 174.595 173.038 1.557 1
1 1395 . 7 1 1 A 122 122 SER CA C 122 58.777 57.707 1.070 1
1 1396 . 7 1 1 A 122 122 SER CB C 122 63.719 67.059 -3.340 1
1 1397 . 7 1 1 A 122 122 SER N N 122 115.069 114.688 0.381 1
1 1398 . 7 1 1 A 123 123 GLY H H 123 8.223 8.567 -0.344 1
1 1399 . 7 1 1 A 123 123 GLY HA2 H 123 4.174 4.260 -0.086 1
1 1400 . 7 1 1 A 123 123 GLY HA3 H 123 4.100 4.262 -0.162 1
1 1401 . 7 1 1 A 123 123 GLY C C 123 171.678 172.039 -0.361 1
1 1402 . 7 1 1 A 123 123 GLY CA C 123 44.815 44.886 -0.071 1
1 1403 . 7 1 1 A 123 123 GLY N N 123 110.151 110.176 -0.025 1
1 1404 . 7 1 1 A 124 124 PRO HA H 124 4.482 4.688 -0.206 1
1 1411 . 7 1 1 A 124 124 PRO C C 124 177.314 176.891 0.423 1
1 1412 . 7 1 1 A 124 124 PRO CA C 124 63.206 62.913 0.293 1
1 1413 . 7 1 1 A 124 124 PRO CB C 124 32.176 32.644 -0.468 1
1 1416 . 7 1 1 A 125 125 SER H H 125 8.485 8.821 -0.336 1
1 1417 . 7 1 1 A 125 125 SER HA H 125 4.472 4.479 -0.007 1
1 1420 . 7 1 1 A 125 125 SER C C 125 174.728 175.006 -0.278 1
1 1421 . 7 1 1 A 125 125 SER CA C 125 58.353 61.147 -2.794 1
1 1422 . 7 1 1 A 125 125 SER CB C 125 64.048 63.991 0.057 1
1 1423 . 7 1 1 A 125 125 SER N N 125 116.081 116.508 -0.427 1
1 1424 . 7 1 1 A 126 126 SER H H 126 8.332 7.631 0.701 1
1 1425 . 7 1 1 A 126 126 SER HA H 126 4.464 4.466 -0.002 1
1 1428 . 7 1 1 A 126 126 SER C C 126 173.980 174.683 -0.703 1
1 1429 . 7 1 1 A 126 126 SER CA C 126 58.336 57.941 0.395 1
1 1430 . 7 1 1 A 126 126 SER CB C 126 63.925 63.811 0.114 1
1 1431 . 7 1 1 A 126 126 SER N N 126 118.037 113.999 4.038 1
1 1 . 8 1 1 A 6 6 SER HA H 6 4.458 5.150 -0.692 1
1 3 . 8 1 1 A 6 6 SER C C 6 175.108 173.210 1.898 1
1 4 . 8 1 1 A 6 6 SER CA C 6 58.689 56.292 2.397 1
1 5 . 8 1 1 A 6 6 SER CB C 6 63.678 65.375 -1.697 1
1 6 . 8 1 1 A 7 7 GLY H H 7 8.449 9.101 -0.652 1
1 7 . 8 1 1 A 7 7 GLY HA2 H 7 3.965 4.065 -0.100 1
1 8 . 8 1 1 A 7 7 GLY HA3 H 7 3.965 4.075 -0.110 1
1 9 . 8 1 1 A 7 7 GLY C C 7 174.380 174.833 -0.453 1
1 10 . 8 1 1 A 7 7 GLY CA C 7 45.435 45.062 0.373 1
1 11 . 8 1 1 A 7 7 GLY N N 7 110.792 114.729 -3.937 1
1 12 . 8 1 1 A 8 8 MET H H 8 8.259 8.943 -0.684 1
1 13 . 8 1 1 A 8 8 MET HA H 8 4.487 4.775 -0.288 1
1 21 . 8 1 1 A 8 8 MET C C 8 176.961 176.047 0.914 1
1 22 . 8 1 1 A 8 8 MET CA C 8 55.565 54.503 1.062 1
1 23 . 8 1 1 A 8 8 MET CB C 8 32.835 32.773 0.062 1
1 26 . 8 1 1 A 8 8 MET N N 8 119.639 120.247 -0.608 1
1 27 . 8 1 1 A 9 9 GLY H H 9 8.472 7.608 0.864 1
1 28 . 8 1 1 A 9 9 GLY HA2 H 9 3.946 3.986 -0.040 1
1 29 . 8 1 1 A 9 9 GLY HA3 H 9 3.946 3.987 -0.041 1
1 30 . 8 1 1 A 9 9 GLY C C 9 174.005 173.504 0.501 1
1 31 . 8 1 1 A 9 9 GLY CA C 9 45.488 45.958 -0.470 1
1 32 . 8 1 1 A 9 9 GLY N N 9 110.107 107.387 2.720 1
1 33 . 8 1 1 A 10 10 ASP H H 10 8.292 8.332 -0.040 1
1 34 . 8 1 1 A 10 10 ASP HA H 10 4.636 4.934 -0.298 1
1 37 . 8 1 1 A 10 10 ASP C C 10 176.768 175.293 1.475 1
1 38 . 8 1 1 A 10 10 ASP CA C 10 54.206 53.171 1.035 1
1 39 . 8 1 1 A 10 10 ASP CB C 10 41.306 41.665 -0.359 1
1 40 . 8 1 1 A 10 10 ASP N N 10 120.370 120.073 0.297 1
1 41 . 8 1 1 A 11 11 GLY H H 11 8.452 8.242 0.210 1
1 42 . 8 1 1 A 11 11 GLY HA2 H 11 3.980 4.133 -0.153 1
1 43 . 8 1 1 A 11 11 GLY HA3 H 11 4.022 4.140 -0.118 1
1 44 . 8 1 1 A 11 11 GLY C C 11 174.102 173.176 0.926 1
1 45 . 8 1 1 A 11 11 GLY CA C 11 45.170 45.796 -0.626 1
1 46 . 8 1 1 A 11 11 GLY N N 11 108.391 111.010 -2.619 1
1 47 . 8 1 1 A 12 12 ALA H H 12 8.293 8.204 0.089 1
1 48 . 8 1 1 A 12 12 ALA HA H 12 3.777 4.397 -0.620 1
1 52 . 8 1 1 A 12 12 ALA C C 12 178.193 178.577 -0.384 1
1 53 . 8 1 1 A 12 12 ALA CA C 12 52.759 52.690 0.069 1
1 54 . 8 1 1 A 12 12 ALA CB C 12 17.855 19.476 -1.621 1
1 55 . 8 1 1 A 12 12 ALA N N 12 124.185 123.504 0.681 1
1 56 . 8 1 1 A 13 13 VAL H H 13 8.822 8.662 0.160 1
1 57 . 8 1 1 A 13 13 VAL HA H 13 3.912 3.678 0.234 1
1 65 . 8 1 1 A 13 13 VAL C C 13 176.073 176.031 0.042 1
1 66 . 8 1 1 A 13 13 VAL CA C 13 63.100 66.613 -3.513 1
1 67 . 8 1 1 A 13 13 VAL CB C 13 32.711 31.918 0.793 1
1 70 . 8 1 1 A 13 13 VAL N N 13 120.877 124.745 -3.868 1
1 71 . 8 1 1 A 14 14 LYS H H 14 7.093 7.519 -0.426 1
1 72 . 8 1 1 A 14 14 LYS HA H 14 4.169 4.602 -0.433 1
1 81 . 8 1 1 A 14 14 LYS C C 14 173.291 173.876 -0.585 1
1 82 . 8 1 1 A 14 14 LYS CA C 14 56.465 55.615 0.850 1
1 83 . 8 1 1 A 14 14 LYS CB C 14 35.960 35.505 0.455 1
1 87 . 8 1 1 A 14 14 LYS N N 14 118.693 118.796 -0.103 1
1 88 . 8 1 1 A 15 15 GLN H H 15 8.522 8.633 -0.111 1
1 89 . 8 1 1 A 15 15 GLN HA H 15 5.542 5.222 0.320 1
1 96 . 8 1 1 A 15 15 GLN C C 15 174.992 176.003 -1.011 1
1 97 . 8 1 1 A 15 15 GLN CA C 15 54.312 53.975 0.337 1
1 98 . 8 1 1 A 15 15 GLN CB C 15 33.585 31.677 1.908 1
1 100 . 8 1 1 A 15 15 GLN N N 15 124.024 125.168 -1.144 1
1 102 . 8 1 1 A 16 16 GLY H H 16 8.740 7.932 0.808 1
1 103 . 8 1 1 A 16 16 GLY HA2 H 16 4.511 4.146 0.365 1
1 104 . 8 1 1 A 16 16 GLY HA3 H 16 4.064 4.421 -0.357 1
1 105 . 8 1 1 A 16 16 GLY C C 16 171.431 171.258 0.173 1
1 106 . 8 1 1 A 16 16 GLY CA C 16 46.106 46.019 0.087 1
1 107 . 8 1 1 A 16 16 GLY N N 16 109.611 109.752 -0.141 1
1 108 . 8 1 1 A 17 17 PHE H H 17 8.886 8.582 0.304 1
1 109 . 8 1 1 A 17 17 PHE HA H 17 5.466 5.192 0.274 1
1 114 . 8 1 1 A 17 17 PHE C C 17 174.795 174.652 0.143 1
1 115 . 8 1 1 A 17 17 PHE CA C 17 57.788 56.212 1.576 1
1 116 . 8 1 1 A 17 17 PHE CB C 17 41.315 41.018 0.297 1
1 119 . 8 1 1 A 17 17 PHE N N 17 122.684 119.518 3.166 1
1 120 . 8 1 1 A 18 18 LEU H H 18 8.762 8.624 0.138 1
1 121 . 8 1 1 A 18 18 LEU HA H 18 4.946 4.771 0.175 1
1 131 . 8 1 1 A 18 18 LEU C C 18 175.461 175.179 0.282 1
1 132 . 8 1 1 A 18 18 LEU CA C 18 52.970 53.397 -0.427 1
1 133 . 8 1 1 A 18 18 LEU CB C 18 47.945 44.577 3.368 1
1 137 . 8 1 1 A 18 18 LEU N N 18 119.045 123.688 -4.643 1
1 138 . 8 1 1 A 19 19 TYR H H 19 9.272 8.237 1.035 1
1 139 . 8 1 1 A 19 19 TYR HA H 19 5.682 5.743 -0.061 1
1 146 . 8 1 1 A 19 19 TYR C C 19 174.829 174.645 0.184 1
1 147 . 8 1 1 A 19 19 TYR CA C 19 56.482 56.305 0.177 1
1 148 . 8 1 1 A 19 19 TYR CB C 19 41.717 40.731 0.986 1
1 153 . 8 1 1 A 19 19 TYR N N 19 118.024 123.100 -5.076 1
1 154 . 8 1 1 A 20 20 LEU H H 20 9.441 8.978 0.463 1
1 155 . 8 1 1 A 20 20 LEU HA H 20 5.283 5.258 0.025 1
1 165 . 8 1 1 A 20 20 LEU C C 20 175.935 175.924 0.011 1
1 166 . 8 1 1 A 20 20 LEU CA C 20 53.464 53.734 -0.270 1
1 167 . 8 1 1 A 20 20 LEU CB C 20 46.570 45.004 1.566 1
1 171 . 8 1 1 A 20 20 LEU N N 20 122.838 125.734 -2.896 1
1 172 . 8 1 1 A 21 21 GLN H H 21 8.391 8.504 -0.113 1
1 173 . 8 1 1 A 21 21 GLN HA H 21 3.791 4.480 -0.689 1
1 180 . 8 1 1 A 21 21 GLN C C 21 175.157 174.906 0.251 1
1 181 . 8 1 1 A 21 21 GLN CA C 21 56.094 55.943 0.151 1
1 182 . 8 1 1 A 21 21 GLN CB C 21 28.434 28.832 -0.398 1
1 184 . 8 1 1 A 21 21 GLN N N 21 129.943 128.152 1.791 1
1 186 . 8 1 1 A 22 22 GLN H H 22 8.829 8.106 0.723 1
1 187 . 8 1 1 A 22 22 GLN HA H 22 4.553 4.891 -0.338 1
1 194 . 8 1 1 A 22 22 GLN C C 22 174.998 174.640 0.358 1
1 195 . 8 1 1 A 22 22 GLN CA C 22 54.912 54.297 0.615 1
1 196 . 8 1 1 A 22 22 GLN CB C 22 31.930 33.521 -1.591 1
1 198 . 8 1 1 A 22 22 GLN N N 22 127.199 124.890 2.309 1
1 200 . 8 1 1 A 23 23 GLN HA H 23 4.142 4.663 -0.521 1
1 207 . 8 1 1 A 23 23 GLN CA C 23 56.427 54.850 1.577 1
1 208 . 8 1 1 A 23 23 GLN CB C 23 29.227 29.232 -0.005 1
1 211 . 8 1 1 A 24 24 GLN HA H 24 4.523 4.580 -0.057 1
1 218 . 8 1 1 A 24 24 GLN CB C 24 29.759 30.997 -1.238 1
1 221 . 8 1 1 A 25 25 THR HA H 25 3.870 4.630 -0.760 1
1 226 . 8 1 1 A 25 25 THR CA C 25 65.096 60.917 4.179 1
1 227 . 8 1 1 A 25 25 THR CB C 25 68.924 71.580 -2.656 1
1 229 . 8 1 1 A 26 26 PHE HA H 26 4.690 4.177 0.513 1
1 236 . 8 1 1 A 26 26 PHE C C 26 175.523 175.663 -0.140 1
1 237 . 8 1 1 A 26 26 PHE CA C 26 57.312 58.596 -1.284 1
1 238 . 8 1 1 A 26 26 PHE CB C 26 39.003 37.127 1.876 1
1 243 . 8 1 1 A 27 27 GLY H H 27 7.755 8.374 -0.619 1
1 244 . 8 1 1 A 27 27 GLY HA2 H 27 4.172 4.075 0.097 1
1 245 . 8 1 1 A 27 27 GLY HA3 H 27 3.783 4.091 -0.308 1
1 246 . 8 1 1 A 27 27 GLY C C 27 172.557 173.439 -0.882 1
1 247 . 8 1 1 A 27 27 GLY CA C 27 44.924 44.737 0.187 1
1 248 . 8 1 1 A 27 27 GLY N N 27 109.216 105.025 4.191 1
1 249 . 8 1 1 A 28 28 LYS H H 28 8.241 8.071 0.170 1
1 250 . 8 1 1 A 28 28 LYS HA H 28 4.530 5.376 -0.846 1
1 259 . 8 1 1 A 28 28 LYS C C 28 176.204 174.441 1.763 1
1 260 . 8 1 1 A 28 28 LYS CA C 28 55.741 55.079 0.662 1
1 261 . 8 1 1 A 28 28 LYS CB C 28 33.904 35.107 -1.203 1
1 265 . 8 1 1 A 28 28 LYS N N 28 118.743 118.246 0.497 1
1 266 . 8 1 1 A 29 29 LYS H H 29 8.356 8.272 0.084 1
1 267 . 8 1 1 A 29 29 LYS HA H 29 4.559 4.708 -0.149 1
1 274 . 8 1 1 A 29 29 LYS C C 29 175.420 175.485 -0.065 1
1 275 . 8 1 1 A 29 29 LYS CA C 29 55.406 54.133 1.273 1
1 276 . 8 1 1 A 29 29 LYS CB C 29 35.618 37.145 -1.527 1
1 280 . 8 1 1 A 29 29 LYS N N 29 121.198 119.791 1.407 1
1 281 . 8 1 1 A 30 30 TRP H H 30 8.891 8.642 0.249 1
1 282 . 8 1 1 A 30 30 TRP HA H 30 4.951 5.102 -0.151 1
1 291 . 8 1 1 A 30 30 TRP C C 30 175.902 176.468 -0.566 1
1 292 . 8 1 1 A 30 30 TRP CA C 30 56.677 56.795 -0.118 1
1 293 . 8 1 1 A 30 30 TRP CB C 30 30.614 30.630 -0.016 1
1 299 . 8 1 1 A 30 30 TRP N N 30 123.304 119.855 3.449 1
1 301 . 8 1 1 A 31 31 ARG H H 31 8.712 9.291 -0.579 1
1 302 . 8 1 1 A 31 31 ARG HA H 31 4.820 4.954 -0.134 1
1 309 . 8 1 1 A 31 31 ARG C C 31 174.026 175.006 -0.980 1
1 310 . 8 1 1 A 31 31 ARG CA C 31 54.895 53.370 1.525 1
1 311 . 8 1 1 A 31 31 ARG CB C 31 34.045 33.993 0.052 1
1 314 . 8 1 1 A 31 31 ARG N N 31 123.973 122.176 1.797 1
1 315 . 8 1 1 A 32 32 ARG H H 32 8.820 8.249 0.571 1
1 316 . 8 1 1 A 32 32 ARG HA H 32 3.965 4.762 -0.797 1
1 323 . 8 1 1 A 32 32 ARG C C 32 174.785 175.311 -0.526 1
1 324 . 8 1 1 A 32 32 ARG CA C 32 56.924 55.414 1.510 1
1 325 . 8 1 1 A 32 32 ARG CB C 32 31.806 32.005 -0.199 1
1 328 . 8 1 1 A 32 32 ARG N N 32 127.041 121.389 5.652 1
1 329 . 8 1 1 A 33 33 PHE H H 33 9.372 8.563 0.809 1
1 330 . 8 1 1 A 33 33 PHE HA H 33 4.863 5.021 -0.158 1
1 338 . 8 1 1 A 33 33 PHE C C 33 176.359 175.317 1.042 1
1 339 . 8 1 1 A 33 33 PHE CA C 33 57.224 56.221 1.003 1
1 340 . 8 1 1 A 33 33 PHE CB C 33 43.385 41.463 1.922 1
1 346 . 8 1 1 A 33 33 PHE N N 33 125.882 119.934 5.948 1
1 347 . 8 1 1 A 34 34 GLY H H 34 9.160 8.852 0.308 1
1 348 . 8 1 1 A 34 34 GLY HA2 H 34 4.182 4.116 0.066 1
1 349 . 8 1 1 A 34 34 GLY HA3 H 34 3.714 4.133 -0.419 1
1 350 . 8 1 1 A 34 34 GLY C C 34 172.920 173.045 -0.125 1
1 351 . 8 1 1 A 34 34 GLY CA C 34 46.247 45.965 0.282 1
1 352 . 8 1 1 A 34 34 GLY N N 34 108.654 111.347 -2.693 1
1 353 . 8 1 1 A 35 35 ALA H H 35 8.982 8.266 0.716 1
1 354 . 8 1 1 A 35 35 ALA HA H 35 5.660 5.636 0.024 1
1 358 . 8 1 1 A 35 35 ALA C C 35 176.547 175.438 1.109 1
1 359 . 8 1 1 A 35 35 ALA CA C 35 50.500 49.798 0.702 1
1 360 . 8 1 1 A 35 35 ALA CB C 35 24.034 22.754 1.280 1
1 361 . 8 1 1 A 35 35 ALA N N 35 130.076 127.513 2.563 1
1 362 . 8 1 1 A 36 36 SER H H 36 8.852 8.743 0.109 1
1 363 . 8 1 1 A 36 36 SER HA H 36 5.203 4.893 0.310 1
1 366 . 8 1 1 A 36 36 SER C C 36 170.939 172.255 -1.316 1
1 367 . 8 1 1 A 36 36 SER CA C 36 57.806 57.414 0.392 1
1 368 . 8 1 1 A 36 36 SER CB C 36 66.986 65.476 1.510 1
1 369 . 8 1 1 A 36 36 SER N N 36 116.620 116.983 -0.363 1
1 370 . 8 1 1 A 37 37 LEU H H 37 8.862 8.617 0.245 1
1 371 . 8 1 1 A 37 37 LEU HA H 37 5.163 4.736 0.427 1
1 381 . 8 1 1 A 37 37 LEU C C 37 173.525 174.080 -0.555 1
1 382 . 8 1 1 A 37 37 LEU CA C 37 53.112 53.535 -0.423 1
1 383 . 8 1 1 A 37 37 LEU CB C 37 46.077 43.645 2.432 1
1 387 . 8 1 1 A 37 37 LEU N N 37 127.638 128.940 -1.302 1
1 388 . 8 1 1 A 38 38 TYR H H 38 9.280 8.858 0.422 1
1 389 . 8 1 1 A 38 38 TYR HA H 38 4.820 5.383 -0.563 1
1 396 . 8 1 1 A 38 38 TYR C C 38 175.430 174.855 0.575 1
1 397 . 8 1 1 A 38 38 TYR CA C 38 57.436 56.147 1.289 1
1 398 . 8 1 1 A 38 38 TYR CB C 38 42.128 42.090 0.038 1
1 403 . 8 1 1 A 38 38 TYR N N 38 125.215 126.052 -0.837 1
1 404 . 8 1 1 A 39 39 GLY H H 39 8.532 8.544 -0.012 1
1 405 . 8 1 1 A 39 39 GLY HA2 H 39 4.220 4.188 0.032 1
1 406 . 8 1 1 A 39 39 GLY HA3 H 39 3.941 4.190 -0.249 1
1 407 . 8 1 1 A 39 39 GLY C C 39 172.950 172.853 0.097 1
1 408 . 8 1 1 A 39 39 GLY CA C 39 44.817 44.337 0.480 1
1 409 . 8 1 1 A 39 39 GLY N N 39 106.424 109.499 -3.075 1
1 410 . 8 1 1 A 40 40 GLY H H 40 8.477 8.333 0.144 1
1 411 . 8 1 1 A 40 40 GLY HA2 H 40 4.102 4.188 -0.086 1
1 412 . 8 1 1 A 40 40 GLY HA3 H 40 3.927 4.189 -0.262 1
1 413 . 8 1 1 A 40 40 GLY C C 40 174.002 173.297 0.705 1
1 414 . 8 1 1 A 40 40 GLY CA C 40 44.694 44.154 0.540 1
1 415 . 8 1 1 A 40 40 GLY N N 40 106.881 107.766 -0.885 1
1 416 . 8 1 1 A 41 41 SER H H 41 8.600 8.538 0.062 1
1 417 . 8 1 1 A 41 41 SER HA H 41 4.520 4.344 0.176 1
1 420 . 8 1 1 A 41 41 SER C C 41 174.355 174.666 -0.311 1
1 421 . 8 1 1 A 41 41 SER CA C 41 58.565 58.422 0.143 1
1 422 . 8 1 1 A 41 41 SER CB C 41 64.413 64.067 0.346 1
1 423 . 8 1 1 A 41 41 SER N N 41 115.751 117.377 -1.626 1
1 424 . 8 1 1 A 42 42 ASP H H 42 8.533 9.155 -0.622 1
1 425 . 8 1 1 A 42 42 ASP HA H 42 4.560 4.332 0.228 1
1 428 . 8 1 1 A 42 42 ASP CA C 42 55.230 55.534 -0.304 1
1 429 . 8 1 1 A 42 42 ASP CB C 42 40.648 39.281 1.367 1
1 430 . 8 1 1 A 42 42 ASP N N 42 119.037 118.313 0.724 1
1 431 . 8 1 1 A 43 43 CYS H H 43 8.152 8.491 -0.339 1
1 432 . 8 1 1 A 43 43 CYS HA H 43 4.541 4.170 0.371 1
1 435 . 8 1 1 A 43 43 CYS C C 43 173.975 173.817 0.158 1
1 436 . 8 1 1 A 43 43 CYS CA C 43 58.265 59.869 -1.604 1
1 437 . 8 1 1 A 43 43 CYS CB C 43 28.393 25.973 2.420 1
1 438 . 8 1 1 A 43 43 CYS N N 43 116.881 115.529 1.352 1
1 439 . 8 1 1 A 44 44 ALA H H 44 8.047 7.427 0.620 1
1 440 . 8 1 1 A 44 44 ALA HA H 44 4.395 4.464 -0.069 1
1 444 . 8 1 1 A 44 44 ALA C C 44 176.472 176.979 -0.507 1
1 445 . 8 1 1 A 44 44 ALA CA C 44 52.688 51.398 1.290 1
1 446 . 8 1 1 A 44 44 ALA CB C 44 20.579 19.113 1.466 1
1 447 . 8 1 1 A 44 44 ALA N N 44 125.989 121.877 4.112 1
1 448 . 8 1 1 A 45 45 LEU H H 45 8.052 8.559 -0.507 1
1 449 . 8 1 1 A 45 45 LEU HA H 45 4.452 4.311 0.141 1
1 459 . 8 1 1 A 45 45 LEU C C 45 176.196 175.524 0.672 1
1 460 . 8 1 1 A 45 45 LEU CA C 45 53.771 56.287 -2.516 1
1 461 . 8 1 1 A 45 45 LEU CB C 45 43.116 42.560 0.556 1
1 465 . 8 1 1 A 45 45 LEU N N 45 119.889 127.358 -7.469 1
1 466 . 8 1 1 A 46 46 ALA H H 46 8.381 8.734 -0.353 1
1 467 . 8 1 1 A 46 46 ALA HA H 46 4.449 5.736 -1.287 1
1 471 . 8 1 1 A 46 46 ALA C C 46 179.093 176.352 2.741 1
1 472 . 8 1 1 A 46 46 ALA CA C 46 52.829 50.249 2.580 1
1 473 . 8 1 1 A 46 46 ALA CB C 46 18.687 22.379 -3.692 1
1 474 . 8 1 1 A 46 46 ALA N N 46 125.635 129.605 -3.970 1
1 475 . 8 1 1 A 47 47 ARG H H 47 9.012 8.921 0.091 1
1 476 . 8 1 1 A 47 47 ARG HA H 47 5.192 5.119 0.073 1
1 484 . 8 1 1 A 47 47 ARG C C 47 171.524 173.795 -2.271 1
1 485 . 8 1 1 A 47 47 ARG CA C 47 55.265 55.027 0.238 1
1 486 . 8 1 1 A 47 47 ARG CB C 47 30.970 34.065 -3.095 1
1 489 . 8 1 1 A 47 47 ARG N N 47 120.048 118.584 1.464 1
1 491 . 8 1 1 A 48 48 LEU H H 48 9.029 8.478 0.551 1
1 492 . 8 1 1 A 48 48 LEU HA H 48 5.221 4.969 0.252 1
1 502 . 8 1 1 A 48 48 LEU C C 48 174.348 174.827 -0.479 1
1 503 . 8 1 1 A 48 48 LEU CA C 48 53.253 54.027 -0.774 1
1 504 . 8 1 1 A 48 48 LEU CB C 48 45.419 43.730 1.689 1
1 508 . 8 1 1 A 48 48 LEU N N 48 123.315 123.990 -0.675 1
1 509 . 8 1 1 A 49 49 GLU H H 49 9.473 8.374 1.099 1
1 510 . 8 1 1 A 49 49 GLU HA H 49 5.222 5.158 0.064 1
1 515 . 8 1 1 A 49 49 GLU C C 49 175.507 175.534 -0.027 1
1 516 . 8 1 1 A 49 49 GLU CA C 49 55.159 54.874 0.285 1
1 517 . 8 1 1 A 49 49 GLU CB C 49 32.341 32.343 -0.002 1
1 519 . 8 1 1 A 49 49 GLU N N 49 124.751 126.798 -2.047 1
1 520 . 8 1 1 A 50 50 LEU H H 50 9.088 8.360 0.728 1
1 521 . 8 1 1 A 50 50 LEU HA H 50 5.382 5.188 0.194 1
1 531 . 8 1 1 A 50 50 LEU C C 50 175.474 175.787 -0.313 1
1 532 . 8 1 1 A 50 50 LEU CA C 50 52.865 53.749 -0.884 1
1 533 . 8 1 1 A 50 50 LEU CB C 50 43.239 46.457 -3.218 1
1 537 . 8 1 1 A 50 50 LEU N N 50 124.221 121.317 2.904 1
1 538 . 8 1 1 A 51 51 GLN H H 51 9.602 8.719 0.883 1
1 539 . 8 1 1 A 51 51 GLN HA H 51 5.095 5.129 -0.034 1
1 546 . 8 1 1 A 51 51 GLN C C 51 175.306 174.425 0.881 1
1 547 . 8 1 1 A 51 51 GLN CA C 51 54.576 54.191 0.385 1
1 548 . 8 1 1 A 51 51 GLN CB C 51 32.177 32.404 -0.227 1
1 550 . 8 1 1 A 51 51 GLN N N 51 123.268 120.221 3.047 1
1 552 . 8 1 1 A 52 52 GLU H H 52 9.172 8.978 0.194 1
1 553 . 8 1 1 A 52 52 GLU HA H 52 4.092 4.960 -0.868 1
1 558 . 8 1 1 A 52 52 GLU C C 52 176.523 176.073 0.450 1
1 559 . 8 1 1 A 52 52 GLU CA C 52 57.500 55.271 2.229 1
1 560 . 8 1 1 A 52 52 GLU CB C 52 30.696 31.869 -1.173 1
1 562 . 8 1 1 A 52 52 GLU N N 52 128.982 123.551 5.431 1
1 563 . 8 1 1 A 53 53 GLY H H 53 8.644 8.769 -0.125 1
1 564 . 8 1 1 A 53 53 GLY HA2 H 53 4.261 4.076 0.185 1
1 565 . 8 1 1 A 53 53 GLY HA3 H 53 3.993 4.080 -0.087 1
1 566 . 8 1 1 A 53 53 GLY C C 53 172.550 175.430 -2.880 1
1 567 . 8 1 1 A 53 53 GLY CA C 53 45.911 46.923 -1.012 1
1 568 . 8 1 1 A 53 53 GLY N N 53 110.844 115.181 -4.337 1
1 569 . 8 1 1 A 54 54 PRO HA H 54 4.392 4.620 -0.228 1
1 576 . 8 1 1 A 54 54 PRO C C 54 176.828 176.241 0.587 1
1 577 . 8 1 1 A 54 54 PRO CA C 54 63.665 64.137 -0.472 1
1 578 . 8 1 1 A 54 54 PRO CB C 54 32.012 31.687 0.325 1
1 581 . 8 1 1 A 55 55 GLU H H 55 8.934 8.306 0.628 1
1 582 . 8 1 1 A 55 55 GLU HA H 55 4.193 4.474 -0.281 1
1 587 . 8 1 1 A 55 55 GLU C C 55 176.189 175.191 0.998 1
1 588 . 8 1 1 A 55 55 GLU CA C 55 57.383 55.960 1.423 1
1 589 . 8 1 1 A 55 55 GLU CB C 55 28.945 29.903 -0.958 1
1 591 . 8 1 1 A 55 55 GLU N N 55 120.312 117.057 3.255 1
1 592 . 8 1 1 A 56 56 LYS H H 56 7.937 7.363 0.574 1
1 593 . 8 1 1 A 56 56 LYS HA H 56 4.578 4.694 -0.116 1
1 602 . 8 1 1 A 56 56 LYS C C 56 174.295 175.717 -1.422 1
1 603 . 8 1 1 A 56 56 LYS CA C 56 54.171 52.897 1.274 1
1 604 . 8 1 1 A 56 56 LYS CB C 56 32.555 35.354 -2.799 1
1 608 . 8 1 1 A 56 56 LYS N N 56 122.008 121.885 0.123 1
1 609 . 8 1 1 A 57 57 PRO HA H 57 4.370 4.451 -0.081 1
1 616 . 8 1 1 A 57 57 PRO CA C 57 63.431 65.164 -1.733 1
1 617 . 8 1 1 A 57 57 PRO CB C 57 32.072 32.011 0.061 1
1 620 . 8 1 1 A 58 58 ARG H H 58 8.310 8.070 0.240 1
1 621 . 8 1 1 A 58 58 ARG HA H 58 4.295 4.688 -0.393 1
1 628 . 8 1 1 A 58 58 ARG CA C 58 56.570 54.500 2.070 1
1 629 . 8 1 1 A 58 58 ARG CB C 58 30.860 33.216 -2.356 1
1 632 . 8 1 1 A 58 58 ARG N N 58 120.045 118.378 1.667 1
1 633 . 8 1 1 A 60 60 CYS HA H 60 4.482 4.760 -0.278 1
1 636 . 8 1 1 A 60 60 CYS CA C 60 58.621 57.467 1.154 1
1 637 . 8 1 1 A 60 60 CYS CB C 60 28.267 29.880 -1.613 1
1 638 . 8 1 1 A 61 61 GLU HA H 61 4.226 4.566 -0.340 1
1 643 . 8 1 1 A 61 61 GLU C C 61 176.299 175.307 0.992 1
1 644 . 8 1 1 A 61 61 GLU CA C 61 57.100 55.617 1.483 1
1 645 . 8 1 1 A 61 61 GLU CB C 61 29.873 28.964 0.909 1
1 647 . 8 1 1 A 62 62 ALA H H 62 8.282 7.500 0.782 1
1 648 . 8 1 1 A 62 62 ALA HA H 62 4.302 4.842 -0.540 1
1 652 . 8 1 1 A 62 62 ALA C C 62 177.277 175.826 1.451 1
1 653 . 8 1 1 A 62 62 ALA CA C 62 52.512 51.009 1.503 1
1 654 . 8 1 1 A 62 62 ALA CB C 62 19.592 23.305 -3.713 1
1 655 . 8 1 1 A 62 62 ALA N N 62 124.386 123.666 0.720 1
1 656 . 8 1 1 A 63 63 ALA H H 63 8.399 8.433 -0.034 1
1 657 . 8 1 1 A 63 63 ALA HA H 63 4.375 4.347 0.028 1
1 661 . 8 1 1 A 63 63 ALA C C 63 176.843 177.360 -0.517 1
1 662 . 8 1 1 A 63 63 ALA CA C 63 52.658 52.283 0.375 1
1 663 . 8 1 1 A 63 63 ALA CB C 63 19.592 19.085 0.507 1
1 664 . 8 1 1 A 63 63 ALA N N 63 123.892 123.023 0.869 1
1 665 . 8 1 1 A 64 64 ARG H H 64 8.152 8.397 -0.245 1
1 666 . 8 1 1 A 64 64 ARG HA H 64 5.008 4.372 0.636 1
1 673 . 8 1 1 A 64 64 ARG C C 64 175.594 175.227 0.367 1
1 674 . 8 1 1 A 64 64 ARG CA C 64 55.282 55.825 -0.543 1
1 675 . 8 1 1 A 64 64 ARG CB C 64 32.506 31.122 1.384 1
1 678 . 8 1 1 A 64 64 ARG N N 64 119.787 118.932 0.855 1
1 679 . 8 1 1 A 65 65 LYS H H 65 8.945 8.528 0.417 1
1 680 . 8 1 1 A 65 65 LYS HA H 65 4.602 4.795 -0.193 1
1 689 . 8 1 1 A 65 65 LYS C C 65 174.657 175.041 -0.384 1
1 690 . 8 1 1 A 65 65 LYS CA C 65 54.948 55.794 -0.846 1
1 691 . 8 1 1 A 65 65 LYS CB C 65 34.068 33.610 0.458 1
1 695 . 8 1 1 A 65 65 LYS N N 65 124.171 122.587 1.584 1
1 696 . 8 1 1 A 66 66 VAL H H 66 8.672 8.727 -0.055 1
1 697 . 8 1 1 A 66 66 VAL HA H 66 4.532 5.160 -0.628 1
1 705 . 8 1 1 A 66 66 VAL C C 66 175.078 173.779 1.299 1
1 706 . 8 1 1 A 66 66 VAL CA C 66 61.865 60.061 1.804 1
1 707 . 8 1 1 A 66 66 VAL CB C 66 33.835 34.517 -0.682 1
1 710 . 8 1 1 A 66 66 VAL N N 66 124.380 126.161 -1.781 1
1 711 . 8 1 1 A 67 67 ILE H H 67 9.071 9.217 -0.146 1
1 712 . 8 1 1 A 67 67 ILE HA H 67 4.142 4.538 -0.396 1
1 722 . 8 1 1 A 67 67 ILE C C 67 175.819 175.758 0.061 1
1 723 . 8 1 1 A 67 67 ILE CA C 67 60.383 60.404 -0.021 1
1 724 . 8 1 1 A 67 67 ILE CB C 67 39.908 37.844 2.064 1
1 728 . 8 1 1 A 67 67 ILE N N 67 129.537 129.894 -0.357 1
1 729 . 8 1 1 A 68 68 ARG H H 68 9.203 8.668 0.535 1
1 730 . 8 1 1 A 68 68 ARG HA H 68 4.198 4.310 -0.112 1
1 737 . 8 1 1 A 68 68 ARG C C 68 177.769 177.159 0.610 1
1 738 . 8 1 1 A 68 68 ARG CA C 68 56.835 56.628 0.207 1
1 739 . 8 1 1 A 68 68 ARG CB C 68 29.832 30.741 -0.909 1
1 742 . 8 1 1 A 68 68 ARG N N 68 128.484 128.593 -0.109 1
1 743 . 8 1 1 A 69 69 LEU H H 69 8.212 8.602 -0.390 1
1 744 . 8 1 1 A 69 69 LEU HA H 69 4.221 4.009 0.212 1
1 754 . 8 1 1 A 69 69 LEU C C 69 178.996 178.734 0.262 1
1 755 . 8 1 1 A 69 69 LEU CA C 69 57.136 57.441 -0.305 1
1 756 . 8 1 1 A 69 69 LEU CB C 69 39.455 41.259 -1.804 1
1 760 . 8 1 1 A 69 69 LEU N N 69 123.807 123.516 0.291 1
1 761 . 8 1 1 A 70 70 SER H H 70 8.823 8.039 0.784 1
1 762 . 8 1 1 A 70 70 SER HA H 70 4.331 4.058 0.273 1
1 765 . 8 1 1 A 70 70 SER C C 70 175.076 176.662 -1.586 1
1 766 . 8 1 1 A 70 70 SER CA C 70 60.329 61.322 -0.993 1
1 767 . 8 1 1 A 70 70 SER CB C 70 62.362 62.979 -0.617 1
1 768 . 8 1 1 A 70 70 SER N N 70 115.162 113.988 1.174 1
1 769 . 8 1 1 A 71 71 ASP H H 71 7.602 8.424 -0.822 1
1 770 . 8 1 1 A 71 71 ASP HA H 71 4.820 4.397 0.423 1
1 773 . 8 1 1 A 71 71 ASP C C 71 176.478 176.477 0.001 1
1 774 . 8 1 1 A 71 71 ASP CA C 71 54.241 56.645 -2.404 1
1 775 . 8 1 1 A 71 71 ASP CB C 71 41.347 40.702 0.645 1
1 776 . 8 1 1 A 71 71 ASP N N 71 119.590 121.963 -2.373 1
1 777 . 8 1 1 A 72 72 CYS H H 72 7.715 7.473 0.242 1
1 778 . 8 1 1 A 72 72 CYS HA H 72 4.372 4.752 -0.380 1
1 781 . 8 1 1 A 72 72 CYS C C 72 173.690 174.643 -0.953 1
1 782 . 8 1 1 A 72 72 CYS CA C 72 60.836 57.990 2.846 1
1 783 . 8 1 1 A 72 72 CYS CB C 72 27.655 26.092 1.563 1
1 784 . 8 1 1 A 72 72 CYS N N 72 118.346 116.902 1.444 1
1 785 . 8 1 1 A 73 73 LEU H H 73 9.472 8.607 0.865 1
1 786 . 8 1 1 A 73 73 LEU HA H 73 4.593 3.955 0.638 1
1 796 . 8 1 1 A 73 73 LEU C C 73 177.562 176.685 0.877 1
1 797 . 8 1 1 A 73 73 LEU CA C 73 55.724 57.799 -2.075 1
1 798 . 8 1 1 A 73 73 LEU CB C 73 43.774 41.971 1.803 1
1 802 . 8 1 1 A 73 73 LEU N N 73 124.752 128.615 -3.863 1
1 803 . 8 1 1 A 74 74 ARG H H 74 7.658 7.373 0.285 1
1 804 . 8 1 1 A 74 74 ARG HA H 74 4.592 5.175 -0.583 1
1 811 . 8 1 1 A 74 74 ARG C C 74 173.605 174.389 -0.784 1
1 812 . 8 1 1 A 74 74 ARG CA C 74 56.465 55.616 0.849 1
1 813 . 8 1 1 A 74 74 ARG CB C 74 34.068 33.900 0.168 1
1 816 . 8 1 1 A 74 74 ARG N N 74 115.565 115.901 -0.336 1
1 817 . 8 1 1 A 75 75 VAL H H 75 8.622 8.872 -0.250 1
1 818 . 8 1 1 A 75 75 VAL HA H 75 5.170 5.297 -0.127 1
1 826 . 8 1 1 A 75 75 VAL C C 75 173.985 174.221 -0.236 1
1 827 . 8 1 1 A 75 75 VAL CA C 75 60.930 59.278 1.652 1
1 828 . 8 1 1 A 75 75 VAL CB C 75 35.073 36.659 -1.586 1
1 831 . 8 1 1 A 75 75 VAL N N 75 124.278 119.123 5.155 1
1 832 . 8 1 1 A 76 76 ALA H H 76 8.272 8.935 -0.663 1
1 833 . 8 1 1 A 76 76 ALA HA H 76 4.648 4.891 -0.243 1
1 837 . 8 1 1 A 76 76 ALA C C 76 175.630 175.517 0.113 1
1 838 . 8 1 1 A 76 76 ALA CA C 76 51.294 51.440 -0.146 1
1 839 . 8 1 1 A 76 76 ALA CB C 76 22.759 23.396 -0.637 1
1 840 . 8 1 1 A 76 76 ALA N N 76 126.015 122.991 3.024 1
1 841 . 8 1 1 A 77 77 GLU H H 77 9.184 8.742 0.442 1
1 842 . 8 1 1 A 77 77 GLU HA H 77 4.060 5.145 -1.085 1
1 847 . 8 1 1 A 77 77 GLU C C 77 174.949 175.864 -0.915 1
1 848 . 8 1 1 A 77 77 GLU CA C 77 58.424 54.985 3.439 1
1 849 . 8 1 1 A 77 77 GLU CB C 77 30.161 32.067 -1.906 1
1 851 . 8 1 1 A 77 77 GLU N N 77 120.223 118.071 2.152 1
1 852 . 8 1 1 A 78 78 ALA H H 78 7.985 8.786 -0.801 1
1 853 . 8 1 1 A 78 78 ALA HA H 78 4.776 4.370 0.406 1
1 857 . 8 1 1 A 78 78 ALA C C 78 177.250 178.289 -1.039 1
1 858 . 8 1 1 A 78 78 ALA CA C 78 50.888 54.007 -3.119 1
1 859 . 8 1 1 A 78 78 ALA CB C 78 20.851 20.108 0.743 1
1 860 . 8 1 1 A 78 78 ALA N N 78 125.143 126.591 -1.448 1
1 861 . 8 1 1 A 79 79 GLY H H 79 8.604 8.265 0.339 1
1 862 . 8 1 1 A 79 79 GLY HA2 H 79 4.327 3.953 0.374 1
1 863 . 8 1 1 A 79 79 GLY HA3 H 79 3.963 3.965 -0.002 1
1 864 . 8 1 1 A 79 79 GLY C C 79 175.360 174.591 0.769 1
1 865 . 8 1 1 A 79 79 GLY CA C 79 44.925 46.756 -1.831 1
1 866 . 8 1 1 A 79 79 GLY N N 79 109.420 105.078 4.342 1
1 867 . 8 1 1 A 80 80 GLY H H 80 8.649 8.273 0.376 1
1 868 . 8 1 1 A 80 80 GLY HA2 H 80 3.962 3.977 -0.015 1
1 869 . 8 1 1 A 80 80 GLY HA3 H 80 3.962 3.983 -0.021 1
1 870 . 8 1 1 A 80 80 GLY C C 80 175.052 176.019 -0.967 1
1 871 . 8 1 1 A 80 80 GLY CA C 80 45.955 46.283 -0.328 1
1 872 . 8 1 1 A 80 80 GLY N N 80 108.295 113.696 -5.401 1
1 873 . 8 1 1 A 81 81 GLU H H 81 8.921 8.736 0.185 1
1 874 . 8 1 1 A 81 81 GLU HA H 81 4.298 4.069 0.229 1
1 879 . 8 1 1 A 81 81 GLU C C 81 176.532 177.692 -1.160 1
1 880 . 8 1 1 A 81 81 GLU CA C 81 57.118 59.499 -2.381 1
1 881 . 8 1 1 A 81 81 GLU CB C 81 28.599 29.581 -0.982 1
1 883 . 8 1 1 A 81 81 GLU N N 81 121.170 125.701 -4.531 1
1 884 . 8 1 1 A 82 82 ALA H H 82 8.032 7.516 0.516 1
1 885 . 8 1 1 A 82 82 ALA HA H 82 4.371 4.257 0.114 1
1 889 . 8 1 1 A 82 82 ALA C C 82 177.160 178.531 -1.371 1
1 890 . 8 1 1 A 82 82 ALA CA C 82 52.653 52.781 -0.128 1
1 891 . 8 1 1 A 82 82 ALA CB C 82 19.304 20.176 -0.872 1
1 892 . 8 1 1 A 82 82 ALA N N 82 124.988 121.397 3.591 1
1 893 . 8 1 1 A 83 83 SER H H 83 8.319 8.836 -0.517 1
1 894 . 8 1 1 A 83 83 SER HA H 83 4.331 4.378 -0.047 1
1 897 . 8 1 1 A 83 83 SER C C 83 174.045 174.602 -0.557 1
1 898 . 8 1 1 A 83 83 SER CA C 83 58.053 61.144 -3.091 1
1 899 . 8 1 1 A 83 83 SER CB C 83 63.184 63.066 0.118 1
1 900 . 8 1 1 A 83 83 SER N N 83 114.181 115.661 -1.480 1
1 901 . 8 1 1 A 84 84 SER H H 84 7.823 7.841 -0.018 1
1 902 . 8 1 1 A 84 84 SER HA H 84 3.194 4.433 -1.239 1
1 905 . 8 1 1 A 84 84 SER C C 84 171.072 173.955 -2.883 1
1 906 . 8 1 1 A 84 84 SER CA C 84 57.206 56.965 0.241 1
1 907 . 8 1 1 A 84 84 SER CB C 84 61.622 63.141 -1.519 1
1 908 . 8 1 1 A 84 84 SER N N 84 117.302 114.510 2.792 1
1 909 . 8 1 1 A 85 85 PRO HA H 85 3.922 4.548 -0.626 1
1 916 . 8 1 1 A 85 85 PRO CA C 85 62.691 62.324 0.367 1
1 917 . 8 1 1 A 85 85 PRO CB C 85 31.515 33.169 -1.654 1
1 920 . 8 1 1 A 86 86 ARG HA H 86 3.882 3.963 -0.081 1
1 927 . 8 1 1 A 86 86 ARG C C 86 175.712 176.772 -1.060 1
1 928 . 8 1 1 A 86 86 ARG CA C 86 57.877 58.568 -0.691 1
1 929 . 8 1 1 A 86 86 ARG CB C 86 29.791 29.688 0.103 1
1 932 . 8 1 1 A 87 87 ASP H H 87 8.903 7.931 0.972 1
1 933 . 8 1 1 A 87 87 ASP HA H 87 4.342 4.673 -0.331 1
1 936 . 8 1 1 A 87 87 ASP C C 87 175.723 175.379 0.344 1
1 937 . 8 1 1 A 87 87 ASP CA C 87 56.377 54.421 1.956 1
1 938 . 8 1 1 A 87 87 ASP CB C 87 39.208 41.311 -2.103 1
1 939 . 8 1 1 A 87 87 ASP N N 87 117.520 118.098 -0.578 1
1 940 . 8 1 1 A 88 88 THR H H 88 7.776 7.268 0.508 1
1 941 . 8 1 1 A 88 88 THR HA H 88 5.101 5.092 0.009 1
1 946 . 8 1 1 A 88 88 THR C C 88 173.825 172.653 1.172 1
1 947 . 8 1 1 A 88 88 THR CA C 88 60.154 60.198 -0.044 1
1 948 . 8 1 1 A 88 88 THR CB C 88 72.702 72.945 -0.243 1
1 950 . 8 1 1 A 88 88 THR N N 88 108.770 111.266 -2.496 1
1 951 . 8 1 1 A 89 89 SER H H 89 9.006 9.370 -0.364 1
1 952 . 8 1 1 A 89 89 SER HA H 89 4.718 5.163 -0.445 1
1 955 . 8 1 1 A 89 89 SER C C 89 173.728 172.912 0.816 1
1 956 . 8 1 1 A 89 89 SER CA C 89 57.453 57.827 -0.374 1
1 957 . 8 1 1 A 89 89 SER CB C 89 65.611 65.722 -0.111 1
1 958 . 8 1 1 A 89 89 SER N N 89 114.151 117.133 -2.982 1
1 959 . 8 1 1 A 90 90 ALA H H 90 9.001 8.865 0.136 1
1 960 . 8 1 1 A 90 90 ALA HA H 90 5.660 4.798 0.862 1
1 964 . 8 1 1 A 90 90 ALA C C 90 177.669 177.172 0.497 1
1 965 . 8 1 1 A 90 90 ALA CA C 90 51.670 51.926 -0.256 1
1 966 . 8 1 1 A 90 90 ALA CB C 90 22.265 20.298 1.967 1
1 967 . 8 1 1 A 90 90 ALA N N 90 126.177 129.511 -3.334 1
1 968 . 8 1 1 A 91 91 PHE H H 91 9.672 8.346 1.326 1
1 969 . 8 1 1 A 91 91 PHE HA H 91 5.039 5.521 -0.482 1
1 977 . 8 1 1 A 91 91 PHE C C 91 170.731 173.484 -2.753 1
1 978 . 8 1 1 A 91 91 PHE CA C 91 56.271 55.239 1.032 1
1 979 . 8 1 1 A 91 91 PHE CB C 91 41.553 42.070 -0.517 1
1 985 . 8 1 1 A 91 91 PHE N N 91 118.968 116.360 2.608 1
1 986 . 8 1 1 A 92 92 PHE H H 92 9.422 9.513 -0.091 1
1 987 . 8 1 1 A 92 92 PHE HA H 92 5.674 5.110 0.564 1
1 995 . 8 1 1 A 92 92 PHE C C 92 174.570 175.268 -0.698 1
1 996 . 8 1 1 A 92 92 PHE CA C 92 55.917 57.606 -1.689 1
1 997 . 8 1 1 A 92 92 PHE CB C 92 42.787 41.364 1.423 1
1 1003 . 8 1 1 A 92 92 PHE N N 92 117.543 118.087 -0.544 1
1 1004 . 8 1 1 A 93 93 LEU H H 93 9.021 8.860 0.161 1
1 1005 . 8 1 1 A 93 93 LEU HA H 93 5.122 4.982 0.140 1
1 1015 . 8 1 1 A 93 93 LEU C C 93 174.799 174.272 0.527 1
1 1016 . 8 1 1 A 93 93 LEU CA C 93 54.912 54.743 0.169 1
1 1017 . 8 1 1 A 93 93 LEU CB C 93 45.254 44.685 0.569 1
1 1021 . 8 1 1 A 93 93 LEU N N 93 121.719 121.695 0.024 1
1 1022 . 8 1 1 A 94 94 GLU H H 94 9.294 9.567 -0.273 1
1 1023 . 8 1 1 A 94 94 GLU HA H 94 5.043 5.246 -0.203 1
1 1028 . 8 1 1 A 94 94 GLU C C 94 175.754 175.534 0.220 1
1 1029 . 8 1 1 A 94 94 GLU CA C 94 56.018 54.943 1.075 1
1 1030 . 8 1 1 A 94 94 GLU CB C 94 32.752 32.648 0.104 1
1 1032 . 8 1 1 A 94 94 GLU N N 94 127.032 128.615 -1.583 1
1 1033 . 8 1 1 A 95 95 THR H H 95 8.822 8.562 0.260 1
1 1034 . 8 1 1 A 95 95 THR HA H 95 5.398 5.374 0.024 1
1 1039 . 8 1 1 A 95 95 THR C C 95 173.860 175.516 -1.656 1
1 1040 . 8 1 1 A 95 95 THR CA C 95 59.588 59.497 0.091 1
1 1041 . 8 1 1 A 95 95 THR CB C 95 72.191 72.347 -0.156 1
1 1043 . 8 1 1 A 95 95 THR N N 95 118.685 118.053 0.632 1
1 1044 . 8 1 1 A 96 96 LYS H H 96 8.823 9.098 -0.275 1
1 1045 . 8 1 1 A 96 96 LYS HA H 96 4.022 3.933 0.089 1
1 1054 . 8 1 1 A 96 96 LYS C C 96 177.330 179.033 -1.703 1
1 1055 . 8 1 1 A 96 96 LYS CA C 96 59.588 60.268 -0.680 1
1 1056 . 8 1 1 A 96 96 LYS CB C 96 32.588 31.904 0.684 1
1 1060 . 8 1 1 A 96 96 LYS N N 96 118.801 121.472 -2.671 1
1 1061 . 8 1 1 A 97 97 GLU H H 97 8.092 7.789 0.303 1
1 1062 . 8 1 1 A 97 97 GLU HA H 97 4.282 4.191 0.091 1
1 1067 . 8 1 1 A 97 97 GLU C C 97 176.290 176.095 0.195 1
1 1068 . 8 1 1 A 97 97 GLU CA C 97 57.365 58.793 -1.428 1
1 1069 . 8 1 1 A 97 97 GLU CB C 97 31.559 30.875 0.684 1
1 1071 . 8 1 1 A 97 97 GLU N N 97 113.992 118.755 -4.763 1
1 1072 . 8 1 1 A 98 98 ARG H H 98 7.482 7.108 0.374 1
1 1073 . 8 1 1 A 98 98 ARG HA H 98 4.397 4.533 -0.136 1
1 1080 . 8 1 1 A 98 98 ARG C C 98 172.792 173.074 -0.282 1
1 1081 . 8 1 1 A 98 98 ARG CA C 98 55.689 54.687 1.002 1
1 1082 . 8 1 1 A 98 98 ARG CB C 98 32.711 31.380 1.331 1
1 1085 . 8 1 1 A 98 98 ARG N N 98 116.022 114.553 1.469 1
1 1086 . 8 1 1 A 99 99 LEU H H 99 8.423 8.306 0.117 1
1 1087 . 8 1 1 A 99 99 LEU HA H 99 4.807 4.776 0.031 1
1 1097 . 8 1 1 A 99 99 LEU C C 99 175.903 174.130 1.773 1
1 1098 . 8 1 1 A 99 99 LEU CA C 99 54.383 53.509 0.874 1
1 1099 . 8 1 1 A 99 99 LEU CB C 99 43.362 43.460 -0.098 1
1 1103 . 8 1 1 A 99 99 LEU N N 99 124.983 121.271 3.712 1
1 1104 . 8 1 1 A 100 100 TYR H H 100 9.144 9.330 -0.186 1
1 1105 . 8 1 1 A 100 100 TYR HA H 100 4.542 5.109 -0.567 1
1 1112 . 8 1 1 A 100 100 TYR C C 100 173.479 174.574 -1.095 1
1 1113 . 8 1 1 A 100 100 TYR CA C 100 57.735 56.520 1.215 1
1 1114 . 8 1 1 A 100 100 TYR CB C 100 39.291 41.377 -2.086 1
1 1119 . 8 1 1 A 100 100 TYR N N 100 126.679 127.293 -0.614 1
1 1120 . 8 1 1 A 101 101 LEU H H 101 9.043 8.776 0.267 1
1 1121 . 8 1 1 A 101 101 LEU HA H 101 4.747 4.919 -0.172 1
1 1131 . 8 1 1 A 101 101 LEU C C 101 173.530 175.185 -1.655 1
1 1132 . 8 1 1 A 101 101 LEU CA C 101 54.524 53.663 0.861 1
1 1133 . 8 1 1 A 101 101 LEU CB C 101 42.499 43.797 -1.298 1
1 1137 . 8 1 1 A 101 101 LEU N N 101 127.422 124.814 2.608 1
1 1138 . 8 1 1 A 102 102 LEU H H 102 8.493 8.556 -0.063 1
1 1139 . 8 1 1 A 102 102 LEU HA H 102 5.612 5.367 0.245 1
1 1149 . 8 1 1 A 102 102 LEU C C 102 175.794 176.091 -0.297 1
1 1150 . 8 1 1 A 102 102 LEU CA C 102 53.076 53.314 -0.238 1
1 1151 . 8 1 1 A 102 102 LEU CB C 102 45.994 43.902 2.092 1
1 1155 . 8 1 1 A 102 102 LEU N N 102 126.021 128.747 -2.726 1
1 1156 . 8 1 1 A 103 103 ALA H H 103 9.073 9.191 -0.118 1
1 1157 . 8 1 1 A 103 103 ALA HA H 103 5.081 5.382 -0.301 1
1 1161 . 8 1 1 A 103 103 ALA C C 103 175.133 175.851 -0.718 1
1 1162 . 8 1 1 A 103 103 ALA CA C 103 51.688 49.831 1.857 1
1 1163 . 8 1 1 A 103 103 ALA CB C 103 21.689 22.499 -0.810 1
1 1164 . 8 1 1 A 103 103 ALA N N 103 117.679 122.908 -5.229 1
1 1165 . 8 1 1 A 104 104 ALA H H 104 8.582 8.399 0.183 1
1 1166 . 8 1 1 A 104 104 ALA HA H 104 5.220 4.806 0.414 1
1 1170 . 8 1 1 A 104 104 ALA C C 104 173.471 174.275 -0.804 1
1 1171 . 8 1 1 A 104 104 ALA CA C 104 47.959 49.700 -1.741 1
1 1172 . 8 1 1 A 104 104 ALA CB C 104 21.359 22.616 -1.257 1
1 1173 . 8 1 1 A 104 104 ALA N N 104 123.419 121.744 1.675 1
1 1174 . 8 1 1 A 105 105 PRO HA H 105 4.542 4.785 -0.243 1
1 1181 . 8 1 1 A 105 105 PRO C C 105 178.409 177.941 0.468 1
1 1182 . 8 1 1 A 105 105 PRO CA C 105 64.301 62.797 1.504 1
1 1183 . 8 1 1 A 105 105 PRO CB C 105 32.094 31.657 0.437 1
1 1186 . 8 1 1 A 106 106 ALA H H 106 8.302 8.679 -0.377 1
1 1187 . 8 1 1 A 106 106 ALA HA H 106 4.022 4.029 -0.007 1
1 1191 . 8 1 1 A 106 106 ALA C C 106 179.641 179.700 -0.059 1
1 1192 . 8 1 1 A 106 106 ALA CA C 106 56.341 55.166 1.175 1
1 1193 . 8 1 1 A 106 106 ALA CB C 106 18.523 18.140 0.383 1
1 1194 . 8 1 1 A 106 106 ALA N N 106 127.733 127.893 -0.160 1
1 1195 . 8 1 1 A 107 107 ALA H H 107 9.035 8.050 0.985 1
1 1196 . 8 1 1 A 107 107 ALA HA H 107 4.331 4.035 0.296 1
1 1200 . 8 1 1 A 107 107 ALA C C 107 178.586 179.742 -1.156 1
1 1201 . 8 1 1 A 107 107 ALA CA C 107 53.765 55.243 -1.478 1
1 1202 . 8 1 1 A 107 107 ALA CB C 107 18.728 18.187 0.541 1
1 1203 . 8 1 1 A 107 107 ALA N N 107 118.203 119.852 -1.649 1
1 1204 . 8 1 1 A 108 108 GLU H H 108 8.399 7.930 0.469 1
1 1205 . 8 1 1 A 108 108 GLU HA H 108 4.631 4.156 0.475 1
1 1210 . 8 1 1 A 108 108 GLU C C 108 177.127 178.764 -1.637 1
1 1211 . 8 1 1 A 108 108 GLU CA C 108 55.847 58.551 -2.704 1
1 1212 . 8 1 1 A 108 108 GLU CB C 108 32.135 30.130 2.005 1
1 1214 . 8 1 1 A 108 108 GLU N N 108 114.661 118.054 -3.393 1
1 1215 . 8 1 1 A 109 109 ARG H H 109 7.412 8.727 -1.315 1
1 1216 . 8 1 1 A 109 109 ARG HA H 109 3.682 4.173 -0.491 1
1 1223 . 8 1 1 A 109 109 ARG C C 109 176.917 179.079 -2.162 1
1 1224 . 8 1 1 A 109 109 ARG CA C 109 61.600 59.891 1.709 1
1 1225 . 8 1 1 A 109 109 ARG CB C 109 28.845 30.071 -1.226 1
1 1228 . 8 1 1 A 109 109 ARG N N 109 120.954 121.057 -0.103 1
1 1229 . 8 1 1 A 110 110 GLY H H 110 8.833 8.519 0.314 1
1 1230 . 8 1 1 A 110 110 GLY HA2 H 110 3.872 3.799 0.073 1
1 1231 . 8 1 1 A 110 110 GLY HA3 H 110 3.685 3.816 -0.131 1
1 1232 . 8 1 1 A 110 110 GLY C C 110 175.997 175.967 0.030 1
1 1233 . 8 1 1 A 110 110 GLY CA C 110 47.323 47.498 -0.175 1
1 1234 . 8 1 1 A 110 110 GLY N N 110 106.563 107.193 -0.630 1
1 1235 . 8 1 1 A 111 111 ASP H H 111 7.882 8.241 -0.359 1
1 1236 . 8 1 1 A 111 111 ASP HA H 111 4.312 4.372 -0.060 1
1 1239 . 8 1 1 A 111 111 ASP C C 111 179.467 178.751 0.716 1
1 1240 . 8 1 1 A 111 111 ASP CA C 111 56.976 56.735 0.241 1
1 1241 . 8 1 1 A 111 111 ASP CB C 111 40.648 40.894 -0.246 1
1 1242 . 8 1 1 A 111 111 ASP N N 111 121.402 121.482 -0.080 1
1 1243 . 8 1 1 A 112 112 TRP H H 112 7.804 8.449 -0.645 1
1 1244 . 8 1 1 A 112 112 TRP HA H 112 3.831 4.202 -0.371 1
1 1253 . 8 1 1 A 112 112 TRP C C 112 177.547 178.653 -1.106 1
1 1254 . 8 1 1 A 112 112 TRP CA C 112 62.006 59.936 2.070 1
1 1255 . 8 1 1 A 112 112 TRP CB C 112 29.421 29.337 0.084 1
1 1261 . 8 1 1 A 112 112 TRP N N 112 119.904 119.853 0.051 1
1 1263 . 8 1 1 A 113 113 VAL H H 113 7.982 7.846 0.136 1
1 1264 . 8 1 1 A 113 113 VAL HA H 113 3.072 3.651 -0.579 1
1 1272 . 8 1 1 A 113 113 VAL C C 113 178.015 178.219 -0.204 1
1 1273 . 8 1 1 A 113 113 VAL CA C 113 67.407 66.768 0.639 1
1 1274 . 8 1 1 A 113 113 VAL CB C 113 31.724 31.611 0.113 1
1 1277 . 8 1 1 A 113 113 VAL N N 113 117.575 119.047 -1.472 1
1 1278 . 8 1 1 A 114 114 GLN H H 114 8.268 8.054 0.214 1
1 1279 . 8 1 1 A 114 114 GLN HA H 114 3.994 3.945 0.049 1
1 1286 . 8 1 1 A 114 114 GLN C C 114 178.021 178.029 -0.008 1
1 1287 . 8 1 1 A 114 114 GLN CA C 114 59.112 58.899 0.213 1
1 1288 . 8 1 1 A 114 114 GLN CB C 114 28.685 28.547 0.138 1
1 1290 . 8 1 1 A 114 114 GLN N N 114 117.479 119.960 -2.481 1
1 1292 . 8 1 1 A 115 115 ALA H H 115 7.915 7.867 0.048 1
1 1293 . 8 1 1 A 115 115 ALA HA H 115 3.972 4.072 -0.100 1
1 1297 . 8 1 1 A 115 115 ALA C C 115 180.030 179.748 0.282 1
1 1298 . 8 1 1 A 115 115 ALA CA C 115 55.142 55.099 0.043 1
1 1299 . 8 1 1 A 115 115 ALA CB C 115 18.152 18.566 -0.414 1
1 1300 . 8 1 1 A 115 115 ALA N N 115 120.858 120.749 0.109 1
1 1301 . 8 1 1 A 116 116 ILE H H 116 8.172 8.488 -0.316 1
1 1302 . 8 1 1 A 116 116 ILE HA H 116 3.482 3.852 -0.370 1
1 1312 . 8 1 1 A 116 116 ILE C C 116 177.739 177.709 0.030 1
1 1313 . 8 1 1 A 116 116 ILE CA C 116 66.119 65.013 1.106 1
1 1314 . 8 1 1 A 116 116 ILE CB C 116 38.222 37.642 0.580 1
1 1318 . 8 1 1 A 116 116 ILE N N 116 115.977 117.374 -1.397 1
1 1319 . 8 1 1 A 117 117 CYS H H 117 8.449 8.468 -0.019 1
1 1320 . 8 1 1 A 117 117 CYS HA H 117 4.032 4.606 -0.574 1
1 1323 . 8 1 1 A 117 117 CYS C C 117 177.321 177.330 -0.009 1
1 1324 . 8 1 1 A 117 117 CYS CA C 117 64.777 61.710 3.067 1
1 1325 . 8 1 1 A 117 117 CYS CB C 117 26.871 27.058 -0.187 1
1 1326 . 8 1 1 A 117 117 CYS N N 117 117.253 120.174 -2.921 1
1 1327 . 8 1 1 A 118 118 LEU H H 118 8.182 8.012 0.170 1
1 1328 . 8 1 1 A 118 118 LEU HA H 118 4.052 4.120 -0.068 1
1 1338 . 8 1 1 A 118 118 LEU C C 118 179.217 179.014 0.203 1
1 1339 . 8 1 1 A 118 118 LEU CA C 118 57.877 57.423 0.454 1
1 1340 . 8 1 1 A 118 118 LEU CB C 118 42.088 41.806 0.282 1
1 1344 . 8 1 1 A 118 118 LEU N N 118 119.665 121.292 -1.627 1
1 1345 . 8 1 1 A 119 119 LEU H H 119 7.142 7.903 -0.761 1
1 1346 . 8 1 1 A 119 119 LEU HA H 119 4.192 4.232 -0.040 1
1 1356 . 8 1 1 A 119 119 LEU C C 119 178.492 178.913 -0.421 1
1 1357 . 8 1 1 A 119 119 LEU CA C 119 56.259 57.458 -1.199 1
1 1358 . 8 1 1 A 119 119 LEU CB C 119 43.568 42.530 1.038 1
1 1362 . 8 1 1 A 119 119 LEU N N 119 116.244 119.346 -3.102 1
1 1363 . 8 1 1 A 120 120 ALA H H 120 8.513 8.159 0.354 1
1 1364 . 8 1 1 A 120 120 ALA HA H 120 3.878 4.095 -0.217 1
1 1368 . 8 1 1 A 120 120 ALA C C 120 178.358 177.886 0.472 1
1 1369 . 8 1 1 A 120 120 ALA CA C 120 53.765 54.623 -0.858 1
1 1370 . 8 1 1 A 120 120 ALA CB C 120 18.687 18.576 0.111 1
1 1371 . 8 1 1 A 120 120 ALA N N 120 120.009 120.969 -0.960 1
1 1372 . 8 1 1 A 121 121 PHE H H 121 7.822 8.221 -0.399 1
1 1373 . 8 1 1 A 121 121 PHE HA H 121 5.156 4.898 0.258 1
1 1381 . 8 1 1 A 121 121 PHE C C 121 176.273 175.735 0.538 1
1 1382 . 8 1 1 A 121 121 PHE CA C 121 55.741 57.147 -1.406 1
1 1383 . 8 1 1 A 121 121 PHE CB C 121 39.455 38.498 0.957 1
1 1389 . 8 1 1 A 121 121 PHE N N 121 113.981 116.398 -2.417 1
1 1390 . 8 1 1 A 122 122 SER H H 122 7.765 8.114 -0.349 1
1 1391 . 8 1 1 A 122 122 SER HA H 122 4.579 4.745 -0.166 1
1 1394 . 8 1 1 A 122 122 SER C C 122 174.595 174.147 0.448 1
1 1395 . 8 1 1 A 122 122 SER CA C 122 58.777 57.296 1.481 1
1 1396 . 8 1 1 A 122 122 SER CB C 122 63.719 63.483 0.236 1
1 1397 . 8 1 1 A 122 122 SER N N 122 115.069 116.560 -1.491 1
1 1398 . 8 1 1 A 123 123 GLY H H 123 8.223 7.632 0.591 1
1 1399 . 8 1 1 A 123 123 GLY HA2 H 123 4.174 4.317 -0.143 1
1 1400 . 8 1 1 A 123 123 GLY HA3 H 123 4.100 4.326 -0.226 1
1 1401 . 8 1 1 A 123 123 GLY C C 123 171.678 172.112 -0.434 1
1 1402 . 8 1 1 A 123 123 GLY CA C 123 44.815 45.522 -0.707 1
1 1403 . 8 1 1 A 123 123 GLY N N 123 110.151 109.718 0.433 1
1 1404 . 8 1 1 A 124 124 PRO HA H 124 4.482 4.608 -0.126 1
1 1411 . 8 1 1 A 124 124 PRO C C 124 177.314 176.885 0.429 1
1 1412 . 8 1 1 A 124 124 PRO CA C 124 63.206 62.462 0.744 1
1 1413 . 8 1 1 A 124 124 PRO CB C 124 32.176 30.912 1.264 1
1 1416 . 8 1 1 A 125 125 SER H H 125 8.485 7.899 0.586 1
1 1417 . 8 1 1 A 125 125 SER HA H 125 4.472 4.314 0.158 1
1 1420 . 8 1 1 A 125 125 SER C C 125 174.728 174.615 0.113 1
1 1421 . 8 1 1 A 125 125 SER CA C 125 58.353 60.740 -2.387 1
1 1422 . 8 1 1 A 125 125 SER CB C 125 64.048 63.753 0.295 1
1 1423 . 8 1 1 A 125 125 SER N N 125 116.081 120.163 -4.082 1
1 1424 . 8 1 1 A 126 126 SER H H 126 8.332 8.687 -0.355 1
1 1425 . 8 1 1 A 126 126 SER HA H 126 4.464 4.643 -0.179 1
1 1428 . 8 1 1 A 126 126 SER C C 126 173.980 176.033 -2.053 1
1 1429 . 8 1 1 A 126 126 SER CA C 126 58.336 57.630 0.706 1
1 1430 . 8 1 1 A 126 126 SER CB C 126 63.925 64.394 -0.469 1
1 1431 . 8 1 1 A 126 126 SER N N 126 118.037 120.209 -2.172 1
1 1 . 9 1 1 A 6 6 SER HA H 6 4.458 4.559 -0.101 1
1 3 . 9 1 1 A 6 6 SER C C 6 175.108 174.597 0.511 1
1 4 . 9 1 1 A 6 6 SER CA C 6 58.689 59.032 -0.343 1
1 5 . 9 1 1 A 6 6 SER CB C 6 63.678 63.958 -0.280 1
1 6 . 9 1 1 A 7 7 GLY H H 7 8.449 8.854 -0.405 1
1 7 . 9 1 1 A 7 7 GLY HA2 H 7 3.965 4.228 -0.263 1
1 8 . 9 1 1 A 7 7 GLY HA3 H 7 3.965 4.235 -0.270 1
1 9 . 9 1 1 A 7 7 GLY C C 7 174.380 174.451 -0.071 1
1 10 . 9 1 1 A 7 7 GLY CA C 7 45.435 45.333 0.102 1
1 11 . 9 1 1 A 7 7 GLY N N 7 110.792 110.094 0.698 1
1 12 . 9 1 1 A 8 8 MET H H 8 8.259 8.269 -0.010 1
1 13 . 9 1 1 A 8 8 MET HA H 8 4.487 4.222 0.265 1
1 21 . 9 1 1 A 8 8 MET C C 8 176.961 176.926 0.035 1
1 22 . 9 1 1 A 8 8 MET CA C 8 55.565 57.491 -1.926 1
1 23 . 9 1 1 A 8 8 MET CB C 8 32.835 32.542 0.293 1
1 26 . 9 1 1 A 8 8 MET N N 8 119.639 121.341 -1.702 1
1 27 . 9 1 1 A 9 9 GLY H H 9 8.472 8.535 -0.063 1
1 28 . 9 1 1 A 9 9 GLY HA2 H 9 3.946 4.113 -0.167 1
1 29 . 9 1 1 A 9 9 GLY HA3 H 9 3.946 4.116 -0.170 1
1 30 . 9 1 1 A 9 9 GLY C C 9 174.005 172.493 1.512 1
1 31 . 9 1 1 A 9 9 GLY CA C 9 45.488 44.675 0.813 1
1 32 . 9 1 1 A 9 9 GLY N N 9 110.107 110.191 -0.084 1
1 33 . 9 1 1 A 10 10 ASP H H 10 8.292 8.512 -0.220 1
1 34 . 9 1 1 A 10 10 ASP HA H 10 4.636 5.208 -0.572 1
1 37 . 9 1 1 A 10 10 ASP C C 10 176.768 175.805 0.963 1
1 38 . 9 1 1 A 10 10 ASP CA C 10 54.206 53.162 1.044 1
1 39 . 9 1 1 A 10 10 ASP CB C 10 41.306 41.721 -0.415 1
1 40 . 9 1 1 A 10 10 ASP N N 10 120.370 119.993 0.377 1
1 41 . 9 1 1 A 11 11 GLY H H 11 8.452 8.506 -0.054 1
1 42 . 9 1 1 A 11 11 GLY HA2 H 11 3.980 4.078 -0.098 1
1 43 . 9 1 1 A 11 11 GLY HA3 H 11 4.022 4.160 -0.138 1
1 44 . 9 1 1 A 11 11 GLY C C 11 174.102 174.588 -0.486 1
1 45 . 9 1 1 A 11 11 GLY CA C 11 45.170 46.440 -1.270 1
1 46 . 9 1 1 A 11 11 GLY N N 11 108.391 112.563 -4.172 1
1 47 . 9 1 1 A 12 12 ALA H H 12 8.293 7.919 0.374 1
1 48 . 9 1 1 A 12 12 ALA HA H 12 3.777 4.211 -0.434 1
1 52 . 9 1 1 A 12 12 ALA C C 12 178.193 177.692 0.501 1
1 53 . 9 1 1 A 12 12 ALA CA C 12 52.759 51.937 0.822 1
1 54 . 9 1 1 A 12 12 ALA CB C 12 17.855 18.329 -0.474 1
1 55 . 9 1 1 A 12 12 ALA N N 12 124.185 122.791 1.394 1
1 56 . 9 1 1 A 13 13 VAL H H 13 8.822 8.455 0.367 1
1 57 . 9 1 1 A 13 13 VAL HA H 13 3.912 3.787 0.125 1
1 65 . 9 1 1 A 13 13 VAL C C 13 176.073 175.867 0.206 1
1 66 . 9 1 1 A 13 13 VAL CA C 13 63.100 65.960 -2.860 1
1 67 . 9 1 1 A 13 13 VAL CB C 13 32.711 31.808 0.903 1
1 70 . 9 1 1 A 13 13 VAL N N 13 120.877 125.274 -4.397 1
1 71 . 9 1 1 A 14 14 LYS H H 14 7.093 7.161 -0.068 1
1 72 . 9 1 1 A 14 14 LYS HA H 14 4.169 4.810 -0.641 1
1 81 . 9 1 1 A 14 14 LYS C C 14 173.291 174.851 -1.560 1
1 82 . 9 1 1 A 14 14 LYS CA C 14 56.465 54.575 1.890 1
1 83 . 9 1 1 A 14 14 LYS CB C 14 35.960 34.988 0.972 1
1 87 . 9 1 1 A 14 14 LYS N N 14 118.693 120.107 -1.414 1
1 88 . 9 1 1 A 15 15 GLN H H 15 8.522 8.422 0.100 1
1 89 . 9 1 1 A 15 15 GLN HA H 15 5.542 5.172 0.370 1
1 96 . 9 1 1 A 15 15 GLN C C 15 174.992 175.858 -0.866 1
1 97 . 9 1 1 A 15 15 GLN CA C 15 54.312 53.997 0.315 1
1 98 . 9 1 1 A 15 15 GLN CB C 15 33.585 31.222 2.363 1
1 100 . 9 1 1 A 15 15 GLN N N 15 124.024 125.364 -1.340 1
1 102 . 9 1 1 A 16 16 GLY H H 16 8.740 8.240 0.500 1
1 103 . 9 1 1 A 16 16 GLY HA2 H 16 4.511 4.047 0.464 1
1 104 . 9 1 1 A 16 16 GLY HA3 H 16 4.064 4.445 -0.381 1
1 105 . 9 1 1 A 16 16 GLY C C 16 171.431 171.452 -0.021 1
1 106 . 9 1 1 A 16 16 GLY CA C 16 46.106 45.637 0.469 1
1 107 . 9 1 1 A 16 16 GLY N N 16 109.611 109.304 0.307 1
1 108 . 9 1 1 A 17 17 PHE H H 17 8.886 8.476 0.410 1
1 109 . 9 1 1 A 17 17 PHE HA H 17 5.466 5.157 0.309 1
1 114 . 9 1 1 A 17 17 PHE C C 17 174.795 175.120 -0.325 1
1 115 . 9 1 1 A 17 17 PHE CA C 17 57.788 55.999 1.789 1
1 116 . 9 1 1 A 17 17 PHE CB C 17 41.315 41.153 0.162 1
1 119 . 9 1 1 A 17 17 PHE N N 17 122.684 119.204 3.480 1
1 120 . 9 1 1 A 18 18 LEU H H 18 8.762 8.555 0.207 1
1 121 . 9 1 1 A 18 18 LEU HA H 18 4.946 4.748 0.198 1
1 131 . 9 1 1 A 18 18 LEU C C 18 175.461 175.147 0.314 1
1 132 . 9 1 1 A 18 18 LEU CA C 18 52.970 53.365 -0.395 1
1 133 . 9 1 1 A 18 18 LEU CB C 18 47.945 44.654 3.291 1
1 137 . 9 1 1 A 18 18 LEU N N 18 119.045 123.553 -4.508 1
1 138 . 9 1 1 A 19 19 TYR H H 19 9.272 8.247 1.025 1
1 139 . 9 1 1 A 19 19 TYR HA H 19 5.682 5.676 0.006 1
1 146 . 9 1 1 A 19 19 TYR C C 19 174.829 174.764 0.065 1
1 147 . 9 1 1 A 19 19 TYR CA C 19 56.482 56.608 -0.126 1
1 148 . 9 1 1 A 19 19 TYR CB C 19 41.717 40.519 1.198 1
1 153 . 9 1 1 A 19 19 TYR N N 19 118.024 122.931 -4.907 1
1 154 . 9 1 1 A 20 20 LEU H H 20 9.441 9.454 -0.013 1
1 155 . 9 1 1 A 20 20 LEU HA H 20 5.283 5.277 0.006 1
1 165 . 9 1 1 A 20 20 LEU C C 20 175.935 176.139 -0.204 1
1 166 . 9 1 1 A 20 20 LEU CA C 20 53.464 53.712 -0.248 1
1 167 . 9 1 1 A 20 20 LEU CB C 20 46.570 45.312 1.258 1
1 171 . 9 1 1 A 20 20 LEU N N 20 122.838 125.687 -2.849 1
1 172 . 9 1 1 A 21 21 GLN H H 21 8.391 8.776 -0.385 1
1 173 . 9 1 1 A 21 21 GLN HA H 21 3.791 3.834 -0.043 1
1 180 . 9 1 1 A 21 21 GLN C C 21 175.157 174.967 0.190 1
1 181 . 9 1 1 A 21 21 GLN CA C 21 56.094 55.987 0.107 1
1 182 . 9 1 1 A 21 21 GLN CB C 21 28.434 28.367 0.067 1
1 184 . 9 1 1 A 21 21 GLN N N 21 129.943 127.946 1.997 1
1 186 . 9 1 1 A 22 22 GLN H H 22 8.829 8.280 0.549 1
1 187 . 9 1 1 A 22 22 GLN HA H 22 4.553 4.750 -0.197 1
1 194 . 9 1 1 A 22 22 GLN C C 22 174.998 175.126 -0.128 1
1 195 . 9 1 1 A 22 22 GLN CA C 22 54.912 54.320 0.592 1
1 196 . 9 1 1 A 22 22 GLN CB C 22 31.930 31.263 0.667 1
1 198 . 9 1 1 A 22 22 GLN N N 22 127.199 125.779 1.420 1
1 200 . 9 1 1 A 23 23 GLN HA H 23 4.142 4.256 -0.114 1
1 207 . 9 1 1 A 23 23 GLN CA C 23 56.427 54.622 1.805 1
1 208 . 9 1 1 A 23 23 GLN CB C 23 29.227 27.128 2.099 1
1 211 . 9 1 1 A 24 24 GLN HA H 24 4.523 4.319 0.204 1
1 218 . 9 1 1 A 24 24 GLN CB C 24 29.759 29.674 0.085 1
1 221 . 9 1 1 A 25 25 THR HA H 25 3.870 4.051 -0.181 1
1 226 . 9 1 1 A 25 25 THR CA C 25 65.096 63.354 1.742 1
1 227 . 9 1 1 A 25 25 THR CB C 25 68.924 69.206 -0.282 1
1 229 . 9 1 1 A 26 26 PHE HA H 26 4.690 4.175 0.515 1
1 236 . 9 1 1 A 26 26 PHE C C 26 175.523 174.868 0.655 1
1 237 . 9 1 1 A 26 26 PHE CA C 26 57.312 58.739 -1.427 1
1 238 . 9 1 1 A 26 26 PHE CB C 26 39.003 36.696 2.307 1
1 243 . 9 1 1 A 27 27 GLY H H 27 7.755 7.442 0.313 1
1 244 . 9 1 1 A 27 27 GLY HA2 H 27 4.172 3.777 0.395 1
1 245 . 9 1 1 A 27 27 GLY HA3 H 27 3.783 3.975 -0.192 1
1 246 . 9 1 1 A 27 27 GLY C C 27 172.557 171.140 1.417 1
1 247 . 9 1 1 A 27 27 GLY CA C 27 44.924 45.393 -0.469 1
1 248 . 9 1 1 A 27 27 GLY N N 27 109.216 107.270 1.946 1
1 249 . 9 1 1 A 28 28 LYS H H 28 8.241 8.280 -0.039 1
1 250 . 9 1 1 A 28 28 LYS HA H 28 4.530 4.944 -0.414 1
1 259 . 9 1 1 A 28 28 LYS C C 28 176.204 174.640 1.564 1
1 260 . 9 1 1 A 28 28 LYS CA C 28 55.741 54.611 1.130 1
1 261 . 9 1 1 A 28 28 LYS CB C 28 33.904 36.078 -2.174 1
1 265 . 9 1 1 A 28 28 LYS N N 28 118.743 119.022 -0.279 1
1 266 . 9 1 1 A 29 29 LYS H H 29 8.356 8.597 -0.241 1
1 267 . 9 1 1 A 29 29 LYS HA H 29 4.559 4.794 -0.235 1
1 274 . 9 1 1 A 29 29 LYS C C 29 175.420 174.779 0.641 1
1 275 . 9 1 1 A 29 29 LYS CA C 29 55.406 55.109 0.297 1
1 276 . 9 1 1 A 29 29 LYS CB C 29 35.618 36.669 -1.051 1
1 280 . 9 1 1 A 29 29 LYS N N 29 121.198 122.480 -1.282 1
1 281 . 9 1 1 A 30 30 TRP H H 30 8.891 8.644 0.247 1
1 282 . 9 1 1 A 30 30 TRP HA H 30 4.951 4.959 -0.008 1
1 291 . 9 1 1 A 30 30 TRP C C 30 175.902 176.244 -0.342 1
1 292 . 9 1 1 A 30 30 TRP CA C 30 56.677 57.304 -0.627 1
1 293 . 9 1 1 A 30 30 TRP CB C 30 30.614 31.183 -0.569 1
1 299 . 9 1 1 A 30 30 TRP N N 30 123.304 122.973 0.331 1
1 301 . 9 1 1 A 31 31 ARG H H 31 8.712 9.314 -0.602 1
1 302 . 9 1 1 A 31 31 ARG HA H 31 4.820 4.892 -0.072 1
1 309 . 9 1 1 A 31 31 ARG C C 31 174.026 174.543 -0.517 1
1 310 . 9 1 1 A 31 31 ARG CA C 31 54.895 54.174 0.721 1
1 311 . 9 1 1 A 31 31 ARG CB C 31 34.045 33.581 0.464 1
1 314 . 9 1 1 A 31 31 ARG N N 31 123.973 120.682 3.291 1
1 315 . 9 1 1 A 32 32 ARG H H 32 8.820 8.547 0.273 1
1 316 . 9 1 1 A 32 32 ARG HA H 32 3.965 4.773 -0.808 1
1 323 . 9 1 1 A 32 32 ARG C C 32 174.785 174.650 0.135 1
1 324 . 9 1 1 A 32 32 ARG CA C 32 56.924 56.121 0.803 1
1 325 . 9 1 1 A 32 32 ARG CB C 32 31.806 30.617 1.189 1
1 328 . 9 1 1 A 32 32 ARG N N 32 127.041 125.131 1.910 1
1 329 . 9 1 1 A 33 33 PHE H H 33 9.372 9.345 0.027 1
1 330 . 9 1 1 A 33 33 PHE HA H 33 4.863 5.122 -0.259 1
1 338 . 9 1 1 A 33 33 PHE C C 33 176.359 175.512 0.847 1
1 339 . 9 1 1 A 33 33 PHE CA C 33 57.224 55.923 1.301 1
1 340 . 9 1 1 A 33 33 PHE CB C 33 43.385 40.402 2.983 1
1 346 . 9 1 1 A 33 33 PHE N N 33 125.882 126.309 -0.427 1
1 347 . 9 1 1 A 34 34 GLY H H 34 9.160 8.715 0.445 1
1 348 . 9 1 1 A 34 34 GLY HA2 H 34 4.182 4.093 0.089 1
1 349 . 9 1 1 A 34 34 GLY HA3 H 34 3.714 4.256 -0.542 1
1 350 . 9 1 1 A 34 34 GLY C C 34 172.920 173.271 -0.351 1
1 351 . 9 1 1 A 34 34 GLY CA C 34 46.247 46.034 0.213 1
1 352 . 9 1 1 A 34 34 GLY N N 34 108.654 111.282 -2.628 1
1 353 . 9 1 1 A 35 35 ALA H H 35 8.982 8.461 0.521 1
1 354 . 9 1 1 A 35 35 ALA HA H 35 5.660 5.563 0.097 1
1 358 . 9 1 1 A 35 35 ALA C C 35 176.547 175.824 0.723 1
1 359 . 9 1 1 A 35 35 ALA CA C 35 50.500 50.252 0.248 1
1 360 . 9 1 1 A 35 35 ALA CB C 35 24.034 21.814 2.220 1
1 361 . 9 1 1 A 35 35 ALA N N 35 130.076 127.609 2.467 1
1 362 . 9 1 1 A 36 36 SER H H 36 8.852 8.372 0.480 1
1 363 . 9 1 1 A 36 36 SER HA H 36 5.203 5.032 0.171 1
1 366 . 9 1 1 A 36 36 SER C C 36 170.939 172.452 -1.513 1
1 367 . 9 1 1 A 36 36 SER CA C 36 57.806 57.498 0.308 1
1 368 . 9 1 1 A 36 36 SER CB C 36 66.986 65.697 1.289 1
1 369 . 9 1 1 A 36 36 SER N N 36 116.620 117.143 -0.523 1
1 370 . 9 1 1 A 37 37 LEU H H 37 8.862 8.820 0.042 1
1 371 . 9 1 1 A 37 37 LEU HA H 37 5.163 4.874 0.289 1
1 381 . 9 1 1 A 37 37 LEU C C 37 173.525 173.997 -0.472 1
1 382 . 9 1 1 A 37 37 LEU CA C 37 53.112 53.558 -0.446 1
1 383 . 9 1 1 A 37 37 LEU CB C 37 46.077 44.050 2.027 1
1 387 . 9 1 1 A 37 37 LEU N N 37 127.638 129.258 -1.620 1
1 388 . 9 1 1 A 38 38 TYR H H 38 9.280 8.534 0.746 1
1 389 . 9 1 1 A 38 38 TYR HA H 38 4.820 5.234 -0.414 1
1 396 . 9 1 1 A 38 38 TYR C C 38 175.430 175.548 -0.118 1
1 397 . 9 1 1 A 38 38 TYR CA C 38 57.436 56.271 1.165 1
1 398 . 9 1 1 A 38 38 TYR CB C 38 42.128 41.499 0.629 1
1 403 . 9 1 1 A 38 38 TYR N N 38 125.215 126.182 -0.967 1
1 404 . 9 1 1 A 39 39 GLY H H 39 8.532 8.481 0.051 1
1 405 . 9 1 1 A 39 39 GLY HA2 H 39 4.220 4.160 0.060 1
1 406 . 9 1 1 A 39 39 GLY HA3 H 39 3.941 4.162 -0.221 1
1 407 . 9 1 1 A 39 39 GLY C C 39 172.950 173.641 -0.691 1
1 408 . 9 1 1 A 39 39 GLY CA C 39 44.817 44.853 -0.036 1
1 409 . 9 1 1 A 39 39 GLY N N 39 106.424 110.121 -3.697 1
1 410 . 9 1 1 A 40 40 GLY H H 40 8.477 8.459 0.018 1
1 411 . 9 1 1 A 40 40 GLY HA2 H 40 4.102 4.088 0.014 1
1 412 . 9 1 1 A 40 40 GLY HA3 H 40 3.927 4.090 -0.163 1
1 413 . 9 1 1 A 40 40 GLY C C 40 174.002 175.770 -1.768 1
1 414 . 9 1 1 A 40 40 GLY CA C 40 44.694 44.709 -0.015 1
1 415 . 9 1 1 A 40 40 GLY N N 40 106.881 108.984 -2.103 1
1 416 . 9 1 1 A 41 41 SER H H 41 8.600 8.702 -0.102 1
1 417 . 9 1 1 A 41 41 SER HA H 41 4.520 4.157 0.363 1
1 420 . 9 1 1 A 41 41 SER C C 41 174.355 175.118 -0.763 1
1 421 . 9 1 1 A 41 41 SER CA C 41 58.565 62.457 -3.892 1
1 422 . 9 1 1 A 41 41 SER CB C 41 64.413 62.856 1.557 1
1 423 . 9 1 1 A 41 41 SER N N 41 115.751 118.488 -2.737 1
1 424 . 9 1 1 A 42 42 ASP H H 42 8.533 8.069 0.464 1
1 425 . 9 1 1 A 42 42 ASP HA H 42 4.560 4.540 0.020 1
1 428 . 9 1 1 A 42 42 ASP CA C 42 55.230 55.221 0.009 1
1 429 . 9 1 1 A 42 42 ASP CB C 42 40.648 40.802 -0.154 1
1 430 . 9 1 1 A 42 42 ASP N N 42 119.037 119.568 -0.531 1
1 431 . 9 1 1 A 43 43 CYS H H 43 8.152 8.240 -0.088 1
1 432 . 9 1 1 A 43 43 CYS HA H 43 4.541 4.444 0.097 1
1 435 . 9 1 1 A 43 43 CYS C C 43 173.975 175.105 -1.130 1
1 436 . 9 1 1 A 43 43 CYS CA C 43 58.265 59.361 -1.096 1
1 437 . 9 1 1 A 43 43 CYS CB C 43 28.393 27.669 0.724 1
1 438 . 9 1 1 A 43 43 CYS N N 43 116.881 123.575 -6.694 1
1 439 . 9 1 1 A 44 44 ALA H H 44 8.047 8.640 -0.593 1
1 440 . 9 1 1 A 44 44 ALA HA H 44 4.395 4.780 -0.385 1
1 444 . 9 1 1 A 44 44 ALA C C 44 176.472 175.990 0.482 1
1 445 . 9 1 1 A 44 44 ALA CA C 44 52.688 51.204 1.484 1
1 446 . 9 1 1 A 44 44 ALA CB C 44 20.579 22.780 -2.201 1
1 447 . 9 1 1 A 44 44 ALA N N 44 125.989 127.392 -1.403 1
1 448 . 9 1 1 A 45 45 LEU H H 45 8.052 8.360 -0.308 1
1 449 . 9 1 1 A 45 45 LEU HA H 45 4.452 4.634 -0.182 1
1 459 . 9 1 1 A 45 45 LEU C C 45 176.196 176.055 0.141 1
1 460 . 9 1 1 A 45 45 LEU CA C 45 53.771 54.044 -0.273 1
1 461 . 9 1 1 A 45 45 LEU CB C 45 43.116 42.844 0.272 1
1 465 . 9 1 1 A 45 45 LEU N N 45 119.889 117.886 2.003 1
1 466 . 9 1 1 A 46 46 ALA H H 46 8.381 8.742 -0.361 1
1 467 . 9 1 1 A 46 46 ALA HA H 46 4.449 5.620 -1.171 1
1 471 . 9 1 1 A 46 46 ALA C C 46 179.093 176.132 2.961 1
1 472 . 9 1 1 A 46 46 ALA CA C 46 52.829 50.093 2.736 1
1 473 . 9 1 1 A 46 46 ALA CB C 46 18.687 22.480 -3.793 1
1 474 . 9 1 1 A 46 46 ALA N N 46 125.635 124.443 1.192 1
1 475 . 9 1 1 A 47 47 ARG H H 47 9.012 9.019 -0.007 1
1 476 . 9 1 1 A 47 47 ARG HA H 47 5.192 5.162 0.030 1
1 484 . 9 1 1 A 47 47 ARG C C 47 171.524 173.984 -2.460 1
1 485 . 9 1 1 A 47 47 ARG CA C 47 55.265 54.756 0.509 1
1 486 . 9 1 1 A 47 47 ARG CB C 47 30.970 34.280 -3.310 1
1 489 . 9 1 1 A 47 47 ARG N N 47 120.048 118.994 1.054 1
1 491 . 9 1 1 A 48 48 LEU H H 48 9.029 8.493 0.536 1
1 492 . 9 1 1 A 48 48 LEU HA H 48 5.221 5.141 0.080 1
1 502 . 9 1 1 A 48 48 LEU C C 48 174.348 175.189 -0.841 1
1 503 . 9 1 1 A 48 48 LEU CA C 48 53.253 53.912 -0.659 1
1 504 . 9 1 1 A 48 48 LEU CB C 48 45.419 44.322 1.097 1
1 508 . 9 1 1 A 48 48 LEU N N 48 123.315 124.098 -0.783 1
1 509 . 9 1 1 A 49 49 GLU H H 49 9.473 8.626 0.847 1
1 510 . 9 1 1 A 49 49 GLU HA H 49 5.222 4.996 0.226 1
1 515 . 9 1 1 A 49 49 GLU C C 49 175.507 175.637 -0.130 1
1 516 . 9 1 1 A 49 49 GLU CA C 49 55.159 55.513 -0.354 1
1 517 . 9 1 1 A 49 49 GLU CB C 49 32.341 32.034 0.307 1
1 519 . 9 1 1 A 49 49 GLU N N 49 124.751 126.848 -2.097 1
1 520 . 9 1 1 A 50 50 LEU H H 50 9.088 8.567 0.521 1
1 521 . 9 1 1 A 50 50 LEU HA H 50 5.382 5.520 -0.138 1
1 531 . 9 1 1 A 50 50 LEU C C 50 175.474 174.892 0.582 1
1 532 . 9 1 1 A 50 50 LEU CA C 50 52.865 53.642 -0.777 1
1 533 . 9 1 1 A 50 50 LEU CB C 50 43.239 45.903 -2.664 1
1 537 . 9 1 1 A 50 50 LEU N N 50 124.221 121.563 2.658 1
1 538 . 9 1 1 A 51 51 GLN H H 51 9.602 8.639 0.963 1
1 539 . 9 1 1 A 51 51 GLN HA H 51 5.095 5.022 0.073 1
1 546 . 9 1 1 A 51 51 GLN C C 51 175.306 176.285 -0.979 1
1 547 . 9 1 1 A 51 51 GLN CA C 51 54.576 54.174 0.402 1
1 548 . 9 1 1 A 51 51 GLN CB C 51 32.177 31.511 0.666 1
1 550 . 9 1 1 A 51 51 GLN N N 51 123.268 124.026 -0.758 1
1 552 . 9 1 1 A 52 52 GLU H H 52 9.172 9.106 0.066 1
1 553 . 9 1 1 A 52 52 GLU HA H 52 4.092 4.189 -0.097 1
1 558 . 9 1 1 A 52 52 GLU C C 52 176.523 176.747 -0.224 1
1 559 . 9 1 1 A 52 52 GLU CA C 52 57.500 60.124 -2.624 1
1 560 . 9 1 1 A 52 52 GLU CB C 52 30.696 30.157 0.539 1
1 562 . 9 1 1 A 52 52 GLU N N 52 128.982 126.213 2.769 1
1 563 . 9 1 1 A 53 53 GLY H H 53 8.644 7.446 1.198 1
1 564 . 9 1 1 A 53 53 GLY HA2 H 53 4.261 4.042 0.219 1
1 565 . 9 1 1 A 53 53 GLY HA3 H 53 3.993 4.067 -0.074 1
1 566 . 9 1 1 A 53 53 GLY C C 53 172.550 173.850 -1.300 1
1 567 . 9 1 1 A 53 53 GLY CA C 53 45.911 46.040 -0.129 1
1 568 . 9 1 1 A 53 53 GLY N N 53 110.844 106.309 4.535 1
1 569 . 9 1 1 A 54 54 PRO HA H 54 4.392 4.395 -0.003 1
1 576 . 9 1 1 A 54 54 PRO C C 54 176.828 177.595 -0.767 1
1 577 . 9 1 1 A 54 54 PRO CA C 54 63.665 63.697 -0.032 1
1 578 . 9 1 1 A 54 54 PRO CB C 54 32.012 31.765 0.247 1
1 581 . 9 1 1 A 55 55 GLU H H 55 8.934 8.124 0.810 1
1 582 . 9 1 1 A 55 55 GLU HA H 55 4.193 4.007 0.186 1
1 587 . 9 1 1 A 55 55 GLU C C 55 176.189 175.429 0.760 1
1 588 . 9 1 1 A 55 55 GLU CA C 55 57.383 57.237 0.146 1
1 589 . 9 1 1 A 55 55 GLU CB C 55 28.945 28.370 0.575 1
1 591 . 9 1 1 A 55 55 GLU N N 55 120.312 119.139 1.173 1
1 592 . 9 1 1 A 56 56 LYS H H 56 7.937 7.999 -0.062 1
1 593 . 9 1 1 A 56 56 LYS HA H 56 4.578 4.347 0.231 1
1 602 . 9 1 1 A 56 56 LYS C C 56 174.295 174.839 -0.544 1
1 603 . 9 1 1 A 56 56 LYS CA C 56 54.171 55.055 -0.884 1
1 604 . 9 1 1 A 56 56 LYS CB C 56 32.555 31.730 0.825 1
1 608 . 9 1 1 A 56 56 LYS N N 56 122.008 119.911 2.097 1
1 609 . 9 1 1 A 57 57 PRO HA H 57 4.370 4.734 -0.364 1
1 616 . 9 1 1 A 57 57 PRO CA C 57 63.431 62.715 0.716 1
1 617 . 9 1 1 A 57 57 PRO CB C 57 32.072 30.030 2.042 1
1 620 . 9 1 1 A 58 58 ARG H H 58 8.310 8.146 0.164 1
1 621 . 9 1 1 A 58 58 ARG HA H 58 4.295 4.828 -0.533 1
1 628 . 9 1 1 A 58 58 ARG CA C 58 56.570 54.147 2.423 1
1 629 . 9 1 1 A 58 58 ARG CB C 58 30.860 34.714 -3.854 1
1 632 . 9 1 1 A 58 58 ARG N N 58 120.045 123.609 -3.564 1
1 633 . 9 1 1 A 60 60 CYS HA H 60 4.482 4.990 -0.508 1
1 636 . 9 1 1 A 60 60 CYS CA C 60 58.621 57.483 1.138 1
1 637 . 9 1 1 A 60 60 CYS CB C 60 28.267 26.514 1.753 1
1 638 . 9 1 1 A 61 61 GLU HA H 61 4.226 4.764 -0.538 1
1 643 . 9 1 1 A 61 61 GLU C C 61 176.299 174.485 1.814 1
1 644 . 9 1 1 A 61 61 GLU CA C 61 57.100 55.335 1.765 1
1 645 . 9 1 1 A 61 61 GLU CB C 61 29.873 30.038 -0.165 1
1 647 . 9 1 1 A 62 62 ALA H H 62 8.282 7.639 0.643 1
1 648 . 9 1 1 A 62 62 ALA HA H 62 4.302 4.757 -0.455 1
1 652 . 9 1 1 A 62 62 ALA C C 62 177.277 175.616 1.661 1
1 653 . 9 1 1 A 62 62 ALA CA C 62 52.512 51.509 1.003 1
1 654 . 9 1 1 A 62 62 ALA CB C 62 19.592 23.173 -3.581 1
1 655 . 9 1 1 A 62 62 ALA N N 62 124.386 125.116 -0.730 1
1 656 . 9 1 1 A 63 63 ALA H H 63 8.399 8.464 -0.065 1
1 657 . 9 1 1 A 63 63 ALA HA H 63 4.375 4.617 -0.242 1
1 661 . 9 1 1 A 63 63 ALA C C 63 176.843 177.971 -1.128 1
1 662 . 9 1 1 A 63 63 ALA CA C 63 52.658 51.645 1.013 1
1 663 . 9 1 1 A 63 63 ALA CB C 63 19.592 19.443 0.149 1
1 664 . 9 1 1 A 63 63 ALA N N 63 123.892 122.849 1.043 1
1 665 . 9 1 1 A 64 64 ARG H H 64 8.152 8.472 -0.320 1
1 666 . 9 1 1 A 64 64 ARG HA H 64 5.008 4.355 0.653 1
1 673 . 9 1 1 A 64 64 ARG C C 64 175.594 175.713 -0.119 1
1 674 . 9 1 1 A 64 64 ARG CA C 64 55.282 56.557 -1.275 1
1 675 . 9 1 1 A 64 64 ARG CB C 64 32.506 30.898 1.608 1
1 678 . 9 1 1 A 64 64 ARG N N 64 119.787 121.679 -1.892 1
1 679 . 9 1 1 A 65 65 LYS H H 65 8.945 8.568 0.377 1
1 680 . 9 1 1 A 65 65 LYS HA H 65 4.602 4.740 -0.138 1
1 689 . 9 1 1 A 65 65 LYS C C 65 174.657 175.159 -0.502 1
1 690 . 9 1 1 A 65 65 LYS CA C 65 54.948 55.301 -0.353 1
1 691 . 9 1 1 A 65 65 LYS CB C 65 34.068 33.385 0.683 1
1 695 . 9 1 1 A 65 65 LYS N N 65 124.171 122.922 1.249 1
1 696 . 9 1 1 A 66 66 VAL H H 66 8.672 8.761 -0.089 1
1 697 . 9 1 1 A 66 66 VAL HA H 66 4.532 5.068 -0.536 1
1 705 . 9 1 1 A 66 66 VAL C C 66 175.078 173.990 1.088 1
1 706 . 9 1 1 A 66 66 VAL CA C 66 61.865 59.771 2.094 1
1 707 . 9 1 1 A 66 66 VAL CB C 66 33.835 35.064 -1.229 1
1 710 . 9 1 1 A 66 66 VAL N N 66 124.380 126.261 -1.881 1
1 711 . 9 1 1 A 67 67 ILE H H 67 9.071 9.074 -0.003 1
1 712 . 9 1 1 A 67 67 ILE HA H 67 4.142 4.672 -0.530 1
1 722 . 9 1 1 A 67 67 ILE C C 67 175.819 175.568 0.251 1
1 723 . 9 1 1 A 67 67 ILE CA C 67 60.383 60.478 -0.095 1
1 724 . 9 1 1 A 67 67 ILE CB C 67 39.908 39.045 0.863 1
1 728 . 9 1 1 A 67 67 ILE N N 67 129.537 129.180 0.357 1
1 729 . 9 1 1 A 68 68 ARG H H 68 9.203 8.662 0.541 1
1 730 . 9 1 1 A 68 68 ARG HA H 68 4.198 4.293 -0.095 1
1 737 . 9 1 1 A 68 68 ARG C C 68 177.769 177.321 0.448 1
1 738 . 9 1 1 A 68 68 ARG CA C 68 56.835 57.114 -0.279 1
1 739 . 9 1 1 A 68 68 ARG CB C 68 29.832 30.522 -0.690 1
1 742 . 9 1 1 A 68 68 ARG N N 68 128.484 127.953 0.531 1
1 743 . 9 1 1 A 69 69 LEU H H 69 8.212 8.687 -0.475 1
1 744 . 9 1 1 A 69 69 LEU HA H 69 4.221 4.085 0.136 1
1 754 . 9 1 1 A 69 69 LEU C C 69 178.996 178.930 0.066 1
1 755 . 9 1 1 A 69 69 LEU CA C 69 57.136 57.147 -0.011 1
1 756 . 9 1 1 A 69 69 LEU CB C 69 39.455 41.369 -1.914 1
1 760 . 9 1 1 A 69 69 LEU N N 69 123.807 123.682 0.125 1
1 761 . 9 1 1 A 70 70 SER H H 70 8.823 7.943 0.880 1
1 762 . 9 1 1 A 70 70 SER HA H 70 4.331 4.103 0.228 1
1 765 . 9 1 1 A 70 70 SER C C 70 175.076 176.732 -1.656 1
1 766 . 9 1 1 A 70 70 SER CA C 70 60.329 60.956 -0.627 1
1 767 . 9 1 1 A 70 70 SER CB C 70 62.362 63.144 -0.782 1
1 768 . 9 1 1 A 70 70 SER N N 70 115.162 114.801 0.361 1
1 769 . 9 1 1 A 71 71 ASP H H 71 7.602 7.653 -0.051 1
1 770 . 9 1 1 A 71 71 ASP HA H 71 4.820 4.355 0.465 1
1 773 . 9 1 1 A 71 71 ASP C C 71 176.478 176.611 -0.133 1
1 774 . 9 1 1 A 71 71 ASP CA C 71 54.241 56.604 -2.363 1
1 775 . 9 1 1 A 71 71 ASP CB C 71 41.347 40.826 0.521 1
1 776 . 9 1 1 A 71 71 ASP N N 71 119.590 120.421 -0.831 1
1 777 . 9 1 1 A 72 72 CYS H H 72 7.715 7.110 0.605 1
1 778 . 9 1 1 A 72 72 CYS HA H 72 4.372 4.500 -0.128 1
1 781 . 9 1 1 A 72 72 CYS C C 72 173.690 174.414 -0.724 1
1 782 . 9 1 1 A 72 72 CYS CA C 72 60.836 60.333 0.503 1
1 783 . 9 1 1 A 72 72 CYS CB C 72 27.655 27.987 -0.332 1
1 784 . 9 1 1 A 72 72 CYS N N 72 118.346 117.902 0.444 1
1 785 . 9 1 1 A 73 73 LEU H H 73 9.472 9.461 0.011 1
1 786 . 9 1 1 A 73 73 LEU HA H 73 4.593 4.318 0.275 1
1 796 . 9 1 1 A 73 73 LEU C C 73 177.562 176.807 0.755 1
1 797 . 9 1 1 A 73 73 LEU CA C 73 55.724 56.330 -0.606 1
1 798 . 9 1 1 A 73 73 LEU CB C 73 43.774 42.623 1.151 1
1 802 . 9 1 1 A 73 73 LEU N N 73 124.752 127.172 -2.420 1
1 803 . 9 1 1 A 74 74 ARG H H 74 7.658 7.669 -0.011 1
1 804 . 9 1 1 A 74 74 ARG HA H 74 4.592 5.106 -0.514 1
1 811 . 9 1 1 A 74 74 ARG C C 74 173.605 174.398 -0.793 1
1 812 . 9 1 1 A 74 74 ARG CA C 74 56.465 56.086 0.379 1
1 813 . 9 1 1 A 74 74 ARG CB C 74 34.068 33.933 0.135 1
1 816 . 9 1 1 A 74 74 ARG N N 74 115.565 115.821 -0.256 1
1 817 . 9 1 1 A 75 75 VAL H H 75 8.622 8.733 -0.111 1
1 818 . 9 1 1 A 75 75 VAL HA H 75 5.170 5.289 -0.119 1
1 826 . 9 1 1 A 75 75 VAL C C 75 173.985 174.342 -0.357 1
1 827 . 9 1 1 A 75 75 VAL CA C 75 60.930 59.422 1.508 1
1 828 . 9 1 1 A 75 75 VAL CB C 75 35.073 36.385 -1.312 1
1 831 . 9 1 1 A 75 75 VAL N N 75 124.278 119.064 5.214 1
1 832 . 9 1 1 A 76 76 ALA H H 76 8.272 8.879 -0.607 1
1 833 . 9 1 1 A 76 76 ALA HA H 76 4.648 4.876 -0.228 1
1 837 . 9 1 1 A 76 76 ALA C C 76 175.630 175.976 -0.346 1
1 838 . 9 1 1 A 76 76 ALA CA C 76 51.294 51.299 -0.005 1
1 839 . 9 1 1 A 76 76 ALA CB C 76 22.759 23.689 -0.930 1
1 840 . 9 1 1 A 76 76 ALA N N 76 126.015 123.590 2.425 1
1 841 . 9 1 1 A 77 77 GLU H H 77 9.184 8.635 0.549 1
1 842 . 9 1 1 A 77 77 GLU HA H 77 4.060 5.146 -1.086 1
1 847 . 9 1 1 A 77 77 GLU C C 77 174.949 176.120 -1.171 1
1 848 . 9 1 1 A 77 77 GLU CA C 77 58.424 55.495 2.929 1
1 849 . 9 1 1 A 77 77 GLU CB C 77 30.161 31.694 -1.533 1
1 851 . 9 1 1 A 77 77 GLU N N 77 120.223 118.549 1.674 1
1 852 . 9 1 1 A 78 78 ALA H H 78 7.985 8.953 -0.968 1
1 853 . 9 1 1 A 78 78 ALA HA H 78 4.776 5.356 -0.580 1
1 857 . 9 1 1 A 78 78 ALA C C 78 177.250 177.694 -0.444 1
1 858 . 9 1 1 A 78 78 ALA CA C 78 50.888 50.736 0.152 1
1 859 . 9 1 1 A 78 78 ALA CB C 78 20.851 22.321 -1.470 1
1 860 . 9 1 1 A 78 78 ALA N N 78 125.143 125.344 -0.201 1
1 861 . 9 1 1 A 79 79 GLY H H 79 8.604 8.522 0.082 1
1 862 . 9 1 1 A 79 79 GLY HA2 H 79 4.327 4.219 0.108 1
1 863 . 9 1 1 A 79 79 GLY HA3 H 79 3.963 4.221 -0.258 1
1 864 . 9 1 1 A 79 79 GLY C C 79 175.360 175.007 0.353 1
1 865 . 9 1 1 A 79 79 GLY CA C 79 44.925 44.699 0.226 1
1 866 . 9 1 1 A 79 79 GLY N N 79 109.420 106.368 3.052 1
1 867 . 9 1 1 A 80 80 GLY H H 80 8.649 8.788 -0.139 1
1 868 . 9 1 1 A 80 80 GLY HA2 H 80 3.962 3.915 0.047 1
1 869 . 9 1 1 A 80 80 GLY HA3 H 80 3.962 3.916 0.046 1
1 870 . 9 1 1 A 80 80 GLY C C 80 175.052 175.511 -0.459 1
1 871 . 9 1 1 A 80 80 GLY CA C 80 45.955 46.229 -0.274 1
1 872 . 9 1 1 A 80 80 GLY N N 80 108.295 110.177 -1.882 1
1 873 . 9 1 1 A 81 81 GLU H H 81 8.921 8.315 0.606 1
1 874 . 9 1 1 A 81 81 GLU HA H 81 4.298 4.093 0.205 1
1 879 . 9 1 1 A 81 81 GLU C C 81 176.532 177.951 -1.419 1
1 880 . 9 1 1 A 81 81 GLU CA C 81 57.118 59.495 -2.377 1
1 881 . 9 1 1 A 81 81 GLU CB C 81 28.599 29.793 -1.194 1
1 883 . 9 1 1 A 81 81 GLU N N 81 121.170 120.840 0.330 1
1 884 . 9 1 1 A 82 82 ALA H H 82 8.032 7.538 0.494 1
1 885 . 9 1 1 A 82 82 ALA HA H 82 4.371 4.275 0.096 1
1 889 . 9 1 1 A 82 82 ALA C C 82 177.160 178.359 -1.199 1
1 890 . 9 1 1 A 82 82 ALA CA C 82 52.653 52.426 0.227 1
1 891 . 9 1 1 A 82 82 ALA CB C 82 19.304 19.705 -0.401 1
1 892 . 9 1 1 A 82 82 ALA N N 82 124.988 121.882 3.106 1
1 893 . 9 1 1 A 83 83 SER H H 83 8.319 8.843 -0.524 1
1 894 . 9 1 1 A 83 83 SER HA H 83 4.331 4.208 0.123 1
1 897 . 9 1 1 A 83 83 SER C C 83 174.045 175.138 -1.093 1
1 898 . 9 1 1 A 83 83 SER CA C 83 58.053 62.163 -4.110 1
1 899 . 9 1 1 A 83 83 SER CB C 83 63.184 62.806 0.378 1
1 900 . 9 1 1 A 83 83 SER N N 83 114.181 117.220 -3.039 1
1 901 . 9 1 1 A 84 84 SER H H 84 7.823 7.777 0.046 1
1 902 . 9 1 1 A 84 84 SER HA H 84 3.194 4.486 -1.292 1
1 905 . 9 1 1 A 84 84 SER C C 84 171.072 173.971 -2.899 1
1 906 . 9 1 1 A 84 84 SER CA C 84 57.206 57.001 0.205 1
1 907 . 9 1 1 A 84 84 SER CB C 84 61.622 63.250 -1.628 1
1 908 . 9 1 1 A 84 84 SER N N 84 117.302 115.119 2.183 1
1 909 . 9 1 1 A 85 85 PRO HA H 85 3.922 4.489 -0.567 1
1 916 . 9 1 1 A 85 85 PRO CA C 85 62.691 62.486 0.205 1
1 917 . 9 1 1 A 85 85 PRO CB C 85 31.515 32.607 -1.092 1
1 920 . 9 1 1 A 86 86 ARG HA H 86 3.882 3.953 -0.071 1
1 927 . 9 1 1 A 86 86 ARG C C 86 175.712 177.075 -1.363 1
1 928 . 9 1 1 A 86 86 ARG CA C 86 57.877 58.562 -0.685 1
1 929 . 9 1 1 A 86 86 ARG CB C 86 29.791 29.665 0.126 1
1 932 . 9 1 1 A 87 87 ASP H H 87 8.903 7.932 0.971 1
1 933 . 9 1 1 A 87 87 ASP HA H 87 4.342 4.639 -0.297 1
1 936 . 9 1 1 A 87 87 ASP C C 87 175.723 175.795 -0.072 1
1 937 . 9 1 1 A 87 87 ASP CA C 87 56.377 55.303 1.074 1
1 938 . 9 1 1 A 87 87 ASP CB C 87 39.208 41.116 -1.908 1
1 939 . 9 1 1 A 87 87 ASP N N 87 117.520 118.339 -0.819 1
1 940 . 9 1 1 A 88 88 THR H H 88 7.776 7.591 0.185 1
1 941 . 9 1 1 A 88 88 THR HA H 88 5.101 4.982 0.119 1
1 946 . 9 1 1 A 88 88 THR C C 88 173.825 173.153 0.672 1
1 947 . 9 1 1 A 88 88 THR CA C 88 60.154 59.890 0.264 1
1 948 . 9 1 1 A 88 88 THR CB C 88 72.702 72.328 0.374 1
1 950 . 9 1 1 A 88 88 THR N N 88 108.770 109.956 -1.186 1
1 951 . 9 1 1 A 89 89 SER H H 89 9.006 9.375 -0.369 1
1 952 . 9 1 1 A 89 89 SER HA H 89 4.718 5.174 -0.456 1
1 955 . 9 1 1 A 89 89 SER C C 89 173.728 173.017 0.711 1
1 956 . 9 1 1 A 89 89 SER CA C 89 57.453 57.818 -0.365 1
1 957 . 9 1 1 A 89 89 SER CB C 89 65.611 65.737 -0.126 1
1 958 . 9 1 1 A 89 89 SER N N 89 114.151 116.753 -2.602 1
1 959 . 9 1 1 A 90 90 ALA H H 90 9.001 8.840 0.161 1
1 960 . 9 1 1 A 90 90 ALA HA H 90 5.660 4.736 0.924 1
1 964 . 9 1 1 A 90 90 ALA C C 90 177.669 177.237 0.432 1
1 965 . 9 1 1 A 90 90 ALA CA C 90 51.670 51.928 -0.258 1
1 966 . 9 1 1 A 90 90 ALA CB C 90 22.265 20.265 2.000 1
1 967 . 9 1 1 A 90 90 ALA N N 90 126.177 129.352 -3.175 1
1 968 . 9 1 1 A 91 91 PHE H H 91 9.672 8.408 1.264 1
1 969 . 9 1 1 A 91 91 PHE HA H 91 5.039 5.376 -0.337 1
1 977 . 9 1 1 A 91 91 PHE C C 91 170.731 172.390 -1.659 1
1 978 . 9 1 1 A 91 91 PHE CA C 91 56.271 55.415 0.856 1
1 979 . 9 1 1 A 91 91 PHE CB C 91 41.553 41.772 -0.219 1
1 985 . 9 1 1 A 91 91 PHE N N 91 118.968 116.173 2.795 1
1 986 . 9 1 1 A 92 92 PHE H H 92 9.422 9.372 0.050 1
1 987 . 9 1 1 A 92 92 PHE HA H 92 5.674 5.267 0.407 1
1 995 . 9 1 1 A 92 92 PHE C C 92 174.570 175.163 -0.593 1
1 996 . 9 1 1 A 92 92 PHE CA C 92 55.917 56.716 -0.799 1
1 997 . 9 1 1 A 92 92 PHE CB C 92 42.787 42.172 0.615 1
1 1003 . 9 1 1 A 92 92 PHE N N 92 117.543 117.255 0.288 1
1 1004 . 9 1 1 A 93 93 LEU H H 93 9.021 8.718 0.303 1
1 1005 . 9 1 1 A 93 93 LEU HA H 93 5.122 4.941 0.181 1
1 1015 . 9 1 1 A 93 93 LEU C C 93 174.799 174.217 0.582 1
1 1016 . 9 1 1 A 93 93 LEU CA C 93 54.912 54.725 0.187 1
1 1017 . 9 1 1 A 93 93 LEU CB C 93 45.254 45.137 0.117 1
1 1021 . 9 1 1 A 93 93 LEU N N 93 121.719 121.761 -0.042 1
1 1022 . 9 1 1 A 94 94 GLU H H 94 9.294 9.312 -0.018 1
1 1023 . 9 1 1 A 94 94 GLU HA H 94 5.043 5.201 -0.158 1
1 1028 . 9 1 1 A 94 94 GLU C C 94 175.754 175.498 0.256 1
1 1029 . 9 1 1 A 94 94 GLU CA C 94 56.018 54.961 1.057 1
1 1030 . 9 1 1 A 94 94 GLU CB C 94 32.752 32.650 0.102 1
1 1032 . 9 1 1 A 94 94 GLU N N 94 127.032 128.121 -1.089 1
1 1033 . 9 1 1 A 95 95 THR H H 95 8.822 8.496 0.326 1
1 1034 . 9 1 1 A 95 95 THR HA H 95 5.398 5.079 0.319 1
1 1039 . 9 1 1 A 95 95 THR C C 95 173.860 175.535 -1.675 1
1 1040 . 9 1 1 A 95 95 THR CA C 95 59.588 59.580 0.008 1
1 1041 . 9 1 1 A 95 95 THR CB C 95 72.191 72.257 -0.066 1
1 1043 . 9 1 1 A 95 95 THR N N 95 118.685 117.931 0.754 1
1 1044 . 9 1 1 A 96 96 LYS H H 96 8.823 8.877 -0.054 1
1 1045 . 9 1 1 A 96 96 LYS HA H 96 4.022 3.968 0.054 1
1 1054 . 9 1 1 A 96 96 LYS C C 96 177.330 178.833 -1.503 1
1 1055 . 9 1 1 A 96 96 LYS CA C 96 59.588 59.416 0.172 1
1 1056 . 9 1 1 A 96 96 LYS CB C 96 32.588 32.057 0.531 1
1 1060 . 9 1 1 A 96 96 LYS N N 96 118.801 122.373 -3.572 1
1 1061 . 9 1 1 A 97 97 GLU H H 97 8.092 7.732 0.360 1
1 1062 . 9 1 1 A 97 97 GLU HA H 97 4.282 4.217 0.065 1
1 1067 . 9 1 1 A 97 97 GLU C C 97 176.290 176.184 0.106 1
1 1068 . 9 1 1 A 97 97 GLU CA C 97 57.365 58.610 -1.245 1
1 1069 . 9 1 1 A 97 97 GLU CB C 97 31.559 30.915 0.644 1
1 1071 . 9 1 1 A 97 97 GLU N N 97 113.992 118.921 -4.929 1
1 1072 . 9 1 1 A 98 98 ARG H H 98 7.482 7.085 0.397 1
1 1073 . 9 1 1 A 98 98 ARG HA H 98 4.397 4.566 -0.169 1
1 1080 . 9 1 1 A 98 98 ARG C C 98 172.792 173.042 -0.250 1
1 1081 . 9 1 1 A 98 98 ARG CA C 98 55.689 54.553 1.136 1
1 1082 . 9 1 1 A 98 98 ARG CB C 98 32.711 31.884 0.827 1
1 1085 . 9 1 1 A 98 98 ARG N N 98 116.022 114.919 1.103 1
1 1086 . 9 1 1 A 99 99 LEU H H 99 8.423 8.166 0.257 1
1 1087 . 9 1 1 A 99 99 LEU HA H 99 4.807 4.702 0.105 1
1 1097 . 9 1 1 A 99 99 LEU C C 99 175.903 174.019 1.884 1
1 1098 . 9 1 1 A 99 99 LEU CA C 99 54.383 53.842 0.541 1
1 1099 . 9 1 1 A 99 99 LEU CB C 99 43.362 44.081 -0.719 1
1 1103 . 9 1 1 A 99 99 LEU N N 99 124.983 122.084 2.899 1
1 1104 . 9 1 1 A 100 100 TYR H H 100 9.144 9.567 -0.423 1
1 1105 . 9 1 1 A 100 100 TYR HA H 100 4.542 5.184 -0.642 1
1 1112 . 9 1 1 A 100 100 TYR C C 100 173.479 174.344 -0.865 1
1 1113 . 9 1 1 A 100 100 TYR CA C 100 57.735 56.115 1.620 1
1 1114 . 9 1 1 A 100 100 TYR CB C 100 39.291 40.875 -1.584 1
1 1119 . 9 1 1 A 100 100 TYR N N 100 126.679 126.828 -0.149 1
1 1120 . 9 1 1 A 101 101 LEU H H 101 9.043 8.887 0.156 1
1 1121 . 9 1 1 A 101 101 LEU HA H 101 4.747 4.882 -0.135 1
1 1131 . 9 1 1 A 101 101 LEU C C 101 173.530 175.085 -1.555 1
1 1132 . 9 1 1 A 101 101 LEU CA C 101 54.524 53.640 0.884 1
1 1133 . 9 1 1 A 101 101 LEU CB C 101 42.499 43.904 -1.405 1
1 1137 . 9 1 1 A 101 101 LEU N N 101 127.422 125.763 1.659 1
1 1138 . 9 1 1 A 102 102 LEU H H 102 8.493 8.397 0.096 1
1 1139 . 9 1 1 A 102 102 LEU HA H 102 5.612 5.421 0.191 1
1 1149 . 9 1 1 A 102 102 LEU C C 102 175.794 176.375 -0.581 1
1 1150 . 9 1 1 A 102 102 LEU CA C 102 53.076 53.379 -0.303 1
1 1151 . 9 1 1 A 102 102 LEU CB C 102 45.994 44.303 1.691 1
1 1155 . 9 1 1 A 102 102 LEU N N 102 126.021 128.338 -2.317 1
1 1156 . 9 1 1 A 103 103 ALA H H 103 9.073 9.226 -0.153 1
1 1157 . 9 1 1 A 103 103 ALA HA H 103 5.081 5.449 -0.368 1
1 1161 . 9 1 1 A 103 103 ALA C C 103 175.133 176.090 -0.957 1
1 1162 . 9 1 1 A 103 103 ALA CA C 103 51.688 49.825 1.863 1
1 1163 . 9 1 1 A 103 103 ALA CB C 103 21.689 22.335 -0.646 1
1 1164 . 9 1 1 A 103 103 ALA N N 103 117.679 122.996 -5.317 1
1 1165 . 9 1 1 A 104 104 ALA H H 104 8.582 8.577 0.005 1
1 1166 . 9 1 1 A 104 104 ALA HA H 104 5.220 4.879 0.341 1
1 1170 . 9 1 1 A 104 104 ALA C C 104 173.471 174.347 -0.876 1
1 1171 . 9 1 1 A 104 104 ALA CA C 104 47.959 49.570 -1.611 1
1 1172 . 9 1 1 A 104 104 ALA CB C 104 21.359 22.492 -1.133 1
1 1173 . 9 1 1 A 104 104 ALA N N 104 123.419 122.330 1.089 1
1 1174 . 9 1 1 A 105 105 PRO HA H 105 4.542 4.792 -0.250 1
1 1181 . 9 1 1 A 105 105 PRO C C 105 178.409 177.936 0.473 1
1 1182 . 9 1 1 A 105 105 PRO CA C 105 64.301 62.802 1.499 1
1 1183 . 9 1 1 A 105 105 PRO CB C 105 32.094 31.671 0.423 1
1 1186 . 9 1 1 A 106 106 ALA H H 106 8.302 8.683 -0.381 1
1 1187 . 9 1 1 A 106 106 ALA HA H 106 4.022 4.033 -0.011 1
1 1191 . 9 1 1 A 106 106 ALA C C 106 179.641 179.701 -0.060 1
1 1192 . 9 1 1 A 106 106 ALA CA C 106 56.341 55.171 1.170 1
1 1193 . 9 1 1 A 106 106 ALA CB C 106 18.523 18.141 0.382 1
1 1194 . 9 1 1 A 106 106 ALA N N 106 127.733 127.882 -0.149 1
1 1195 . 9 1 1 A 107 107 ALA H H 107 9.035 8.109 0.926 1
1 1196 . 9 1 1 A 107 107 ALA HA H 107 4.331 4.017 0.314 1
1 1200 . 9 1 1 A 107 107 ALA C C 107 178.586 179.844 -1.258 1
1 1201 . 9 1 1 A 107 107 ALA CA C 107 53.765 55.375 -1.610 1
1 1202 . 9 1 1 A 107 107 ALA CB C 107 18.728 18.234 0.494 1
1 1203 . 9 1 1 A 107 107 ALA N N 107 118.203 120.222 -2.019 1
1 1204 . 9 1 1 A 108 108 GLU H H 108 8.399 7.802 0.597 1
1 1205 . 9 1 1 A 108 108 GLU HA H 108 4.631 4.169 0.462 1
1 1210 . 9 1 1 A 108 108 GLU C C 108 177.127 178.744 -1.617 1
1 1211 . 9 1 1 A 108 108 GLU CA C 108 55.847 58.713 -2.866 1
1 1212 . 9 1 1 A 108 108 GLU CB C 108 32.135 30.100 2.035 1
1 1214 . 9 1 1 A 108 108 GLU N N 108 114.661 118.032 -3.371 1
1 1215 . 9 1 1 A 109 109 ARG H H 109 7.412 8.645 -1.233 1
1 1216 . 9 1 1 A 109 109 ARG HA H 109 3.682 4.135 -0.453 1
1 1223 . 9 1 1 A 109 109 ARG C C 109 176.917 179.112 -2.195 1
1 1224 . 9 1 1 A 109 109 ARG CA C 109 61.600 59.861 1.739 1
1 1225 . 9 1 1 A 109 109 ARG CB C 109 28.845 30.058 -1.213 1
1 1228 . 9 1 1 A 109 109 ARG N N 109 120.954 120.782 0.172 1
1 1229 . 9 1 1 A 110 110 GLY H H 110 8.833 8.548 0.285 1
1 1230 . 9 1 1 A 110 110 GLY HA2 H 110 3.872 3.792 0.080 1
1 1231 . 9 1 1 A 110 110 GLY HA3 H 110 3.685 3.808 -0.123 1
1 1232 . 9 1 1 A 110 110 GLY C C 110 175.997 175.196 0.801 1
1 1233 . 9 1 1 A 110 110 GLY CA C 110 47.323 47.488 -0.165 1
1 1234 . 9 1 1 A 110 110 GLY N N 110 106.563 107.123 -0.560 1
1 1235 . 9 1 1 A 111 111 ASP H H 111 7.882 8.209 -0.327 1
1 1236 . 9 1 1 A 111 111 ASP HA H 111 4.312 4.378 -0.066 1
1 1239 . 9 1 1 A 111 111 ASP C C 111 179.467 177.971 1.496 1
1 1240 . 9 1 1 A 111 111 ASP CA C 111 56.976 56.672 0.304 1
1 1241 . 9 1 1 A 111 111 ASP CB C 111 40.648 41.018 -0.370 1
1 1242 . 9 1 1 A 111 111 ASP N N 111 121.402 120.617 0.785 1
1 1243 . 9 1 1 A 112 112 TRP H H 112 7.804 8.154 -0.350 1
1 1244 . 9 1 1 A 112 112 TRP HA H 112 3.831 4.220 -0.389 1
1 1253 . 9 1 1 A 112 112 TRP C C 112 177.547 178.783 -1.236 1
1 1254 . 9 1 1 A 112 112 TRP CA C 112 62.006 60.029 1.977 1
1 1255 . 9 1 1 A 112 112 TRP CB C 112 29.421 29.377 0.044 1
1 1261 . 9 1 1 A 112 112 TRP N N 112 119.904 120.890 -0.986 1
1 1263 . 9 1 1 A 113 113 VAL H H 113 7.982 8.103 -0.121 1
1 1264 . 9 1 1 A 113 113 VAL HA H 113 3.072 3.654 -0.582 1
1 1272 . 9 1 1 A 113 113 VAL C C 113 178.015 178.342 -0.327 1
1 1273 . 9 1 1 A 113 113 VAL CA C 113 67.407 66.768 0.639 1
1 1274 . 9 1 1 A 113 113 VAL CB C 113 31.724 31.559 0.165 1
1 1277 . 9 1 1 A 113 113 VAL N N 113 117.575 119.485 -1.910 1
1 1278 . 9 1 1 A 114 114 GLN H H 114 8.268 8.162 0.106 1
1 1279 . 9 1 1 A 114 114 GLN HA H 114 3.994 3.968 0.026 1
1 1286 . 9 1 1 A 114 114 GLN C C 114 178.021 178.051 -0.030 1
1 1287 . 9 1 1 A 114 114 GLN CA C 114 59.112 58.674 0.438 1
1 1288 . 9 1 1 A 114 114 GLN CB C 114 28.685 28.914 -0.229 1
1 1290 . 9 1 1 A 114 114 GLN N N 114 117.479 120.165 -2.686 1
1 1292 . 9 1 1 A 115 115 ALA H H 115 7.915 7.943 -0.028 1
1 1293 . 9 1 1 A 115 115 ALA HA H 115 3.972 4.071 -0.099 1
1 1297 . 9 1 1 A 115 115 ALA C C 115 180.030 179.717 0.313 1
1 1298 . 9 1 1 A 115 115 ALA CA C 115 55.142 55.200 -0.058 1
1 1299 . 9 1 1 A 115 115 ALA CB C 115 18.152 18.666 -0.514 1
1 1300 . 9 1 1 A 115 115 ALA N N 115 120.858 120.982 -0.124 1
1 1301 . 9 1 1 A 116 116 ILE H H 116 8.172 8.334 -0.162 1
1 1302 . 9 1 1 A 116 116 ILE HA H 116 3.482 3.868 -0.386 1
1 1312 . 9 1 1 A 116 116 ILE C C 116 177.739 178.575 -0.836 1
1 1313 . 9 1 1 A 116 116 ILE CA C 116 66.119 65.108 1.011 1
1 1314 . 9 1 1 A 116 116 ILE CB C 116 38.222 37.987 0.235 1
1 1318 . 9 1 1 A 116 116 ILE N N 116 115.977 117.552 -1.575 1
1 1319 . 9 1 1 A 117 117 CYS H H 117 8.449 8.080 0.369 1
1 1320 . 9 1 1 A 117 117 CYS HA H 117 4.032 4.597 -0.565 1
1 1323 . 9 1 1 A 117 117 CYS C C 117 177.321 177.373 -0.052 1
1 1324 . 9 1 1 A 117 117 CYS CA C 117 64.777 62.316 2.461 1
1 1325 . 9 1 1 A 117 117 CYS CB C 117 26.871 27.301 -0.430 1
1 1326 . 9 1 1 A 117 117 CYS N N 117 117.253 121.092 -3.839 1
1 1327 . 9 1 1 A 118 118 LEU H H 118 8.182 8.159 0.023 1
1 1328 . 9 1 1 A 118 118 LEU HA H 118 4.052 4.056 -0.004 1
1 1338 . 9 1 1 A 118 118 LEU C C 118 179.217 179.250 -0.033 1
1 1339 . 9 1 1 A 118 118 LEU CA C 118 57.877 57.820 0.057 1
1 1340 . 9 1 1 A 118 118 LEU CB C 118 42.088 41.447 0.641 1
1 1344 . 9 1 1 A 118 118 LEU N N 118 119.665 120.846 -1.181 1
1 1345 . 9 1 1 A 119 119 LEU H H 119 7.142 7.886 -0.744 1
1 1346 . 9 1 1 A 119 119 LEU HA H 119 4.192 4.517 -0.325 1
1 1356 . 9 1 1 A 119 119 LEU C C 119 178.492 178.595 -0.103 1
1 1357 . 9 1 1 A 119 119 LEU CA C 119 56.259 57.754 -1.495 1
1 1358 . 9 1 1 A 119 119 LEU CB C 119 43.568 42.225 1.343 1
1 1362 . 9 1 1 A 119 119 LEU N N 119 116.244 119.134 -2.890 1
1 1363 . 9 1 1 A 120 120 ALA H H 120 8.513 8.375 0.138 1
1 1364 . 9 1 1 A 120 120 ALA HA H 120 3.878 4.273 -0.395 1
1 1368 . 9 1 1 A 120 120 ALA C C 120 178.358 177.982 0.376 1
1 1369 . 9 1 1 A 120 120 ALA CA C 120 53.765 54.651 -0.886 1
1 1370 . 9 1 1 A 120 120 ALA CB C 120 18.687 18.676 0.011 1
1 1371 . 9 1 1 A 120 120 ALA N N 120 120.009 120.188 -0.179 1
1 1372 . 9 1 1 A 121 121 PHE H H 121 7.822 7.988 -0.166 1
1 1373 . 9 1 1 A 121 121 PHE HA H 121 5.156 5.041 0.115 1
1 1381 . 9 1 1 A 121 121 PHE C C 121 176.273 176.082 0.191 1
1 1382 . 9 1 1 A 121 121 PHE CA C 121 55.741 57.099 -1.358 1
1 1383 . 9 1 1 A 121 121 PHE CB C 121 39.455 38.691 0.764 1
1 1389 . 9 1 1 A 121 121 PHE N N 121 113.981 116.089 -2.108 1
1 1390 . 9 1 1 A 122 122 SER H H 122 7.765 8.437 -0.672 1
1 1391 . 9 1 1 A 122 122 SER HA H 122 4.579 4.415 0.164 1
1 1394 . 9 1 1 A 122 122 SER C C 122 174.595 174.953 -0.358 1
1 1395 . 9 1 1 A 122 122 SER CA C 122 58.777 60.998 -2.221 1
1 1396 . 9 1 1 A 122 122 SER CB C 122 63.719 63.489 0.230 1
1 1397 . 9 1 1 A 122 122 SER N N 122 115.069 116.405 -1.336 1
1 1398 . 9 1 1 A 123 123 GLY H H 123 8.223 7.468 0.755 1
1 1399 . 9 1 1 A 123 123 GLY HA2 H 123 4.174 4.103 0.071 1
1 1400 . 9 1 1 A 123 123 GLY HA3 H 123 4.100 4.114 -0.014 1
1 1401 . 9 1 1 A 123 123 GLY C C 123 171.678 172.442 -0.764 1
1 1402 . 9 1 1 A 123 123 GLY CA C 123 44.815 44.671 0.144 1
1 1403 . 9 1 1 A 123 123 GLY N N 123 110.151 105.996 4.155 1
1 1404 . 9 1 1 A 124 124 PRO HA H 124 4.482 4.765 -0.283 1
1 1411 . 9 1 1 A 124 124 PRO C C 124 177.314 176.157 1.157 1
1 1412 . 9 1 1 A 124 124 PRO CA C 124 63.206 62.839 0.367 1
1 1413 . 9 1 1 A 124 124 PRO CB C 124 32.176 31.487 0.689 1
1 1416 . 9 1 1 A 125 125 SER H H 125 8.485 8.571 -0.086 1
1 1417 . 9 1 1 A 125 125 SER HA H 125 4.472 4.971 -0.499 1
1 1420 . 9 1 1 A 125 125 SER C C 125 174.728 173.241 1.487 1
1 1421 . 9 1 1 A 125 125 SER CA C 125 58.353 58.064 0.289 1
1 1422 . 9 1 1 A 125 125 SER CB C 125 64.048 63.173 0.875 1
1 1423 . 9 1 1 A 125 125 SER N N 125 116.081 120.429 -4.348 1
1 1424 . 9 1 1 A 126 126 SER H H 126 8.332 8.519 -0.187 1
1 1425 . 9 1 1 A 126 126 SER HA H 126 4.464 5.096 -0.632 1
1 1428 . 9 1 1 A 126 126 SER C C 126 173.980 172.353 1.627 1
1 1429 . 9 1 1 A 126 126 SER CA C 126 58.336 57.576 0.760 1
1 1430 . 9 1 1 A 126 126 SER CB C 126 63.925 65.898 -1.973 1
1 1431 . 9 1 1 A 126 126 SER N N 126 118.037 118.674 -0.637 1
1 1 . 10 1 1 A 6 6 SER HA H 6 4.458 4.602 -0.144 1
1 3 . 10 1 1 A 6 6 SER C C 6 175.108 174.600 0.508 1
1 4 . 10 1 1 A 6 6 SER CA C 6 58.689 59.778 -1.089 1
1 5 . 10 1 1 A 6 6 SER CB C 6 63.678 63.992 -0.314 1
1 6 . 10 1 1 A 7 7 GLY H H 7 8.449 7.610 0.839 1
1 7 . 10 1 1 A 7 7 GLY HA2 H 7 3.965 4.084 -0.119 1
1 8 . 10 1 1 A 7 7 GLY HA3 H 7 3.965 4.086 -0.121 1
1 9 . 10 1 1 A 7 7 GLY C C 7 174.380 174.650 -0.270 1
1 10 . 10 1 1 A 7 7 GLY CA C 7 45.435 45.566 -0.131 1
1 11 . 10 1 1 A 7 7 GLY N N 7 110.792 107.116 3.676 1
1 12 . 10 1 1 A 8 8 MET H H 8 8.259 8.701 -0.442 1
1 13 . 10 1 1 A 8 8 MET HA H 8 4.487 4.317 0.170 1
1 21 . 10 1 1 A 8 8 MET C C 8 176.961 176.198 0.763 1
1 22 . 10 1 1 A 8 8 MET CA C 8 55.565 56.983 -1.418 1
1 23 . 10 1 1 A 8 8 MET CB C 8 32.835 33.097 -0.262 1
1 26 . 10 1 1 A 8 8 MET N N 8 119.639 124.295 -4.656 1
1 27 . 10 1 1 A 9 9 GLY H H 9 8.472 7.380 1.092 1
1 28 . 10 1 1 A 9 9 GLY HA2 H 9 3.946 4.028 -0.082 1
1 29 . 10 1 1 A 9 9 GLY HA3 H 9 3.946 4.029 -0.083 1
1 30 . 10 1 1 A 9 9 GLY C C 9 174.005 171.529 2.476 1
1 31 . 10 1 1 A 9 9 GLY CA C 9 45.488 45.235 0.253 1
1 32 . 10 1 1 A 9 9 GLY N N 9 110.107 106.762 3.345 1
1 33 . 10 1 1 A 10 10 ASP H H 10 8.292 8.639 -0.347 1
1 34 . 10 1 1 A 10 10 ASP HA H 10 4.636 5.541 -0.905 1
1 37 . 10 1 1 A 10 10 ASP C C 10 176.768 175.012 1.756 1
1 38 . 10 1 1 A 10 10 ASP CA C 10 54.206 52.599 1.607 1
1 39 . 10 1 1 A 10 10 ASP CB C 10 41.306 43.406 -2.100 1
1 40 . 10 1 1 A 10 10 ASP N N 10 120.370 122.101 -1.731 1
1 41 . 10 1 1 A 11 11 GLY H H 11 8.452 8.574 -0.122 1
1 42 . 10 1 1 A 11 11 GLY HA2 H 11 3.980 4.262 -0.282 1
1 43 . 10 1 1 A 11 11 GLY HA3 H 11 4.022 4.311 -0.289 1
1 44 . 10 1 1 A 11 11 GLY C C 11 174.102 172.483 1.619 1
1 45 . 10 1 1 A 11 11 GLY CA C 11 45.170 46.289 -1.119 1
1 46 . 10 1 1 A 11 11 GLY N N 11 108.391 112.867 -4.476 1
1 47 . 10 1 1 A 12 12 ALA H H 12 8.293 8.321 -0.028 1
1 48 . 10 1 1 A 12 12 ALA HA H 12 3.777 4.038 -0.261 1
1 52 . 10 1 1 A 12 12 ALA C C 12 178.193 178.544 -0.351 1
1 53 . 10 1 1 A 12 12 ALA CA C 12 52.759 52.364 0.395 1
1 54 . 10 1 1 A 12 12 ALA CB C 12 17.855 18.876 -1.021 1
1 55 . 10 1 1 A 12 12 ALA N N 12 124.185 127.423 -3.238 1
1 56 . 10 1 1 A 13 13 VAL H H 13 8.822 8.284 0.538 1
1 57 . 10 1 1 A 13 13 VAL HA H 13 3.912 3.707 0.205 1
1 65 . 10 1 1 A 13 13 VAL C C 13 176.073 175.655 0.418 1
1 66 . 10 1 1 A 13 13 VAL CA C 13 63.100 66.496 -3.396 1
1 67 . 10 1 1 A 13 13 VAL CB C 13 32.711 31.885 0.826 1
1 70 . 10 1 1 A 13 13 VAL N N 13 120.877 124.387 -3.510 1
1 71 . 10 1 1 A 14 14 LYS H H 14 7.093 7.195 -0.102 1
1 72 . 10 1 1 A 14 14 LYS HA H 14 4.169 4.707 -0.538 1
1 81 . 10 1 1 A 14 14 LYS C C 14 173.291 174.450 -1.159 1
1 82 . 10 1 1 A 14 14 LYS CA C 14 56.465 54.751 1.714 1
1 83 . 10 1 1 A 14 14 LYS CB C 14 35.960 35.925 0.035 1
1 87 . 10 1 1 A 14 14 LYS N N 14 118.693 119.186 -0.493 1
1 88 . 10 1 1 A 15 15 GLN H H 15 8.522 8.526 -0.004 1
1 89 . 10 1 1 A 15 15 GLN HA H 15 5.542 5.149 0.393 1
1 96 . 10 1 1 A 15 15 GLN C C 15 174.992 175.834 -0.842 1
1 97 . 10 1 1 A 15 15 GLN CA C 15 54.312 53.950 0.362 1
1 98 . 10 1 1 A 15 15 GLN CB C 15 33.585 32.199 1.386 1
1 100 . 10 1 1 A 15 15 GLN N N 15 124.024 124.007 0.017 1
1 102 . 10 1 1 A 16 16 GLY H H 16 8.740 8.249 0.491 1
1 103 . 10 1 1 A 16 16 GLY HA2 H 16 4.511 4.181 0.330 1
1 104 . 10 1 1 A 16 16 GLY HA3 H 16 4.064 4.450 -0.386 1
1 105 . 10 1 1 A 16 16 GLY C C 16 171.431 171.367 0.064 1
1 106 . 10 1 1 A 16 16 GLY CA C 16 46.106 45.999 0.107 1
1 107 . 10 1 1 A 16 16 GLY N N 16 109.611 109.368 0.243 1
1 108 . 10 1 1 A 17 17 PHE H H 17 8.886 8.584 0.302 1
1 109 . 10 1 1 A 17 17 PHE HA H 17 5.466 5.214 0.252 1
1 114 . 10 1 1 A 17 17 PHE C C 17 174.795 175.131 -0.336 1
1 115 . 10 1 1 A 17 17 PHE CA C 17 57.788 56.117 1.671 1
1 116 . 10 1 1 A 17 17 PHE CB C 17 41.315 41.322 -0.007 1
1 119 . 10 1 1 A 17 17 PHE N N 17 122.684 119.464 3.220 1
1 120 . 10 1 1 A 18 18 LEU H H 18 8.762 9.027 -0.265 1
1 121 . 10 1 1 A 18 18 LEU HA H 18 4.946 4.642 0.304 1
1 131 . 10 1 1 A 18 18 LEU C C 18 175.461 175.005 0.456 1
1 132 . 10 1 1 A 18 18 LEU CA C 18 52.970 53.071 -0.101 1
1 133 . 10 1 1 A 18 18 LEU CB C 18 47.945 45.541 2.404 1
1 137 . 10 1 1 A 18 18 LEU N N 18 119.045 123.389 -4.344 1
1 138 . 10 1 1 A 19 19 TYR H H 19 9.272 8.022 1.250 1
1 139 . 10 1 1 A 19 19 TYR HA H 19 5.682 5.571 0.111 1
1 146 . 10 1 1 A 19 19 TYR C C 19 174.829 174.448 0.381 1
1 147 . 10 1 1 A 19 19 TYR CA C 19 56.482 56.365 0.117 1
1 148 . 10 1 1 A 19 19 TYR CB C 19 41.717 41.341 0.376 1
1 153 . 10 1 1 A 19 19 TYR N N 19 118.024 120.418 -2.394 1
1 154 . 10 1 1 A 20 20 LEU H H 20 9.441 8.952 0.489 1
1 155 . 10 1 1 A 20 20 LEU HA H 20 5.283 5.281 0.002 1
1 165 . 10 1 1 A 20 20 LEU C C 20 175.935 175.946 -0.011 1
1 166 . 10 1 1 A 20 20 LEU CA C 20 53.464 53.806 -0.342 1
1 167 . 10 1 1 A 20 20 LEU CB C 20 46.570 45.666 0.904 1
1 171 . 10 1 1 A 20 20 LEU N N 20 122.838 125.207 -2.369 1
1 172 . 10 1 1 A 21 21 GLN H H 21 8.391 8.306 0.085 1
1 173 . 10 1 1 A 21 21 GLN HA H 21 3.791 3.709 0.082 1
1 180 . 10 1 1 A 21 21 GLN C C 21 175.157 174.627 0.530 1
1 181 . 10 1 1 A 21 21 GLN CA C 21 56.094 55.893 0.201 1
1 182 . 10 1 1 A 21 21 GLN CB C 21 28.434 28.765 -0.331 1
1 184 . 10 1 1 A 21 21 GLN N N 21 129.943 127.580 2.363 1
1 186 . 10 1 1 A 22 22 GLN H H 22 8.829 8.621 0.208 1
1 187 . 10 1 1 A 22 22 GLN HA H 22 4.553 4.768 -0.215 1
1 194 . 10 1 1 A 22 22 GLN C C 22 174.998 175.080 -0.082 1
1 195 . 10 1 1 A 22 22 GLN CA C 22 54.912 54.355 0.557 1
1 196 . 10 1 1 A 22 22 GLN CB C 22 31.930 29.595 2.335 1
1 198 . 10 1 1 A 22 22 GLN N N 22 127.199 125.304 1.895 1
1 200 . 10 1 1 A 23 23 GLN HA H 23 4.142 4.657 -0.515 1
1 207 . 10 1 1 A 23 23 GLN CA C 23 56.427 55.078 1.349 1
1 208 . 10 1 1 A 23 23 GLN CB C 23 29.227 29.353 -0.126 1
1 211 . 10 1 1 A 24 24 GLN HA H 24 4.523 3.990 0.533 1
1 218 . 10 1 1 A 24 24 GLN CB C 24 29.759 29.015 0.744 1
1 221 . 10 1 1 A 25 25 THR HA H 25 3.870 4.463 -0.593 1
1 226 . 10 1 1 A 25 25 THR CA C 25 65.096 64.243 0.853 1
1 227 . 10 1 1 A 25 25 THR CB C 25 68.924 70.342 -1.418 1
1 229 . 10 1 1 A 26 26 PHE HA H 26 4.690 4.989 -0.299 1
1 236 . 10 1 1 A 26 26 PHE C C 26 175.523 174.907 0.616 1
1 237 . 10 1 1 A 26 26 PHE CA C 26 57.312 55.911 1.401 1
1 238 . 10 1 1 A 26 26 PHE CB C 26 39.003 41.677 -2.674 1
1 243 . 10 1 1 A 27 27 GLY H H 27 7.755 8.648 -0.893 1
1 244 . 10 1 1 A 27 27 GLY HA2 H 27 4.172 3.615 0.557 1
1 245 . 10 1 1 A 27 27 GLY HA3 H 27 3.783 3.858 -0.075 1
1 246 . 10 1 1 A 27 27 GLY C C 27 172.557 174.564 -2.007 1
1 247 . 10 1 1 A 27 27 GLY CA C 27 44.924 46.722 -1.798 1
1 248 . 10 1 1 A 27 27 GLY N N 27 109.216 108.938 0.278 1
1 249 . 10 1 1 A 28 28 LYS H H 28 8.241 8.157 0.084 1
1 250 . 10 1 1 A 28 28 LYS HA H 28 4.530 4.304 0.226 1
1 259 . 10 1 1 A 28 28 LYS C C 28 176.204 174.824 1.380 1
1 260 . 10 1 1 A 28 28 LYS CA C 28 55.741 55.112 0.629 1
1 261 . 10 1 1 A 28 28 LYS CB C 28 33.904 30.877 3.027 1
1 265 . 10 1 1 A 28 28 LYS N N 28 118.743 118.808 -0.065 1
1 266 . 10 1 1 A 29 29 LYS H H 29 8.356 7.733 0.623 1
1 267 . 10 1 1 A 29 29 LYS HA H 29 4.559 4.883 -0.324 1
1 274 . 10 1 1 A 29 29 LYS C C 29 175.420 174.573 0.847 1
1 275 . 10 1 1 A 29 29 LYS CA C 29 55.406 55.144 0.262 1
1 276 . 10 1 1 A 29 29 LYS CB C 29 35.618 36.350 -0.732 1
1 280 . 10 1 1 A 29 29 LYS N N 29 121.198 124.648 -3.450 1
1 281 . 10 1 1 A 30 30 TRP H H 30 8.891 8.765 0.126 1
1 282 . 10 1 1 A 30 30 TRP HA H 30 4.951 4.873 0.078 1
1 291 . 10 1 1 A 30 30 TRP C C 30 175.902 176.404 -0.502 1
1 292 . 10 1 1 A 30 30 TRP CA C 30 56.677 57.214 -0.537 1
1 293 . 10 1 1 A 30 30 TRP CB C 30 30.614 30.511 0.103 1
1 299 . 10 1 1 A 30 30 TRP N N 30 123.304 124.675 -1.371 1
1 301 . 10 1 1 A 31 31 ARG H H 31 8.712 9.036 -0.324 1
1 302 . 10 1 1 A 31 31 ARG HA H 31 4.820 4.796 0.024 1
1 309 . 10 1 1 A 31 31 ARG C C 31 174.026 174.857 -0.831 1
1 310 . 10 1 1 A 31 31 ARG CA C 31 54.895 54.233 0.662 1
1 311 . 10 1 1 A 31 31 ARG CB C 31 34.045 33.005 1.040 1
1 314 . 10 1 1 A 31 31 ARG N N 31 123.973 123.125 0.848 1
1 315 . 10 1 1 A 32 32 ARG H H 32 8.820 8.365 0.455 1
1 316 . 10 1 1 A 32 32 ARG HA H 32 3.965 4.803 -0.838 1
1 323 . 10 1 1 A 32 32 ARG C C 32 174.785 175.333 -0.548 1
1 324 . 10 1 1 A 32 32 ARG CA C 32 56.924 55.448 1.476 1
1 325 . 10 1 1 A 32 32 ARG CB C 32 31.806 32.328 -0.522 1
1 328 . 10 1 1 A 32 32 ARG N N 32 127.041 121.257 5.784 1
1 329 . 10 1 1 A 33 33 PHE H H 33 9.372 8.516 0.856 1
1 330 . 10 1 1 A 33 33 PHE HA H 33 4.863 4.953 -0.090 1
1 338 . 10 1 1 A 33 33 PHE C C 33 176.359 175.262 1.097 1
1 339 . 10 1 1 A 33 33 PHE CA C 33 57.224 56.516 0.708 1
1 340 . 10 1 1 A 33 33 PHE CB C 33 43.385 41.832 1.553 1
1 346 . 10 1 1 A 33 33 PHE N N 33 125.882 119.256 6.626 1
1 347 . 10 1 1 A 34 34 GLY H H 34 9.160 8.823 0.337 1
1 348 . 10 1 1 A 34 34 GLY HA2 H 34 4.182 4.012 0.170 1
1 349 . 10 1 1 A 34 34 GLY HA3 H 34 3.714 4.020 -0.306 1
1 350 . 10 1 1 A 34 34 GLY C C 34 172.920 173.194 -0.274 1
1 351 . 10 1 1 A 34 34 GLY CA C 34 46.247 45.978 0.269 1
1 352 . 10 1 1 A 34 34 GLY N N 34 108.654 111.650 -2.996 1
1 353 . 10 1 1 A 35 35 ALA H H 35 8.982 8.266 0.716 1
1 354 . 10 1 1 A 35 35 ALA HA H 35 5.660 5.392 0.268 1
1 358 . 10 1 1 A 35 35 ALA C C 35 176.547 175.988 0.559 1
1 359 . 10 1 1 A 35 35 ALA CA C 35 50.500 50.443 0.057 1
1 360 . 10 1 1 A 35 35 ALA CB C 35 24.034 21.419 2.615 1
1 361 . 10 1 1 A 35 35 ALA N N 35 130.076 127.726 2.350 1
1 362 . 10 1 1 A 36 36 SER H H 36 8.852 8.547 0.305 1
1 363 . 10 1 1 A 36 36 SER HA H 36 5.203 4.930 0.273 1
1 366 . 10 1 1 A 36 36 SER C C 36 170.939 172.583 -1.644 1
1 367 . 10 1 1 A 36 36 SER CA C 36 57.806 57.426 0.380 1
1 368 . 10 1 1 A 36 36 SER CB C 36 66.986 65.555 1.431 1
1 369 . 10 1 1 A 36 36 SER N N 36 116.620 117.731 -1.111 1
1 370 . 10 1 1 A 37 37 LEU H H 37 8.862 8.932 -0.070 1
1 371 . 10 1 1 A 37 37 LEU HA H 37 5.163 4.870 0.293 1
1 381 . 10 1 1 A 37 37 LEU C C 37 173.525 173.982 -0.457 1
1 382 . 10 1 1 A 37 37 LEU CA C 37 53.112 53.571 -0.459 1
1 383 . 10 1 1 A 37 37 LEU CB C 37 46.077 43.386 2.691 1
1 387 . 10 1 1 A 37 37 LEU N N 37 127.638 129.120 -1.482 1
1 388 . 10 1 1 A 38 38 TYR H H 38 9.280 8.799 0.481 1
1 389 . 10 1 1 A 38 38 TYR HA H 38 4.820 5.403 -0.583 1
1 396 . 10 1 1 A 38 38 TYR C C 38 175.430 175.077 0.353 1
1 397 . 10 1 1 A 38 38 TYR CA C 38 57.436 56.077 1.359 1
1 398 . 10 1 1 A 38 38 TYR CB C 38 42.128 41.433 0.695 1
1 403 . 10 1 1 A 38 38 TYR N N 38 125.215 126.771 -1.556 1
1 404 . 10 1 1 A 39 39 GLY H H 39 8.532 8.448 0.084 1
1 405 . 10 1 1 A 39 39 GLY HA2 H 39 4.220 4.201 0.019 1
1 406 . 10 1 1 A 39 39 GLY HA3 H 39 3.941 4.208 -0.267 1
1 407 . 10 1 1 A 39 39 GLY C C 39 172.950 173.873 -0.923 1
1 408 . 10 1 1 A 39 39 GLY CA C 39 44.817 44.618 0.199 1
1 409 . 10 1 1 A 39 39 GLY N N 39 106.424 109.797 -3.373 1
1 410 . 10 1 1 A 40 40 GLY H H 40 8.477 8.643 -0.166 1
1 411 . 10 1 1 A 40 40 GLY HA2 H 40 4.102 3.802 0.300 1
1 412 . 10 1 1 A 40 40 GLY HA3 H 40 3.927 3.805 0.122 1
1 413 . 10 1 1 A 40 40 GLY C C 40 174.002 173.608 0.394 1
1 414 . 10 1 1 A 40 40 GLY CA C 40 44.694 47.063 -2.369 1
1 415 . 10 1 1 A 40 40 GLY N N 40 106.881 108.829 -1.948 1
1 416 . 10 1 1 A 41 41 SER H H 41 8.600 7.810 0.790 1
1 417 . 10 1 1 A 41 41 SER HA H 41 4.520 4.744 -0.224 1
1 420 . 10 1 1 A 41 41 SER C C 41 174.355 172.234 2.121 1
1 421 . 10 1 1 A 41 41 SER CA C 41 58.565 57.057 1.508 1
1 422 . 10 1 1 A 41 41 SER CB C 41 64.413 64.787 -0.374 1
1 423 . 10 1 1 A 41 41 SER N N 41 115.751 113.985 1.766 1
1 424 . 10 1 1 A 42 42 ASP H H 42 8.533 8.800 -0.267 1
1 425 . 10 1 1 A 42 42 ASP HA H 42 4.560 4.790 -0.230 1
1 428 . 10 1 1 A 42 42 ASP CA C 42 55.230 53.592 1.638 1
1 429 . 10 1 1 A 42 42 ASP CB C 42 40.648 42.030 -1.382 1
1 430 . 10 1 1 A 42 42 ASP N N 42 119.037 121.495 -2.458 1
1 431 . 10 1 1 A 43 43 CYS H H 43 8.152 8.659 -0.507 1
1 432 . 10 1 1 A 43 43 CYS HA H 43 4.541 4.021 0.520 1
1 435 . 10 1 1 A 43 43 CYS C C 43 173.975 173.704 0.271 1
1 436 . 10 1 1 A 43 43 CYS CA C 43 58.265 60.368 -2.103 1
1 437 . 10 1 1 A 43 43 CYS CB C 43 28.393 26.541 1.852 1
1 438 . 10 1 1 A 43 43 CYS N N 43 116.881 116.697 0.184 1
1 439 . 10 1 1 A 44 44 ALA H H 44 8.047 7.295 0.752 1
1 440 . 10 1 1 A 44 44 ALA HA H 44 4.395 4.752 -0.357 1
1 444 . 10 1 1 A 44 44 ALA C C 44 176.472 175.108 1.364 1
1 445 . 10 1 1 A 44 44 ALA CA C 44 52.688 51.768 0.920 1
1 446 . 10 1 1 A 44 44 ALA CB C 44 20.579 22.647 -2.068 1
1 447 . 10 1 1 A 44 44 ALA N N 44 125.989 118.612 7.377 1
1 448 . 10 1 1 A 45 45 LEU H H 45 8.052 8.573 -0.521 1
1 449 . 10 1 1 A 45 45 LEU HA H 45 4.452 5.028 -0.576 1
1 459 . 10 1 1 A 45 45 LEU C C 45 176.196 175.615 0.581 1
1 460 . 10 1 1 A 45 45 LEU CA C 45 53.771 53.404 0.367 1
1 461 . 10 1 1 A 45 45 LEU CB C 45 43.116 45.701 -2.585 1
1 465 . 10 1 1 A 45 45 LEU N N 45 119.889 119.151 0.738 1
1 466 . 10 1 1 A 46 46 ALA H H 46 8.381 8.468 -0.087 1
1 467 . 10 1 1 A 46 46 ALA HA H 46 4.449 5.250 -0.801 1
1 471 . 10 1 1 A 46 46 ALA C C 46 179.093 176.792 2.301 1
1 472 . 10 1 1 A 46 46 ALA CA C 46 52.829 51.053 1.776 1
1 473 . 10 1 1 A 46 46 ALA CB C 46 18.687 20.482 -1.795 1
1 474 . 10 1 1 A 46 46 ALA N N 46 125.635 123.688 1.947 1
1 475 . 10 1 1 A 47 47 ARG H H 47 9.012 8.759 0.253 1
1 476 . 10 1 1 A 47 47 ARG HA H 47 5.192 5.060 0.132 1
1 484 . 10 1 1 A 47 47 ARG C C 47 171.524 173.849 -2.325 1
1 485 . 10 1 1 A 47 47 ARG CA C 47 55.265 55.097 0.168 1
1 486 . 10 1 1 A 47 47 ARG CB C 47 30.970 33.989 -3.019 1
1 489 . 10 1 1 A 47 47 ARG N N 47 120.048 117.023 3.025 1
1 491 . 10 1 1 A 48 48 LEU H H 48 9.029 8.964 0.065 1
1 492 . 10 1 1 A 48 48 LEU HA H 48 5.221 5.021 0.200 1
1 502 . 10 1 1 A 48 48 LEU C C 48 174.348 174.982 -0.634 1
1 503 . 10 1 1 A 48 48 LEU CA C 48 53.253 54.004 -0.751 1
1 504 . 10 1 1 A 48 48 LEU CB C 48 45.419 43.890 1.529 1
1 508 . 10 1 1 A 48 48 LEU N N 48 123.315 123.751 -0.436 1
1 509 . 10 1 1 A 49 49 GLU H H 49 9.473 8.768 0.705 1
1 510 . 10 1 1 A 49 49 GLU HA H 49 5.222 4.916 0.306 1
1 515 . 10 1 1 A 49 49 GLU C C 49 175.507 175.481 0.026 1
1 516 . 10 1 1 A 49 49 GLU CA C 49 55.159 55.137 0.022 1
1 517 . 10 1 1 A 49 49 GLU CB C 49 32.341 31.948 0.393 1
1 519 . 10 1 1 A 49 49 GLU N N 49 124.751 126.900 -2.149 1
1 520 . 10 1 1 A 50 50 LEU H H 50 9.088 9.015 0.073 1
1 521 . 10 1 1 A 50 50 LEU HA H 50 5.382 5.210 0.172 1
1 531 . 10 1 1 A 50 50 LEU C C 50 175.474 175.865 -0.391 1
1 532 . 10 1 1 A 50 50 LEU CA C 50 52.865 53.335 -0.470 1
1 533 . 10 1 1 A 50 50 LEU CB C 50 43.239 45.168 -1.929 1
1 537 . 10 1 1 A 50 50 LEU N N 50 124.221 124.295 -0.074 1
1 538 . 10 1 1 A 51 51 GLN H H 51 9.602 8.826 0.776 1
1 539 . 10 1 1 A 51 51 GLN HA H 51 5.095 5.041 0.054 1
1 546 . 10 1 1 A 51 51 GLN C C 51 175.306 173.979 1.327 1
1 547 . 10 1 1 A 51 51 GLN CA C 51 54.576 54.398 0.178 1
1 548 . 10 1 1 A 51 51 GLN CB C 51 32.177 31.292 0.885 1
1 550 . 10 1 1 A 51 51 GLN N N 51 123.268 121.353 1.915 1
1 552 . 10 1 1 A 52 52 GLU H H 52 9.172 8.951 0.221 1
1 553 . 10 1 1 A 52 52 GLU HA H 52 4.092 5.069 -0.977 1
1 558 . 10 1 1 A 52 52 GLU C C 52 176.523 175.489 1.034 1
1 559 . 10 1 1 A 52 52 GLU CA C 52 57.500 54.979 2.521 1
1 560 . 10 1 1 A 52 52 GLU CB C 52 30.696 30.748 -0.052 1
1 562 . 10 1 1 A 52 52 GLU N N 52 128.982 125.235 3.747 1
1 563 . 10 1 1 A 53 53 GLY H H 53 8.644 8.315 0.329 1
1 564 . 10 1 1 A 53 53 GLY HA2 H 53 4.261 4.248 0.013 1
1 565 . 10 1 1 A 53 53 GLY HA3 H 53 3.993 4.258 -0.265 1
1 566 . 10 1 1 A 53 53 GLY C C 53 172.550 171.697 0.853 1
1 567 . 10 1 1 A 53 53 GLY CA C 53 45.911 45.627 0.284 1
1 568 . 10 1 1 A 53 53 GLY N N 53 110.844 112.272 -1.428 1
1 569 . 10 1 1 A 54 54 PRO HA H 54 4.392 4.413 -0.021 1
1 576 . 10 1 1 A 54 54 PRO C C 54 176.828 177.491 -0.663 1
1 577 . 10 1 1 A 54 54 PRO CA C 54 63.665 63.949 -0.284 1
1 578 . 10 1 1 A 54 54 PRO CB C 54 32.012 31.446 0.566 1
1 581 . 10 1 1 A 55 55 GLU H H 55 8.934 8.968 -0.034 1
1 582 . 10 1 1 A 55 55 GLU HA H 55 4.193 3.980 0.213 1
1 587 . 10 1 1 A 55 55 GLU C C 55 176.189 175.948 0.241 1
1 588 . 10 1 1 A 55 55 GLU CA C 55 57.383 57.221 0.162 1
1 589 . 10 1 1 A 55 55 GLU CB C 55 28.945 28.303 0.642 1
1 591 . 10 1 1 A 55 55 GLU N N 55 120.312 122.521 -2.209 1
1 592 . 10 1 1 A 56 56 LYS H H 56 7.937 7.684 0.253 1
1 593 . 10 1 1 A 56 56 LYS HA H 56 4.578 4.635 -0.057 1
1 602 . 10 1 1 A 56 56 LYS C C 56 174.295 176.548 -2.253 1
1 603 . 10 1 1 A 56 56 LYS CA C 56 54.171 55.096 -0.925 1
1 604 . 10 1 1 A 56 56 LYS CB C 56 32.555 32.615 -0.060 1
1 608 . 10 1 1 A 56 56 LYS N N 56 122.008 116.673 5.335 1
1 609 . 10 1 1 A 57 57 PRO HA H 57 4.370 4.467 -0.097 1
1 616 . 10 1 1 A 57 57 PRO CA C 57 63.431 64.041 -0.610 1
1 617 . 10 1 1 A 57 57 PRO CB C 57 32.072 31.991 0.081 1
1 620 . 10 1 1 A 58 58 ARG H H 58 8.310 7.563 0.747 1
1 621 . 10 1 1 A 58 58 ARG HA H 58 4.295 4.786 -0.491 1
1 628 . 10 1 1 A 58 58 ARG CA C 58 56.570 55.015 1.555 1
1 629 . 10 1 1 A 58 58 ARG CB C 58 30.860 33.784 -2.924 1
1 632 . 10 1 1 A 58 58 ARG N N 58 120.045 117.254 2.791 1
1 633 . 10 1 1 A 60 60 CYS HA H 60 4.482 4.877 -0.395 1
1 636 . 10 1 1 A 60 60 CYS CA C 60 58.621 57.258 1.363 1
1 637 . 10 1 1 A 60 60 CYS CB C 60 28.267 28.545 -0.278 1
1 638 . 10 1 1 A 61 61 GLU HA H 61 4.226 4.769 -0.543 1
1 643 . 10 1 1 A 61 61 GLU C C 61 176.299 175.832 0.467 1
1 644 . 10 1 1 A 61 61 GLU CA C 61 57.100 55.864 1.236 1
1 645 . 10 1 1 A 61 61 GLU CB C 61 29.873 30.603 -0.730 1
1 647 . 10 1 1 A 62 62 ALA H H 62 8.282 8.412 -0.130 1
1 648 . 10 1 1 A 62 62 ALA HA H 62 4.302 4.361 -0.059 1
1 652 . 10 1 1 A 62 62 ALA C C 62 177.277 176.339 0.938 1
1 653 . 10 1 1 A 62 62 ALA CA C 62 52.512 53.818 -1.306 1
1 654 . 10 1 1 A 62 62 ALA CB C 62 19.592 20.058 -0.466 1
1 655 . 10 1 1 A 62 62 ALA N N 62 124.386 124.551 -0.165 1
1 656 . 10 1 1 A 63 63 ALA H H 63 8.399 7.903 0.496 1
1 657 . 10 1 1 A 63 63 ALA HA H 63 4.375 4.353 0.022 1
1 661 . 10 1 1 A 63 63 ALA C C 63 176.843 176.303 0.540 1
1 662 . 10 1 1 A 63 63 ALA CA C 63 52.658 51.278 1.380 1
1 663 . 10 1 1 A 63 63 ALA CB C 63 19.592 18.332 1.260 1
1 664 . 10 1 1 A 63 63 ALA N N 63 123.892 119.839 4.053 1
1 665 . 10 1 1 A 64 64 ARG H H 64 8.152 8.729 -0.577 1
1 666 . 10 1 1 A 64 64 ARG HA H 64 5.008 4.726 0.282 1
1 673 . 10 1 1 A 64 64 ARG C C 64 175.594 175.059 0.535 1
1 674 . 10 1 1 A 64 64 ARG CA C 64 55.282 55.692 -0.410 1
1 675 . 10 1 1 A 64 64 ARG CB C 64 32.506 31.392 1.114 1
1 678 . 10 1 1 A 64 64 ARG N N 64 119.787 125.819 -6.032 1
1 679 . 10 1 1 A 65 65 LYS H H 65 8.945 8.749 0.196 1
1 680 . 10 1 1 A 65 65 LYS HA H 65 4.602 4.988 -0.386 1
1 689 . 10 1 1 A 65 65 LYS C C 65 174.657 174.399 0.258 1
1 690 . 10 1 1 A 65 65 LYS CA C 65 54.948 54.854 0.094 1
1 691 . 10 1 1 A 65 65 LYS CB C 65 34.068 34.386 -0.318 1
1 695 . 10 1 1 A 65 65 LYS N N 65 124.171 126.017 -1.846 1
1 696 . 10 1 1 A 66 66 VAL H H 66 8.672 9.023 -0.351 1
1 697 . 10 1 1 A 66 66 VAL HA H 66 4.532 5.292 -0.760 1
1 705 . 10 1 1 A 66 66 VAL C C 66 175.078 173.831 1.247 1
1 706 . 10 1 1 A 66 66 VAL CA C 66 61.865 59.658 2.207 1
1 707 . 10 1 1 A 66 66 VAL CB C 66 33.835 34.539 -0.704 1
1 710 . 10 1 1 A 66 66 VAL N N 66 124.380 122.955 1.425 1
1 711 . 10 1 1 A 67 67 ILE H H 67 9.071 9.173 -0.102 1
1 712 . 10 1 1 A 67 67 ILE HA H 67 4.142 4.590 -0.448 1
1 722 . 10 1 1 A 67 67 ILE C C 67 175.819 175.619 0.200 1
1 723 . 10 1 1 A 67 67 ILE CA C 67 60.383 60.438 -0.055 1
1 724 . 10 1 1 A 67 67 ILE CB C 67 39.908 38.132 1.776 1
1 728 . 10 1 1 A 67 67 ILE N N 67 129.537 129.364 0.173 1
1 729 . 10 1 1 A 68 68 ARG H H 68 9.203 8.696 0.507 1
1 730 . 10 1 1 A 68 68 ARG HA H 68 4.198 4.301 -0.103 1
1 737 . 10 1 1 A 68 68 ARG C C 68 177.769 177.367 0.402 1
1 738 . 10 1 1 A 68 68 ARG CA C 68 56.835 57.177 -0.342 1
1 739 . 10 1 1 A 68 68 ARG CB C 68 29.832 30.537 -0.705 1
1 742 . 10 1 1 A 68 68 ARG N N 68 128.484 127.784 0.700 1
1 743 . 10 1 1 A 69 69 LEU H H 69 8.212 8.665 -0.453 1
1 744 . 10 1 1 A 69 69 LEU HA H 69 4.221 4.027 0.194 1
1 754 . 10 1 1 A 69 69 LEU C C 69 178.996 178.817 0.179 1
1 755 . 10 1 1 A 69 69 LEU CA C 69 57.136 57.733 -0.597 1
1 756 . 10 1 1 A 69 69 LEU CB C 69 39.455 41.362 -1.907 1
1 760 . 10 1 1 A 69 69 LEU N N 69 123.807 123.467 0.340 1
1 761 . 10 1 1 A 70 70 SER H H 70 8.823 8.080 0.743 1
1 762 . 10 1 1 A 70 70 SER HA H 70 4.331 4.053 0.278 1
1 765 . 10 1 1 A 70 70 SER C C 70 175.076 176.316 -1.240 1
1 766 . 10 1 1 A 70 70 SER CA C 70 60.329 61.004 -0.675 1
1 767 . 10 1 1 A 70 70 SER CB C 70 62.362 63.105 -0.743 1
1 768 . 10 1 1 A 70 70 SER N N 70 115.162 114.056 1.106 1
1 769 . 10 1 1 A 71 71 ASP H H 71 7.602 7.673 -0.071 1
1 770 . 10 1 1 A 71 71 ASP HA H 71 4.820 4.413 0.407 1
1 773 . 10 1 1 A 71 71 ASP C C 71 176.478 176.652 -0.174 1
1 774 . 10 1 1 A 71 71 ASP CA C 71 54.241 56.684 -2.443 1
1 775 . 10 1 1 A 71 71 ASP CB C 71 41.347 40.980 0.367 1
1 776 . 10 1 1 A 71 71 ASP N N 71 119.590 120.884 -1.294 1
1 777 . 10 1 1 A 72 72 CYS H H 72 7.715 7.391 0.324 1
1 778 . 10 1 1 A 72 72 CYS HA H 72 4.372 4.595 -0.223 1
1 781 . 10 1 1 A 72 72 CYS C C 72 173.690 174.682 -0.992 1
1 782 . 10 1 1 A 72 72 CYS CA C 72 60.836 58.752 2.084 1
1 783 . 10 1 1 A 72 72 CYS CB C 72 27.655 27.187 0.468 1
1 784 . 10 1 1 A 72 72 CYS N N 72 118.346 116.955 1.391 1
1 785 . 10 1 1 A 73 73 LEU H H 73 9.472 8.634 0.838 1
1 786 . 10 1 1 A 73 73 LEU HA H 73 4.593 3.960 0.633 1
1 796 . 10 1 1 A 73 73 LEU C C 73 177.562 177.501 0.061 1
1 797 . 10 1 1 A 73 73 LEU CA C 73 55.724 57.997 -2.273 1
1 798 . 10 1 1 A 73 73 LEU CB C 73 43.774 42.024 1.750 1
1 802 . 10 1 1 A 73 73 LEU N N 73 124.752 128.738 -3.986 1
1 803 . 10 1 1 A 74 74 ARG H H 74 7.658 7.790 -0.132 1
1 804 . 10 1 1 A 74 74 ARG HA H 74 4.592 5.328 -0.736 1
1 811 . 10 1 1 A 74 74 ARG C C 74 173.605 174.749 -1.144 1
1 812 . 10 1 1 A 74 74 ARG CA C 74 56.465 55.252 1.213 1
1 813 . 10 1 1 A 74 74 ARG CB C 74 34.068 35.011 -0.943 1
1 816 . 10 1 1 A 74 74 ARG N N 74 115.565 117.579 -2.014 1
1 817 . 10 1 1 A 75 75 VAL H H 75 8.622 8.707 -0.085 1
1 818 . 10 1 1 A 75 75 VAL HA H 75 5.170 5.228 -0.058 1
1 826 . 10 1 1 A 75 75 VAL C C 75 173.985 174.374 -0.389 1
1 827 . 10 1 1 A 75 75 VAL CA C 75 60.930 59.524 1.406 1
1 828 . 10 1 1 A 75 75 VAL CB C 75 35.073 36.378 -1.305 1
1 831 . 10 1 1 A 75 75 VAL N N 75 124.278 117.018 7.260 1
1 832 . 10 1 1 A 76 76 ALA H H 76 8.272 8.860 -0.588 1
1 833 . 10 1 1 A 76 76 ALA HA H 76 4.648 5.021 -0.373 1
1 837 . 10 1 1 A 76 76 ALA C C 76 175.630 176.290 -0.660 1
1 838 . 10 1 1 A 76 76 ALA CA C 76 51.294 51.323 -0.029 1
1 839 . 10 1 1 A 76 76 ALA CB C 76 22.759 23.922 -1.163 1
1 840 . 10 1 1 A 76 76 ALA N N 76 126.015 123.806 2.209 1
1 841 . 10 1 1 A 77 77 GLU H H 77 9.184 8.694 0.490 1
1 842 . 10 1 1 A 77 77 GLU HA H 77 4.060 5.198 -1.138 1
1 847 . 10 1 1 A 77 77 GLU C C 77 174.949 176.112 -1.163 1
1 848 . 10 1 1 A 77 77 GLU CA C 77 58.424 55.591 2.833 1
1 849 . 10 1 1 A 77 77 GLU CB C 77 30.161 31.404 -1.243 1
1 851 . 10 1 1 A 77 77 GLU N N 77 120.223 118.943 1.280 1
1 852 . 10 1 1 A 78 78 ALA H H 78 7.985 9.094 -1.109 1
1 853 . 10 1 1 A 78 78 ALA HA H 78 4.776 5.096 -0.320 1
1 857 . 10 1 1 A 78 78 ALA C C 78 177.250 176.120 1.130 1
1 858 . 10 1 1 A 78 78 ALA CA C 78 50.888 51.234 -0.346 1
1 859 . 10 1 1 A 78 78 ALA CB C 78 20.851 22.462 -1.611 1
1 860 . 10 1 1 A 78 78 ALA N N 78 125.143 126.273 -1.130 1
1 861 . 10 1 1 A 79 79 GLY H H 79 8.604 8.882 -0.278 1
1 862 . 10 1 1 A 79 79 GLY HA2 H 79 4.327 4.204 0.123 1
1 863 . 10 1 1 A 79 79 GLY HA3 H 79 3.963 4.231 -0.268 1
1 864 . 10 1 1 A 79 79 GLY C C 79 175.360 174.088 1.272 1
1 865 . 10 1 1 A 79 79 GLY CA C 79 44.925 45.360 -0.435 1
1 866 . 10 1 1 A 79 79 GLY N N 79 109.420 106.118 3.302 1
1 867 . 10 1 1 A 80 80 GLY H H 80 8.649 8.450 0.199 1
1 868 . 10 1 1 A 80 80 GLY HA2 H 80 3.962 4.037 -0.075 1
1 869 . 10 1 1 A 80 80 GLY HA3 H 80 3.962 4.047 -0.085 1
1 870 . 10 1 1 A 80 80 GLY C C 80 175.052 174.965 0.087 1
1 871 . 10 1 1 A 80 80 GLY CA C 80 45.955 45.615 0.340 1
1 872 . 10 1 1 A 80 80 GLY N N 80 108.295 113.298 -5.003 1
1 873 . 10 1 1 A 81 81 GLU H H 81 8.921 8.255 0.666 1
1 874 . 10 1 1 A 81 81 GLU HA H 81 4.298 4.290 0.008 1
1 879 . 10 1 1 A 81 81 GLU C C 81 176.532 176.609 -0.077 1
1 880 . 10 1 1 A 81 81 GLU CA C 81 57.118 58.208 -1.090 1
1 881 . 10 1 1 A 81 81 GLU CB C 81 28.599 29.051 -0.452 1
1 883 . 10 1 1 A 81 81 GLU N N 81 121.170 118.323 2.847 1
1 884 . 10 1 1 A 82 82 ALA H H 82 8.032 7.571 0.461 1
1 885 . 10 1 1 A 82 82 ALA HA H 82 4.371 4.372 -0.001 1
1 889 . 10 1 1 A 82 82 ALA C C 82 177.160 177.622 -0.462 1
1 890 . 10 1 1 A 82 82 ALA CA C 82 52.653 51.936 0.717 1
1 891 . 10 1 1 A 82 82 ALA CB C 82 19.304 20.529 -1.225 1
1 892 . 10 1 1 A 82 82 ALA N N 82 124.988 123.655 1.333 1
1 893 . 10 1 1 A 83 83 SER H H 83 8.319 8.992 -0.673 1
1 894 . 10 1 1 A 83 83 SER HA H 83 4.331 4.232 0.099 1
1 897 . 10 1 1 A 83 83 SER C C 83 174.045 175.058 -1.013 1
1 898 . 10 1 1 A 83 83 SER CA C 83 58.053 62.001 -3.948 1
1 899 . 10 1 1 A 83 83 SER CB C 83 63.184 62.660 0.524 1
1 900 . 10 1 1 A 83 83 SER N N 83 114.181 115.906 -1.725 1
1 901 . 10 1 1 A 84 84 SER H H 84 7.823 7.715 0.108 1
1 902 . 10 1 1 A 84 84 SER HA H 84 3.194 4.150 -0.956 1
1 905 . 10 1 1 A 84 84 SER C C 84 171.072 174.115 -3.043 1
1 906 . 10 1 1 A 84 84 SER CA C 84 57.206 57.025 0.181 1
1 907 . 10 1 1 A 84 84 SER CB C 84 61.622 63.459 -1.837 1
1 908 . 10 1 1 A 84 84 SER N N 84 117.302 115.467 1.835 1
1 909 . 10 1 1 A 85 85 PRO HA H 85 3.922 4.511 -0.589 1
1 916 . 10 1 1 A 85 85 PRO CA C 85 62.691 62.143 0.548 1
1 917 . 10 1 1 A 85 85 PRO CB C 85 31.515 32.873 -1.358 1
1 920 . 10 1 1 A 86 86 ARG HA H 86 3.882 4.339 -0.457 1
1 927 . 10 1 1 A 86 86 ARG C C 86 175.712 176.111 -0.399 1
1 928 . 10 1 1 A 86 86 ARG CA C 86 57.877 55.569 2.308 1
1 929 . 10 1 1 A 86 86 ARG CB C 86 29.791 31.893 -2.102 1
1 932 . 10 1 1 A 87 87 ASP H H 87 8.903 9.087 -0.184 1
1 933 . 10 1 1 A 87 87 ASP HA H 87 4.342 4.190 0.152 1
1 936 . 10 1 1 A 87 87 ASP C C 87 175.723 174.663 1.060 1
1 937 . 10 1 1 A 87 87 ASP CA C 87 56.377 55.027 1.350 1
1 938 . 10 1 1 A 87 87 ASP CB C 87 39.208 39.781 -0.573 1
1 939 . 10 1 1 A 87 87 ASP N N 87 117.520 124.150 -6.630 1
1 940 . 10 1 1 A 88 88 THR H H 88 7.776 7.434 0.342 1
1 941 . 10 1 1 A 88 88 THR HA H 88 5.101 5.146 -0.045 1
1 946 . 10 1 1 A 88 88 THR C C 88 173.825 173.004 0.821 1
1 947 . 10 1 1 A 88 88 THR CA C 88 60.154 59.641 0.513 1
1 948 . 10 1 1 A 88 88 THR CB C 88 72.702 73.257 -0.555 1
1 950 . 10 1 1 A 88 88 THR N N 88 108.770 108.505 0.265 1
1 951 . 10 1 1 A 89 89 SER H H 89 9.006 9.429 -0.423 1
1 952 . 10 1 1 A 89 89 SER HA H 89 4.718 5.201 -0.483 1
1 955 . 10 1 1 A 89 89 SER C C 89 173.728 173.071 0.657 1
1 956 . 10 1 1 A 89 89 SER CA C 89 57.453 57.843 -0.390 1
1 957 . 10 1 1 A 89 89 SER CB C 89 65.611 65.293 0.318 1
1 958 . 10 1 1 A 89 89 SER N N 89 114.151 117.276 -3.125 1
1 959 . 10 1 1 A 90 90 ALA H H 90 9.001 8.838 0.163 1
1 960 . 10 1 1 A 90 90 ALA HA H 90 5.660 4.665 0.995 1
1 964 . 10 1 1 A 90 90 ALA C C 90 177.669 177.424 0.245 1
1 965 . 10 1 1 A 90 90 ALA CA C 90 51.670 52.029 -0.359 1
1 966 . 10 1 1 A 90 90 ALA CB C 90 22.265 19.926 2.339 1
1 967 . 10 1 1 A 90 90 ALA N N 90 126.177 128.940 -2.763 1
1 968 . 10 1 1 A 91 91 PHE H H 91 9.672 8.438 1.234 1
1 969 . 10 1 1 A 91 91 PHE HA H 91 5.039 5.689 -0.650 1
1 977 . 10 1 1 A 91 91 PHE C C 91 170.731 173.772 -3.041 1
1 978 . 10 1 1 A 91 91 PHE CA C 91 56.271 55.123 1.148 1
1 979 . 10 1 1 A 91 91 PHE CB C 91 41.553 42.301 -0.748 1
1 985 . 10 1 1 A 91 91 PHE N N 91 118.968 116.771 2.197 1
1 986 . 10 1 1 A 92 92 PHE H H 92 9.422 9.315 0.107 1
1 987 . 10 1 1 A 92 92 PHE HA H 92 5.674 5.114 0.560 1
1 995 . 10 1 1 A 92 92 PHE C C 92 174.570 175.381 -0.811 1
1 996 . 10 1 1 A 92 92 PHE CA C 92 55.917 57.451 -1.534 1
1 997 . 10 1 1 A 92 92 PHE CB C 92 42.787 41.617 1.170 1
1 1003 . 10 1 1 A 92 92 PHE N N 92 117.543 118.101 -0.558 1
1 1004 . 10 1 1 A 93 93 LEU H H 93 9.021 8.780 0.241 1
1 1005 . 10 1 1 A 93 93 LEU HA H 93 5.122 4.978 0.144 1
1 1015 . 10 1 1 A 93 93 LEU C C 93 174.799 174.260 0.539 1
1 1016 . 10 1 1 A 93 93 LEU CA C 93 54.912 54.639 0.273 1
1 1017 . 10 1 1 A 93 93 LEU CB C 93 45.254 45.387 -0.133 1
1 1021 . 10 1 1 A 93 93 LEU N N 93 121.719 121.604 0.115 1
1 1022 . 10 1 1 A 94 94 GLU H H 94 9.294 9.410 -0.116 1
1 1023 . 10 1 1 A 94 94 GLU HA H 94 5.043 5.248 -0.205 1
1 1028 . 10 1 1 A 94 94 GLU C C 94 175.754 175.414 0.340 1
1 1029 . 10 1 1 A 94 94 GLU CA C 94 56.018 54.917 1.101 1
1 1030 . 10 1 1 A 94 94 GLU CB C 94 32.752 33.144 -0.392 1
1 1032 . 10 1 1 A 94 94 GLU N N 94 127.032 128.881 -1.849 1
1 1033 . 10 1 1 A 95 95 THR H H 95 8.822 8.543 0.279 1
1 1034 . 10 1 1 A 95 95 THR HA H 95 5.398 5.177 0.221 1
1 1039 . 10 1 1 A 95 95 THR C C 95 173.860 175.467 -1.607 1
1 1040 . 10 1 1 A 95 95 THR CA C 95 59.588 59.593 -0.005 1
1 1041 . 10 1 1 A 95 95 THR CB C 95 72.191 72.394 -0.203 1
1 1043 . 10 1 1 A 95 95 THR N N 95 118.685 117.991 0.694 1
1 1044 . 10 1 1 A 96 96 LYS H H 96 8.823 8.965 -0.142 1
1 1045 . 10 1 1 A 96 96 LYS HA H 96 4.022 3.984 0.038 1
1 1054 . 10 1 1 A 96 96 LYS C C 96 177.330 178.431 -1.101 1
1 1055 . 10 1 1 A 96 96 LYS CA C 96 59.588 60.197 -0.609 1
1 1056 . 10 1 1 A 96 96 LYS CB C 96 32.588 32.126 0.462 1
1 1060 . 10 1 1 A 96 96 LYS N N 96 118.801 122.479 -3.678 1
1 1061 . 10 1 1 A 97 97 GLU H H 97 8.092 7.854 0.238 1
1 1062 . 10 1 1 A 97 97 GLU HA H 97 4.282 4.197 0.085 1
1 1067 . 10 1 1 A 97 97 GLU C C 97 176.290 176.831 -0.541 1
1 1068 . 10 1 1 A 97 97 GLU CA C 97 57.365 58.854 -1.489 1
1 1069 . 10 1 1 A 97 97 GLU CB C 97 31.559 29.942 1.617 1
1 1071 . 10 1 1 A 97 97 GLU N N 97 113.992 119.408 -5.416 1
1 1072 . 10 1 1 A 98 98 ARG H H 98 7.482 7.090 0.392 1
1 1073 . 10 1 1 A 98 98 ARG HA H 98 4.397 4.582 -0.185 1
1 1080 . 10 1 1 A 98 98 ARG C C 98 172.792 173.135 -0.343 1
1 1081 . 10 1 1 A 98 98 ARG CA C 98 55.689 54.518 1.171 1
1 1082 . 10 1 1 A 98 98 ARG CB C 98 32.711 31.776 0.935 1
1 1085 . 10 1 1 A 98 98 ARG N N 98 116.022 113.451 2.571 1
1 1086 . 10 1 1 A 99 99 LEU H H 99 8.423 8.288 0.135 1
1 1087 . 10 1 1 A 99 99 LEU HA H 99 4.807 4.761 0.046 1
1 1097 . 10 1 1 A 99 99 LEU C C 99 175.903 173.970 1.933 1
1 1098 . 10 1 1 A 99 99 LEU CA C 99 54.383 53.603 0.780 1
1 1099 . 10 1 1 A 99 99 LEU CB C 99 43.362 44.199 -0.837 1
1 1103 . 10 1 1 A 99 99 LEU N N 99 124.983 121.300 3.683 1
1 1104 . 10 1 1 A 100 100 TYR H H 100 9.144 9.444 -0.300 1
1 1105 . 10 1 1 A 100 100 TYR HA H 100 4.542 5.272 -0.730 1
1 1112 . 10 1 1 A 100 100 TYR C C 100 173.479 174.376 -0.897 1
1 1113 . 10 1 1 A 100 100 TYR CA C 100 57.735 56.266 1.469 1
1 1114 . 10 1 1 A 100 100 TYR CB C 100 39.291 41.699 -2.408 1
1 1119 . 10 1 1 A 100 100 TYR N N 100 126.679 126.958 -0.279 1
1 1120 . 10 1 1 A 101 101 LEU H H 101 9.043 8.904 0.139 1
1 1121 . 10 1 1 A 101 101 LEU HA H 101 4.747 4.868 -0.121 1
1 1131 . 10 1 1 A 101 101 LEU C C 101 173.530 174.884 -1.354 1
1 1132 . 10 1 1 A 101 101 LEU CA C 101 54.524 53.796 0.728 1
1 1133 . 10 1 1 A 101 101 LEU CB C 101 42.499 44.789 -2.290 1
1 1137 . 10 1 1 A 101 101 LEU N N 101 127.422 124.466 2.956 1
1 1138 . 10 1 1 A 102 102 LEU H H 102 8.493 8.717 -0.224 1
1 1139 . 10 1 1 A 102 102 LEU HA H 102 5.612 5.554 0.058 1
1 1149 . 10 1 1 A 102 102 LEU C C 102 175.794 175.723 0.071 1
1 1150 . 10 1 1 A 102 102 LEU CA C 102 53.076 53.356 -0.280 1
1 1151 . 10 1 1 A 102 102 LEU CB C 102 45.994 45.328 0.666 1
1 1155 . 10 1 1 A 102 102 LEU N N 102 126.021 128.646 -2.625 1
1 1156 . 10 1 1 A 103 103 ALA H H 103 9.073 8.931 0.142 1
1 1157 . 10 1 1 A 103 103 ALA HA H 103 5.081 5.402 -0.321 1
1 1161 . 10 1 1 A 103 103 ALA C C 103 175.133 175.922 -0.789 1
1 1162 . 10 1 1 A 103 103 ALA CA C 103 51.688 49.793 1.895 1
1 1163 . 10 1 1 A 103 103 ALA CB C 103 21.689 22.585 -0.896 1
1 1164 . 10 1 1 A 103 103 ALA N N 103 117.679 123.347 -5.668 1
1 1165 . 10 1 1 A 104 104 ALA H H 104 8.582 8.624 -0.042 1
1 1166 . 10 1 1 A 104 104 ALA HA H 104 5.220 4.895 0.325 1
1 1170 . 10 1 1 A 104 104 ALA C C 104 173.471 174.274 -0.803 1
1 1171 . 10 1 1 A 104 104 ALA CA C 104 47.959 49.857 -1.898 1
1 1172 . 10 1 1 A 104 104 ALA CB C 104 21.359 22.459 -1.100 1
1 1173 . 10 1 1 A 104 104 ALA N N 104 123.419 121.336 2.083 1
1 1174 . 10 1 1 A 105 105 PRO HA H 105 4.542 4.791 -0.249 1
1 1181 . 10 1 1 A 105 105 PRO C C 105 178.409 177.951 0.458 1
1 1182 . 10 1 1 A 105 105 PRO CA C 105 64.301 62.834 1.467 1
1 1183 . 10 1 1 A 105 105 PRO CB C 105 32.094 31.653 0.441 1
1 1186 . 10 1 1 A 106 106 ALA H H 106 8.302 8.683 -0.381 1
1 1187 . 10 1 1 A 106 106 ALA HA H 106 4.022 4.034 -0.012 1
1 1191 . 10 1 1 A 106 106 ALA C C 106 179.641 179.703 -0.062 1
1 1192 . 10 1 1 A 106 106 ALA CA C 106 56.341 55.181 1.160 1
1 1193 . 10 1 1 A 106 106 ALA CB C 106 18.523 18.210 0.313 1
1 1194 . 10 1 1 A 106 106 ALA N N 106 127.733 127.932 -0.199 1
1 1195 . 10 1 1 A 107 107 ALA H H 107 9.035 8.078 0.957 1
1 1196 . 10 1 1 A 107 107 ALA HA H 107 4.331 4.037 0.294 1
1 1200 . 10 1 1 A 107 107 ALA C C 107 178.586 179.636 -1.050 1
1 1201 . 10 1 1 A 107 107 ALA CA C 107 53.765 55.210 -1.445 1
1 1202 . 10 1 1 A 107 107 ALA CB C 107 18.728 18.295 0.433 1
1 1203 . 10 1 1 A 107 107 ALA N N 107 118.203 119.864 -1.661 1
1 1204 . 10 1 1 A 108 108 GLU H H 108 8.399 8.227 0.172 1
1 1205 . 10 1 1 A 108 108 GLU HA H 108 4.631 4.165 0.466 1
1 1210 . 10 1 1 A 108 108 GLU C C 108 177.127 178.923 -1.796 1
1 1211 . 10 1 1 A 108 108 GLU CA C 108 55.847 58.781 -2.934 1
1 1212 . 10 1 1 A 108 108 GLU CB C 108 32.135 30.184 1.951 1
1 1214 . 10 1 1 A 108 108 GLU N N 108 114.661 118.175 -3.514 1
1 1215 . 10 1 1 A 109 109 ARG H H 109 7.412 8.667 -1.255 1
1 1216 . 10 1 1 A 109 109 ARG HA H 109 3.682 4.139 -0.457 1
1 1223 . 10 1 1 A 109 109 ARG C C 109 176.917 179.336 -2.419 1
1 1224 . 10 1 1 A 109 109 ARG CA C 109 61.600 59.803 1.797 1
1 1225 . 10 1 1 A 109 109 ARG CB C 109 28.845 30.427 -1.582 1
1 1228 . 10 1 1 A 109 109 ARG N N 109 120.954 120.951 0.003 1
1 1229 . 10 1 1 A 110 110 GLY H H 110 8.833 8.496 0.337 1
1 1230 . 10 1 1 A 110 110 GLY HA2 H 110 3.872 3.815 0.057 1
1 1231 . 10 1 1 A 110 110 GLY HA3 H 110 3.685 3.829 -0.144 1
1 1232 . 10 1 1 A 110 110 GLY C C 110 175.997 175.223 0.774 1
1 1233 . 10 1 1 A 110 110 GLY CA C 110 47.323 47.594 -0.271 1
1 1234 . 10 1 1 A 110 110 GLY N N 110 106.563 107.299 -0.736 1
1 1235 . 10 1 1 A 111 111 ASP H H 111 7.882 8.168 -0.286 1
1 1236 . 10 1 1 A 111 111 ASP HA H 111 4.312 4.351 -0.039 1
1 1239 . 10 1 1 A 111 111 ASP C C 111 179.467 178.159 1.308 1
1 1240 . 10 1 1 A 111 111 ASP CA C 111 56.976 56.710 0.266 1
1 1241 . 10 1 1 A 111 111 ASP CB C 111 40.648 41.001 -0.353 1
1 1242 . 10 1 1 A 111 111 ASP N N 111 121.402 120.622 0.780 1
1 1243 . 10 1 1 A 112 112 TRP H H 112 7.804 8.388 -0.584 1
1 1244 . 10 1 1 A 112 112 TRP HA H 112 3.831 4.204 -0.373 1
1 1253 . 10 1 1 A 112 112 TRP C C 112 177.547 178.752 -1.205 1
1 1254 . 10 1 1 A 112 112 TRP CA C 112 62.006 59.929 2.077 1
1 1255 . 10 1 1 A 112 112 TRP CB C 112 29.421 29.198 0.223 1
1 1261 . 10 1 1 A 112 112 TRP N N 112 119.904 120.673 -0.769 1
1 1263 . 10 1 1 A 113 113 VAL H H 113 7.982 8.052 -0.070 1
1 1264 . 10 1 1 A 113 113 VAL HA H 113 3.072 3.641 -0.569 1
1 1272 . 10 1 1 A 113 113 VAL C C 113 178.015 178.490 -0.475 1
1 1273 . 10 1 1 A 113 113 VAL CA C 113 67.407 66.486 0.921 1
1 1274 . 10 1 1 A 113 113 VAL CB C 113 31.724 31.499 0.225 1
1 1277 . 10 1 1 A 113 113 VAL N N 113 117.575 119.071 -1.496 1
1 1278 . 10 1 1 A 114 114 GLN H H 114 8.268 7.912 0.356 1
1 1279 . 10 1 1 A 114 114 GLN HA H 114 3.994 4.048 -0.054 1
1 1286 . 10 1 1 A 114 114 GLN C C 114 178.021 178.137 -0.116 1
1 1287 . 10 1 1 A 114 114 GLN CA C 114 59.112 58.674 0.438 1
1 1288 . 10 1 1 A 114 114 GLN CB C 114 28.685 28.983 -0.298 1
1 1290 . 10 1 1 A 114 114 GLN N N 114 117.479 119.995 -2.516 1
1 1292 . 10 1 1 A 115 115 ALA H H 115 7.915 8.448 -0.533 1
1 1293 . 10 1 1 A 115 115 ALA HA H 115 3.972 4.099 -0.127 1
1 1297 . 10 1 1 A 115 115 ALA C C 115 180.030 180.182 -0.152 1
1 1298 . 10 1 1 A 115 115 ALA CA C 115 55.142 55.205 -0.063 1
1 1299 . 10 1 1 A 115 115 ALA CB C 115 18.152 18.276 -0.124 1
1 1300 . 10 1 1 A 115 115 ALA N N 115 120.858 120.651 0.207 1
1 1301 . 10 1 1 A 116 116 ILE H H 116 8.172 8.471 -0.299 1
1 1302 . 10 1 1 A 116 116 ILE HA H 116 3.482 3.628 -0.146 1
1 1312 . 10 1 1 A 116 116 ILE C C 116 177.739 177.561 0.178 1
1 1313 . 10 1 1 A 116 116 ILE CA C 116 66.119 65.300 0.819 1
1 1314 . 10 1 1 A 116 116 ILE CB C 116 38.222 37.836 0.386 1
1 1318 . 10 1 1 A 116 116 ILE N N 116 115.977 117.731 -1.754 1
1 1319 . 10 1 1 A 117 117 CYS H H 117 8.449 8.590 -0.141 1
1 1320 . 10 1 1 A 117 117 CYS HA H 117 4.032 4.509 -0.477 1
1 1323 . 10 1 1 A 117 117 CYS C C 117 177.321 176.181 1.140 1
1 1324 . 10 1 1 A 117 117 CYS CA C 117 64.777 62.019 2.758 1
1 1325 . 10 1 1 A 117 117 CYS CB C 117 26.871 27.213 -0.342 1
1 1326 . 10 1 1 A 117 117 CYS N N 117 117.253 120.923 -3.670 1
1 1327 . 10 1 1 A 118 118 LEU H H 118 8.182 7.675 0.507 1
1 1328 . 10 1 1 A 118 118 LEU HA H 118 4.052 4.263 -0.211 1
1 1338 . 10 1 1 A 118 118 LEU C C 118 179.217 179.108 0.109 1
1 1339 . 10 1 1 A 118 118 LEU CA C 118 57.877 56.996 0.881 1
1 1340 . 10 1 1 A 118 118 LEU CB C 118 42.088 41.883 0.205 1
1 1344 . 10 1 1 A 118 118 LEU N N 118 119.665 120.556 -0.891 1
1 1345 . 10 1 1 A 119 119 LEU H H 119 7.142 8.042 -0.900 1
1 1346 . 10 1 1 A 119 119 LEU HA H 119 4.192 4.195 -0.003 1
1 1356 . 10 1 1 A 119 119 LEU C C 119 178.492 178.411 0.081 1
1 1357 . 10 1 1 A 119 119 LEU CA C 119 56.259 57.993 -1.734 1
1 1358 . 10 1 1 A 119 119 LEU CB C 119 43.568 42.047 1.521 1
1 1362 . 10 1 1 A 119 119 LEU N N 119 116.244 119.881 -3.637 1
1 1363 . 10 1 1 A 120 120 ALA H H 120 8.513 8.347 0.166 1
1 1364 . 10 1 1 A 120 120 ALA HA H 120 3.878 3.976 -0.098 1
1 1368 . 10 1 1 A 120 120 ALA C C 120 178.358 178.272 0.086 1
1 1369 . 10 1 1 A 120 120 ALA CA C 120 53.765 54.846 -1.081 1
1 1370 . 10 1 1 A 120 120 ALA CB C 120 18.687 18.511 0.176 1
1 1371 . 10 1 1 A 120 120 ALA N N 120 120.009 119.796 0.213 1
1 1372 . 10 1 1 A 121 121 PHE H H 121 7.822 8.375 -0.553 1
1 1373 . 10 1 1 A 121 121 PHE HA H 121 5.156 5.034 0.122 1
1 1381 . 10 1 1 A 121 121 PHE C C 121 176.273 176.036 0.237 1
1 1382 . 10 1 1 A 121 121 PHE CA C 121 55.741 57.040 -1.299 1
1 1383 . 10 1 1 A 121 121 PHE CB C 121 39.455 38.536 0.919 1
1 1389 . 10 1 1 A 121 121 PHE N N 121 113.981 115.519 -1.538 1
1 1390 . 10 1 1 A 122 122 SER H H 122 7.765 8.043 -0.278 1
1 1391 . 10 1 1 A 122 122 SER HA H 122 4.579 4.691 -0.112 1
1 1394 . 10 1 1 A 122 122 SER C C 122 174.595 175.074 -0.479 1
1 1395 . 10 1 1 A 122 122 SER CA C 122 58.777 59.954 -1.177 1
1 1396 . 10 1 1 A 122 122 SER CB C 122 63.719 64.051 -0.332 1
1 1397 . 10 1 1 A 122 122 SER N N 122 115.069 114.438 0.631 1
1 1398 . 10 1 1 A 123 123 GLY H H 123 8.223 7.862 0.361 1
1 1399 . 10 1 1 A 123 123 GLY HA2 H 123 4.174 4.006 0.168 1
1 1400 . 10 1 1 A 123 123 GLY HA3 H 123 4.100 4.011 0.089 1
1 1401 . 10 1 1 A 123 123 GLY C C 123 171.678 175.029 -3.351 1
1 1402 . 10 1 1 A 123 123 GLY CA C 123 44.815 46.151 -1.336 1
1 1403 . 10 1 1 A 123 123 GLY N N 123 110.151 109.205 0.946 1
1 1404 . 10 1 1 A 124 124 PRO HA H 124 4.482 4.521 -0.039 1
1 1411 . 10 1 1 A 124 124 PRO C C 124 177.314 176.781 0.533 1
1 1412 . 10 1 1 A 124 124 PRO CA C 124 63.206 64.434 -1.228 1
1 1413 . 10 1 1 A 124 124 PRO CB C 124 32.176 31.969 0.207 1
1 1416 . 10 1 1 A 125 125 SER H H 125 8.485 7.730 0.755 1
1 1417 . 10 1 1 A 125 125 SER HA H 125 4.472 4.456 0.016 1
1 1420 . 10 1 1 A 125 125 SER C C 125 174.728 174.359 0.369 1
1 1421 . 10 1 1 A 125 125 SER CA C 125 58.353 58.675 -0.322 1
1 1422 . 10 1 1 A 125 125 SER CB C 125 64.048 63.517 0.531 1
1 1423 . 10 1 1 A 125 125 SER N N 125 116.081 111.986 4.095 1
1 1424 . 10 1 1 A 126 126 SER H H 126 8.332 8.474 -0.142 1
1 1425 . 10 1 1 A 126 126 SER HA H 126 4.464 4.795 -0.331 1
1 1428 . 10 1 1 A 126 126 SER C C 126 173.980 174.321 -0.341 1
1 1429 . 10 1 1 A 126 126 SER CA C 126 58.336 58.040 0.296 1
1 1430 . 10 1 1 A 126 126 SER CB C 126 63.925 64.610 -0.685 1
1 1431 . 10 1 1 A 126 126 SER N N 126 118.037 118.682 -0.645 1
1 1 . 11 1 1 A 6 6 SER HA H 6 4.458 4.736 -0.278 1
1 3 . 11 1 1 A 6 6 SER C C 6 175.108 174.127 0.981 1
1 4 . 11 1 1 A 6 6 SER CA C 6 58.689 57.570 1.119 1
1 5 . 11 1 1 A 6 6 SER CB C 6 63.678 63.237 0.441 1
1 6 . 11 1 1 A 7 7 GLY H H 7 8.449 7.984 0.465 1
1 7 . 11 1 1 A 7 7 GLY HA2 H 7 3.965 3.910 0.055 1
1 8 . 11 1 1 A 7 7 GLY HA3 H 7 3.965 3.911 0.054 1
1 9 . 11 1 1 A 7 7 GLY C C 7 174.380 174.453 -0.073 1
1 10 . 11 1 1 A 7 7 GLY CA C 7 45.435 46.994 -1.559 1
1 11 . 11 1 1 A 7 7 GLY N N 7 110.792 109.887 0.905 1
1 12 . 11 1 1 A 8 8 MET H H 8 8.259 7.771 0.488 1
1 13 . 11 1 1 A 8 8 MET HA H 8 4.487 4.951 -0.464 1
1 21 . 11 1 1 A 8 8 MET C C 8 176.961 175.600 1.361 1
1 22 . 11 1 1 A 8 8 MET CA C 8 55.565 54.602 0.963 1
1 23 . 11 1 1 A 8 8 MET CB C 8 32.835 35.276 -2.441 1
1 26 . 11 1 1 A 8 8 MET N N 8 119.639 118.744 0.895 1
1 27 . 11 1 1 A 9 9 GLY H H 9 8.472 8.589 -0.117 1
1 28 . 11 1 1 A 9 9 GLY HA2 H 9 3.946 4.094 -0.148 1
1 29 . 11 1 1 A 9 9 GLY HA3 H 9 3.946 4.094 -0.148 1
1 30 . 11 1 1 A 9 9 GLY C C 9 174.005 174.830 -0.825 1
1 31 . 11 1 1 A 9 9 GLY CA C 9 45.488 44.227 1.261 1
1 32 . 11 1 1 A 9 9 GLY N N 9 110.107 108.962 1.145 1
1 33 . 11 1 1 A 10 10 ASP H H 10 8.292 8.655 -0.363 1
1 34 . 11 1 1 A 10 10 ASP HA H 10 4.636 4.704 -0.068 1
1 37 . 11 1 1 A 10 10 ASP C C 10 176.768 176.766 0.002 1
1 38 . 11 1 1 A 10 10 ASP CA C 10 54.206 55.407 -1.201 1
1 39 . 11 1 1 A 10 10 ASP CB C 10 41.306 42.624 -1.318 1
1 40 . 11 1 1 A 10 10 ASP N N 10 120.370 120.939 -0.569 1
1 41 . 11 1 1 A 11 11 GLY H H 11 8.452 7.919 0.533 1
1 42 . 11 1 1 A 11 11 GLY HA2 H 11 3.980 4.118 -0.138 1
1 43 . 11 1 1 A 11 11 GLY HA3 H 11 4.022 4.165 -0.143 1
1 44 . 11 1 1 A 11 11 GLY C C 11 174.102 173.239 0.863 1
1 45 . 11 1 1 A 11 11 GLY CA C 11 45.170 45.465 -0.295 1
1 46 . 11 1 1 A 11 11 GLY N N 11 108.391 104.186 4.205 1
1 47 . 11 1 1 A 12 12 ALA H H 12 8.293 8.292 0.001 1
1 48 . 11 1 1 A 12 12 ALA HA H 12 3.777 4.188 -0.411 1
1 52 . 11 1 1 A 12 12 ALA C C 12 178.193 178.763 -0.570 1
1 53 . 11 1 1 A 12 12 ALA CA C 12 52.759 52.403 0.356 1
1 54 . 11 1 1 A 12 12 ALA CB C 12 17.855 18.766 -0.911 1
1 55 . 11 1 1 A 12 12 ALA N N 12 124.185 126.871 -2.686 1
1 56 . 11 1 1 A 13 13 VAL H H 13 8.822 8.616 0.206 1
1 57 . 11 1 1 A 13 13 VAL HA H 13 3.912 3.650 0.262 1
1 65 . 11 1 1 A 13 13 VAL C C 13 176.073 175.822 0.251 1
1 66 . 11 1 1 A 13 13 VAL CA C 13 63.100 66.727 -3.627 1
1 67 . 11 1 1 A 13 13 VAL CB C 13 32.711 31.900 0.811 1
1 70 . 11 1 1 A 13 13 VAL N N 13 120.877 123.808 -2.931 1
1 71 . 11 1 1 A 14 14 LYS H H 14 7.093 7.250 -0.157 1
1 72 . 11 1 1 A 14 14 LYS HA H 14 4.169 4.731 -0.562 1
1 81 . 11 1 1 A 14 14 LYS C C 14 173.291 174.750 -1.459 1
1 82 . 11 1 1 A 14 14 LYS CA C 14 56.465 54.782 1.683 1
1 83 . 11 1 1 A 14 14 LYS CB C 14 35.960 35.204 0.756 1
1 87 . 11 1 1 A 14 14 LYS N N 14 118.693 119.077 -0.384 1
1 88 . 11 1 1 A 15 15 GLN H H 15 8.522 8.334 0.188 1
1 89 . 11 1 1 A 15 15 GLN HA H 15 5.542 5.141 0.401 1
1 96 . 11 1 1 A 15 15 GLN C C 15 174.992 175.701 -0.709 1
1 97 . 11 1 1 A 15 15 GLN CA C 15 54.312 54.164 0.148 1
1 98 . 11 1 1 A 15 15 GLN CB C 15 33.585 31.464 2.121 1
1 100 . 11 1 1 A 15 15 GLN N N 15 124.024 124.944 -0.920 1
1 102 . 11 1 1 A 16 16 GLY H H 16 8.740 8.007 0.733 1
1 103 . 11 1 1 A 16 16 GLY HA2 H 16 4.511 3.792 0.719 1
1 104 . 11 1 1 A 16 16 GLY HA3 H 16 4.064 4.307 -0.243 1
1 105 . 11 1 1 A 16 16 GLY C C 16 171.431 171.219 0.212 1
1 106 . 11 1 1 A 16 16 GLY CA C 16 46.106 45.924 0.182 1
1 107 . 11 1 1 A 16 16 GLY N N 16 109.611 108.425 1.186 1
1 108 . 11 1 1 A 17 17 PHE H H 17 8.886 8.466 0.420 1
1 109 . 11 1 1 A 17 17 PHE HA H 17 5.466 5.186 0.280 1
1 114 . 11 1 1 A 17 17 PHE C C 17 174.795 174.683 0.112 1
1 115 . 11 1 1 A 17 17 PHE CA C 17 57.788 56.280 1.508 1
1 116 . 11 1 1 A 17 17 PHE CB C 17 41.315 41.516 -0.201 1
1 119 . 11 1 1 A 17 17 PHE N N 17 122.684 119.515 3.169 1
1 120 . 11 1 1 A 18 18 LEU H H 18 8.762 8.527 0.235 1
1 121 . 11 1 1 A 18 18 LEU HA H 18 4.946 4.594 0.352 1
1 131 . 11 1 1 A 18 18 LEU C C 18 175.461 175.415 0.046 1
1 132 . 11 1 1 A 18 18 LEU CA C 18 52.970 52.772 0.198 1
1 133 . 11 1 1 A 18 18 LEU CB C 18 47.945 44.586 3.359 1
1 137 . 11 1 1 A 18 18 LEU N N 18 119.045 123.855 -4.810 1
1 138 . 11 1 1 A 19 19 TYR H H 19 9.272 8.242 1.030 1
1 139 . 11 1 1 A 19 19 TYR HA H 19 5.682 5.270 0.412 1
1 146 . 11 1 1 A 19 19 TYR C C 19 174.829 174.326 0.503 1
1 147 . 11 1 1 A 19 19 TYR CA C 19 56.482 56.624 -0.142 1
1 148 . 11 1 1 A 19 19 TYR CB C 19 41.717 41.266 0.451 1
1 153 . 11 1 1 A 19 19 TYR N N 19 118.024 118.389 -0.365 1
1 154 . 11 1 1 A 20 20 LEU H H 20 9.441 8.656 0.785 1
1 155 . 11 1 1 A 20 20 LEU HA H 20 5.283 5.358 -0.075 1
1 165 . 11 1 1 A 20 20 LEU C C 20 175.935 174.981 0.954 1
1 166 . 11 1 1 A 20 20 LEU CA C 20 53.464 53.963 -0.499 1
1 167 . 11 1 1 A 20 20 LEU CB C 20 46.570 46.408 0.162 1
1 171 . 11 1 1 A 20 20 LEU N N 20 122.838 125.193 -2.355 1
1 172 . 11 1 1 A 21 21 GLN H H 21 8.391 8.874 -0.483 1
1 173 . 11 1 1 A 21 21 GLN HA H 21 3.791 4.275 -0.484 1
1 180 . 11 1 1 A 21 21 GLN C C 21 175.157 175.003 0.154 1
1 181 . 11 1 1 A 21 21 GLN CA C 21 56.094 55.345 0.749 1
1 182 . 11 1 1 A 21 21 GLN CB C 21 28.434 29.334 -0.900 1
1 184 . 11 1 1 A 21 21 GLN N N 21 129.943 127.468 2.475 1
1 186 . 11 1 1 A 22 22 GLN H H 22 8.829 8.240 0.589 1
1 187 . 11 1 1 A 22 22 GLN HA H 22 4.553 4.889 -0.336 1
1 194 . 11 1 1 A 22 22 GLN C C 22 174.998 173.838 1.160 1
1 195 . 11 1 1 A 22 22 GLN CA C 22 54.912 54.678 0.234 1
1 196 . 11 1 1 A 22 22 GLN CB C 22 31.930 32.821 -0.891 1
1 198 . 11 1 1 A 22 22 GLN N N 22 127.199 124.385 2.814 1
1 200 . 11 1 1 A 23 23 GLN HA H 23 4.142 4.751 -0.609 1
1 207 . 11 1 1 A 23 23 GLN CA C 23 56.427 54.844 1.583 1
1 208 . 11 1 1 A 23 23 GLN CB C 23 29.227 29.969 -0.742 1
1 211 . 11 1 1 A 24 24 GLN HA H 24 4.523 4.734 -0.211 1
1 218 . 11 1 1 A 24 24 GLN CB C 24 29.759 31.546 -1.787 1
1 221 . 11 1 1 A 25 25 THR HA H 25 3.870 4.051 -0.181 1
1 226 . 11 1 1 A 25 25 THR CA C 25 65.096 64.572 0.524 1
1 227 . 11 1 1 A 25 25 THR CB C 25 68.924 68.613 0.311 1
1 229 . 11 1 1 A 26 26 PHE HA H 26 4.690 4.467 0.223 1
1 236 . 11 1 1 A 26 26 PHE C C 26 175.523 175.831 -0.308 1
1 237 . 11 1 1 A 26 26 PHE CA C 26 57.312 59.868 -2.556 1
1 238 . 11 1 1 A 26 26 PHE CB C 26 39.003 40.233 -1.230 1
1 243 . 11 1 1 A 27 27 GLY H H 27 7.755 7.453 0.302 1
1 244 . 11 1 1 A 27 27 GLY HA2 H 27 4.172 4.093 0.079 1
1 245 . 11 1 1 A 27 27 GLY HA3 H 27 3.783 4.108 -0.325 1
1 246 . 11 1 1 A 27 27 GLY C C 27 172.557 172.869 -0.312 1
1 247 . 11 1 1 A 27 27 GLY CA C 27 44.924 45.281 -0.357 1
1 248 . 11 1 1 A 27 27 GLY N N 27 109.216 104.034 5.182 1
1 249 . 11 1 1 A 28 28 LYS H H 28 8.241 8.515 -0.274 1
1 250 . 11 1 1 A 28 28 LYS HA H 28 4.530 4.897 -0.367 1
1 259 . 11 1 1 A 28 28 LYS C C 28 176.204 175.896 0.308 1
1 260 . 11 1 1 A 28 28 LYS CA C 28 55.741 55.740 0.001 1
1 261 . 11 1 1 A 28 28 LYS CB C 28 33.904 31.680 2.224 1
1 265 . 11 1 1 A 28 28 LYS N N 28 118.743 116.878 1.865 1
1 266 . 11 1 1 A 29 29 LYS H H 29 8.356 7.787 0.569 1
1 267 . 11 1 1 A 29 29 LYS HA H 29 4.559 4.707 -0.148 1
1 274 . 11 1 1 A 29 29 LYS C C 29 175.420 175.770 -0.350 1
1 275 . 11 1 1 A 29 29 LYS CA C 29 55.406 54.358 1.048 1
1 276 . 11 1 1 A 29 29 LYS CB C 29 35.618 34.836 0.782 1
1 280 . 11 1 1 A 29 29 LYS N N 29 121.198 123.128 -1.930 1
1 281 . 11 1 1 A 30 30 TRP H H 30 8.891 8.808 0.083 1
1 282 . 11 1 1 A 30 30 TRP HA H 30 4.951 4.876 0.075 1
1 291 . 11 1 1 A 30 30 TRP C C 30 175.902 175.541 0.361 1
1 292 . 11 1 1 A 30 30 TRP CA C 30 56.677 57.238 -0.561 1
1 293 . 11 1 1 A 30 30 TRP CB C 30 30.614 30.867 -0.253 1
1 299 . 11 1 1 A 30 30 TRP N N 30 123.304 120.413 2.891 1
1 301 . 11 1 1 A 31 31 ARG H H 31 8.712 8.502 0.210 1
1 302 . 11 1 1 A 31 31 ARG HA H 31 4.820 4.814 0.006 1
1 309 . 11 1 1 A 31 31 ARG C C 31 174.026 174.905 -0.879 1
1 310 . 11 1 1 A 31 31 ARG CA C 31 54.895 54.223 0.672 1
1 311 . 11 1 1 A 31 31 ARG CB C 31 34.045 33.633 0.412 1
1 314 . 11 1 1 A 31 31 ARG N N 31 123.973 122.151 1.822 1
1 315 . 11 1 1 A 32 32 ARG H H 32 8.820 8.419 0.401 1
1 316 . 11 1 1 A 32 32 ARG HA H 32 3.965 4.488 -0.523 1
1 323 . 11 1 1 A 32 32 ARG C C 32 174.785 175.803 -1.018 1
1 324 . 11 1 1 A 32 32 ARG CA C 32 56.924 56.603 0.321 1
1 325 . 11 1 1 A 32 32 ARG CB C 32 31.806 31.135 0.671 1
1 328 . 11 1 1 A 32 32 ARG N N 32 127.041 125.907 1.134 1
1 329 . 11 1 1 A 33 33 PHE H H 33 9.372 8.553 0.819 1
1 330 . 11 1 1 A 33 33 PHE HA H 33 4.863 4.927 -0.064 1
1 338 . 11 1 1 A 33 33 PHE C C 33 176.359 175.540 0.819 1
1 339 . 11 1 1 A 33 33 PHE CA C 33 57.224 56.857 0.367 1
1 340 . 11 1 1 A 33 33 PHE CB C 33 43.385 42.889 0.496 1
1 346 . 11 1 1 A 33 33 PHE N N 33 125.882 119.778 6.104 1
1 347 . 11 1 1 A 34 34 GLY H H 34 9.160 8.860 0.300 1
1 348 . 11 1 1 A 34 34 GLY HA2 H 34 4.182 4.112 0.070 1
1 349 . 11 1 1 A 34 34 GLY HA3 H 34 3.714 4.198 -0.484 1
1 350 . 11 1 1 A 34 34 GLY C C 34 172.920 173.006 -0.086 1
1 351 . 11 1 1 A 34 34 GLY CA C 34 46.247 46.225 0.022 1
1 352 . 11 1 1 A 34 34 GLY N N 34 108.654 111.230 -2.576 1
1 353 . 11 1 1 A 35 35 ALA H H 35 8.982 8.394 0.588 1
1 354 . 11 1 1 A 35 35 ALA HA H 35 5.660 5.067 0.593 1
1 358 . 11 1 1 A 35 35 ALA C C 35 176.547 176.237 0.310 1
1 359 . 11 1 1 A 35 35 ALA CA C 35 50.500 50.672 -0.172 1
1 360 . 11 1 1 A 35 35 ALA CB C 35 24.034 20.180 3.854 1
1 361 . 11 1 1 A 35 35 ALA N N 35 130.076 129.283 0.793 1
1 362 . 11 1 1 A 36 36 SER H H 36 8.852 8.830 0.022 1
1 363 . 11 1 1 A 36 36 SER HA H 36 5.203 4.989 0.214 1
1 366 . 11 1 1 A 36 36 SER C C 36 170.939 172.586 -1.647 1
1 367 . 11 1 1 A 36 36 SER CA C 36 57.806 57.416 0.390 1
1 368 . 11 1 1 A 36 36 SER CB C 36 66.986 64.763 2.223 1
1 369 . 11 1 1 A 36 36 SER N N 36 116.620 120.585 -3.965 1
1 370 . 11 1 1 A 37 37 LEU H H 37 8.862 8.783 0.079 1
1 371 . 11 1 1 A 37 37 LEU HA H 37 5.163 4.831 0.332 1
1 381 . 11 1 1 A 37 37 LEU C C 37 173.525 174.150 -0.625 1
1 382 . 11 1 1 A 37 37 LEU CA C 37 53.112 53.543 -0.431 1
1 383 . 11 1 1 A 37 37 LEU CB C 37 46.077 43.416 2.661 1
1 387 . 11 1 1 A 37 37 LEU N N 37 127.638 129.168 -1.530 1
1 388 . 11 1 1 A 38 38 TYR H H 38 9.280 8.667 0.613 1
1 389 . 11 1 1 A 38 38 TYR HA H 38 4.820 5.242 -0.422 1
1 396 . 11 1 1 A 38 38 TYR C C 38 175.430 175.571 -0.141 1
1 397 . 11 1 1 A 38 38 TYR CA C 38 57.436 56.098 1.338 1
1 398 . 11 1 1 A 38 38 TYR CB C 38 42.128 41.050 1.078 1
1 403 . 11 1 1 A 38 38 TYR N N 38 125.215 127.188 -1.973 1
1 404 . 11 1 1 A 39 39 GLY H H 39 8.532 8.367 0.165 1
1 405 . 11 1 1 A 39 39 GLY HA2 H 39 4.220 4.232 -0.012 1
1 406 . 11 1 1 A 39 39 GLY HA3 H 39 3.941 4.242 -0.301 1
1 407 . 11 1 1 A 39 39 GLY C C 39 172.950 171.515 1.435 1
1 408 . 11 1 1 A 39 39 GLY CA C 39 44.817 45.275 -0.458 1
1 409 . 11 1 1 A 39 39 GLY N N 39 106.424 109.647 -3.223 1
1 410 . 11 1 1 A 40 40 GLY H H 40 8.477 8.329 0.148 1
1 411 . 11 1 1 A 40 40 GLY HA2 H 40 4.102 4.310 -0.208 1
1 412 . 11 1 1 A 40 40 GLY HA3 H 40 3.927 4.316 -0.389 1
1 413 . 11 1 1 A 40 40 GLY C C 40 174.002 174.300 -0.298 1
1 414 . 11 1 1 A 40 40 GLY CA C 40 44.694 45.990 -1.296 1
1 415 . 11 1 1 A 40 40 GLY N N 40 106.881 109.459 -2.578 1
1 416 . 11 1 1 A 41 41 SER H H 41 8.600 8.819 -0.219 1
1 417 . 11 1 1 A 41 41 SER HA H 41 4.520 4.157 0.363 1
1 420 . 11 1 1 A 41 41 SER C C 41 174.355 174.677 -0.322 1
1 421 . 11 1 1 A 41 41 SER CA C 41 58.565 62.147 -3.582 1
1 422 . 11 1 1 A 41 41 SER CB C 41 64.413 63.091 1.322 1
1 423 . 11 1 1 A 41 41 SER N N 41 115.751 116.219 -0.468 1
1 424 . 11 1 1 A 42 42 ASP H H 42 8.533 7.905 0.628 1
1 425 . 11 1 1 A 42 42 ASP HA H 42 4.560 4.805 -0.245 1
1 428 . 11 1 1 A 42 42 ASP CA C 42 55.230 53.257 1.973 1
1 429 . 11 1 1 A 42 42 ASP CB C 42 40.648 39.882 0.766 1
1 430 . 11 1 1 A 42 42 ASP N N 42 119.037 119.937 -0.900 1
1 431 . 11 1 1 A 43 43 CYS H H 43 8.152 8.064 0.088 1
1 432 . 11 1 1 A 43 43 CYS HA H 43 4.541 4.912 -0.371 1
1 435 . 11 1 1 A 43 43 CYS C C 43 173.975 174.089 -0.114 1
1 436 . 11 1 1 A 43 43 CYS CA C 43 58.265 58.491 -0.226 1
1 437 . 11 1 1 A 43 43 CYS CB C 43 28.393 31.607 -3.214 1
1 438 . 11 1 1 A 43 43 CYS N N 43 116.881 122.696 -5.815 1
1 439 . 11 1 1 A 44 44 ALA H H 44 8.047 8.633 -0.586 1
1 440 . 11 1 1 A 44 44 ALA HA H 44 4.395 4.516 -0.121 1
1 444 . 11 1 1 A 44 44 ALA C C 44 176.472 176.445 0.027 1
1 445 . 11 1 1 A 44 44 ALA CA C 44 52.688 52.263 0.425 1
1 446 . 11 1 1 A 44 44 ALA CB C 44 20.579 19.321 1.258 1
1 447 . 11 1 1 A 44 44 ALA N N 44 125.989 126.136 -0.147 1
1 448 . 11 1 1 A 45 45 LEU H H 45 8.052 7.415 0.637 1
1 449 . 11 1 1 A 45 45 LEU HA H 45 4.452 5.016 -0.564 1
1 459 . 11 1 1 A 45 45 LEU C C 45 176.196 174.849 1.347 1
1 460 . 11 1 1 A 45 45 LEU CA C 45 53.771 53.477 0.294 1
1 461 . 11 1 1 A 45 45 LEU CB C 45 43.116 45.567 -2.451 1
1 465 . 11 1 1 A 45 45 LEU N N 45 119.889 120.774 -0.885 1
1 466 . 11 1 1 A 46 46 ALA H H 46 8.381 8.690 -0.309 1
1 467 . 11 1 1 A 46 46 ALA HA H 46 4.449 5.362 -0.913 1
1 471 . 11 1 1 A 46 46 ALA C C 46 179.093 175.508 3.585 1
1 472 . 11 1 1 A 46 46 ALA CA C 46 52.829 51.838 0.991 1
1 473 . 11 1 1 A 46 46 ALA CB C 46 18.687 21.586 -2.899 1
1 474 . 11 1 1 A 46 46 ALA N N 46 125.635 127.241 -1.606 1
1 475 . 11 1 1 A 47 47 ARG H H 47 9.012 8.517 0.495 1
1 476 . 11 1 1 A 47 47 ARG HA H 47 5.192 5.093 0.099 1
1 484 . 11 1 1 A 47 47 ARG C C 47 171.524 173.912 -2.388 1
1 485 . 11 1 1 A 47 47 ARG CA C 47 55.265 54.502 0.763 1
1 486 . 11 1 1 A 47 47 ARG CB C 47 30.970 33.838 -2.868 1
1 489 . 11 1 1 A 47 47 ARG N N 47 120.048 120.488 -0.440 1
1 491 . 11 1 1 A 48 48 LEU H H 48 9.029 8.478 0.551 1
1 492 . 11 1 1 A 48 48 LEU HA H 48 5.221 5.022 0.199 1
1 502 . 11 1 1 A 48 48 LEU C C 48 174.348 174.686 -0.338 1
1 503 . 11 1 1 A 48 48 LEU CA C 48 53.253 53.943 -0.690 1
1 504 . 11 1 1 A 48 48 LEU CB C 48 45.419 43.835 1.584 1
1 508 . 11 1 1 A 48 48 LEU N N 48 123.315 121.709 1.606 1
1 509 . 11 1 1 A 49 49 GLU H H 49 9.473 8.834 0.639 1
1 510 . 11 1 1 A 49 49 GLU HA H 49 5.222 4.953 0.269 1
1 515 . 11 1 1 A 49 49 GLU C C 49 175.507 175.099 0.408 1
1 516 . 11 1 1 A 49 49 GLU CA C 49 55.159 55.599 -0.440 1
1 517 . 11 1 1 A 49 49 GLU CB C 49 32.341 31.676 0.665 1
1 519 . 11 1 1 A 49 49 GLU N N 49 124.751 127.812 -3.061 1
1 520 . 11 1 1 A 50 50 LEU H H 50 9.088 8.552 0.536 1
1 521 . 11 1 1 A 50 50 LEU HA H 50 5.382 5.224 0.158 1
1 531 . 11 1 1 A 50 50 LEU C C 50 175.474 174.831 0.643 1
1 532 . 11 1 1 A 50 50 LEU CA C 50 52.865 53.736 -0.871 1
1 533 . 11 1 1 A 50 50 LEU CB C 50 43.239 45.258 -2.019 1
1 537 . 11 1 1 A 50 50 LEU N N 50 124.221 126.472 -2.251 1
1 538 . 11 1 1 A 51 51 GLN H H 51 9.602 8.611 0.991 1
1 539 . 11 1 1 A 51 51 GLN HA H 51 5.095 4.792 0.303 1
1 546 . 11 1 1 A 51 51 GLN C C 51 175.306 176.103 -0.797 1
1 547 . 11 1 1 A 51 51 GLN CA C 51 54.576 55.088 -0.512 1
1 548 . 11 1 1 A 51 51 GLN CB C 51 32.177 30.735 1.442 1
1 550 . 11 1 1 A 51 51 GLN N N 51 123.268 124.430 -1.162 1
1 552 . 11 1 1 A 52 52 GLU H H 52 9.172 9.043 0.129 1
1 553 . 11 1 1 A 52 52 GLU HA H 52 4.092 4.251 -0.159 1
1 558 . 11 1 1 A 52 52 GLU C C 52 176.523 176.664 -0.141 1
1 559 . 11 1 1 A 52 52 GLU CA C 52 57.500 58.439 -0.939 1
1 560 . 11 1 1 A 52 52 GLU CB C 52 30.696 30.538 0.158 1
1 562 . 11 1 1 A 52 52 GLU N N 52 128.982 124.990 3.992 1
1 563 . 11 1 1 A 53 53 GLY H H 53 8.644 7.498 1.146 1
1 564 . 11 1 1 A 53 53 GLY HA2 H 53 4.261 4.177 0.084 1
1 565 . 11 1 1 A 53 53 GLY HA3 H 53 3.993 4.188 -0.195 1
1 566 . 11 1 1 A 53 53 GLY C C 53 172.550 174.074 -1.524 1
1 567 . 11 1 1 A 53 53 GLY CA C 53 45.911 46.158 -0.247 1
1 568 . 11 1 1 A 53 53 GLY N N 53 110.844 107.126 3.718 1
1 569 . 11 1 1 A 54 54 PRO HA H 54 4.392 4.634 -0.242 1
1 576 . 11 1 1 A 54 54 PRO C C 54 176.828 176.352 0.476 1
1 577 . 11 1 1 A 54 54 PRO CA C 54 63.665 62.837 0.828 1
1 578 . 11 1 1 A 54 54 PRO CB C 54 32.012 32.239 -0.227 1
1 581 . 11 1 1 A 55 55 GLU H H 55 8.934 8.573 0.361 1
1 582 . 11 1 1 A 55 55 GLU HA H 55 4.193 4.498 -0.305 1
1 587 . 11 1 1 A 55 55 GLU C C 55 176.189 175.983 0.206 1
1 588 . 11 1 1 A 55 55 GLU CA C 55 57.383 55.488 1.895 1
1 589 . 11 1 1 A 55 55 GLU CB C 55 28.945 31.220 -2.275 1
1 591 . 11 1 1 A 55 55 GLU N N 55 120.312 121.917 -1.605 1
1 592 . 11 1 1 A 56 56 LYS H H 56 7.937 8.681 -0.744 1
1 593 . 11 1 1 A 56 56 LYS HA H 56 4.578 4.907 -0.329 1
1 602 . 11 1 1 A 56 56 LYS C C 56 174.295 176.101 -1.806 1
1 603 . 11 1 1 A 56 56 LYS CA C 56 54.171 53.194 0.977 1
1 604 . 11 1 1 A 56 56 LYS CB C 56 32.555 34.896 -2.341 1
1 608 . 11 1 1 A 56 56 LYS N N 56 122.008 121.590 0.418 1
1 609 . 11 1 1 A 57 57 PRO HA H 57 4.370 4.339 0.031 1
1 616 . 11 1 1 A 57 57 PRO CA C 57 63.431 65.355 -1.924 1
1 617 . 11 1 1 A 57 57 PRO CB C 57 32.072 32.039 0.033 1
1 620 . 11 1 1 A 58 58 ARG H H 58 8.310 8.224 0.086 1
1 621 . 11 1 1 A 58 58 ARG HA H 58 4.295 4.442 -0.147 1
1 628 . 11 1 1 A 58 58 ARG CA C 58 56.570 56.838 -0.268 1
1 629 . 11 1 1 A 58 58 ARG CB C 58 30.860 32.652 -1.792 1
1 632 . 11 1 1 A 58 58 ARG N N 58 120.045 116.008 4.037 1
1 633 . 11 1 1 A 60 60 CYS HA H 60 4.482 4.920 -0.438 1
1 636 . 11 1 1 A 60 60 CYS CA C 60 58.621 58.387 0.234 1
1 637 . 11 1 1 A 60 60 CYS CB C 60 28.267 31.390 -3.123 1
1 638 . 11 1 1 A 61 61 GLU HA H 61 4.226 4.397 -0.171 1
1 643 . 11 1 1 A 61 61 GLU C C 61 176.299 174.653 1.646 1
1 644 . 11 1 1 A 61 61 GLU CA C 61 57.100 55.607 1.493 1
1 645 . 11 1 1 A 61 61 GLU CB C 61 29.873 28.138 1.735 1
1 647 . 11 1 1 A 62 62 ALA H H 62 8.282 7.802 0.480 1
1 648 . 11 1 1 A 62 62 ALA HA H 62 4.302 4.895 -0.593 1
1 652 . 11 1 1 A 62 62 ALA C C 62 177.277 174.937 2.340 1
1 653 . 11 1 1 A 62 62 ALA CA C 62 52.512 51.240 1.272 1
1 654 . 11 1 1 A 62 62 ALA CB C 62 19.592 23.954 -4.362 1
1 655 . 11 1 1 A 62 62 ALA N N 62 124.386 125.444 -1.058 1
1 656 . 11 1 1 A 63 63 ALA H H 63 8.399 8.772 -0.373 1
1 657 . 11 1 1 A 63 63 ALA HA H 63 4.375 5.297 -0.922 1
1 661 . 11 1 1 A 63 63 ALA C C 63 176.843 175.820 1.023 1
1 662 . 11 1 1 A 63 63 ALA CA C 63 52.658 50.349 2.309 1
1 663 . 11 1 1 A 63 63 ALA CB C 63 19.592 22.892 -3.300 1
1 664 . 11 1 1 A 63 63 ALA N N 63 123.892 121.091 2.801 1
1 665 . 11 1 1 A 64 64 ARG H H 64 8.152 8.626 -0.474 1
1 666 . 11 1 1 A 64 64 ARG HA H 64 5.008 4.725 0.283 1
1 673 . 11 1 1 A 64 64 ARG C C 64 175.594 175.159 0.435 1
1 674 . 11 1 1 A 64 64 ARG CA C 64 55.282 54.948 0.334 1
1 675 . 11 1 1 A 64 64 ARG CB C 64 32.506 32.011 0.495 1
1 678 . 11 1 1 A 64 64 ARG N N 64 119.787 121.704 -1.917 1
1 679 . 11 1 1 A 65 65 LYS H H 65 8.945 8.396 0.549 1
1 680 . 11 1 1 A 65 65 LYS HA H 65 4.602 5.061 -0.459 1
1 689 . 11 1 1 A 65 65 LYS C C 65 174.657 174.871 -0.214 1
1 690 . 11 1 1 A 65 65 LYS CA C 65 54.948 54.686 0.262 1
1 691 . 11 1 1 A 65 65 LYS CB C 65 34.068 34.544 -0.476 1
1 695 . 11 1 1 A 65 65 LYS N N 65 124.171 120.116 4.055 1
1 696 . 11 1 1 A 66 66 VAL H H 66 8.672 8.934 -0.262 1
1 697 . 11 1 1 A 66 66 VAL HA H 66 4.532 5.015 -0.483 1
1 705 . 11 1 1 A 66 66 VAL C C 66 175.078 173.891 1.187 1
1 706 . 11 1 1 A 66 66 VAL CA C 66 61.865 59.962 1.903 1
1 707 . 11 1 1 A 66 66 VAL CB C 66 33.835 34.830 -0.995 1
1 710 . 11 1 1 A 66 66 VAL N N 66 124.380 121.764 2.616 1
1 711 . 11 1 1 A 67 67 ILE H H 67 9.071 8.869 0.202 1
1 712 . 11 1 1 A 67 67 ILE HA H 67 4.142 4.604 -0.462 1
1 722 . 11 1 1 A 67 67 ILE C C 67 175.819 175.521 0.298 1
1 723 . 11 1 1 A 67 67 ILE CA C 67 60.383 60.419 -0.036 1
1 724 . 11 1 1 A 67 67 ILE CB C 67 39.908 38.570 1.338 1
1 728 . 11 1 1 A 67 67 ILE N N 67 129.537 129.527 0.010 1
1 729 . 11 1 1 A 68 68 ARG H H 68 9.203 8.784 0.419 1
1 730 . 11 1 1 A 68 68 ARG HA H 68 4.198 4.237 -0.039 1
1 737 . 11 1 1 A 68 68 ARG C C 68 177.769 176.958 0.811 1
1 738 . 11 1 1 A 68 68 ARG CA C 68 56.835 56.400 0.435 1
1 739 . 11 1 1 A 68 68 ARG CB C 68 29.832 30.580 -0.748 1
1 742 . 11 1 1 A 68 68 ARG N N 68 128.484 128.502 -0.018 1
1 743 . 11 1 1 A 69 69 LEU H H 69 8.212 8.619 -0.407 1
1 744 . 11 1 1 A 69 69 LEU HA H 69 4.221 4.035 0.186 1
1 754 . 11 1 1 A 69 69 LEU C C 69 178.996 178.518 0.478 1
1 755 . 11 1 1 A 69 69 LEU CA C 69 57.136 57.561 -0.425 1
1 756 . 11 1 1 A 69 69 LEU CB C 69 39.455 40.975 -1.520 1
1 760 . 11 1 1 A 69 69 LEU N N 69 123.807 125.148 -1.341 1
1 761 . 11 1 1 A 70 70 SER H H 70 8.823 7.868 0.955 1
1 762 . 11 1 1 A 70 70 SER HA H 70 4.331 4.212 0.119 1
1 765 . 11 1 1 A 70 70 SER C C 70 175.076 175.993 -0.917 1
1 766 . 11 1 1 A 70 70 SER CA C 70 60.329 62.041 -1.712 1
1 767 . 11 1 1 A 70 70 SER CB C 70 62.362 62.800 -0.438 1
1 768 . 11 1 1 A 70 70 SER N N 70 115.162 114.553 0.609 1
1 769 . 11 1 1 A 71 71 ASP H H 71 7.602 8.109 -0.507 1
1 770 . 11 1 1 A 71 71 ASP HA H 71 4.820 4.500 0.320 1
1 773 . 11 1 1 A 71 71 ASP C C 71 176.478 177.216 -0.738 1
1 774 . 11 1 1 A 71 71 ASP CA C 71 54.241 56.828 -2.587 1
1 775 . 11 1 1 A 71 71 ASP CB C 71 41.347 40.860 0.487 1
1 776 . 11 1 1 A 71 71 ASP N N 71 119.590 119.158 0.432 1
1 777 . 11 1 1 A 72 72 CYS H H 72 7.715 7.372 0.343 1
1 778 . 11 1 1 A 72 72 CYS HA H 72 4.372 4.574 -0.202 1
1 781 . 11 1 1 A 72 72 CYS C C 72 173.690 174.684 -0.994 1
1 782 . 11 1 1 A 72 72 CYS CA C 72 60.836 59.517 1.319 1
1 783 . 11 1 1 A 72 72 CYS CB C 72 27.655 27.606 0.049 1
1 784 . 11 1 1 A 72 72 CYS N N 72 118.346 117.855 0.491 1
1 785 . 11 1 1 A 73 73 LEU H H 73 9.472 8.984 0.488 1
1 786 . 11 1 1 A 73 73 LEU HA H 73 4.593 4.143 0.450 1
1 796 . 11 1 1 A 73 73 LEU C C 73 177.562 177.056 0.506 1
1 797 . 11 1 1 A 73 73 LEU CA C 73 55.724 57.486 -1.762 1
1 798 . 11 1 1 A 73 73 LEU CB C 73 43.774 42.179 1.595 1
1 802 . 11 1 1 A 73 73 LEU N N 73 124.752 129.007 -4.255 1
1 803 . 11 1 1 A 74 74 ARG H H 74 7.658 7.740 -0.082 1
1 804 . 11 1 1 A 74 74 ARG HA H 74 4.592 5.078 -0.486 1
1 811 . 11 1 1 A 74 74 ARG C C 74 173.605 174.623 -1.018 1
1 812 . 11 1 1 A 74 74 ARG CA C 74 56.465 56.061 0.404 1
1 813 . 11 1 1 A 74 74 ARG CB C 74 34.068 33.931 0.137 1
1 816 . 11 1 1 A 74 74 ARG N N 74 115.565 116.093 -0.528 1
1 817 . 11 1 1 A 75 75 VAL H H 75 8.622 8.861 -0.239 1
1 818 . 11 1 1 A 75 75 VAL HA H 75 5.170 5.236 -0.066 1
1 826 . 11 1 1 A 75 75 VAL C C 75 173.985 174.453 -0.468 1
1 827 . 11 1 1 A 75 75 VAL CA C 75 60.930 60.265 0.665 1
1 828 . 11 1 1 A 75 75 VAL CB C 75 35.073 34.761 0.312 1
1 831 . 11 1 1 A 75 75 VAL N N 75 124.278 120.095 4.183 1
1 832 . 11 1 1 A 76 76 ALA H H 76 8.272 8.776 -0.504 1
1 833 . 11 1 1 A 76 76 ALA HA H 76 4.648 5.122 -0.474 1
1 837 . 11 1 1 A 76 76 ALA C C 76 175.630 176.090 -0.460 1
1 838 . 11 1 1 A 76 76 ALA CA C 76 51.294 51.173 0.121 1
1 839 . 11 1 1 A 76 76 ALA CB C 76 22.759 24.361 -1.602 1
1 840 . 11 1 1 A 76 76 ALA N N 76 126.015 124.892 1.123 1
1 841 . 11 1 1 A 77 77 GLU H H 77 9.184 8.731 0.453 1
1 842 . 11 1 1 A 77 77 GLU HA H 77 4.060 5.125 -1.065 1
1 847 . 11 1 1 A 77 77 GLU C C 77 174.949 175.460 -0.511 1
1 848 . 11 1 1 A 77 77 GLU CA C 77 58.424 55.269 3.155 1
1 849 . 11 1 1 A 77 77 GLU CB C 77 30.161 31.367 -1.206 1
1 851 . 11 1 1 A 77 77 GLU N N 77 120.223 118.617 1.606 1
1 852 . 11 1 1 A 78 78 ALA H H 78 7.985 9.245 -1.260 1
1 853 . 11 1 1 A 78 78 ALA HA H 78 4.776 5.071 -0.295 1
1 857 . 11 1 1 A 78 78 ALA C C 78 177.250 177.489 -0.239 1
1 858 . 11 1 1 A 78 78 ALA CA C 78 50.888 50.521 0.367 1
1 859 . 11 1 1 A 78 78 ALA CB C 78 20.851 20.137 0.714 1
1 860 . 11 1 1 A 78 78 ALA N N 78 125.143 126.775 -1.632 1
1 861 . 11 1 1 A 79 79 GLY H H 79 8.604 8.732 -0.128 1
1 862 . 11 1 1 A 79 79 GLY HA2 H 79 4.327 4.040 0.287 1
1 863 . 11 1 1 A 79 79 GLY HA3 H 79 3.963 4.048 -0.085 1
1 864 . 11 1 1 A 79 79 GLY C C 79 175.360 173.540 1.820 1
1 865 . 11 1 1 A 79 79 GLY CA C 79 44.925 44.801 0.124 1
1 866 . 11 1 1 A 79 79 GLY N N 79 109.420 110.414 -0.994 1
1 867 . 11 1 1 A 80 80 GLY H H 80 8.649 8.578 0.071 1
1 868 . 11 1 1 A 80 80 GLY HA2 H 80 3.962 3.868 0.094 1
1 869 . 11 1 1 A 80 80 GLY HA3 H 80 3.962 3.880 0.082 1
1 870 . 11 1 1 A 80 80 GLY C C 80 175.052 174.472 0.580 1
1 871 . 11 1 1 A 80 80 GLY CA C 80 45.955 47.178 -1.223 1
1 872 . 11 1 1 A 80 80 GLY N N 80 108.295 108.983 -0.688 1
1 873 . 11 1 1 A 81 81 GLU H H 81 8.921 8.854 0.067 1
1 874 . 11 1 1 A 81 81 GLU HA H 81 4.298 4.590 -0.292 1
1 879 . 11 1 1 A 81 81 GLU C C 81 176.532 175.183 1.349 1
1 880 . 11 1 1 A 81 81 GLU CA C 81 57.118 55.630 1.488 1
1 881 . 11 1 1 A 81 81 GLU CB C 81 28.599 30.437 -1.838 1
1 883 . 11 1 1 A 81 81 GLU N N 81 121.170 122.489 -1.319 1
1 884 . 11 1 1 A 82 82 ALA H H 82 8.032 7.349 0.683 1
1 885 . 11 1 1 A 82 82 ALA HA H 82 4.371 4.510 -0.139 1
1 889 . 11 1 1 A 82 82 ALA C C 82 177.160 177.243 -0.083 1
1 890 . 11 1 1 A 82 82 ALA CA C 82 52.653 51.053 1.600 1
1 891 . 11 1 1 A 82 82 ALA CB C 82 19.304 21.578 -2.274 1
1 892 . 11 1 1 A 82 82 ALA N N 82 124.988 121.245 3.743 1
1 893 . 11 1 1 A 83 83 SER H H 83 8.319 9.120 -0.801 1
1 894 . 11 1 1 A 83 83 SER HA H 83 4.331 4.281 0.050 1
1 897 . 11 1 1 A 83 83 SER C C 83 174.045 174.711 -0.666 1
1 898 . 11 1 1 A 83 83 SER CA C 83 58.053 61.531 -3.478 1
1 899 . 11 1 1 A 83 83 SER CB C 83 63.184 62.848 0.336 1
1 900 . 11 1 1 A 83 83 SER N N 83 114.181 114.642 -0.461 1
1 901 . 11 1 1 A 84 84 SER H H 84 7.823 7.798 0.025 1
1 902 . 11 1 1 A 84 84 SER HA H 84 3.194 4.060 -0.866 1
1 905 . 11 1 1 A 84 84 SER C C 84 171.072 174.080 -3.008 1
1 906 . 11 1 1 A 84 84 SER CA C 84 57.206 56.980 0.226 1
1 907 . 11 1 1 A 84 84 SER CB C 84 61.622 63.436 -1.814 1
1 908 . 11 1 1 A 84 84 SER N N 84 117.302 114.387 2.915 1
1 909 . 11 1 1 A 85 85 PRO HA H 85 3.922 4.534 -0.612 1
1 916 . 11 1 1 A 85 85 PRO CA C 85 62.691 62.132 0.559 1
1 917 . 11 1 1 A 85 85 PRO CB C 85 31.515 32.692 -1.177 1
1 920 . 11 1 1 A 86 86 ARG HA H 86 3.882 4.401 -0.519 1
1 927 . 11 1 1 A 86 86 ARG C C 86 175.712 176.042 -0.330 1
1 928 . 11 1 1 A 86 86 ARG CA C 86 57.877 55.490 2.387 1
1 929 . 11 1 1 A 86 86 ARG CB C 86 29.791 31.782 -1.991 1
1 932 . 11 1 1 A 87 87 ASP H H 87 8.903 8.805 0.098 1
1 933 . 11 1 1 A 87 87 ASP HA H 87 4.342 4.233 0.109 1
1 936 . 11 1 1 A 87 87 ASP C C 87 175.723 175.079 0.644 1
1 937 . 11 1 1 A 87 87 ASP CA C 87 56.377 55.157 1.220 1
1 938 . 11 1 1 A 87 87 ASP CB C 87 39.208 39.625 -0.417 1
1 939 . 11 1 1 A 87 87 ASP N N 87 117.520 120.402 -2.882 1
1 940 . 11 1 1 A 88 88 THR H H 88 7.776 7.395 0.381 1
1 941 . 11 1 1 A 88 88 THR HA H 88 5.101 5.095 0.006 1
1 946 . 11 1 1 A 88 88 THR C C 88 173.825 172.730 1.095 1
1 947 . 11 1 1 A 88 88 THR CA C 88 60.154 60.156 -0.002 1
1 948 . 11 1 1 A 88 88 THR CB C 88 72.702 72.617 0.085 1
1 950 . 11 1 1 A 88 88 THR N N 88 108.770 108.162 0.608 1
1 951 . 11 1 1 A 89 89 SER H H 89 9.006 9.130 -0.124 1
1 952 . 11 1 1 A 89 89 SER HA H 89 4.718 5.178 -0.460 1
1 955 . 11 1 1 A 89 89 SER C C 89 173.728 173.155 0.573 1
1 956 . 11 1 1 A 89 89 SER CA C 89 57.453 57.797 -0.344 1
1 957 . 11 1 1 A 89 89 SER CB C 89 65.611 65.728 -0.117 1
1 958 . 11 1 1 A 89 89 SER N N 89 114.151 116.919 -2.768 1
1 959 . 11 1 1 A 90 90 ALA H H 90 9.001 8.786 0.215 1
1 960 . 11 1 1 A 90 90 ALA HA H 90 5.660 4.643 1.017 1
1 964 . 11 1 1 A 90 90 ALA C C 90 177.669 177.002 0.667 1
1 965 . 11 1 1 A 90 90 ALA CA C 90 51.670 51.778 -0.108 1
1 966 . 11 1 1 A 90 90 ALA CB C 90 22.265 20.041 2.224 1
1 967 . 11 1 1 A 90 90 ALA N N 90 126.177 129.210 -3.033 1
1 968 . 11 1 1 A 91 91 PHE H H 91 9.672 8.154 1.518 1
1 969 . 11 1 1 A 91 91 PHE HA H 91 5.039 5.512 -0.473 1
1 977 . 11 1 1 A 91 91 PHE C C 91 170.731 172.596 -1.865 1
1 978 . 11 1 1 A 91 91 PHE CA C 91 56.271 55.448 0.823 1
1 979 . 11 1 1 A 91 91 PHE CB C 91 41.553 42.368 -0.815 1
1 985 . 11 1 1 A 91 91 PHE N N 91 118.968 115.501 3.467 1
1 986 . 11 1 1 A 92 92 PHE H H 92 9.422 9.489 -0.067 1
1 987 . 11 1 1 A 92 92 PHE HA H 92 5.674 5.147 0.527 1
1 995 . 11 1 1 A 92 92 PHE C C 92 174.570 175.122 -0.552 1
1 996 . 11 1 1 A 92 92 PHE CA C 92 55.917 57.349 -1.432 1
1 997 . 11 1 1 A 92 92 PHE CB C 92 42.787 41.181 1.606 1
1 1003 . 11 1 1 A 92 92 PHE N N 92 117.543 119.094 -1.551 1
1 1004 . 11 1 1 A 93 93 LEU H H 93 9.021 8.653 0.368 1
1 1005 . 11 1 1 A 93 93 LEU HA H 93 5.122 5.095 0.027 1
1 1015 . 11 1 1 A 93 93 LEU C C 93 174.799 174.295 0.504 1
1 1016 . 11 1 1 A 93 93 LEU CA C 93 54.912 54.535 0.377 1
1 1017 . 11 1 1 A 93 93 LEU CB C 93 45.254 45.446 -0.192 1
1 1021 . 11 1 1 A 93 93 LEU N N 93 121.719 123.449 -1.730 1
1 1022 . 11 1 1 A 94 94 GLU H H 94 9.294 8.941 0.353 1
1 1023 . 11 1 1 A 94 94 GLU HA H 94 5.043 5.277 -0.234 1
1 1028 . 11 1 1 A 94 94 GLU C C 94 175.754 175.321 0.433 1
1 1029 . 11 1 1 A 94 94 GLU CA C 94 56.018 54.919 1.099 1
1 1030 . 11 1 1 A 94 94 GLU CB C 94 32.752 33.332 -0.580 1
1 1032 . 11 1 1 A 94 94 GLU N N 94 127.032 128.699 -1.667 1
1 1033 . 11 1 1 A 95 95 THR H H 95 8.822 8.988 -0.166 1
1 1034 . 11 1 1 A 95 95 THR HA H 95 5.398 5.060 0.338 1
1 1039 . 11 1 1 A 95 95 THR C C 95 173.860 175.667 -1.807 1
1 1040 . 11 1 1 A 95 95 THR CA C 95 59.588 59.399 0.189 1
1 1041 . 11 1 1 A 95 95 THR CB C 95 72.191 72.226 -0.035 1
1 1043 . 11 1 1 A 95 95 THR N N 95 118.685 116.884 1.801 1
1 1044 . 11 1 1 A 96 96 LYS H H 96 8.823 9.068 -0.245 1
1 1045 . 11 1 1 A 96 96 LYS HA H 96 4.022 4.000 0.022 1
1 1054 . 11 1 1 A 96 96 LYS C C 96 177.330 178.279 -0.949 1
1 1055 . 11 1 1 A 96 96 LYS CA C 96 59.588 59.163 0.425 1
1 1056 . 11 1 1 A 96 96 LYS CB C 96 32.588 32.070 0.518 1
1 1060 . 11 1 1 A 96 96 LYS N N 96 118.801 121.705 -2.904 1
1 1061 . 11 1 1 A 97 97 GLU H H 97 8.092 7.728 0.364 1
1 1062 . 11 1 1 A 97 97 GLU HA H 97 4.282 4.333 -0.051 1
1 1067 . 11 1 1 A 97 97 GLU C C 97 176.290 176.910 -0.620 1
1 1068 . 11 1 1 A 97 97 GLU CA C 97 57.365 58.245 -0.880 1
1 1069 . 11 1 1 A 97 97 GLU CB C 97 31.559 30.354 1.205 1
1 1071 . 11 1 1 A 97 97 GLU N N 97 113.992 117.391 -3.399 1
1 1072 . 11 1 1 A 98 98 ARG H H 98 7.482 7.182 0.300 1
1 1073 . 11 1 1 A 98 98 ARG HA H 98 4.397 4.720 -0.323 1
1 1080 . 11 1 1 A 98 98 ARG C C 98 172.792 173.480 -0.688 1
1 1081 . 11 1 1 A 98 98 ARG CA C 98 55.689 54.171 1.518 1
1 1082 . 11 1 1 A 98 98 ARG CB C 98 32.711 33.170 -0.459 1
1 1085 . 11 1 1 A 98 98 ARG N N 98 116.022 113.992 2.030 1
1 1086 . 11 1 1 A 99 99 LEU H H 99 8.423 8.309 0.114 1
1 1087 . 11 1 1 A 99 99 LEU HA H 99 4.807 4.825 -0.018 1
1 1097 . 11 1 1 A 99 99 LEU C C 99 175.903 174.163 1.740 1
1 1098 . 11 1 1 A 99 99 LEU CA C 99 54.383 53.452 0.931 1
1 1099 . 11 1 1 A 99 99 LEU CB C 99 43.362 44.670 -1.308 1
1 1103 . 11 1 1 A 99 99 LEU N N 99 124.983 121.558 3.425 1
1 1104 . 11 1 1 A 100 100 TYR H H 100 9.144 9.672 -0.528 1
1 1105 . 11 1 1 A 100 100 TYR HA H 100 4.542 5.206 -0.664 1
1 1112 . 11 1 1 A 100 100 TYR C C 100 173.479 174.528 -1.049 1
1 1113 . 11 1 1 A 100 100 TYR CA C 100 57.735 56.425 1.310 1
1 1114 . 11 1 1 A 100 100 TYR CB C 100 39.291 43.037 -3.746 1
1 1119 . 11 1 1 A 100 100 TYR N N 100 126.679 125.007 1.672 1
1 1120 . 11 1 1 A 101 101 LEU H H 101 9.043 8.897 0.146 1
1 1121 . 11 1 1 A 101 101 LEU HA H 101 4.747 4.803 -0.056 1
1 1131 . 11 1 1 A 101 101 LEU C C 101 173.530 175.206 -1.676 1
1 1132 . 11 1 1 A 101 101 LEU CA C 101 54.524 54.048 0.476 1
1 1133 . 11 1 1 A 101 101 LEU CB C 101 42.499 44.266 -1.767 1
1 1137 . 11 1 1 A 101 101 LEU N N 101 127.422 124.158 3.264 1
1 1138 . 11 1 1 A 102 102 LEU H H 102 8.493 8.048 0.445 1
1 1139 . 11 1 1 A 102 102 LEU HA H 102 5.612 5.473 0.139 1
1 1149 . 11 1 1 A 102 102 LEU C C 102 175.794 175.783 0.011 1
1 1150 . 11 1 1 A 102 102 LEU CA C 102 53.076 53.055 0.021 1
1 1151 . 11 1 1 A 102 102 LEU CB C 102 45.994 44.300 1.694 1
1 1155 . 11 1 1 A 102 102 LEU N N 102 126.021 128.838 -2.817 1
1 1156 . 11 1 1 A 103 103 ALA H H 103 9.073 8.731 0.342 1
1 1157 . 11 1 1 A 103 103 ALA HA H 103 5.081 5.229 -0.148 1
1 1161 . 11 1 1 A 103 103 ALA C C 103 175.133 175.571 -0.438 1
1 1162 . 11 1 1 A 103 103 ALA CA C 103 51.688 50.026 1.662 1
1 1163 . 11 1 1 A 103 103 ALA CB C 103 21.689 22.488 -0.799 1
1 1164 . 11 1 1 A 103 103 ALA N N 103 117.679 121.463 -3.784 1
1 1165 . 11 1 1 A 104 104 ALA H H 104 8.582 8.432 0.150 1
1 1166 . 11 1 1 A 104 104 ALA HA H 104 5.220 4.748 0.472 1
1 1170 . 11 1 1 A 104 104 ALA C C 104 173.471 174.092 -0.621 1
1 1171 . 11 1 1 A 104 104 ALA CA C 104 47.959 49.888 -1.929 1
1 1172 . 11 1 1 A 104 104 ALA CB C 104 21.359 22.253 -0.894 1
1 1173 . 11 1 1 A 104 104 ALA N N 104 123.419 120.749 2.670 1
1 1174 . 11 1 1 A 105 105 PRO HA H 105 4.542 4.785 -0.243 1
1 1181 . 11 1 1 A 105 105 PRO C C 105 178.409 177.878 0.531 1
1 1182 . 11 1 1 A 105 105 PRO CA C 105 64.301 62.750 1.551 1
1 1183 . 11 1 1 A 105 105 PRO CB C 105 32.094 31.661 0.433 1
1 1186 . 11 1 1 A 106 106 ALA H H 106 8.302 8.671 -0.369 1
1 1187 . 11 1 1 A 106 106 ALA HA H 106 4.022 4.021 0.001 1
1 1191 . 11 1 1 A 106 106 ALA C C 106 179.641 179.615 0.026 1
1 1192 . 11 1 1 A 106 106 ALA CA C 106 56.341 55.260 1.081 1
1 1193 . 11 1 1 A 106 106 ALA CB C 106 18.523 18.321 0.202 1
1 1194 . 11 1 1 A 106 106 ALA N N 106 127.733 127.801 -0.068 1
1 1195 . 11 1 1 A 107 107 ALA H H 107 9.035 8.138 0.897 1
1 1196 . 11 1 1 A 107 107 ALA HA H 107 4.331 4.033 0.298 1
1 1200 . 11 1 1 A 107 107 ALA C C 107 178.586 180.022 -1.436 1
1 1201 . 11 1 1 A 107 107 ALA CA C 107 53.765 55.305 -1.540 1
1 1202 . 11 1 1 A 107 107 ALA CB C 107 18.728 18.199 0.529 1
1 1203 . 11 1 1 A 107 107 ALA N N 107 118.203 120.339 -2.136 1
1 1204 . 11 1 1 A 108 108 GLU H H 108 8.399 8.225 0.174 1
1 1205 . 11 1 1 A 108 108 GLU HA H 108 4.631 4.118 0.513 1
1 1210 . 11 1 1 A 108 108 GLU C C 108 177.127 178.811 -1.684 1
1 1211 . 11 1 1 A 108 108 GLU CA C 108 55.847 59.222 -3.375 1
1 1212 . 11 1 1 A 108 108 GLU CB C 108 32.135 29.944 2.191 1
1 1214 . 11 1 1 A 108 108 GLU N N 108 114.661 117.968 -3.307 1
1 1215 . 11 1 1 A 109 109 ARG H H 109 7.412 8.579 -1.167 1
1 1216 . 11 1 1 A 109 109 ARG HA H 109 3.682 4.106 -0.424 1
1 1223 . 11 1 1 A 109 109 ARG C C 109 176.917 179.168 -2.251 1
1 1224 . 11 1 1 A 109 109 ARG CA C 109 61.600 59.727 1.873 1
1 1225 . 11 1 1 A 109 109 ARG CB C 109 28.845 30.405 -1.560 1
1 1228 . 11 1 1 A 109 109 ARG N N 109 120.954 120.968 -0.014 1
1 1229 . 11 1 1 A 110 110 GLY H H 110 8.833 8.056 0.777 1
1 1230 . 11 1 1 A 110 110 GLY HA2 H 110 3.872 3.797 0.075 1
1 1231 . 11 1 1 A 110 110 GLY HA3 H 110 3.685 3.814 -0.129 1
1 1232 . 11 1 1 A 110 110 GLY C C 110 175.997 175.718 0.279 1
1 1233 . 11 1 1 A 110 110 GLY CA C 110 47.323 47.589 -0.266 1
1 1234 . 11 1 1 A 110 110 GLY N N 110 106.563 107.147 -0.584 1
1 1235 . 11 1 1 A 111 111 ASP H H 111 7.882 8.471 -0.589 1
1 1236 . 11 1 1 A 111 111 ASP HA H 111 4.312 4.290 0.022 1
1 1239 . 11 1 1 A 111 111 ASP C C 111 179.467 178.482 0.985 1
1 1240 . 11 1 1 A 111 111 ASP CA C 111 56.976 56.529 0.447 1
1 1241 . 11 1 1 A 111 111 ASP CB C 111 40.648 40.376 0.272 1
1 1242 . 11 1 1 A 111 111 ASP N N 111 121.402 121.893 -0.491 1
1 1243 . 11 1 1 A 112 112 TRP H H 112 7.804 8.422 -0.618 1
1 1244 . 11 1 1 A 112 112 TRP HA H 112 3.831 4.181 -0.350 1
1 1253 . 11 1 1 A 112 112 TRP C C 112 177.547 178.674 -1.127 1
1 1254 . 11 1 1 A 112 112 TRP CA C 112 62.006 60.003 2.003 1
1 1255 . 11 1 1 A 112 112 TRP CB C 112 29.421 29.344 0.077 1
1 1261 . 11 1 1 A 112 112 TRP N N 112 119.904 119.747 0.157 1
1 1263 . 11 1 1 A 113 113 VAL H H 113 7.982 8.200 -0.218 1
1 1264 . 11 1 1 A 113 113 VAL HA H 113 3.072 3.657 -0.585 1
1 1272 . 11 1 1 A 113 113 VAL C C 113 178.015 178.682 -0.667 1
1 1273 . 11 1 1 A 113 113 VAL CA C 113 67.407 66.762 0.645 1
1 1274 . 11 1 1 A 113 113 VAL CB C 113 31.724 31.512 0.212 1
1 1277 . 11 1 1 A 113 113 VAL N N 113 117.575 119.405 -1.830 1
1 1278 . 11 1 1 A 114 114 GLN H H 114 8.268 8.081 0.187 1
1 1279 . 11 1 1 A 114 114 GLN HA H 114 3.994 4.050 -0.056 1
1 1286 . 11 1 1 A 114 114 GLN C C 114 178.021 177.665 0.356 1
1 1287 . 11 1 1 A 114 114 GLN CA C 114 59.112 58.679 0.433 1
1 1288 . 11 1 1 A 114 114 GLN CB C 114 28.685 28.799 -0.114 1
1 1290 . 11 1 1 A 114 114 GLN N N 114 117.479 120.040 -2.561 1
1 1292 . 11 1 1 A 115 115 ALA H H 115 7.915 8.479 -0.564 1
1 1293 . 11 1 1 A 115 115 ALA HA H 115 3.972 4.039 -0.067 1
1 1297 . 11 1 1 A 115 115 ALA C C 115 180.030 179.976 0.054 1
1 1298 . 11 1 1 A 115 115 ALA CA C 115 55.142 55.135 0.007 1
1 1299 . 11 1 1 A 115 115 ALA CB C 115 18.152 18.434 -0.282 1
1 1300 . 11 1 1 A 115 115 ALA N N 115 120.858 120.778 0.080 1
1 1301 . 11 1 1 A 116 116 ILE H H 116 8.172 8.602 -0.430 1
1 1302 . 11 1 1 A 116 116 ILE HA H 116 3.482 3.812 -0.330 1
1 1312 . 11 1 1 A 116 116 ILE C C 116 177.739 178.600 -0.861 1
1 1313 . 11 1 1 A 116 116 ILE CA C 116 66.119 64.850 1.269 1
1 1314 . 11 1 1 A 116 116 ILE CB C 116 38.222 37.824 0.398 1
1 1318 . 11 1 1 A 116 116 ILE N N 116 115.977 117.841 -1.864 1
1 1319 . 11 1 1 A 117 117 CYS H H 117 8.449 8.374 0.075 1
1 1320 . 11 1 1 A 117 117 CYS HA H 117 4.032 4.520 -0.488 1
1 1323 . 11 1 1 A 117 117 CYS C C 117 177.321 177.524 -0.203 1
1 1324 . 11 1 1 A 117 117 CYS CA C 117 64.777 63.739 1.038 1
1 1325 . 11 1 1 A 117 117 CYS CB C 117 26.871 28.102 -1.231 1
1 1326 . 11 1 1 A 117 117 CYS N N 117 117.253 119.775 -2.522 1
1 1327 . 11 1 1 A 118 118 LEU H H 118 8.182 8.048 0.134 1
1 1328 . 11 1 1 A 118 118 LEU HA H 118 4.052 4.039 0.013 1
1 1338 . 11 1 1 A 118 118 LEU C C 118 179.217 179.091 0.126 1
1 1339 . 11 1 1 A 118 118 LEU CA C 118 57.877 58.036 -0.159 1
1 1340 . 11 1 1 A 118 118 LEU CB C 118 42.088 41.937 0.151 1
1 1344 . 11 1 1 A 118 118 LEU N N 118 119.665 120.477 -0.812 1
1 1345 . 11 1 1 A 119 119 LEU H H 119 7.142 7.394 -0.252 1
1 1346 . 11 1 1 A 119 119 LEU HA H 119 4.192 4.269 -0.077 1
1 1356 . 11 1 1 A 119 119 LEU C C 119 178.492 178.228 0.264 1
1 1357 . 11 1 1 A 119 119 LEU CA C 119 56.259 57.232 -0.973 1
1 1358 . 11 1 1 A 119 119 LEU CB C 119 43.568 42.347 1.221 1
1 1362 . 11 1 1 A 119 119 LEU N N 119 116.244 118.002 -1.758 1
1 1363 . 11 1 1 A 120 120 ALA H H 120 8.513 8.380 0.133 1
1 1364 . 11 1 1 A 120 120 ALA HA H 120 3.878 3.929 -0.051 1
1 1368 . 11 1 1 A 120 120 ALA C C 120 178.358 178.558 -0.200 1
1 1369 . 11 1 1 A 120 120 ALA CA C 120 53.765 55.172 -1.407 1
1 1370 . 11 1 1 A 120 120 ALA CB C 120 18.687 18.838 -0.151 1
1 1371 . 11 1 1 A 120 120 ALA N N 120 120.009 120.936 -0.927 1
1 1372 . 11 1 1 A 121 121 PHE H H 121 7.822 8.404 -0.582 1
1 1373 . 11 1 1 A 121 121 PHE HA H 121 5.156 4.958 0.198 1
1 1381 . 11 1 1 A 121 121 PHE C C 121 176.273 176.316 -0.043 1
1 1382 . 11 1 1 A 121 121 PHE CA C 121 55.741 56.501 -0.760 1
1 1383 . 11 1 1 A 121 121 PHE CB C 121 39.455 38.077 1.378 1
1 1389 . 11 1 1 A 121 121 PHE N N 121 113.981 114.222 -0.241 1
1 1390 . 11 1 1 A 122 122 SER H H 122 7.765 8.206 -0.441 1
1 1391 . 11 1 1 A 122 122 SER HA H 122 4.579 4.397 0.182 1
1 1394 . 11 1 1 A 122 122 SER C C 122 174.595 174.514 0.081 1
1 1395 . 11 1 1 A 122 122 SER CA C 122 58.777 61.164 -2.387 1
1 1396 . 11 1 1 A 122 122 SER CB C 122 63.719 63.603 0.116 1
1 1397 . 11 1 1 A 122 122 SER N N 122 115.069 116.107 -1.038 1
1 1398 . 11 1 1 A 123 123 GLY H H 123 8.223 7.988 0.235 1
1 1399 . 11 1 1 A 123 123 GLY HA2 H 123 4.174 4.145 0.029 1
1 1400 . 11 1 1 A 123 123 GLY HA3 H 123 4.100 4.153 -0.053 1
1 1401 . 11 1 1 A 123 123 GLY C C 123 171.678 174.719 -3.041 1
1 1402 . 11 1 1 A 123 123 GLY CA C 123 44.815 44.010 0.805 1
1 1403 . 11 1 1 A 123 123 GLY N N 123 110.151 108.913 1.238 1
1 1404 . 11 1 1 A 124 124 PRO HA H 124 4.482 4.490 -0.008 1
1 1411 . 11 1 1 A 124 124 PRO C C 124 177.314 177.662 -0.348 1
1 1412 . 11 1 1 A 124 124 PRO CA C 124 63.206 63.855 -0.649 1
1 1413 . 11 1 1 A 124 124 PRO CB C 124 32.176 32.072 0.104 1
1 1416 . 11 1 1 A 125 125 SER H H 125 8.485 8.549 -0.064 1
1 1417 . 11 1 1 A 125 125 SER HA H 125 4.472 4.145 0.327 1
1 1420 . 11 1 1 A 125 125 SER C C 125 174.728 174.949 -0.221 1
1 1421 . 11 1 1 A 125 125 SER CA C 125 58.353 61.490 -3.137 1
1 1422 . 11 1 1 A 125 125 SER CB C 125 64.048 63.028 1.020 1
1 1423 . 11 1 1 A 125 125 SER N N 125 116.081 115.440 0.641 1
1 1424 . 11 1 1 A 126 126 SER H H 126 8.332 7.789 0.543 1
1 1425 . 11 1 1 A 126 126 SER HA H 126 4.464 4.765 -0.301 1
1 1428 . 11 1 1 A 126 126 SER C C 126 173.980 174.251 -0.271 1
1 1429 . 11 1 1 A 126 126 SER CA C 126 58.336 57.394 0.942 1
1 1430 . 11 1 1 A 126 126 SER CB C 126 63.925 65.852 -1.927 1
1 1431 . 11 1 1 A 126 126 SER N N 126 118.037 112.724 5.313 1
1 1 . 12 1 1 A 6 6 SER HA H 6 4.458 5.034 -0.576 1
1 3 . 12 1 1 A 6 6 SER C C 6 175.108 174.113 0.995 1
1 4 . 12 1 1 A 6 6 SER CA C 6 58.689 57.856 0.833 1
1 5 . 12 1 1 A 6 6 SER CB C 6 63.678 64.044 -0.366 1
1 6 . 12 1 1 A 7 7 GLY H H 7 8.449 8.654 -0.205 1
1 7 . 12 1 1 A 7 7 GLY HA2 H 7 3.965 4.325 -0.360 1
1 8 . 12 1 1 A 7 7 GLY HA3 H 7 3.965 4.326 -0.361 1
1 9 . 12 1 1 A 7 7 GLY C C 7 174.380 172.113 2.267 1
1 10 . 12 1 1 A 7 7 GLY CA C 7 45.435 45.589 -0.154 1
1 11 . 12 1 1 A 7 7 GLY N N 7 110.792 112.498 -1.706 1
1 12 . 12 1 1 A 8 8 MET H H 8 8.259 8.357 -0.098 1
1 13 . 12 1 1 A 8 8 MET HA H 8 4.487 5.283 -0.796 1
1 21 . 12 1 1 A 8 8 MET C C 8 176.961 175.580 1.381 1
1 22 . 12 1 1 A 8 8 MET CA C 8 55.565 54.350 1.215 1
1 23 . 12 1 1 A 8 8 MET CB C 8 32.835 35.949 -3.114 1
1 26 . 12 1 1 A 8 8 MET N N 8 119.639 119.981 -0.342 1
1 27 . 12 1 1 A 9 9 GLY H H 9 8.472 8.462 0.010 1
1 28 . 12 1 1 A 9 9 GLY HA2 H 9 3.946 4.127 -0.181 1
1 29 . 12 1 1 A 9 9 GLY HA3 H 9 3.946 4.129 -0.183 1
1 30 . 12 1 1 A 9 9 GLY C C 9 174.005 174.047 -0.042 1
1 31 . 12 1 1 A 9 9 GLY CA C 9 45.488 45.622 -0.134 1
1 32 . 12 1 1 A 9 9 GLY N N 9 110.107 109.381 0.726 1
1 33 . 12 1 1 A 10 10 ASP H H 10 8.292 8.938 -0.646 1
1 34 . 12 1 1 A 10 10 ASP HA H 10 4.636 4.799 -0.163 1
1 37 . 12 1 1 A 10 10 ASP C C 10 176.768 176.823 -0.055 1
1 38 . 12 1 1 A 10 10 ASP CA C 10 54.206 56.116 -1.910 1
1 39 . 12 1 1 A 10 10 ASP CB C 10 41.306 42.439 -1.133 1
1 40 . 12 1 1 A 10 10 ASP N N 10 120.370 124.482 -4.112 1
1 41 . 12 1 1 A 11 11 GLY H H 11 8.452 7.970 0.482 1
1 42 . 12 1 1 A 11 11 GLY HA2 H 11 3.980 4.168 -0.188 1
1 43 . 12 1 1 A 11 11 GLY HA3 H 11 4.022 4.209 -0.187 1
1 44 . 12 1 1 A 11 11 GLY C C 11 174.102 173.686 0.416 1
1 45 . 12 1 1 A 11 11 GLY CA C 11 45.170 45.636 -0.466 1
1 46 . 12 1 1 A 11 11 GLY N N 11 108.391 104.420 3.971 1
1 47 . 12 1 1 A 12 12 ALA H H 12 8.293 8.273 0.020 1
1 48 . 12 1 1 A 12 12 ALA HA H 12 3.777 4.424 -0.647 1
1 52 . 12 1 1 A 12 12 ALA C C 12 178.193 178.172 0.021 1
1 53 . 12 1 1 A 12 12 ALA CA C 12 52.759 52.305 0.454 1
1 54 . 12 1 1 A 12 12 ALA CB C 12 17.855 18.528 -0.673 1
1 55 . 12 1 1 A 12 12 ALA N N 12 124.185 126.398 -2.213 1
1 56 . 12 1 1 A 13 13 VAL H H 13 8.822 8.536 0.286 1
1 57 . 12 1 1 A 13 13 VAL HA H 13 3.912 3.797 0.115 1
1 65 . 12 1 1 A 13 13 VAL C C 13 176.073 175.647 0.426 1
1 66 . 12 1 1 A 13 13 VAL CA C 13 63.100 65.791 -2.691 1
1 67 . 12 1 1 A 13 13 VAL CB C 13 32.711 31.887 0.824 1
1 70 . 12 1 1 A 13 13 VAL N N 13 120.877 125.394 -4.517 1
1 71 . 12 1 1 A 14 14 LYS H H 14 7.093 7.107 -0.014 1
1 72 . 12 1 1 A 14 14 LYS HA H 14 4.169 4.699 -0.530 1
1 81 . 12 1 1 A 14 14 LYS C C 14 173.291 174.348 -1.057 1
1 82 . 12 1 1 A 14 14 LYS CA C 14 56.465 54.788 1.677 1
1 83 . 12 1 1 A 14 14 LYS CB C 14 35.960 35.899 0.061 1
1 87 . 12 1 1 A 14 14 LYS N N 14 118.693 119.153 -0.460 1
1 88 . 12 1 1 A 15 15 GLN H H 15 8.522 8.533 -0.011 1
1 89 . 12 1 1 A 15 15 GLN HA H 15 5.542 5.240 0.302 1
1 96 . 12 1 1 A 15 15 GLN C C 15 174.992 175.790 -0.798 1
1 97 . 12 1 1 A 15 15 GLN CA C 15 54.312 54.078 0.234 1
1 98 . 12 1 1 A 15 15 GLN CB C 15 33.585 32.265 1.320 1
1 100 . 12 1 1 A 15 15 GLN N N 15 124.024 123.954 0.070 1
1 102 . 12 1 1 A 16 16 GLY H H 16 8.740 7.964 0.776 1
1 103 . 12 1 1 A 16 16 GLY HA2 H 16 4.511 4.114 0.397 1
1 104 . 12 1 1 A 16 16 GLY HA3 H 16 4.064 4.419 -0.355 1
1 105 . 12 1 1 A 16 16 GLY C C 16 171.431 171.334 0.097 1
1 106 . 12 1 1 A 16 16 GLY CA C 16 46.106 45.851 0.255 1
1 107 . 12 1 1 A 16 16 GLY N N 16 109.611 109.272 0.339 1
1 108 . 12 1 1 A 17 17 PHE H H 17 8.886 8.547 0.339 1
1 109 . 12 1 1 A 17 17 PHE HA H 17 5.466 5.097 0.369 1
1 114 . 12 1 1 A 17 17 PHE C C 17 174.795 175.101 -0.306 1
1 115 . 12 1 1 A 17 17 PHE CA C 17 57.788 56.502 1.286 1
1 116 . 12 1 1 A 17 17 PHE CB C 17 41.315 41.015 0.300 1
1 119 . 12 1 1 A 17 17 PHE N N 17 122.684 119.232 3.452 1
1 120 . 12 1 1 A 18 18 LEU H H 18 8.762 8.553 0.209 1
1 121 . 12 1 1 A 18 18 LEU HA H 18 4.946 4.774 0.172 1
1 131 . 12 1 1 A 18 18 LEU C C 18 175.461 175.027 0.434 1
1 132 . 12 1 1 A 18 18 LEU CA C 18 52.970 53.354 -0.384 1
1 133 . 12 1 1 A 18 18 LEU CB C 18 47.945 44.601 3.344 1
1 137 . 12 1 1 A 18 18 LEU N N 18 119.045 123.661 -4.616 1
1 138 . 12 1 1 A 19 19 TYR H H 19 9.272 8.040 1.232 1
1 139 . 12 1 1 A 19 19 TYR HA H 19 5.682 5.457 0.225 1
1 146 . 12 1 1 A 19 19 TYR C C 19 174.829 174.749 0.080 1
1 147 . 12 1 1 A 19 19 TYR CA C 19 56.482 57.131 -0.649 1
1 148 . 12 1 1 A 19 19 TYR CB C 19 41.717 40.148 1.569 1
1 153 . 12 1 1 A 19 19 TYR N N 19 118.024 122.938 -4.914 1
1 154 . 12 1 1 A 20 20 LEU H H 20 9.441 9.149 0.292 1
1 155 . 12 1 1 A 20 20 LEU HA H 20 5.283 5.218 0.065 1
1 165 . 12 1 1 A 20 20 LEU C C 20 175.935 175.894 0.041 1
1 166 . 12 1 1 A 20 20 LEU CA C 20 53.464 53.703 -0.239 1
1 167 . 12 1 1 A 20 20 LEU CB C 20 46.570 44.690 1.880 1
1 171 . 12 1 1 A 20 20 LEU N N 20 122.838 125.882 -3.044 1
1 172 . 12 1 1 A 21 21 GLN H H 21 8.391 8.370 0.021 1
1 173 . 12 1 1 A 21 21 GLN HA H 21 3.791 3.975 -0.184 1
1 180 . 12 1 1 A 21 21 GLN C C 21 175.157 174.719 0.438 1
1 181 . 12 1 1 A 21 21 GLN CA C 21 56.094 56.005 0.089 1
1 182 . 12 1 1 A 21 21 GLN CB C 21 28.434 28.645 -0.211 1
1 184 . 12 1 1 A 21 21 GLN N N 21 129.943 128.013 1.930 1
1 186 . 12 1 1 A 22 22 GLN H H 22 8.829 8.819 0.010 1
1 187 . 12 1 1 A 22 22 GLN HA H 22 4.553 4.782 -0.229 1
1 194 . 12 1 1 A 22 22 GLN C C 22 174.998 174.919 0.079 1
1 195 . 12 1 1 A 22 22 GLN CA C 22 54.912 54.315 0.597 1
1 196 . 12 1 1 A 22 22 GLN CB C 22 31.930 30.909 1.021 1
1 198 . 12 1 1 A 22 22 GLN N N 22 127.199 125.556 1.643 1
1 200 . 12 1 1 A 23 23 GLN HA H 23 4.142 4.504 -0.362 1
1 207 . 12 1 1 A 23 23 GLN CA C 23 56.427 55.497 0.930 1
1 208 . 12 1 1 A 23 23 GLN CB C 23 29.227 28.652 0.575 1
1 211 . 12 1 1 A 24 24 GLN HA H 24 4.523 4.691 -0.168 1
1 218 . 12 1 1 A 24 24 GLN CB C 24 29.759 31.895 -2.136 1
1 221 . 12 1 1 A 25 25 THR HA H 25 3.870 4.011 -0.141 1
1 226 . 12 1 1 A 25 25 THR CA C 25 65.096 65.705 -0.609 1
1 227 . 12 1 1 A 25 25 THR CB C 25 68.924 69.201 -0.277 1
1 229 . 12 1 1 A 26 26 PHE HA H 26 4.690 4.834 -0.144 1
1 236 . 12 1 1 A 26 26 PHE C C 26 175.523 175.928 -0.405 1
1 237 . 12 1 1 A 26 26 PHE CA C 26 57.312 56.903 0.409 1
1 238 . 12 1 1 A 26 26 PHE CB C 26 39.003 39.817 -0.814 1
1 243 . 12 1 1 A 27 27 GLY H H 27 7.755 7.914 -0.159 1
1 244 . 12 1 1 A 27 27 GLY HA2 H 27 4.172 3.714 0.458 1
1 245 . 12 1 1 A 27 27 GLY HA3 H 27 3.783 3.734 0.049 1
1 246 . 12 1 1 A 27 27 GLY C C 27 172.557 174.180 -1.623 1
1 247 . 12 1 1 A 27 27 GLY CA C 27 44.924 44.565 0.359 1
1 248 . 12 1 1 A 27 27 GLY N N 27 109.216 109.947 -0.731 1
1 249 . 12 1 1 A 28 28 LYS H H 28 8.241 7.593 0.648 1
1 250 . 12 1 1 A 28 28 LYS HA H 28 4.530 3.677 0.853 1
1 259 . 12 1 1 A 28 28 LYS C C 28 176.204 174.893 1.311 1
1 260 . 12 1 1 A 28 28 LYS CA C 28 55.741 57.199 -1.458 1
1 261 . 12 1 1 A 28 28 LYS CB C 28 33.904 29.262 4.642 1
1 265 . 12 1 1 A 28 28 LYS N N 28 118.743 118.038 0.705 1
1 266 . 12 1 1 A 29 29 LYS H H 29 8.356 7.359 0.997 1
1 267 . 12 1 1 A 29 29 LYS HA H 29 4.559 4.735 -0.176 1
1 274 . 12 1 1 A 29 29 LYS C C 29 175.420 175.269 0.151 1
1 275 . 12 1 1 A 29 29 LYS CA C 29 55.406 54.210 1.196 1
1 276 . 12 1 1 A 29 29 LYS CB C 29 35.618 36.559 -0.941 1
1 280 . 12 1 1 A 29 29 LYS N N 29 121.198 115.917 5.281 1
1 281 . 12 1 1 A 30 30 TRP H H 30 8.891 8.612 0.279 1
1 282 . 12 1 1 A 30 30 TRP HA H 30 4.951 4.769 0.182 1
1 291 . 12 1 1 A 30 30 TRP C C 30 175.902 176.642 -0.740 1
1 292 . 12 1 1 A 30 30 TRP CA C 30 56.677 57.724 -1.047 1
1 293 . 12 1 1 A 30 30 TRP CB C 30 30.614 29.831 0.783 1
1 299 . 12 1 1 A 30 30 TRP N N 30 123.304 120.853 2.451 1
1 301 . 12 1 1 A 31 31 ARG H H 31 8.712 9.218 -0.506 1
1 302 . 12 1 1 A 31 31 ARG HA H 31 4.820 4.793 0.027 1
1 309 . 12 1 1 A 31 31 ARG C C 31 174.026 175.283 -1.257 1
1 310 . 12 1 1 A 31 31 ARG CA C 31 54.895 54.200 0.695 1
1 311 . 12 1 1 A 31 31 ARG CB C 31 34.045 33.275 0.770 1
1 314 . 12 1 1 A 31 31 ARG N N 31 123.973 123.420 0.553 1
1 315 . 12 1 1 A 32 32 ARG H H 32 8.820 8.389 0.431 1
1 316 . 12 1 1 A 32 32 ARG HA H 32 3.965 5.015 -1.050 1
1 323 . 12 1 1 A 32 32 ARG C C 32 174.785 174.932 -0.147 1
1 324 . 12 1 1 A 32 32 ARG CA C 32 56.924 55.269 1.655 1
1 325 . 12 1 1 A 32 32 ARG CB C 32 31.806 31.748 0.058 1
1 328 . 12 1 1 A 32 32 ARG N N 32 127.041 121.647 5.394 1
1 329 . 12 1 1 A 33 33 PHE H H 33 9.372 8.574 0.798 1
1 330 . 12 1 1 A 33 33 PHE HA H 33 4.863 5.008 -0.145 1
1 338 . 12 1 1 A 33 33 PHE C C 33 176.359 175.549 0.810 1
1 339 . 12 1 1 A 33 33 PHE CA C 33 57.224 56.820 0.404 1
1 340 . 12 1 1 A 33 33 PHE CB C 33 43.385 43.239 0.146 1
1 346 . 12 1 1 A 33 33 PHE N N 33 125.882 118.919 6.963 1
1 347 . 12 1 1 A 34 34 GLY H H 34 9.160 8.477 0.683 1
1 348 . 12 1 1 A 34 34 GLY HA2 H 34 4.182 3.939 0.243 1
1 349 . 12 1 1 A 34 34 GLY HA3 H 34 3.714 4.065 -0.351 1
1 350 . 12 1 1 A 34 34 GLY C C 34 172.920 172.950 -0.030 1
1 351 . 12 1 1 A 34 34 GLY CA C 34 46.247 46.195 0.052 1
1 352 . 12 1 1 A 34 34 GLY N N 34 108.654 111.130 -2.476 1
1 353 . 12 1 1 A 35 35 ALA H H 35 8.982 8.391 0.591 1
1 354 . 12 1 1 A 35 35 ALA HA H 35 5.660 5.511 0.149 1
1 358 . 12 1 1 A 35 35 ALA C C 35 176.547 176.163 0.384 1
1 359 . 12 1 1 A 35 35 ALA CA C 35 50.500 50.459 0.041 1
1 360 . 12 1 1 A 35 35 ALA CB C 35 24.034 20.447 3.587 1
1 361 . 12 1 1 A 35 35 ALA N N 35 130.076 128.741 1.335 1
1 362 . 12 1 1 A 36 36 SER H H 36 8.852 8.658 0.194 1
1 363 . 12 1 1 A 36 36 SER HA H 36 5.203 5.044 0.159 1
1 366 . 12 1 1 A 36 36 SER C C 36 170.939 172.570 -1.631 1
1 367 . 12 1 1 A 36 36 SER CA C 36 57.806 57.496 0.310 1
1 368 . 12 1 1 A 36 36 SER CB C 36 66.986 64.462 2.524 1
1 369 . 12 1 1 A 36 36 SER N N 36 116.620 119.985 -3.365 1
1 370 . 12 1 1 A 37 37 LEU H H 37 8.862 8.657 0.205 1
1 371 . 12 1 1 A 37 37 LEU HA H 37 5.163 5.040 0.123 1
1 381 . 12 1 1 A 37 37 LEU C C 37 173.525 174.224 -0.699 1
1 382 . 12 1 1 A 37 37 LEU CA C 37 53.112 53.233 -0.121 1
1 383 . 12 1 1 A 37 37 LEU CB C 37 46.077 43.863 2.214 1
1 387 . 12 1 1 A 37 37 LEU N N 37 127.638 128.463 -0.825 1
1 388 . 12 1 1 A 38 38 TYR H H 38 9.280 8.500 0.780 1
1 389 . 12 1 1 A 38 38 TYR HA H 38 4.820 5.166 -0.346 1
1 396 . 12 1 1 A 38 38 TYR C C 38 175.430 175.838 -0.408 1
1 397 . 12 1 1 A 38 38 TYR CA C 38 57.436 56.445 0.991 1
1 398 . 12 1 1 A 38 38 TYR CB C 38 42.128 41.261 0.867 1
1 403 . 12 1 1 A 38 38 TYR N N 38 125.215 126.844 -1.629 1
1 404 . 12 1 1 A 39 39 GLY H H 39 8.532 8.622 -0.090 1
1 405 . 12 1 1 A 39 39 GLY HA2 H 39 4.220 4.143 0.077 1
1 406 . 12 1 1 A 39 39 GLY HA3 H 39 3.941 4.146 -0.205 1
1 407 . 12 1 1 A 39 39 GLY C C 39 172.950 174.285 -1.335 1
1 408 . 12 1 1 A 39 39 GLY CA C 39 44.817 44.425 0.392 1
1 409 . 12 1 1 A 39 39 GLY N N 39 106.424 110.170 -3.746 1
1 410 . 12 1 1 A 40 40 GLY H H 40 8.477 8.599 -0.122 1
1 411 . 12 1 1 A 40 40 GLY HA2 H 40 4.102 4.042 0.060 1
1 412 . 12 1 1 A 40 40 GLY HA3 H 40 3.927 4.045 -0.118 1
1 413 . 12 1 1 A 40 40 GLY C C 40 174.002 174.285 -0.283 1
1 414 . 12 1 1 A 40 40 GLY CA C 40 44.694 45.444 -0.750 1
1 415 . 12 1 1 A 40 40 GLY N N 40 106.881 108.330 -1.449 1
1 416 . 12 1 1 A 41 41 SER H H 41 8.600 8.008 0.592 1
1 417 . 12 1 1 A 41 41 SER HA H 41 4.520 4.506 0.014 1
1 420 . 12 1 1 A 41 41 SER C C 41 174.355 174.077 0.278 1
1 421 . 12 1 1 A 41 41 SER CA C 41 58.565 58.568 -0.003 1
1 422 . 12 1 1 A 41 41 SER CB C 41 64.413 64.387 0.026 1
1 423 . 12 1 1 A 41 41 SER N N 41 115.751 115.703 0.048 1
1 424 . 12 1 1 A 42 42 ASP H H 42 8.533 8.777 -0.244 1
1 425 . 12 1 1 A 42 42 ASP HA H 42 4.560 4.556 0.004 1
1 428 . 12 1 1 A 42 42 ASP CA C 42 55.230 54.124 1.106 1
1 429 . 12 1 1 A 42 42 ASP CB C 42 40.648 41.897 -1.249 1
1 430 . 12 1 1 A 42 42 ASP N N 42 119.037 122.622 -3.585 1
1 431 . 12 1 1 A 43 43 CYS H H 43 8.152 8.833 -0.681 1
1 432 . 12 1 1 A 43 43 CYS HA H 43 4.541 4.180 0.361 1
1 435 . 12 1 1 A 43 43 CYS C C 43 173.975 173.718 0.257 1
1 436 . 12 1 1 A 43 43 CYS CA C 43 58.265 59.916 -1.651 1
1 437 . 12 1 1 A 43 43 CYS CB C 43 28.393 25.525 2.868 1
1 438 . 12 1 1 A 43 43 CYS N N 43 116.881 120.711 -3.830 1
1 439 . 12 1 1 A 44 44 ALA H H 44 8.047 7.615 0.432 1
1 440 . 12 1 1 A 44 44 ALA HA H 44 4.395 4.944 -0.549 1
1 444 . 12 1 1 A 44 44 ALA C C 44 176.472 174.821 1.651 1
1 445 . 12 1 1 A 44 44 ALA CA C 44 52.688 50.525 2.163 1
1 446 . 12 1 1 A 44 44 ALA CB C 44 20.579 22.813 -2.234 1
1 447 . 12 1 1 A 44 44 ALA N N 44 125.989 123.274 2.715 1
1 448 . 12 1 1 A 45 45 LEU H H 45 8.052 8.481 -0.429 1
1 449 . 12 1 1 A 45 45 LEU HA H 45 4.452 5.137 -0.685 1
1 459 . 12 1 1 A 45 45 LEU C C 45 176.196 174.788 1.408 1
1 460 . 12 1 1 A 45 45 LEU CA C 45 53.771 53.422 0.349 1
1 461 . 12 1 1 A 45 45 LEU CB C 45 43.116 45.199 -2.083 1
1 465 . 12 1 1 A 45 45 LEU N N 45 119.889 120.962 -1.073 1
1 466 . 12 1 1 A 46 46 ALA H H 46 8.381 8.918 -0.537 1
1 467 . 12 1 1 A 46 46 ALA HA H 46 4.449 5.579 -1.130 1
1 471 . 12 1 1 A 46 46 ALA C C 46 179.093 175.816 3.277 1
1 472 . 12 1 1 A 46 46 ALA CA C 46 52.829 50.668 2.161 1
1 473 . 12 1 1 A 46 46 ALA CB C 46 18.687 22.580 -3.893 1
1 474 . 12 1 1 A 46 46 ALA N N 46 125.635 127.667 -2.032 1
1 475 . 12 1 1 A 47 47 ARG H H 47 9.012 8.973 0.039 1
1 476 . 12 1 1 A 47 47 ARG HA H 47 5.192 5.166 0.026 1
1 484 . 12 1 1 A 47 47 ARG C C 47 171.524 174.063 -2.539 1
1 485 . 12 1 1 A 47 47 ARG CA C 47 55.265 54.743 0.522 1
1 486 . 12 1 1 A 47 47 ARG CB C 47 30.970 34.080 -3.110 1
1 489 . 12 1 1 A 47 47 ARG N N 47 120.048 120.155 -0.107 1
1 491 . 12 1 1 A 48 48 LEU H H 48 9.029 8.678 0.351 1
1 492 . 12 1 1 A 48 48 LEU HA H 48 5.221 5.093 0.128 1
1 502 . 12 1 1 A 48 48 LEU C C 48 174.348 176.109 -1.761 1
1 503 . 12 1 1 A 48 48 LEU CA C 48 53.253 53.899 -0.646 1
1 504 . 12 1 1 A 48 48 LEU CB C 48 45.419 44.349 1.070 1
1 508 . 12 1 1 A 48 48 LEU N N 48 123.315 124.098 -0.783 1
1 509 . 12 1 1 A 49 49 GLU H H 49 9.473 8.593 0.880 1
1 510 . 12 1 1 A 49 49 GLU HA H 49 5.222 4.889 0.333 1
1 515 . 12 1 1 A 49 49 GLU C C 49 175.507 175.599 -0.092 1
1 516 . 12 1 1 A 49 49 GLU CA C 49 55.159 55.597 -0.438 1
1 517 . 12 1 1 A 49 49 GLU CB C 49 32.341 31.608 0.733 1
1 519 . 12 1 1 A 49 49 GLU N N 49 124.751 126.409 -1.658 1
1 520 . 12 1 1 A 50 50 LEU H H 50 9.088 8.516 0.572 1
1 521 . 12 1 1 A 50 50 LEU HA H 50 5.382 5.325 0.057 1
1 531 . 12 1 1 A 50 50 LEU C C 50 175.474 175.726 -0.252 1
1 532 . 12 1 1 A 50 50 LEU CA C 50 52.865 53.673 -0.808 1
1 533 . 12 1 1 A 50 50 LEU CB C 50 43.239 46.708 -3.469 1
1 537 . 12 1 1 A 50 50 LEU N N 50 124.221 121.641 2.580 1
1 538 . 12 1 1 A 51 51 GLN H H 51 9.602 8.680 0.922 1
1 539 . 12 1 1 A 51 51 GLN HA H 51 5.095 4.820 0.275 1
1 546 . 12 1 1 A 51 51 GLN C C 51 175.306 173.433 1.873 1
1 547 . 12 1 1 A 51 51 GLN CA C 51 54.576 54.746 -0.170 1
1 548 . 12 1 1 A 51 51 GLN CB C 51 32.177 32.407 -0.230 1
1 550 . 12 1 1 A 51 51 GLN N N 51 123.268 121.643 1.625 1
1 552 . 12 1 1 A 52 52 GLU H H 52 9.172 8.889 0.283 1
1 553 . 12 1 1 A 52 52 GLU HA H 52 4.092 5.271 -1.179 1
1 558 . 12 1 1 A 52 52 GLU C C 52 176.523 176.295 0.228 1
1 559 . 12 1 1 A 52 52 GLU CA C 52 57.500 55.188 2.312 1
1 560 . 12 1 1 A 52 52 GLU CB C 52 30.696 31.912 -1.216 1
1 562 . 12 1 1 A 52 52 GLU N N 52 128.982 127.216 1.766 1
1 563 . 12 1 1 A 53 53 GLY H H 53 8.644 8.584 0.060 1
1 564 . 12 1 1 A 53 53 GLY HA2 H 53 4.261 4.241 0.020 1
1 565 . 12 1 1 A 53 53 GLY HA3 H 53 3.993 4.244 -0.251 1
1 566 . 12 1 1 A 53 53 GLY C C 53 172.550 174.695 -2.145 1
1 567 . 12 1 1 A 53 53 GLY CA C 53 45.911 45.445 0.466 1
1 568 . 12 1 1 A 53 53 GLY N N 53 110.844 114.515 -3.671 1
1 569 . 12 1 1 A 54 54 PRO HA H 54 4.392 4.536 -0.144 1
1 576 . 12 1 1 A 54 54 PRO C C 54 176.828 176.656 0.172 1
1 577 . 12 1 1 A 54 54 PRO CA C 54 63.665 64.530 -0.865 1
1 578 . 12 1 1 A 54 54 PRO CB C 54 32.012 32.166 -0.154 1
1 581 . 12 1 1 A 55 55 GLU H H 55 8.934 7.976 0.958 1
1 582 . 12 1 1 A 55 55 GLU HA H 55 4.193 4.791 -0.598 1
1 587 . 12 1 1 A 55 55 GLU C C 55 176.189 174.960 1.229 1
1 588 . 12 1 1 A 55 55 GLU CA C 55 57.383 55.383 2.000 1
1 589 . 12 1 1 A 55 55 GLU CB C 55 28.945 32.210 -3.265 1
1 591 . 12 1 1 A 55 55 GLU N N 55 120.312 117.853 2.459 1
1 592 . 12 1 1 A 56 56 LYS H H 56 7.937 8.742 -0.805 1
1 593 . 12 1 1 A 56 56 LYS HA H 56 4.578 4.894 -0.316 1
1 602 . 12 1 1 A 56 56 LYS C C 56 174.295 174.219 0.076 1
1 603 . 12 1 1 A 56 56 LYS CA C 56 54.171 52.969 1.202 1
1 604 . 12 1 1 A 56 56 LYS CB C 56 32.555 35.102 -2.547 1
1 608 . 12 1 1 A 56 56 LYS N N 56 122.008 123.616 -1.608 1
1 609 . 12 1 1 A 57 57 PRO HA H 57 4.370 4.575 -0.205 1
1 616 . 12 1 1 A 57 57 PRO CA C 57 63.431 62.737 0.694 1
1 617 . 12 1 1 A 57 57 PRO CB C 57 32.072 30.663 1.409 1
1 620 . 12 1 1 A 58 58 ARG H H 58 8.310 8.323 -0.013 1
1 621 . 12 1 1 A 58 58 ARG HA H 58 4.295 3.811 0.484 1
1 628 . 12 1 1 A 58 58 ARG CA C 58 56.570 57.108 -0.538 1
1 629 . 12 1 1 A 58 58 ARG CB C 58 30.860 27.765 3.095 1
1 632 . 12 1 1 A 58 58 ARG N N 58 120.045 116.933 3.112 1
1 633 . 12 1 1 A 60 60 CYS HA H 60 4.482 5.191 -0.709 1
1 636 . 12 1 1 A 60 60 CYS CA C 60 58.621 57.869 0.752 1
1 637 . 12 1 1 A 60 60 CYS CB C 60 28.267 31.263 -2.996 1
1 638 . 12 1 1 A 61 61 GLU HA H 61 4.226 4.211 0.015 1
1 643 . 12 1 1 A 61 61 GLU C C 61 176.299 177.149 -0.850 1
1 644 . 12 1 1 A 61 61 GLU CA C 61 57.100 57.625 -0.525 1
1 645 . 12 1 1 A 61 61 GLU CB C 61 29.873 30.317 -0.444 1
1 647 . 12 1 1 A 62 62 ALA H H 62 8.282 8.560 -0.278 1
1 648 . 12 1 1 A 62 62 ALA HA H 62 4.302 4.442 -0.140 1
1 652 . 12 1 1 A 62 62 ALA C C 62 177.277 175.982 1.295 1
1 653 . 12 1 1 A 62 62 ALA CA C 62 52.512 51.691 0.821 1
1 654 . 12 1 1 A 62 62 ALA CB C 62 19.592 18.037 1.555 1
1 655 . 12 1 1 A 62 62 ALA N N 62 124.386 125.039 -0.653 1
1 656 . 12 1 1 A 63 63 ALA H H 63 8.399 7.643 0.756 1
1 657 . 12 1 1 A 63 63 ALA HA H 63 4.375 4.811 -0.436 1
1 661 . 12 1 1 A 63 63 ALA C C 63 176.843 175.530 1.313 1
1 662 . 12 1 1 A 63 63 ALA CA C 63 52.658 51.568 1.090 1
1 663 . 12 1 1 A 63 63 ALA CB C 63 19.592 23.069 -3.477 1
1 664 . 12 1 1 A 63 63 ALA N N 63 123.892 120.790 3.102 1
1 665 . 12 1 1 A 64 64 ARG H H 64 8.152 8.751 -0.599 1
1 666 . 12 1 1 A 64 64 ARG HA H 64 5.008 5.042 -0.034 1
1 673 . 12 1 1 A 64 64 ARG C C 64 175.594 174.562 1.032 1
1 674 . 12 1 1 A 64 64 ARG CA C 64 55.282 54.096 1.186 1
1 675 . 12 1 1 A 64 64 ARG CB C 64 32.506 34.264 -1.758 1
1 678 . 12 1 1 A 64 64 ARG N N 64 119.787 117.840 1.947 1
1 679 . 12 1 1 A 65 65 LYS H H 65 8.945 8.579 0.366 1
1 680 . 12 1 1 A 65 65 LYS HA H 65 4.602 4.962 -0.360 1
1 689 . 12 1 1 A 65 65 LYS C C 65 174.657 174.897 -0.240 1
1 690 . 12 1 1 A 65 65 LYS CA C 65 54.948 54.910 0.038 1
1 691 . 12 1 1 A 65 65 LYS CB C 65 34.068 34.072 -0.004 1
1 695 . 12 1 1 A 65 65 LYS N N 65 124.171 122.435 1.736 1
1 696 . 12 1 1 A 66 66 VAL H H 66 8.672 8.848 -0.176 1
1 697 . 12 1 1 A 66 66 VAL HA H 66 4.532 4.973 -0.441 1
1 705 . 12 1 1 A 66 66 VAL C C 66 175.078 173.682 1.396 1
1 706 . 12 1 1 A 66 66 VAL CA C 66 61.865 59.503 2.362 1
1 707 . 12 1 1 A 66 66 VAL CB C 66 33.835 35.826 -1.991 1
1 710 . 12 1 1 A 66 66 VAL N N 66 124.380 122.571 1.809 1
1 711 . 12 1 1 A 67 67 ILE H H 67 9.071 9.349 -0.278 1
1 712 . 12 1 1 A 67 67 ILE HA H 67 4.142 4.686 -0.544 1
1 722 . 12 1 1 A 67 67 ILE C C 67 175.819 175.685 0.134 1
1 723 . 12 1 1 A 67 67 ILE CA C 67 60.383 60.365 0.018 1
1 724 . 12 1 1 A 67 67 ILE CB C 67 39.908 39.883 0.025 1
1 728 . 12 1 1 A 67 67 ILE N N 67 129.537 127.997 1.540 1
1 729 . 12 1 1 A 68 68 ARG H H 68 9.203 8.679 0.524 1
1 730 . 12 1 1 A 68 68 ARG HA H 68 4.198 4.269 -0.071 1
1 737 . 12 1 1 A 68 68 ARG C C 68 177.769 176.968 0.801 1
1 738 . 12 1 1 A 68 68 ARG CA C 68 56.835 56.724 0.111 1
1 739 . 12 1 1 A 68 68 ARG CB C 68 29.832 30.401 -0.569 1
1 742 . 12 1 1 A 68 68 ARG N N 68 128.484 128.069 0.415 1
1 743 . 12 1 1 A 69 69 LEU H H 69 8.212 8.668 -0.456 1
1 744 . 12 1 1 A 69 69 LEU HA H 69 4.221 4.139 0.082 1
1 754 . 12 1 1 A 69 69 LEU C C 69 178.996 178.535 0.461 1
1 755 . 12 1 1 A 69 69 LEU CA C 69 57.136 57.253 -0.117 1
1 756 . 12 1 1 A 69 69 LEU CB C 69 39.455 41.490 -2.035 1
1 760 . 12 1 1 A 69 69 LEU N N 69 123.807 125.179 -1.372 1
1 761 . 12 1 1 A 70 70 SER H H 70 8.823 8.056 0.767 1
1 762 . 12 1 1 A 70 70 SER HA H 70 4.331 4.186 0.145 1
1 765 . 12 1 1 A 70 70 SER C C 70 175.076 174.887 0.189 1
1 766 . 12 1 1 A 70 70 SER CA C 70 60.329 60.890 -0.561 1
1 767 . 12 1 1 A 70 70 SER CB C 70 62.362 62.853 -0.491 1
1 768 . 12 1 1 A 70 70 SER N N 70 115.162 114.811 0.351 1
1 769 . 12 1 1 A 71 71 ASP H H 71 7.602 7.817 -0.215 1
1 770 . 12 1 1 A 71 71 ASP HA H 71 4.820 4.598 0.222 1
1 773 . 12 1 1 A 71 71 ASP C C 71 176.478 176.599 -0.121 1
1 774 . 12 1 1 A 71 71 ASP CA C 71 54.241 54.641 -0.400 1
1 775 . 12 1 1 A 71 71 ASP CB C 71 41.347 41.662 -0.315 1
1 776 . 12 1 1 A 71 71 ASP N N 71 119.590 119.030 0.560 1
1 777 . 12 1 1 A 72 72 CYS H H 72 7.715 7.168 0.547 1
1 778 . 12 1 1 A 72 72 CYS HA H 72 4.372 4.389 -0.017 1
1 781 . 12 1 1 A 72 72 CYS C C 72 173.690 174.280 -0.590 1
1 782 . 12 1 1 A 72 72 CYS CA C 72 60.836 59.698 1.138 1
1 783 . 12 1 1 A 72 72 CYS CB C 72 27.655 27.667 -0.012 1
1 784 . 12 1 1 A 72 72 CYS N N 72 118.346 118.275 0.071 1
1 785 . 12 1 1 A 73 73 LEU H H 73 9.472 9.267 0.205 1
1 786 . 12 1 1 A 73 73 LEU HA H 73 4.593 4.243 0.350 1
1 796 . 12 1 1 A 73 73 LEU C C 73 177.562 176.769 0.793 1
1 797 . 12 1 1 A 73 73 LEU CA C 73 55.724 56.475 -0.751 1
1 798 . 12 1 1 A 73 73 LEU CB C 73 43.774 42.633 1.141 1
1 802 . 12 1 1 A 73 73 LEU N N 73 124.752 127.650 -2.898 1
1 803 . 12 1 1 A 74 74 ARG H H 74 7.658 7.702 -0.044 1
1 804 . 12 1 1 A 74 74 ARG HA H 74 4.592 5.104 -0.512 1
1 811 . 12 1 1 A 74 74 ARG C C 74 173.605 174.643 -1.038 1
1 812 . 12 1 1 A 74 74 ARG CA C 74 56.465 55.950 0.515 1
1 813 . 12 1 1 A 74 74 ARG CB C 74 34.068 33.903 0.165 1
1 816 . 12 1 1 A 74 74 ARG N N 74 115.565 116.132 -0.567 1
1 817 . 12 1 1 A 75 75 VAL H H 75 8.622 8.821 -0.199 1
1 818 . 12 1 1 A 75 75 VAL HA H 75 5.170 5.261 -0.091 1
1 826 . 12 1 1 A 75 75 VAL C C 75 173.985 174.514 -0.529 1
1 827 . 12 1 1 A 75 75 VAL CA C 75 60.930 59.724 1.206 1
1 828 . 12 1 1 A 75 75 VAL CB C 75 35.073 36.242 -1.169 1
1 831 . 12 1 1 A 75 75 VAL N N 75 124.278 119.421 4.857 1
1 832 . 12 1 1 A 76 76 ALA H H 76 8.272 8.924 -0.652 1
1 833 . 12 1 1 A 76 76 ALA HA H 76 4.648 4.971 -0.323 1
1 837 . 12 1 1 A 76 76 ALA C C 76 175.630 176.202 -0.572 1
1 838 . 12 1 1 A 76 76 ALA CA C 76 51.294 51.371 -0.077 1
1 839 . 12 1 1 A 76 76 ALA CB C 76 22.759 23.926 -1.167 1
1 840 . 12 1 1 A 76 76 ALA N N 76 126.015 124.157 1.858 1
1 841 . 12 1 1 A 77 77 GLU H H 77 9.184 8.663 0.521 1
1 842 . 12 1 1 A 77 77 GLU HA H 77 4.060 5.078 -1.018 1
1 847 . 12 1 1 A 77 77 GLU C C 77 174.949 176.417 -1.468 1
1 848 . 12 1 1 A 77 77 GLU CA C 77 58.424 55.395 3.029 1
1 849 . 12 1 1 A 77 77 GLU CB C 77 30.161 30.992 -0.831 1
1 851 . 12 1 1 A 77 77 GLU N N 77 120.223 118.623 1.600 1
1 852 . 12 1 1 A 78 78 ALA H H 78 7.985 8.893 -0.908 1
1 853 . 12 1 1 A 78 78 ALA HA H 78 4.776 4.797 -0.021 1
1 857 . 12 1 1 A 78 78 ALA C C 78 177.250 177.347 -0.097 1
1 858 . 12 1 1 A 78 78 ALA CA C 78 50.888 51.879 -0.991 1
1 859 . 12 1 1 A 78 78 ALA CB C 78 20.851 20.444 0.407 1
1 860 . 12 1 1 A 78 78 ALA N N 78 125.143 129.492 -4.349 1
1 861 . 12 1 1 A 79 79 GLY H H 79 8.604 8.275 0.329 1
1 862 . 12 1 1 A 79 79 GLY HA2 H 79 4.327 4.105 0.222 1
1 863 . 12 1 1 A 79 79 GLY HA3 H 79 3.963 4.109 -0.146 1
1 864 . 12 1 1 A 79 79 GLY C C 79 175.360 173.750 1.610 1
1 865 . 12 1 1 A 79 79 GLY CA C 79 44.925 44.790 0.135 1
1 866 . 12 1 1 A 79 79 GLY N N 79 109.420 105.624 3.796 1
1 867 . 12 1 1 A 80 80 GLY H H 80 8.649 8.513 0.136 1
1 868 . 12 1 1 A 80 80 GLY HA2 H 80 3.962 4.046 -0.084 1
1 869 . 12 1 1 A 80 80 GLY HA3 H 80 3.962 4.048 -0.086 1
1 870 . 12 1 1 A 80 80 GLY C C 80 175.052 173.778 1.274 1
1 871 . 12 1 1 A 80 80 GLY CA C 80 45.955 46.342 -0.387 1
1 872 . 12 1 1 A 80 80 GLY N N 80 108.295 112.072 -3.777 1
1 873 . 12 1 1 A 81 81 GLU H H 81 8.921 8.431 0.490 1
1 874 . 12 1 1 A 81 81 GLU HA H 81 4.298 4.562 -0.264 1
1 879 . 12 1 1 A 81 81 GLU C C 81 176.532 175.446 1.086 1
1 880 . 12 1 1 A 81 81 GLU CA C 81 57.118 55.428 1.690 1
1 881 . 12 1 1 A 81 81 GLU CB C 81 28.599 30.420 -1.821 1
1 883 . 12 1 1 A 81 81 GLU N N 81 121.170 122.386 -1.216 1
1 884 . 12 1 1 A 82 82 ALA H H 82 8.032 7.381 0.651 1
1 885 . 12 1 1 A 82 82 ALA HA H 82 4.371 4.498 -0.127 1
1 889 . 12 1 1 A 82 82 ALA C C 82 177.160 177.111 0.049 1
1 890 . 12 1 1 A 82 82 ALA CA C 82 52.653 51.054 1.599 1
1 891 . 12 1 1 A 82 82 ALA CB C 82 19.304 22.010 -2.706 1
1 892 . 12 1 1 A 82 82 ALA N N 82 124.988 122.142 2.846 1
1 893 . 12 1 1 A 83 83 SER H H 83 8.319 8.784 -0.465 1
1 894 . 12 1 1 A 83 83 SER HA H 83 4.331 4.273 0.058 1
1 897 . 12 1 1 A 83 83 SER C C 83 174.045 175.344 -1.299 1
1 898 . 12 1 1 A 83 83 SER CA C 83 58.053 62.240 -4.187 1
1 899 . 12 1 1 A 83 83 SER CB C 83 63.184 62.950 0.234 1
1 900 . 12 1 1 A 83 83 SER N N 83 114.181 115.457 -1.276 1
1 901 . 12 1 1 A 84 84 SER H H 84 7.823 7.920 -0.097 1
1 902 . 12 1 1 A 84 84 SER HA H 84 3.194 4.359 -1.165 1
1 905 . 12 1 1 A 84 84 SER C C 84 171.072 173.993 -2.921 1
1 906 . 12 1 1 A 84 84 SER CA C 84 57.206 56.921 0.285 1
1 907 . 12 1 1 A 84 84 SER CB C 84 61.622 63.226 -1.604 1
1 908 . 12 1 1 A 84 84 SER N N 84 117.302 115.010 2.292 1
1 909 . 12 1 1 A 85 85 PRO HA H 85 3.922 4.607 -0.685 1
1 916 . 12 1 1 A 85 85 PRO CA C 85 62.691 62.333 0.358 1
1 917 . 12 1 1 A 85 85 PRO CB C 85 31.515 33.166 -1.651 1
1 920 . 12 1 1 A 86 86 ARG HA H 86 3.882 4.438 -0.556 1
1 927 . 12 1 1 A 86 86 ARG C C 86 175.712 176.354 -0.642 1
1 928 . 12 1 1 A 86 86 ARG CA C 86 57.877 56.251 1.626 1
1 929 . 12 1 1 A 86 86 ARG CB C 86 29.791 30.285 -0.494 1
1 932 . 12 1 1 A 87 87 ASP H H 87 8.903 7.854 1.049 1
1 933 . 12 1 1 A 87 87 ASP HA H 87 4.342 4.732 -0.390 1
1 936 . 12 1 1 A 87 87 ASP C C 87 175.723 175.373 0.350 1
1 937 . 12 1 1 A 87 87 ASP CA C 87 56.377 53.988 2.389 1
1 938 . 12 1 1 A 87 87 ASP CB C 87 39.208 41.707 -2.499 1
1 939 . 12 1 1 A 87 87 ASP N N 87 117.520 118.359 -0.839 1
1 940 . 12 1 1 A 88 88 THR H H 88 7.776 7.635 0.141 1
1 941 . 12 1 1 A 88 88 THR HA H 88 5.101 5.053 0.048 1
1 946 . 12 1 1 A 88 88 THR C C 88 173.825 172.997 0.828 1
1 947 . 12 1 1 A 88 88 THR CA C 88 60.154 59.885 0.269 1
1 948 . 12 1 1 A 88 88 THR CB C 88 72.702 72.933 -0.231 1
1 950 . 12 1 1 A 88 88 THR N N 88 108.770 111.346 -2.576 1
1 951 . 12 1 1 A 89 89 SER H H 89 9.006 9.431 -0.425 1
1 952 . 12 1 1 A 89 89 SER HA H 89 4.718 5.215 -0.497 1
1 955 . 12 1 1 A 89 89 SER C C 89 173.728 173.408 0.320 1
1 956 . 12 1 1 A 89 89 SER CA C 89 57.453 57.858 -0.405 1
1 957 . 12 1 1 A 89 89 SER CB C 89 65.611 65.542 0.069 1
1 958 . 12 1 1 A 89 89 SER N N 89 114.151 117.578 -3.427 1
1 959 . 12 1 1 A 90 90 ALA H H 90 9.001 8.281 0.720 1
1 960 . 12 1 1 A 90 90 ALA HA H 90 5.660 4.683 0.977 1
1 964 . 12 1 1 A 90 90 ALA C C 90 177.669 177.489 0.180 1
1 965 . 12 1 1 A 90 90 ALA CA C 90 51.670 52.055 -0.385 1
1 966 . 12 1 1 A 90 90 ALA CB C 90 22.265 20.028 2.237 1
1 967 . 12 1 1 A 90 90 ALA N N 90 126.177 129.008 -2.831 1
1 968 . 12 1 1 A 91 91 PHE H H 91 9.672 8.368 1.304 1
1 969 . 12 1 1 A 91 91 PHE HA H 91 5.039 5.640 -0.601 1
1 977 . 12 1 1 A 91 91 PHE C C 91 170.731 173.510 -2.779 1
1 978 . 12 1 1 A 91 91 PHE CA C 91 56.271 55.138 1.133 1
1 979 . 12 1 1 A 91 91 PHE CB C 91 41.553 42.190 -0.637 1
1 985 . 12 1 1 A 91 91 PHE N N 91 118.968 116.340 2.628 1
1 986 . 12 1 1 A 92 92 PHE H H 92 9.422 9.452 -0.030 1
1 987 . 12 1 1 A 92 92 PHE HA H 92 5.674 5.190 0.484 1
1 995 . 12 1 1 A 92 92 PHE C C 92 174.570 175.310 -0.740 1
1 996 . 12 1 1 A 92 92 PHE CA C 92 55.917 57.474 -1.557 1
1 997 . 12 1 1 A 92 92 PHE CB C 92 42.787 41.712 1.075 1
1 1003 . 12 1 1 A 92 92 PHE N N 92 117.543 117.858 -0.315 1
1 1004 . 12 1 1 A 93 93 LEU H H 93 9.021 8.749 0.272 1
1 1005 . 12 1 1 A 93 93 LEU HA H 93 5.122 4.897 0.225 1
1 1015 . 12 1 1 A 93 93 LEU C C 93 174.799 174.250 0.549 1
1 1016 . 12 1 1 A 93 93 LEU CA C 93 54.912 54.760 0.152 1
1 1017 . 12 1 1 A 93 93 LEU CB C 93 45.254 45.366 -0.112 1
1 1021 . 12 1 1 A 93 93 LEU N N 93 121.719 121.712 0.007 1
1 1022 . 12 1 1 A 94 94 GLU H H 94 9.294 9.042 0.252 1
1 1023 . 12 1 1 A 94 94 GLU HA H 94 5.043 5.205 -0.162 1
1 1028 . 12 1 1 A 94 94 GLU C C 94 175.754 175.370 0.384 1
1 1029 . 12 1 1 A 94 94 GLU CA C 94 56.018 54.900 1.118 1
1 1030 . 12 1 1 A 94 94 GLU CB C 94 32.752 33.028 -0.276 1
1 1032 . 12 1 1 A 94 94 GLU N N 94 127.032 128.631 -1.599 1
1 1033 . 12 1 1 A 95 95 THR H H 95 8.822 8.439 0.383 1
1 1034 . 12 1 1 A 95 95 THR HA H 95 5.398 5.052 0.346 1
1 1039 . 12 1 1 A 95 95 THR C C 95 173.860 175.332 -1.472 1
1 1040 . 12 1 1 A 95 95 THR CA C 95 59.588 59.606 -0.018 1
1 1041 . 12 1 1 A 95 95 THR CB C 95 72.191 72.374 -0.183 1
1 1043 . 12 1 1 A 95 95 THR N N 95 118.685 117.252 1.433 1
1 1044 . 12 1 1 A 96 96 LYS H H 96 8.823 9.078 -0.255 1
1 1045 . 12 1 1 A 96 96 LYS HA H 96 4.022 3.940 0.082 1
1 1054 . 12 1 1 A 96 96 LYS C C 96 177.330 178.701 -1.371 1
1 1055 . 12 1 1 A 96 96 LYS CA C 96 59.588 59.686 -0.098 1
1 1056 . 12 1 1 A 96 96 LYS CB C 96 32.588 32.037 0.551 1
1 1060 . 12 1 1 A 96 96 LYS N N 96 118.801 121.975 -3.174 1
1 1061 . 12 1 1 A 97 97 GLU H H 97 8.092 7.760 0.332 1
1 1062 . 12 1 1 A 97 97 GLU HA H 97 4.282 4.300 -0.018 1
1 1067 . 12 1 1 A 97 97 GLU C C 97 176.290 176.790 -0.500 1
1 1068 . 12 1 1 A 97 97 GLU CA C 97 57.365 58.451 -1.086 1
1 1069 . 12 1 1 A 97 97 GLU CB C 97 31.559 30.433 1.126 1
1 1071 . 12 1 1 A 97 97 GLU N N 97 113.992 117.905 -3.913 1
1 1072 . 12 1 1 A 98 98 ARG H H 98 7.482 7.062 0.420 1
1 1073 . 12 1 1 A 98 98 ARG HA H 98 4.397 4.575 -0.178 1
1 1080 . 12 1 1 A 98 98 ARG C C 98 172.792 173.196 -0.404 1
1 1081 . 12 1 1 A 98 98 ARG CA C 98 55.689 54.468 1.221 1
1 1082 . 12 1 1 A 98 98 ARG CB C 98 32.711 32.050 0.661 1
1 1085 . 12 1 1 A 98 98 ARG N N 98 116.022 113.520 2.502 1
1 1086 . 12 1 1 A 99 99 LEU H H 99 8.423 8.167 0.256 1
1 1087 . 12 1 1 A 99 99 LEU HA H 99 4.807 4.687 0.120 1
1 1097 . 12 1 1 A 99 99 LEU C C 99 175.903 174.032 1.871 1
1 1098 . 12 1 1 A 99 99 LEU CA C 99 54.383 53.787 0.596 1
1 1099 . 12 1 1 A 99 99 LEU CB C 99 43.362 44.072 -0.710 1
1 1103 . 12 1 1 A 99 99 LEU N N 99 124.983 121.789 3.194 1
1 1104 . 12 1 1 A 100 100 TYR H H 100 9.144 9.420 -0.276 1
1 1105 . 12 1 1 A 100 100 TYR HA H 100 4.542 5.186 -0.644 1
1 1112 . 12 1 1 A 100 100 TYR C C 100 173.479 174.408 -0.929 1
1 1113 . 12 1 1 A 100 100 TYR CA C 100 57.735 56.018 1.717 1
1 1114 . 12 1 1 A 100 100 TYR CB C 100 39.291 40.736 -1.445 1
1 1119 . 12 1 1 A 100 100 TYR N N 100 126.679 126.969 -0.290 1
1 1120 . 12 1 1 A 101 101 LEU H H 101 9.043 8.864 0.179 1
1 1121 . 12 1 1 A 101 101 LEU HA H 101 4.747 4.910 -0.163 1
1 1131 . 12 1 1 A 101 101 LEU C C 101 173.530 175.053 -1.523 1
1 1132 . 12 1 1 A 101 101 LEU CA C 101 54.524 53.628 0.896 1
1 1133 . 12 1 1 A 101 101 LEU CB C 101 42.499 43.590 -1.091 1
1 1137 . 12 1 1 A 101 101 LEU N N 101 127.422 125.609 1.813 1
1 1138 . 12 1 1 A 102 102 LEU H H 102 8.493 8.507 -0.014 1
1 1139 . 12 1 1 A 102 102 LEU HA H 102 5.612 5.424 0.188 1
1 1149 . 12 1 1 A 102 102 LEU C C 102 175.794 176.229 -0.435 1
1 1150 . 12 1 1 A 102 102 LEU CA C 102 53.076 53.251 -0.175 1
1 1151 . 12 1 1 A 102 102 LEU CB C 102 45.994 43.899 2.095 1
1 1155 . 12 1 1 A 102 102 LEU N N 102 126.021 127.668 -1.647 1
1 1156 . 12 1 1 A 103 103 ALA H H 103 9.073 9.190 -0.117 1
1 1157 . 12 1 1 A 103 103 ALA HA H 103 5.081 5.387 -0.306 1
1 1161 . 12 1 1 A 103 103 ALA C C 103 175.133 175.994 -0.861 1
1 1162 . 12 1 1 A 103 103 ALA CA C 103 51.688 49.886 1.802 1
1 1163 . 12 1 1 A 103 103 ALA CB C 103 21.689 22.484 -0.795 1
1 1164 . 12 1 1 A 103 103 ALA N N 103 117.679 123.619 -5.940 1
1 1165 . 12 1 1 A 104 104 ALA H H 104 8.582 8.598 -0.016 1
1 1166 . 12 1 1 A 104 104 ALA HA H 104 5.220 4.782 0.438 1
1 1170 . 12 1 1 A 104 104 ALA C C 104 173.471 174.044 -0.573 1
1 1171 . 12 1 1 A 104 104 ALA CA C 104 47.959 49.917 -1.958 1
1 1172 . 12 1 1 A 104 104 ALA CB C 104 21.359 22.054 -0.695 1
1 1173 . 12 1 1 A 104 104 ALA N N 104 123.419 121.271 2.148 1
1 1174 . 12 1 1 A 105 105 PRO HA H 105 4.542 4.738 -0.196 1
1 1181 . 12 1 1 A 105 105 PRO C C 105 178.409 177.890 0.519 1
1 1182 . 12 1 1 A 105 105 PRO CA C 105 64.301 62.838 1.463 1
1 1183 . 12 1 1 A 105 105 PRO CB C 105 32.094 31.653 0.441 1
1 1186 . 12 1 1 A 106 106 ALA H H 106 8.302 8.675 -0.373 1
1 1187 . 12 1 1 A 106 106 ALA HA H 106 4.022 4.023 -0.001 1
1 1191 . 12 1 1 A 106 106 ALA C C 106 179.641 179.696 -0.055 1
1 1192 . 12 1 1 A 106 106 ALA CA C 106 56.341 55.189 1.152 1
1 1193 . 12 1 1 A 106 106 ALA CB C 106 18.523 18.272 0.251 1
1 1194 . 12 1 1 A 106 106 ALA N N 106 127.733 128.209 -0.476 1
1 1195 . 12 1 1 A 107 107 ALA H H 107 9.035 8.189 0.846 1
1 1196 . 12 1 1 A 107 107 ALA HA H 107 4.331 4.023 0.308 1
1 1200 . 12 1 1 A 107 107 ALA C C 107 178.586 179.505 -0.919 1
1 1201 . 12 1 1 A 107 107 ALA CA C 107 53.765 55.287 -1.522 1
1 1202 . 12 1 1 A 107 107 ALA CB C 107 18.728 18.319 0.409 1
1 1203 . 12 1 1 A 107 107 ALA N N 107 118.203 120.005 -1.802 1
1 1204 . 12 1 1 A 108 108 GLU H H 108 8.399 8.202 0.197 1
1 1205 . 12 1 1 A 108 108 GLU HA H 108 4.631 4.110 0.521 1
1 1210 . 12 1 1 A 108 108 GLU C C 108 177.127 178.812 -1.685 1
1 1211 . 12 1 1 A 108 108 GLU CA C 108 55.847 58.556 -2.709 1
1 1212 . 12 1 1 A 108 108 GLU CB C 108 32.135 29.790 2.345 1
1 1214 . 12 1 1 A 108 108 GLU N N 108 114.661 118.013 -3.352 1
1 1215 . 12 1 1 A 109 109 ARG H H 109 7.412 8.643 -1.231 1
1 1216 . 12 1 1 A 109 109 ARG HA H 109 3.682 4.091 -0.409 1
1 1223 . 12 1 1 A 109 109 ARG C C 109 176.917 179.276 -2.359 1
1 1224 . 12 1 1 A 109 109 ARG CA C 109 61.600 59.868 1.732 1
1 1225 . 12 1 1 A 109 109 ARG CB C 109 28.845 30.480 -1.635 1
1 1228 . 12 1 1 A 109 109 ARG N N 109 120.954 121.047 -0.093 1
1 1229 . 12 1 1 A 110 110 GLY H H 110 8.833 8.466 0.367 1
1 1230 . 12 1 1 A 110 110 GLY HA2 H 110 3.872 3.795 0.077 1
1 1231 . 12 1 1 A 110 110 GLY HA3 H 110 3.685 3.806 -0.121 1
1 1232 . 12 1 1 A 110 110 GLY C C 110 175.997 175.233 0.764 1
1 1233 . 12 1 1 A 110 110 GLY CA C 110 47.323 47.492 -0.169 1
1 1234 . 12 1 1 A 110 110 GLY N N 110 106.563 107.262 -0.699 1
1 1235 . 12 1 1 A 111 111 ASP H H 111 7.882 8.101 -0.219 1
1 1236 . 12 1 1 A 111 111 ASP HA H 111 4.312 4.308 0.004 1
1 1239 . 12 1 1 A 111 111 ASP C C 111 179.467 177.992 1.475 1
1 1240 . 12 1 1 A 111 111 ASP CA C 111 56.976 56.726 0.250 1
1 1241 . 12 1 1 A 111 111 ASP CB C 111 40.648 40.909 -0.261 1
1 1242 . 12 1 1 A 111 111 ASP N N 111 121.402 120.609 0.793 1
1 1243 . 12 1 1 A 112 112 TRP H H 112 7.804 8.402 -0.598 1
1 1244 . 12 1 1 A 112 112 TRP HA H 112 3.831 4.200 -0.369 1
1 1253 . 12 1 1 A 112 112 TRP C C 112 177.547 178.609 -1.062 1
1 1254 . 12 1 1 A 112 112 TRP CA C 112 62.006 59.956 2.050 1
1 1255 . 12 1 1 A 112 112 TRP CB C 112 29.421 29.231 0.190 1
1 1261 . 12 1 1 A 112 112 TRP N N 112 119.904 120.619 -0.715 1
1 1263 . 12 1 1 A 113 113 VAL H H 113 7.982 7.960 0.022 1
1 1264 . 12 1 1 A 113 113 VAL HA H 113 3.072 3.606 -0.534 1
1 1272 . 12 1 1 A 113 113 VAL C C 113 178.015 178.286 -0.271 1
1 1273 . 12 1 1 A 113 113 VAL CA C 113 67.407 66.796 0.611 1
1 1274 . 12 1 1 A 113 113 VAL CB C 113 31.724 31.604 0.120 1
1 1277 . 12 1 1 A 113 113 VAL N N 113 117.575 119.054 -1.479 1
1 1278 . 12 1 1 A 114 114 GLN H H 114 8.268 8.231 0.037 1
1 1279 . 12 1 1 A 114 114 GLN HA H 114 3.994 3.963 0.031 1
1 1286 . 12 1 1 A 114 114 GLN C C 114 178.021 177.839 0.182 1
1 1287 . 12 1 1 A 114 114 GLN CA C 114 59.112 58.815 0.297 1
1 1288 . 12 1 1 A 114 114 GLN CB C 114 28.685 28.721 -0.036 1
1 1290 . 12 1 1 A 114 114 GLN N N 114 117.479 120.092 -2.613 1
1 1292 . 12 1 1 A 115 115 ALA H H 115 7.915 8.433 -0.518 1
1 1293 . 12 1 1 A 115 115 ALA HA H 115 3.972 4.099 -0.127 1
1 1297 . 12 1 1 A 115 115 ALA C C 115 180.030 180.094 -0.064 1
1 1298 . 12 1 1 A 115 115 ALA CA C 115 55.142 55.184 -0.042 1
1 1299 . 12 1 1 A 115 115 ALA CB C 115 18.152 18.367 -0.215 1
1 1300 . 12 1 1 A 115 115 ALA N N 115 120.858 120.448 0.410 1
1 1301 . 12 1 1 A 116 116 ILE H H 116 8.172 8.338 -0.166 1
1 1302 . 12 1 1 A 116 116 ILE HA H 116 3.482 3.650 -0.168 1
1 1312 . 12 1 1 A 116 116 ILE C C 116 177.739 178.187 -0.448 1
1 1313 . 12 1 1 A 116 116 ILE CA C 116 66.119 65.447 0.672 1
1 1314 . 12 1 1 A 116 116 ILE CB C 116 38.222 37.832 0.390 1
1 1318 . 12 1 1 A 116 116 ILE N N 116 115.977 118.014 -2.037 1
1 1319 . 12 1 1 A 117 117 CYS H H 117 8.449 8.647 -0.198 1
1 1320 . 12 1 1 A 117 117 CYS HA H 117 4.032 4.346 -0.314 1
1 1323 . 12 1 1 A 117 117 CYS C C 117 177.321 176.436 0.885 1
1 1324 . 12 1 1 A 117 117 CYS CA C 117 64.777 61.980 2.797 1
1 1325 . 12 1 1 A 117 117 CYS CB C 117 26.871 27.221 -0.350 1
1 1326 . 12 1 1 A 117 117 CYS N N 117 117.253 120.326 -3.073 1
1 1327 . 12 1 1 A 118 118 LEU H H 118 8.182 7.646 0.536 1
1 1328 . 12 1 1 A 118 118 LEU HA H 118 4.052 4.241 -0.189 1
1 1338 . 12 1 1 A 118 118 LEU C C 118 179.217 178.851 0.366 1
1 1339 . 12 1 1 A 118 118 LEU CA C 118 57.877 57.221 0.656 1
1 1340 . 12 1 1 A 118 118 LEU CB C 118 42.088 42.372 -0.284 1
1 1344 . 12 1 1 A 118 118 LEU N N 118 119.665 120.760 -1.095 1
1 1345 . 12 1 1 A 119 119 LEU H H 119 7.142 8.328 -1.186 1
1 1346 . 12 1 1 A 119 119 LEU HA H 119 4.192 4.197 -0.005 1
1 1356 . 12 1 1 A 119 119 LEU C C 119 178.492 178.444 0.048 1
1 1357 . 12 1 1 A 119 119 LEU CA C 119 56.259 57.954 -1.695 1
1 1358 . 12 1 1 A 119 119 LEU CB C 119 43.568 42.128 1.440 1
1 1362 . 12 1 1 A 119 119 LEU N N 119 116.244 118.929 -2.685 1
1 1363 . 12 1 1 A 120 120 ALA H H 120 8.513 8.244 0.269 1
1 1364 . 12 1 1 A 120 120 ALA HA H 120 3.878 4.067 -0.189 1
1 1368 . 12 1 1 A 120 120 ALA C C 120 178.358 178.510 -0.152 1
1 1369 . 12 1 1 A 120 120 ALA CA C 120 53.765 55.118 -1.353 1
1 1370 . 12 1 1 A 120 120 ALA CB C 120 18.687 18.644 0.043 1
1 1371 . 12 1 1 A 120 120 ALA N N 120 120.009 120.112 -0.103 1
1 1372 . 12 1 1 A 121 121 PHE H H 121 7.822 8.243 -0.421 1
1 1373 . 12 1 1 A 121 121 PHE HA H 121 5.156 4.919 0.237 1
1 1381 . 12 1 1 A 121 121 PHE C C 121 176.273 175.394 0.879 1
1 1382 . 12 1 1 A 121 121 PHE CA C 121 55.741 56.838 -1.097 1
1 1383 . 12 1 1 A 121 121 PHE CB C 121 39.455 38.255 1.200 1
1 1389 . 12 1 1 A 121 121 PHE N N 121 113.981 115.770 -1.789 1
1 1390 . 12 1 1 A 122 122 SER H H 122 7.765 8.432 -0.667 1
1 1391 . 12 1 1 A 122 122 SER HA H 122 4.579 4.592 -0.013 1
1 1394 . 12 1 1 A 122 122 SER C C 122 174.595 172.967 1.628 1
1 1395 . 12 1 1 A 122 122 SER CA C 122 58.777 57.281 1.496 1
1 1396 . 12 1 1 A 122 122 SER CB C 122 63.719 61.896 1.823 1
1 1397 . 12 1 1 A 122 122 SER N N 122 115.069 117.183 -2.114 1
1 1398 . 12 1 1 A 123 123 GLY H H 123 8.223 8.136 0.087 1
1 1399 . 12 1 1 A 123 123 GLY HA2 H 123 4.174 4.194 -0.020 1
1 1400 . 12 1 1 A 123 123 GLY HA3 H 123 4.100 4.199 -0.099 1
1 1401 . 12 1 1 A 123 123 GLY C C 123 171.678 172.015 -0.337 1
1 1402 . 12 1 1 A 123 123 GLY CA C 123 44.815 44.701 0.114 1
1 1403 . 12 1 1 A 123 123 GLY N N 123 110.151 113.545 -3.394 1
1 1404 . 12 1 1 A 124 124 PRO HA H 124 4.482 4.675 -0.193 1
1 1411 . 12 1 1 A 124 124 PRO C C 124 177.314 177.487 -0.173 1
1 1412 . 12 1 1 A 124 124 PRO CA C 124 63.206 62.754 0.452 1
1 1413 . 12 1 1 A 124 124 PRO CB C 124 32.176 31.782 0.394 1
1 1416 . 12 1 1 A 125 125 SER H H 125 8.485 8.732 -0.247 1
1 1417 . 12 1 1 A 125 125 SER HA H 125 4.472 4.453 0.019 1
1 1420 . 12 1 1 A 125 125 SER C C 125 174.728 174.150 0.578 1
1 1421 . 12 1 1 A 125 125 SER CA C 125 58.353 60.363 -2.010 1
1 1422 . 12 1 1 A 125 125 SER CB C 125 64.048 63.818 0.230 1
1 1423 . 12 1 1 A 125 125 SER N N 125 116.081 119.833 -3.752 1
1 1424 . 12 1 1 A 126 126 SER H H 126 8.332 7.995 0.337 1
1 1425 . 12 1 1 A 126 126 SER HA H 126 4.464 4.792 -0.328 1
1 1428 . 12 1 1 A 126 126 SER C C 126 173.980 173.823 0.157 1
1 1429 . 12 1 1 A 126 126 SER CA C 126 58.336 57.539 0.797 1
1 1430 . 12 1 1 A 126 126 SER CB C 126 63.925 65.792 -1.867 1
1 1431 . 12 1 1 A 126 126 SER N N 126 118.037 113.869 4.168 1
1 1 . 13 1 1 A 6 6 SER HA H 6 4.458 5.070 -0.612 1
1 3 . 13 1 1 A 6 6 SER C C 6 175.108 173.936 1.172 1
1 4 . 13 1 1 A 6 6 SER CA C 6 58.689 57.306 1.383 1
1 5 . 13 1 1 A 6 6 SER CB C 6 63.678 65.181 -1.503 1
1 6 . 13 1 1 A 7 7 GLY H H 7 8.449 8.900 -0.451 1
1 7 . 13 1 1 A 7 7 GLY HA2 H 7 3.965 3.997 -0.032 1
1 8 . 13 1 1 A 7 7 GLY HA3 H 7 3.965 3.998 -0.033 1
1 9 . 13 1 1 A 7 7 GLY C C 7 174.380 173.124 1.256 1
1 10 . 13 1 1 A 7 7 GLY CA C 7 45.435 45.505 -0.070 1
1 11 . 13 1 1 A 7 7 GLY N N 7 110.792 112.948 -2.156 1
1 12 . 13 1 1 A 8 8 MET H H 8 8.259 8.545 -0.286 1
1 13 . 13 1 1 A 8 8 MET HA H 8 4.487 4.268 0.219 1
1 21 . 13 1 1 A 8 8 MET C C 8 176.961 176.445 0.516 1
1 22 . 13 1 1 A 8 8 MET CA C 8 55.565 57.120 -1.555 1
1 23 . 13 1 1 A 8 8 MET CB C 8 32.835 32.465 0.370 1
1 26 . 13 1 1 A 8 8 MET N N 8 119.639 122.830 -3.191 1
1 27 . 13 1 1 A 9 9 GLY H H 9 8.472 8.474 -0.002 1
1 28 . 13 1 1 A 9 9 GLY HA2 H 9 3.946 4.187 -0.241 1
1 29 . 13 1 1 A 9 9 GLY HA3 H 9 3.946 4.196 -0.250 1
1 30 . 13 1 1 A 9 9 GLY C C 9 174.005 171.609 2.396 1
1 31 . 13 1 1 A 9 9 GLY CA C 9 45.488 45.388 0.100 1
1 32 . 13 1 1 A 9 9 GLY N N 9 110.107 110.007 0.100 1
1 33 . 13 1 1 A 10 10 ASP H H 10 8.292 8.451 -0.159 1
1 34 . 13 1 1 A 10 10 ASP HA H 10 4.636 4.713 -0.077 1
1 37 . 13 1 1 A 10 10 ASP C C 10 176.768 175.538 1.230 1
1 38 . 13 1 1 A 10 10 ASP CA C 10 54.206 53.916 0.290 1
1 39 . 13 1 1 A 10 10 ASP CB C 10 41.306 39.193 2.113 1
1 40 . 13 1 1 A 10 10 ASP N N 10 120.370 121.441 -1.071 1
1 41 . 13 1 1 A 11 11 GLY H H 11 8.452 8.906 -0.454 1
1 42 . 13 1 1 A 11 11 GLY HA2 H 11 3.980 4.165 -0.185 1
1 43 . 13 1 1 A 11 11 GLY HA3 H 11 4.022 4.179 -0.157 1
1 44 . 13 1 1 A 11 11 GLY C C 11 174.102 173.173 0.929 1
1 45 . 13 1 1 A 11 11 GLY CA C 11 45.170 46.014 -0.844 1
1 46 . 13 1 1 A 11 11 GLY N N 11 108.391 111.173 -2.782 1
1 47 . 13 1 1 A 12 12 ALA H H 12 8.293 8.728 -0.435 1
1 48 . 13 1 1 A 12 12 ALA HA H 12 3.777 4.255 -0.478 1
1 52 . 13 1 1 A 12 12 ALA C C 12 178.193 178.216 -0.023 1
1 53 . 13 1 1 A 12 12 ALA CA C 12 52.759 52.492 0.267 1
1 54 . 13 1 1 A 12 12 ALA CB C 12 17.855 19.082 -1.227 1
1 55 . 13 1 1 A 12 12 ALA N N 12 124.185 127.704 -3.519 1
1 56 . 13 1 1 A 13 13 VAL H H 13 8.822 8.772 0.050 1
1 57 . 13 1 1 A 13 13 VAL HA H 13 3.912 3.877 0.035 1
1 65 . 13 1 1 A 13 13 VAL C C 13 176.073 175.928 0.145 1
1 66 . 13 1 1 A 13 13 VAL CA C 13 63.100 64.921 -1.821 1
1 67 . 13 1 1 A 13 13 VAL CB C 13 32.711 31.870 0.841 1
1 70 . 13 1 1 A 13 13 VAL N N 13 120.877 123.442 -2.565 1
1 71 . 13 1 1 A 14 14 LYS H H 14 7.093 7.006 0.087 1
1 72 . 13 1 1 A 14 14 LYS HA H 14 4.169 4.547 -0.378 1
1 81 . 13 1 1 A 14 14 LYS C C 14 173.291 173.930 -0.639 1
1 82 . 13 1 1 A 14 14 LYS CA C 14 56.465 55.740 0.725 1
1 83 . 13 1 1 A 14 14 LYS CB C 14 35.960 35.742 0.218 1
1 87 . 13 1 1 A 14 14 LYS N N 14 118.693 119.354 -0.661 1
1 88 . 13 1 1 A 15 15 GLN H H 15 8.522 8.528 -0.006 1
1 89 . 13 1 1 A 15 15 GLN HA H 15 5.542 5.228 0.314 1
1 96 . 13 1 1 A 15 15 GLN C C 15 174.992 175.628 -0.636 1
1 97 . 13 1 1 A 15 15 GLN CA C 15 54.312 54.028 0.284 1
1 98 . 13 1 1 A 15 15 GLN CB C 15 33.585 31.912 1.673 1
1 100 . 13 1 1 A 15 15 GLN N N 15 124.024 124.292 -0.268 1
1 102 . 13 1 1 A 16 16 GLY H H 16 8.740 7.855 0.885 1
1 103 . 13 1 1 A 16 16 GLY HA2 H 16 4.511 3.820 0.691 1
1 104 . 13 1 1 A 16 16 GLY HA3 H 16 4.064 4.321 -0.257 1
1 105 . 13 1 1 A 16 16 GLY C C 16 171.431 171.326 0.105 1
1 106 . 13 1 1 A 16 16 GLY CA C 16 46.106 46.084 0.022 1
1 107 . 13 1 1 A 16 16 GLY N N 16 109.611 108.570 1.041 1
1 108 . 13 1 1 A 17 17 PHE H H 17 8.886 8.327 0.559 1
1 109 . 13 1 1 A 17 17 PHE HA H 17 5.466 5.218 0.248 1
1 114 . 13 1 1 A 17 17 PHE C C 17 174.795 174.672 0.123 1
1 115 . 13 1 1 A 17 17 PHE CA C 17 57.788 56.296 1.492 1
1 116 . 13 1 1 A 17 17 PHE CB C 17 41.315 41.431 -0.116 1
1 119 . 13 1 1 A 17 17 PHE N N 17 122.684 119.586 3.098 1
1 120 . 13 1 1 A 18 18 LEU H H 18 8.762 8.640 0.122 1
1 121 . 13 1 1 A 18 18 LEU HA H 18 4.946 4.711 0.235 1
1 131 . 13 1 1 A 18 18 LEU C C 18 175.461 175.432 0.029 1
1 132 . 13 1 1 A 18 18 LEU CA C 18 52.970 53.004 -0.034 1
1 133 . 13 1 1 A 18 18 LEU CB C 18 47.945 44.913 3.032 1
1 137 . 13 1 1 A 18 18 LEU N N 18 119.045 123.942 -4.897 1
1 138 . 13 1 1 A 19 19 TYR H H 19 9.272 8.292 0.980 1
1 139 . 13 1 1 A 19 19 TYR HA H 19 5.682 5.513 0.169 1
1 146 . 13 1 1 A 19 19 TYR C C 19 174.829 174.396 0.433 1
1 147 . 13 1 1 A 19 19 TYR CA C 19 56.482 56.336 0.146 1
1 148 . 13 1 1 A 19 19 TYR CB C 19 41.717 41.320 0.397 1
1 153 . 13 1 1 A 19 19 TYR N N 19 118.024 119.607 -1.583 1
1 154 . 13 1 1 A 20 20 LEU H H 20 9.441 9.532 -0.091 1
1 155 . 13 1 1 A 20 20 LEU HA H 20 5.283 5.207 0.076 1
1 165 . 13 1 1 A 20 20 LEU C C 20 175.935 176.058 -0.123 1
1 166 . 13 1 1 A 20 20 LEU CA C 20 53.464 53.768 -0.304 1
1 167 . 13 1 1 A 20 20 LEU CB C 20 46.570 45.625 0.945 1
1 171 . 13 1 1 A 20 20 LEU N N 20 122.838 125.156 -2.318 1
1 172 . 13 1 1 A 21 21 GLN H H 21 8.391 8.900 -0.509 1
1 173 . 13 1 1 A 21 21 GLN HA H 21 3.791 4.124 -0.333 1
1 180 . 13 1 1 A 21 21 GLN C C 21 175.157 174.675 0.482 1
1 181 . 13 1 1 A 21 21 GLN CA C 21 56.094 56.118 -0.024 1
1 182 . 13 1 1 A 21 21 GLN CB C 21 28.434 28.463 -0.029 1
1 184 . 13 1 1 A 21 21 GLN N N 21 129.943 127.719 2.224 1
1 186 . 13 1 1 A 22 22 GLN H H 22 8.829 8.233 0.596 1
1 187 . 13 1 1 A 22 22 GLN HA H 22 4.553 5.002 -0.449 1
1 194 . 13 1 1 A 22 22 GLN C C 22 174.998 174.777 0.221 1
1 195 . 13 1 1 A 22 22 GLN CA C 22 54.912 54.110 0.802 1
1 196 . 13 1 1 A 22 22 GLN CB C 22 31.930 30.949 0.981 1
1 198 . 13 1 1 A 22 22 GLN N N 22 127.199 126.010 1.189 1
1 200 . 13 1 1 A 23 23 GLN HA H 23 4.142 5.250 -1.108 1
1 207 . 13 1 1 A 23 23 GLN CA C 23 56.427 54.303 2.124 1
1 208 . 13 1 1 A 23 23 GLN CB C 23 29.227 31.913 -2.686 1
1 211 . 13 1 1 A 24 24 GLN HA H 24 4.523 4.462 0.061 1
1 218 . 13 1 1 A 24 24 GLN CB C 24 29.759 31.171 -1.412 1
1 221 . 13 1 1 A 25 25 THR HA H 25 3.870 3.753 0.117 1
1 226 . 13 1 1 A 25 25 THR CA C 25 65.096 62.674 2.422 1
1 227 . 13 1 1 A 25 25 THR CB C 25 68.924 66.805 2.119 1
1 229 . 13 1 1 A 26 26 PHE HA H 26 4.690 4.952 -0.262 1
1 236 . 13 1 1 A 26 26 PHE C C 26 175.523 175.140 0.383 1
1 237 . 13 1 1 A 26 26 PHE CA C 26 57.312 56.445 0.867 1
1 238 . 13 1 1 A 26 26 PHE CB C 26 39.003 43.340 -4.337 1
1 243 . 13 1 1 A 27 27 GLY H H 27 7.755 8.807 -1.052 1
1 244 . 13 1 1 A 27 27 GLY HA2 H 27 4.172 4.036 0.136 1
1 245 . 13 1 1 A 27 27 GLY HA3 H 27 3.783 4.039 -0.256 1
1 246 . 13 1 1 A 27 27 GLY C C 27 172.557 173.682 -1.125 1
1 247 . 13 1 1 A 27 27 GLY CA C 27 44.924 45.650 -0.726 1
1 248 . 13 1 1 A 27 27 GLY N N 27 109.216 109.103 0.113 1
1 249 . 13 1 1 A 28 28 LYS H H 28 8.241 8.355 -0.114 1
1 250 . 13 1 1 A 28 28 LYS HA H 28 4.530 4.180 0.350 1
1 259 . 13 1 1 A 28 28 LYS C C 28 176.204 176.537 -0.333 1
1 260 . 13 1 1 A 28 28 LYS CA C 28 55.741 56.741 -1.000 1
1 261 . 13 1 1 A 28 28 LYS CB C 28 33.904 32.750 1.154 1
1 265 . 13 1 1 A 28 28 LYS N N 28 118.743 121.255 -2.512 1
1 266 . 13 1 1 A 29 29 LYS H H 29 8.356 8.617 -0.261 1
1 267 . 13 1 1 A 29 29 LYS HA H 29 4.559 4.795 -0.236 1
1 274 . 13 1 1 A 29 29 LYS C C 29 175.420 174.556 0.864 1
1 275 . 13 1 1 A 29 29 LYS CA C 29 55.406 54.302 1.104 1
1 276 . 13 1 1 A 29 29 LYS CB C 29 35.618 36.037 -0.419 1
1 280 . 13 1 1 A 29 29 LYS N N 29 121.198 120.552 0.646 1
1 281 . 13 1 1 A 30 30 TRP H H 30 8.891 8.699 0.192 1
1 282 . 13 1 1 A 30 30 TRP HA H 30 4.951 5.211 -0.260 1
1 291 . 13 1 1 A 30 30 TRP C C 30 175.902 175.856 0.046 1
1 292 . 13 1 1 A 30 30 TRP CA C 30 56.677 56.396 0.281 1
1 293 . 13 1 1 A 30 30 TRP CB C 30 30.614 31.781 -1.167 1
1 299 . 13 1 1 A 30 30 TRP N N 30 123.304 119.974 3.330 1
1 301 . 13 1 1 A 31 31 ARG H H 31 8.712 9.086 -0.374 1
1 302 . 13 1 1 A 31 31 ARG HA H 31 4.820 4.975 -0.155 1
1 309 . 13 1 1 A 31 31 ARG C C 31 174.026 175.356 -1.330 1
1 310 . 13 1 1 A 31 31 ARG CA C 31 54.895 54.255 0.640 1
1 311 . 13 1 1 A 31 31 ARG CB C 31 34.045 33.023 1.022 1
1 314 . 13 1 1 A 31 31 ARG N N 31 123.973 121.208 2.765 1
1 315 . 13 1 1 A 32 32 ARG H H 32 8.820 8.346 0.474 1
1 316 . 13 1 1 A 32 32 ARG HA H 32 3.965 5.293 -1.328 1
1 323 . 13 1 1 A 32 32 ARG C C 32 174.785 174.927 -0.142 1
1 324 . 13 1 1 A 32 32 ARG CA C 32 56.924 55.614 1.310 1
1 325 . 13 1 1 A 32 32 ARG CB C 32 31.806 31.640 0.166 1
1 328 . 13 1 1 A 32 32 ARG N N 32 127.041 123.376 3.665 1
1 329 . 13 1 1 A 33 33 PHE H H 33 9.372 8.767 0.605 1
1 330 . 13 1 1 A 33 33 PHE HA H 33 4.863 4.970 -0.107 1
1 338 . 13 1 1 A 33 33 PHE C C 33 176.359 175.666 0.693 1
1 339 . 13 1 1 A 33 33 PHE CA C 33 57.224 56.602 0.622 1
1 340 . 13 1 1 A 33 33 PHE CB C 33 43.385 43.350 0.035 1
1 346 . 13 1 1 A 33 33 PHE N N 33 125.882 119.026 6.856 1
1 347 . 13 1 1 A 34 34 GLY H H 34 9.160 8.990 0.170 1
1 348 . 13 1 1 A 34 34 GLY HA2 H 34 4.182 4.145 0.037 1
1 349 . 13 1 1 A 34 34 GLY HA3 H 34 3.714 4.239 -0.525 1
1 350 . 13 1 1 A 34 34 GLY C C 34 172.920 173.193 -0.273 1
1 351 . 13 1 1 A 34 34 GLY CA C 34 46.247 46.075 0.172 1
1 352 . 13 1 1 A 34 34 GLY N N 34 108.654 110.414 -1.760 1
1 353 . 13 1 1 A 35 35 ALA H H 35 8.982 8.434 0.548 1
1 354 . 13 1 1 A 35 35 ALA HA H 35 5.660 5.603 0.057 1
1 358 . 13 1 1 A 35 35 ALA C C 35 176.547 176.139 0.408 1
1 359 . 13 1 1 A 35 35 ALA CA C 35 50.500 50.692 -0.192 1
1 360 . 13 1 1 A 35 35 ALA CB C 35 24.034 21.812 2.222 1
1 361 . 13 1 1 A 35 35 ALA N N 35 130.076 128.621 1.455 1
1 362 . 13 1 1 A 36 36 SER H H 36 8.852 8.446 0.406 1
1 363 . 13 1 1 A 36 36 SER HA H 36 5.203 4.956 0.247 1
1 366 . 13 1 1 A 36 36 SER C C 36 170.939 172.324 -1.385 1
1 367 . 13 1 1 A 36 36 SER CA C 36 57.806 57.470 0.336 1
1 368 . 13 1 1 A 36 36 SER CB C 36 66.986 65.623 1.363 1
1 369 . 13 1 1 A 36 36 SER N N 36 116.620 116.811 -0.191 1
1 370 . 13 1 1 A 37 37 LEU H H 37 8.862 8.724 0.138 1
1 371 . 13 1 1 A 37 37 LEU HA H 37 5.163 4.844 0.319 1
1 381 . 13 1 1 A 37 37 LEU C C 37 173.525 174.170 -0.645 1
1 382 . 13 1 1 A 37 37 LEU CA C 37 53.112 53.421 -0.309 1
1 383 . 13 1 1 A 37 37 LEU CB C 37 46.077 43.401 2.676 1
1 387 . 13 1 1 A 37 37 LEU N N 37 127.638 129.018 -1.380 1
1 388 . 13 1 1 A 38 38 TYR H H 38 9.280 8.514 0.766 1
1 389 . 13 1 1 A 38 38 TYR HA H 38 4.820 5.292 -0.472 1
1 396 . 13 1 1 A 38 38 TYR C C 38 175.430 175.070 0.360 1
1 397 . 13 1 1 A 38 38 TYR CA C 38 57.436 56.228 1.208 1
1 398 . 13 1 1 A 38 38 TYR CB C 38 42.128 41.287 0.841 1
1 403 . 13 1 1 A 38 38 TYR N N 38 125.215 126.909 -1.694 1
1 404 . 13 1 1 A 39 39 GLY H H 39 8.532 8.595 -0.063 1
1 405 . 13 1 1 A 39 39 GLY HA2 H 39 4.220 4.161 0.059 1
1 406 . 13 1 1 A 39 39 GLY HA3 H 39 3.941 4.164 -0.223 1
1 407 . 13 1 1 A 39 39 GLY C C 39 172.950 174.210 -1.260 1
1 408 . 13 1 1 A 39 39 GLY CA C 39 44.817 44.603 0.214 1
1 409 . 13 1 1 A 39 39 GLY N N 39 106.424 110.145 -3.721 1
1 410 . 13 1 1 A 40 40 GLY H H 40 8.477 8.603 -0.126 1
1 411 . 13 1 1 A 40 40 GLY HA2 H 40 4.102 4.035 0.067 1
1 412 . 13 1 1 A 40 40 GLY HA3 H 40 3.927 4.038 -0.111 1
1 413 . 13 1 1 A 40 40 GLY C C 40 174.002 174.206 -0.204 1
1 414 . 13 1 1 A 40 40 GLY CA C 40 44.694 45.541 -0.847 1
1 415 . 13 1 1 A 40 40 GLY N N 40 106.881 108.399 -1.518 1
1 416 . 13 1 1 A 41 41 SER H H 41 8.600 7.837 0.763 1
1 417 . 13 1 1 A 41 41 SER HA H 41 4.520 4.706 -0.186 1
1 420 . 13 1 1 A 41 41 SER C C 41 174.355 173.501 0.854 1
1 421 . 13 1 1 A 41 41 SER CA C 41 58.565 57.509 1.056 1
1 422 . 13 1 1 A 41 41 SER CB C 41 64.413 65.283 -0.870 1
1 423 . 13 1 1 A 41 41 SER N N 41 115.751 116.633 -0.882 1
1 424 . 13 1 1 A 42 42 ASP H H 42 8.533 8.628 -0.095 1
1 425 . 13 1 1 A 42 42 ASP HA H 42 4.560 4.500 0.060 1
1 428 . 13 1 1 A 42 42 ASP CA C 42 55.230 55.125 0.105 1
1 429 . 13 1 1 A 42 42 ASP CB C 42 40.648 40.026 0.622 1
1 430 . 13 1 1 A 42 42 ASP N N 42 119.037 122.884 -3.847 1
1 431 . 13 1 1 A 43 43 CYS H H 43 8.152 8.632 -0.480 1
1 432 . 13 1 1 A 43 43 CYS HA H 43 4.541 4.882 -0.341 1
1 435 . 13 1 1 A 43 43 CYS C C 43 173.975 173.393 0.582 1
1 436 . 13 1 1 A 43 43 CYS CA C 43 58.265 58.111 0.154 1
1 437 . 13 1 1 A 43 43 CYS CB C 43 28.393 30.978 -2.585 1
1 438 . 13 1 1 A 43 43 CYS N N 43 116.881 123.147 -6.266 1
1 439 . 13 1 1 A 44 44 ALA H H 44 8.047 8.623 -0.576 1
1 440 . 13 1 1 A 44 44 ALA HA H 44 4.395 4.634 -0.239 1
1 444 . 13 1 1 A 44 44 ALA C C 44 176.472 177.625 -1.153 1
1 445 . 13 1 1 A 44 44 ALA CA C 44 52.688 51.851 0.837 1
1 446 . 13 1 1 A 44 44 ALA CB C 44 20.579 19.194 1.385 1
1 447 . 13 1 1 A 44 44 ALA N N 44 125.989 125.858 0.131 1
1 448 . 13 1 1 A 45 45 LEU H H 45 8.052 7.806 0.246 1
1 449 . 13 1 1 A 45 45 LEU HA H 45 4.452 4.319 0.133 1
1 459 . 13 1 1 A 45 45 LEU C C 45 176.196 177.209 -1.013 1
1 460 . 13 1 1 A 45 45 LEU CA C 45 53.771 56.297 -2.526 1
1 461 . 13 1 1 A 45 45 LEU CB C 45 43.116 42.392 0.724 1
1 465 . 13 1 1 A 45 45 LEU N N 45 119.889 118.688 1.201 1
1 466 . 13 1 1 A 46 46 ALA H H 46 8.381 7.348 1.033 1
1 467 . 13 1 1 A 46 46 ALA HA H 46 4.449 4.494 -0.045 1
1 471 . 13 1 1 A 46 46 ALA C C 46 179.093 177.032 2.061 1
1 472 . 13 1 1 A 46 46 ALA CA C 46 52.829 52.987 -0.158 1
1 473 . 13 1 1 A 46 46 ALA CB C 46 18.687 19.168 -0.481 1
1 474 . 13 1 1 A 46 46 ALA N N 46 125.635 121.900 3.735 1
1 475 . 13 1 1 A 47 47 ARG H H 47 9.012 8.647 0.365 1
1 476 . 13 1 1 A 47 47 ARG HA H 47 5.192 5.071 0.121 1
1 484 . 13 1 1 A 47 47 ARG C C 47 171.524 173.722 -2.198 1
1 485 . 13 1 1 A 47 47 ARG CA C 47 55.265 55.018 0.247 1
1 486 . 13 1 1 A 47 47 ARG CB C 47 30.970 32.824 -1.854 1
1 489 . 13 1 1 A 47 47 ARG N N 47 120.048 121.008 -0.960 1
1 491 . 13 1 1 A 48 48 LEU H H 48 9.029 8.491 0.538 1
1 492 . 13 1 1 A 48 48 LEU HA H 48 5.221 4.966 0.255 1
1 502 . 13 1 1 A 48 48 LEU C C 48 174.348 175.116 -0.768 1
1 503 . 13 1 1 A 48 48 LEU CA C 48 53.253 53.864 -0.611 1
1 504 . 13 1 1 A 48 48 LEU CB C 48 45.419 44.023 1.396 1
1 508 . 13 1 1 A 48 48 LEU N N 48 123.315 123.918 -0.603 1
1 509 . 13 1 1 A 49 49 GLU H H 49 9.473 8.649 0.824 1
1 510 . 13 1 1 A 49 49 GLU HA H 49 5.222 4.816 0.406 1
1 515 . 13 1 1 A 49 49 GLU C C 49 175.507 175.896 -0.389 1
1 516 . 13 1 1 A 49 49 GLU CA C 49 55.159 55.853 -0.694 1
1 517 . 13 1 1 A 49 49 GLU CB C 49 32.341 31.735 0.606 1
1 519 . 13 1 1 A 49 49 GLU N N 49 124.751 127.008 -2.257 1
1 520 . 13 1 1 A 50 50 LEU H H 50 9.088 8.531 0.557 1
1 521 . 13 1 1 A 50 50 LEU HA H 50 5.382 5.158 0.224 1
1 531 . 13 1 1 A 50 50 LEU C C 50 175.474 176.107 -0.633 1
1 532 . 13 1 1 A 50 50 LEU CA C 50 52.865 53.600 -0.735 1
1 533 . 13 1 1 A 50 50 LEU CB C 50 43.239 45.866 -2.627 1
1 537 . 13 1 1 A 50 50 LEU N N 50 124.221 123.062 1.159 1
1 538 . 13 1 1 A 51 51 GLN H H 51 9.602 8.957 0.645 1
1 539 . 13 1 1 A 51 51 GLN HA H 51 5.095 5.024 0.071 1
1 546 . 13 1 1 A 51 51 GLN C C 51 175.306 174.308 0.998 1
1 547 . 13 1 1 A 51 51 GLN CA C 51 54.576 54.265 0.311 1
1 548 . 13 1 1 A 51 51 GLN CB C 51 32.177 30.857 1.320 1
1 550 . 13 1 1 A 51 51 GLN N N 51 123.268 121.052 2.216 1
1 552 . 13 1 1 A 52 52 GLU H H 52 9.172 8.738 0.434 1
1 553 . 13 1 1 A 52 52 GLU HA H 52 4.092 4.350 -0.258 1
1 558 . 13 1 1 A 52 52 GLU C C 52 176.523 177.412 -0.889 1
1 559 . 13 1 1 A 52 52 GLU CA C 52 57.500 57.361 0.139 1
1 560 . 13 1 1 A 52 52 GLU CB C 52 30.696 30.381 0.315 1
1 562 . 13 1 1 A 52 52 GLU N N 52 128.982 126.317 2.665 1
1 563 . 13 1 1 A 53 53 GLY H H 53 8.644 9.074 -0.430 1
1 564 . 13 1 1 A 53 53 GLY HA2 H 53 4.261 4.149 0.112 1
1 565 . 13 1 1 A 53 53 GLY HA3 H 53 3.993 4.182 -0.189 1
1 566 . 13 1 1 A 53 53 GLY C C 53 172.550 175.173 -2.623 1
1 567 . 13 1 1 A 53 53 GLY CA C 53 45.911 46.026 -0.115 1
1 568 . 13 1 1 A 53 53 GLY N N 53 110.844 114.916 -4.072 1
1 569 . 13 1 1 A 54 54 PRO HA H 54 4.392 4.596 -0.204 1
1 576 . 13 1 1 A 54 54 PRO C C 54 176.828 176.607 0.221 1
1 577 . 13 1 1 A 54 54 PRO CA C 54 63.665 64.362 -0.697 1
1 578 . 13 1 1 A 54 54 PRO CB C 54 32.012 32.017 -0.005 1
1 581 . 13 1 1 A 55 55 GLU H H 55 8.934 7.786 1.148 1
1 582 . 13 1 1 A 55 55 GLU HA H 55 4.193 4.377 -0.184 1
1 587 . 13 1 1 A 55 55 GLU C C 55 176.189 176.203 -0.014 1
1 588 . 13 1 1 A 55 55 GLU CA C 55 57.383 56.137 1.246 1
1 589 . 13 1 1 A 55 55 GLU CB C 55 28.945 30.165 -1.220 1
1 591 . 13 1 1 A 55 55 GLU N N 55 120.312 116.020 4.292 1
1 592 . 13 1 1 A 56 56 LYS H H 56 7.937 8.365 -0.428 1
1 593 . 13 1 1 A 56 56 LYS HA H 56 4.578 4.274 0.304 1
1 602 . 13 1 1 A 56 56 LYS C C 56 174.295 175.889 -1.594 1
1 603 . 13 1 1 A 56 56 LYS CA C 56 54.171 55.519 -1.348 1
1 604 . 13 1 1 A 56 56 LYS CB C 56 32.555 32.534 0.021 1
1 608 . 13 1 1 A 56 56 LYS N N 56 122.008 118.982 3.026 1
1 609 . 13 1 1 A 57 57 PRO HA H 57 4.370 4.593 -0.223 1
1 616 . 13 1 1 A 57 57 PRO CA C 57 63.431 62.748 0.683 1
1 617 . 13 1 1 A 57 57 PRO CB C 57 32.072 30.296 1.776 1
1 620 . 13 1 1 A 58 58 ARG H H 58 8.310 8.153 0.157 1
1 621 . 13 1 1 A 58 58 ARG HA H 58 4.295 4.694 -0.399 1
1 628 . 13 1 1 A 58 58 ARG CA C 58 56.570 54.747 1.823 1
1 629 . 13 1 1 A 58 58 ARG CB C 58 30.860 29.886 0.974 1
1 632 . 13 1 1 A 58 58 ARG N N 58 120.045 119.476 0.569 1
1 633 . 13 1 1 A 60 60 CYS HA H 60 4.482 4.344 0.138 1
1 636 . 13 1 1 A 60 60 CYS CA C 60 58.621 61.489 -2.868 1
1 637 . 13 1 1 A 60 60 CYS CB C 60 28.267 27.928 0.339 1
1 638 . 13 1 1 A 61 61 GLU HA H 61 4.226 4.579 -0.353 1
1 643 . 13 1 1 A 61 61 GLU C C 61 176.299 175.817 0.482 1
1 644 . 13 1 1 A 61 61 GLU CA C 61 57.100 55.288 1.812 1
1 645 . 13 1 1 A 61 61 GLU CB C 61 29.873 29.637 0.236 1
1 647 . 13 1 1 A 62 62 ALA H H 62 8.282 8.395 -0.113 1
1 648 . 13 1 1 A 62 62 ALA HA H 62 4.302 4.312 -0.010 1
1 652 . 13 1 1 A 62 62 ALA C C 62 177.277 176.342 0.935 1
1 653 . 13 1 1 A 62 62 ALA CA C 62 52.512 52.382 0.130 1
1 654 . 13 1 1 A 62 62 ALA CB C 62 19.592 17.980 1.612 1
1 655 . 13 1 1 A 62 62 ALA N N 62 124.386 125.913 -1.527 1
1 656 . 13 1 1 A 63 63 ALA H H 63 8.399 8.086 0.313 1
1 657 . 13 1 1 A 63 63 ALA HA H 63 4.375 4.889 -0.514 1
1 661 . 13 1 1 A 63 63 ALA C C 63 176.843 175.426 1.417 1
1 662 . 13 1 1 A 63 63 ALA CA C 63 52.658 51.748 0.910 1
1 663 . 13 1 1 A 63 63 ALA CB C 63 19.592 22.551 -2.959 1
1 664 . 13 1 1 A 63 63 ALA N N 63 123.892 125.573 -1.681 1
1 665 . 13 1 1 A 64 64 ARG H H 64 8.152 8.998 -0.846 1
1 666 . 13 1 1 A 64 64 ARG HA H 64 5.008 5.064 -0.056 1
1 673 . 13 1 1 A 64 64 ARG C C 64 175.594 173.861 1.733 1
1 674 . 13 1 1 A 64 64 ARG CA C 64 55.282 54.506 0.776 1
1 675 . 13 1 1 A 64 64 ARG CB C 64 32.506 32.964 -0.458 1
1 678 . 13 1 1 A 64 64 ARG N N 64 119.787 123.651 -3.864 1
1 679 . 13 1 1 A 65 65 LYS H H 65 8.945 8.953 -0.008 1
1 680 . 13 1 1 A 65 65 LYS HA H 65 4.602 4.911 -0.309 1
1 689 . 13 1 1 A 65 65 LYS C C 65 174.657 174.658 -0.001 1
1 690 . 13 1 1 A 65 65 LYS CA C 65 54.948 54.872 0.076 1
1 691 . 13 1 1 A 65 65 LYS CB C 65 34.068 34.086 -0.018 1
1 695 . 13 1 1 A 65 65 LYS N N 65 124.171 124.427 -0.256 1
1 696 . 13 1 1 A 66 66 VAL H H 66 8.672 8.881 -0.209 1
1 697 . 13 1 1 A 66 66 VAL HA H 66 4.532 5.136 -0.604 1
1 705 . 13 1 1 A 66 66 VAL C C 66 175.078 174.075 1.003 1
1 706 . 13 1 1 A 66 66 VAL CA C 66 61.865 59.551 2.314 1
1 707 . 13 1 1 A 66 66 VAL CB C 66 33.835 34.769 -0.934 1
1 710 . 13 1 1 A 66 66 VAL N N 66 124.380 126.318 -1.938 1
1 711 . 13 1 1 A 67 67 ILE H H 67 9.071 9.167 -0.096 1
1 712 . 13 1 1 A 67 67 ILE HA H 67 4.142 4.703 -0.561 1
1 722 . 13 1 1 A 67 67 ILE C C 67 175.819 175.528 0.291 1
1 723 . 13 1 1 A 67 67 ILE CA C 67 60.383 60.569 -0.186 1
1 724 . 13 1 1 A 67 67 ILE CB C 67 39.908 39.750 0.158 1
1 728 . 13 1 1 A 67 67 ILE N N 67 129.537 128.646 0.891 1
1 729 . 13 1 1 A 68 68 ARG H H 68 9.203 8.683 0.520 1
1 730 . 13 1 1 A 68 68 ARG HA H 68 4.198 4.289 -0.091 1
1 737 . 13 1 1 A 68 68 ARG C C 68 177.769 177.330 0.439 1
1 738 . 13 1 1 A 68 68 ARG CA C 68 56.835 57.153 -0.318 1
1 739 . 13 1 1 A 68 68 ARG CB C 68 29.832 30.537 -0.705 1
1 742 . 13 1 1 A 68 68 ARG N N 68 128.484 127.810 0.674 1
1 743 . 13 1 1 A 69 69 LEU H H 69 8.212 8.633 -0.421 1
1 744 . 13 1 1 A 69 69 LEU HA H 69 4.221 4.151 0.070 1
1 754 . 13 1 1 A 69 69 LEU C C 69 178.996 178.668 0.328 1
1 755 . 13 1 1 A 69 69 LEU CA C 69 57.136 56.820 0.316 1
1 756 . 13 1 1 A 69 69 LEU CB C 69 39.455 41.638 -2.183 1
1 760 . 13 1 1 A 69 69 LEU N N 69 123.807 123.351 0.456 1
1 761 . 13 1 1 A 70 70 SER H H 70 8.823 8.016 0.807 1
1 762 . 13 1 1 A 70 70 SER HA H 70 4.331 4.125 0.206 1
1 765 . 13 1 1 A 70 70 SER C C 70 175.076 176.737 -1.661 1
1 766 . 13 1 1 A 70 70 SER CA C 70 60.329 60.787 -0.458 1
1 767 . 13 1 1 A 70 70 SER CB C 70 62.362 62.594 -0.232 1
1 768 . 13 1 1 A 70 70 SER N N 70 115.162 113.329 1.833 1
1 769 . 13 1 1 A 71 71 ASP H H 71 7.602 7.585 0.017 1
1 770 . 13 1 1 A 71 71 ASP HA H 71 4.820 4.506 0.314 1
1 773 . 13 1 1 A 71 71 ASP C C 71 176.478 177.093 -0.615 1
1 774 . 13 1 1 A 71 71 ASP CA C 71 54.241 56.179 -1.938 1
1 775 . 13 1 1 A 71 71 ASP CB C 71 41.347 40.869 0.478 1
1 776 . 13 1 1 A 71 71 ASP N N 71 119.590 118.980 0.610 1
1 777 . 13 1 1 A 72 72 CYS H H 72 7.715 7.449 0.266 1
1 778 . 13 1 1 A 72 72 CYS HA H 72 4.372 4.588 -0.216 1
1 781 . 13 1 1 A 72 72 CYS C C 72 173.690 174.596 -0.906 1
1 782 . 13 1 1 A 72 72 CYS CA C 72 60.836 58.933 1.903 1
1 783 . 13 1 1 A 72 72 CYS CB C 72 27.655 27.590 0.065 1
1 784 . 13 1 1 A 72 72 CYS N N 72 118.346 118.204 0.142 1
1 785 . 13 1 1 A 73 73 LEU H H 73 9.472 9.014 0.458 1
1 786 . 13 1 1 A 73 73 LEU HA H 73 4.593 4.321 0.272 1
1 796 . 13 1 1 A 73 73 LEU C C 73 177.562 176.913 0.649 1
1 797 . 13 1 1 A 73 73 LEU CA C 73 55.724 56.839 -1.115 1
1 798 . 13 1 1 A 73 73 LEU CB C 73 43.774 42.410 1.364 1
1 802 . 13 1 1 A 73 73 LEU N N 73 124.752 129.003 -4.251 1
1 803 . 13 1 1 A 74 74 ARG H H 74 7.658 7.293 0.365 1
1 804 . 13 1 1 A 74 74 ARG HA H 74 4.592 4.639 -0.047 1
1 811 . 13 1 1 A 74 74 ARG C C 74 173.605 174.399 -0.794 1
1 812 . 13 1 1 A 74 74 ARG CA C 74 56.465 55.886 0.579 1
1 813 . 13 1 1 A 74 74 ARG CB C 74 34.068 33.815 0.253 1
1 816 . 13 1 1 A 74 74 ARG N N 74 115.565 116.049 -0.484 1
1 817 . 13 1 1 A 75 75 VAL H H 75 8.622 8.530 0.092 1
1 818 . 13 1 1 A 75 75 VAL HA H 75 5.170 5.201 -0.031 1
1 826 . 13 1 1 A 75 75 VAL C C 75 173.985 174.396 -0.411 1
1 827 . 13 1 1 A 75 75 VAL CA C 75 60.930 59.567 1.363 1
1 828 . 13 1 1 A 75 75 VAL CB C 75 35.073 36.356 -1.283 1
1 831 . 13 1 1 A 75 75 VAL N N 75 124.278 118.708 5.570 1
1 832 . 13 1 1 A 76 76 ALA H H 76 8.272 8.930 -0.658 1
1 833 . 13 1 1 A 76 76 ALA HA H 76 4.648 5.098 -0.450 1
1 837 . 13 1 1 A 76 76 ALA C C 76 175.630 175.508 0.122 1
1 838 . 13 1 1 A 76 76 ALA CA C 76 51.294 51.091 0.203 1
1 839 . 13 1 1 A 76 76 ALA CB C 76 22.759 24.280 -1.521 1
1 840 . 13 1 1 A 76 76 ALA N N 76 126.015 124.431 1.584 1
1 841 . 13 1 1 A 77 77 GLU H H 77 9.184 8.676 0.508 1
1 842 . 13 1 1 A 77 77 GLU HA H 77 4.060 5.288 -1.228 1
1 847 . 13 1 1 A 77 77 GLU C C 77 174.949 175.806 -0.857 1
1 848 . 13 1 1 A 77 77 GLU CA C 77 58.424 54.954 3.470 1
1 849 . 13 1 1 A 77 77 GLU CB C 77 30.161 31.882 -1.721 1
1 851 . 13 1 1 A 77 77 GLU N N 77 120.223 118.049 2.174 1
1 852 . 13 1 1 A 78 78 ALA H H 78 7.985 9.182 -1.197 1
1 853 . 13 1 1 A 78 78 ALA HA H 78 4.776 5.277 -0.501 1
1 857 . 13 1 1 A 78 78 ALA C C 78 177.250 176.653 0.597 1
1 858 . 13 1 1 A 78 78 ALA CA C 78 50.888 50.925 -0.037 1
1 859 . 13 1 1 A 78 78 ALA CB C 78 20.851 21.226 -0.375 1
1 860 . 13 1 1 A 78 78 ALA N N 78 125.143 128.637 -3.494 1
1 861 . 13 1 1 A 79 79 GLY H H 79 8.604 8.513 0.091 1
1 862 . 13 1 1 A 79 79 GLY HA2 H 79 4.327 4.211 0.116 1
1 863 . 13 1 1 A 79 79 GLY HA3 H 79 3.963 4.227 -0.264 1
1 864 . 13 1 1 A 79 79 GLY C C 79 175.360 173.931 1.429 1
1 865 . 13 1 1 A 79 79 GLY CA C 79 44.925 45.536 -0.611 1
1 866 . 13 1 1 A 79 79 GLY N N 79 109.420 105.721 3.699 1
1 867 . 13 1 1 A 80 80 GLY H H 80 8.649 8.920 -0.271 1
1 868 . 13 1 1 A 80 80 GLY HA2 H 80 3.962 4.003 -0.041 1
1 869 . 13 1 1 A 80 80 GLY HA3 H 80 3.962 4.009 -0.047 1
1 870 . 13 1 1 A 80 80 GLY C C 80 175.052 175.924 -0.872 1
1 871 . 13 1 1 A 80 80 GLY CA C 80 45.955 45.109 0.846 1
1 872 . 13 1 1 A 80 80 GLY N N 80 108.295 114.317 -6.022 1
1 873 . 13 1 1 A 81 81 GLU H H 81 8.921 8.251 0.670 1
1 874 . 13 1 1 A 81 81 GLU HA H 81 4.298 4.239 0.059 1
1 879 . 13 1 1 A 81 81 GLU C C 81 176.532 177.286 -0.754 1
1 880 . 13 1 1 A 81 81 GLU CA C 81 57.118 59.199 -2.081 1
1 881 . 13 1 1 A 81 81 GLU CB C 81 28.599 29.926 -1.327 1
1 883 . 13 1 1 A 81 81 GLU N N 81 121.170 118.718 2.452 1
1 884 . 13 1 1 A 82 82 ALA H H 82 8.032 7.312 0.720 1
1 885 . 13 1 1 A 82 82 ALA HA H 82 4.371 4.312 0.059 1
1 889 . 13 1 1 A 82 82 ALA C C 82 177.160 177.850 -0.690 1
1 890 . 13 1 1 A 82 82 ALA CA C 82 52.653 52.535 0.118 1
1 891 . 13 1 1 A 82 82 ALA CB C 82 19.304 19.899 -0.595 1
1 892 . 13 1 1 A 82 82 ALA N N 82 124.988 121.707 3.281 1
1 893 . 13 1 1 A 83 83 SER H H 83 8.319 8.874 -0.555 1
1 894 . 13 1 1 A 83 83 SER HA H 83 4.331 4.272 0.059 1
1 897 . 13 1 1 A 83 83 SER C C 83 174.045 174.544 -0.499 1
1 898 . 13 1 1 A 83 83 SER CA C 83 58.053 61.316 -3.263 1
1 899 . 13 1 1 A 83 83 SER CB C 83 63.184 63.009 0.175 1
1 900 . 13 1 1 A 83 83 SER N N 83 114.181 115.407 -1.226 1
1 901 . 13 1 1 A 84 84 SER H H 84 7.823 7.760 0.063 1
1 902 . 13 1 1 A 84 84 SER HA H 84 3.194 4.473 -1.279 1
1 905 . 13 1 1 A 84 84 SER C C 84 171.072 173.968 -2.896 1
1 906 . 13 1 1 A 84 84 SER CA C 84 57.206 57.116 0.090 1
1 907 . 13 1 1 A 84 84 SER CB C 84 61.622 63.064 -1.442 1
1 908 . 13 1 1 A 84 84 SER N N 84 117.302 114.166 3.136 1
1 909 . 13 1 1 A 85 85 PRO HA H 85 3.922 4.580 -0.658 1
1 916 . 13 1 1 A 85 85 PRO CA C 85 62.691 62.655 0.036 1
1 917 . 13 1 1 A 85 85 PRO CB C 85 31.515 32.644 -1.129 1
1 920 . 13 1 1 A 86 86 ARG HA H 86 3.882 3.977 -0.095 1
1 927 . 13 1 1 A 86 86 ARG C C 86 175.712 177.763 -2.051 1
1 928 . 13 1 1 A 86 86 ARG CA C 86 57.877 59.474 -1.597 1
1 929 . 13 1 1 A 86 86 ARG CB C 86 29.791 29.654 0.137 1
1 932 . 13 1 1 A 87 87 ASP H H 87 8.903 8.062 0.841 1
1 933 . 13 1 1 A 87 87 ASP HA H 87 4.342 4.435 -0.093 1
1 936 . 13 1 1 A 87 87 ASP C C 87 175.723 176.138 -0.415 1
1 937 . 13 1 1 A 87 87 ASP CA C 87 56.377 56.766 -0.389 1
1 938 . 13 1 1 A 87 87 ASP CB C 87 39.208 40.786 -1.578 1
1 939 . 13 1 1 A 87 87 ASP N N 87 117.520 118.466 -0.946 1
1 940 . 13 1 1 A 88 88 THR H H 88 7.776 7.805 -0.029 1
1 941 . 13 1 1 A 88 88 THR HA H 88 5.101 4.982 0.119 1
1 946 . 13 1 1 A 88 88 THR C C 88 173.825 173.256 0.569 1
1 947 . 13 1 1 A 88 88 THR CA C 88 60.154 59.870 0.284 1
1 948 . 13 1 1 A 88 88 THR CB C 88 72.702 71.714 0.988 1
1 950 . 13 1 1 A 88 88 THR N N 88 108.770 109.193 -0.423 1
1 951 . 13 1 1 A 89 89 SER H H 89 9.006 9.344 -0.338 1
1 952 . 13 1 1 A 89 89 SER HA H 89 4.718 5.183 -0.465 1
1 955 . 13 1 1 A 89 89 SER C C 89 173.728 172.972 0.756 1
1 956 . 13 1 1 A 89 89 SER CA C 89 57.453 57.750 -0.297 1
1 957 . 13 1 1 A 89 89 SER CB C 89 65.611 65.686 -0.075 1
1 958 . 13 1 1 A 89 89 SER N N 89 114.151 117.904 -3.753 1
1 959 . 13 1 1 A 90 90 ALA H H 90 9.001 8.838 0.163 1
1 960 . 13 1 1 A 90 90 ALA HA H 90 5.660 4.716 0.944 1
1 964 . 13 1 1 A 90 90 ALA C C 90 177.669 177.141 0.528 1
1 965 . 13 1 1 A 90 90 ALA CA C 90 51.670 51.902 -0.232 1
1 966 . 13 1 1 A 90 90 ALA CB C 90 22.265 20.229 2.036 1
1 967 . 13 1 1 A 90 90 ALA N N 90 126.177 129.445 -3.268 1
1 968 . 13 1 1 A 91 91 PHE H H 91 9.672 8.325 1.347 1
1 969 . 13 1 1 A 91 91 PHE HA H 91 5.039 5.650 -0.611 1
1 977 . 13 1 1 A 91 91 PHE C C 91 170.731 173.693 -2.962 1
1 978 . 13 1 1 A 91 91 PHE CA C 91 56.271 55.289 0.982 1
1 979 . 13 1 1 A 91 91 PHE CB C 91 41.553 42.142 -0.589 1
1 985 . 13 1 1 A 91 91 PHE N N 91 118.968 116.472 2.496 1
1 986 . 13 1 1 A 92 92 PHE H H 92 9.422 9.172 0.250 1
1 987 . 13 1 1 A 92 92 PHE HA H 92 5.674 5.045 0.629 1
1 995 . 13 1 1 A 92 92 PHE C C 92 174.570 175.376 -0.806 1
1 996 . 13 1 1 A 92 92 PHE CA C 92 55.917 57.723 -1.806 1
1 997 . 13 1 1 A 92 92 PHE CB C 92 42.787 41.234 1.553 1
1 1003 . 13 1 1 A 92 92 PHE N N 92 117.543 118.875 -1.332 1
1 1004 . 13 1 1 A 93 93 LEU H H 93 9.021 8.842 0.179 1
1 1005 . 13 1 1 A 93 93 LEU HA H 93 5.122 5.004 0.118 1
1 1015 . 13 1 1 A 93 93 LEU C C 93 174.799 174.253 0.546 1
1 1016 . 13 1 1 A 93 93 LEU CA C 93 54.912 54.722 0.190 1
1 1017 . 13 1 1 A 93 93 LEU CB C 93 45.254 44.786 0.468 1
1 1021 . 13 1 1 A 93 93 LEU N N 93 121.719 121.705 0.014 1
1 1022 . 13 1 1 A 94 94 GLU H H 94 9.294 9.349 -0.055 1
1 1023 . 13 1 1 A 94 94 GLU HA H 94 5.043 5.245 -0.202 1
1 1028 . 13 1 1 A 94 94 GLU C C 94 175.754 175.492 0.262 1
1 1029 . 13 1 1 A 94 94 GLU CA C 94 56.018 54.824 1.194 1
1 1030 . 13 1 1 A 94 94 GLU CB C 94 32.752 32.858 -0.106 1
1 1032 . 13 1 1 A 94 94 GLU N N 94 127.032 128.796 -1.764 1
1 1033 . 13 1 1 A 95 95 THR H H 95 8.822 8.492 0.330 1
1 1034 . 13 1 1 A 95 95 THR HA H 95 5.398 5.066 0.332 1
1 1039 . 13 1 1 A 95 95 THR C C 95 173.860 175.837 -1.977 1
1 1040 . 13 1 1 A 95 95 THR CA C 95 59.588 59.597 -0.009 1
1 1041 . 13 1 1 A 95 95 THR CB C 95 72.191 71.951 0.240 1
1 1043 . 13 1 1 A 95 95 THR N N 95 118.685 118.635 0.050 1
1 1044 . 13 1 1 A 96 96 LYS H H 96 8.823 9.025 -0.202 1
1 1045 . 13 1 1 A 96 96 LYS HA H 96 4.022 4.009 0.013 1
1 1054 . 13 1 1 A 96 96 LYS C C 96 177.330 178.750 -1.420 1
1 1055 . 13 1 1 A 96 96 LYS CA C 96 59.588 59.879 -0.291 1
1 1056 . 13 1 1 A 96 96 LYS CB C 96 32.588 32.035 0.553 1
1 1060 . 13 1 1 A 96 96 LYS N N 96 118.801 120.896 -2.095 1
1 1061 . 13 1 1 A 97 97 GLU H H 97 8.092 7.789 0.303 1
1 1062 . 13 1 1 A 97 97 GLU HA H 97 4.282 4.289 -0.007 1
1 1067 . 13 1 1 A 97 97 GLU C C 97 176.290 176.820 -0.530 1
1 1068 . 13 1 1 A 97 97 GLU CA C 97 57.365 58.444 -1.079 1
1 1069 . 13 1 1 A 97 97 GLU CB C 97 31.559 30.416 1.143 1
1 1071 . 13 1 1 A 97 97 GLU N N 97 113.992 118.678 -4.686 1
1 1072 . 13 1 1 A 98 98 ARG H H 98 7.482 7.209 0.273 1
1 1073 . 13 1 1 A 98 98 ARG HA H 98 4.397 4.564 -0.167 1
1 1080 . 13 1 1 A 98 98 ARG C C 98 172.792 173.087 -0.295 1
1 1081 . 13 1 1 A 98 98 ARG CA C 98 55.689 54.664 1.025 1
1 1082 . 13 1 1 A 98 98 ARG CB C 98 32.711 31.895 0.816 1
1 1085 . 13 1 1 A 98 98 ARG N N 98 116.022 113.656 2.366 1
1 1086 . 13 1 1 A 99 99 LEU H H 99 8.423 8.193 0.230 1
1 1087 . 13 1 1 A 99 99 LEU HA H 99 4.807 4.811 -0.004 1
1 1097 . 13 1 1 A 99 99 LEU C C 99 175.903 174.053 1.850 1
1 1098 . 13 1 1 A 99 99 LEU CA C 99 54.383 53.940 0.443 1
1 1099 . 13 1 1 A 99 99 LEU CB C 99 43.362 44.084 -0.722 1
1 1103 . 13 1 1 A 99 99 LEU N N 99 124.983 122.135 2.848 1
1 1104 . 13 1 1 A 100 100 TYR H H 100 9.144 9.424 -0.280 1
1 1105 . 13 1 1 A 100 100 TYR HA H 100 4.542 5.235 -0.693 1
1 1112 . 13 1 1 A 100 100 TYR C C 100 173.479 174.615 -1.136 1
1 1113 . 13 1 1 A 100 100 TYR CA C 100 57.735 56.544 1.191 1
1 1114 . 13 1 1 A 100 100 TYR CB C 100 39.291 40.593 -1.302 1
1 1119 . 13 1 1 A 100 100 TYR N N 100 126.679 126.840 -0.161 1
1 1120 . 13 1 1 A 101 101 LEU H H 101 9.043 8.935 0.108 1
1 1121 . 13 1 1 A 101 101 LEU HA H 101 4.747 4.775 -0.028 1
1 1131 . 13 1 1 A 101 101 LEU C C 101 173.530 174.970 -1.440 1
1 1132 . 13 1 1 A 101 101 LEU CA C 101 54.524 53.848 0.676 1
1 1133 . 13 1 1 A 101 101 LEU CB C 101 42.499 43.739 -1.240 1
1 1137 . 13 1 1 A 101 101 LEU N N 101 127.422 126.530 0.892 1
1 1138 . 13 1 1 A 102 102 LEU H H 102 8.493 8.506 -0.013 1
1 1139 . 13 1 1 A 102 102 LEU HA H 102 5.612 5.612 0.000 1
1 1149 . 13 1 1 A 102 102 LEU C C 102 175.794 176.079 -0.285 1
1 1150 . 13 1 1 A 102 102 LEU CA C 102 53.076 53.244 -0.168 1
1 1151 . 13 1 1 A 102 102 LEU CB C 102 45.994 44.467 1.527 1
1 1155 . 13 1 1 A 102 102 LEU N N 102 126.021 128.734 -2.713 1
1 1156 . 13 1 1 A 103 103 ALA H H 103 9.073 8.667 0.406 1
1 1157 . 13 1 1 A 103 103 ALA HA H 103 5.081 5.325 -0.244 1
1 1161 . 13 1 1 A 103 103 ALA C C 103 175.133 175.825 -0.692 1
1 1162 . 13 1 1 A 103 103 ALA CA C 103 51.688 49.794 1.894 1
1 1163 . 13 1 1 A 103 103 ALA CB C 103 21.689 22.513 -0.824 1
1 1164 . 13 1 1 A 103 103 ALA N N 103 117.679 123.084 -5.405 1
1 1165 . 13 1 1 A 104 104 ALA H H 104 8.582 8.182 0.400 1
1 1166 . 13 1 1 A 104 104 ALA HA H 104 5.220 4.679 0.541 1
1 1170 . 13 1 1 A 104 104 ALA C C 104 173.471 174.095 -0.624 1
1 1171 . 13 1 1 A 104 104 ALA CA C 104 47.959 49.839 -1.880 1
1 1172 . 13 1 1 A 104 104 ALA CB C 104 21.359 22.212 -0.853 1
1 1173 . 13 1 1 A 104 104 ALA N N 104 123.419 121.233 2.186 1
1 1174 . 13 1 1 A 105 105 PRO HA H 105 4.542 4.744 -0.202 1
1 1181 . 13 1 1 A 105 105 PRO C C 105 178.409 177.958 0.451 1
1 1182 . 13 1 1 A 105 105 PRO CA C 105 64.301 62.839 1.462 1
1 1183 . 13 1 1 A 105 105 PRO CB C 105 32.094 31.600 0.494 1
1 1186 . 13 1 1 A 106 106 ALA H H 106 8.302 8.679 -0.377 1
1 1187 . 13 1 1 A 106 106 ALA HA H 106 4.022 4.018 0.004 1
1 1191 . 13 1 1 A 106 106 ALA C C 106 179.641 179.590 0.051 1
1 1192 . 13 1 1 A 106 106 ALA CA C 106 56.341 55.273 1.068 1
1 1193 . 13 1 1 A 106 106 ALA CB C 106 18.523 18.425 0.098 1
1 1194 . 13 1 1 A 106 106 ALA N N 106 127.733 128.139 -0.406 1
1 1195 . 13 1 1 A 107 107 ALA H H 107 9.035 8.292 0.743 1
1 1196 . 13 1 1 A 107 107 ALA HA H 107 4.331 4.008 0.323 1
1 1200 . 13 1 1 A 107 107 ALA C C 107 178.586 179.820 -1.234 1
1 1201 . 13 1 1 A 107 107 ALA CA C 107 53.765 55.270 -1.505 1
1 1202 . 13 1 1 A 107 107 ALA CB C 107 18.728 18.261 0.467 1
1 1203 . 13 1 1 A 107 107 ALA N N 107 118.203 119.694 -1.491 1
1 1204 . 13 1 1 A 108 108 GLU H H 108 8.399 8.285 0.114 1
1 1205 . 13 1 1 A 108 108 GLU HA H 108 4.631 4.094 0.537 1
1 1210 . 13 1 1 A 108 108 GLU C C 108 177.127 178.712 -1.585 1
1 1211 . 13 1 1 A 108 108 GLU CA C 108 55.847 58.821 -2.974 1
1 1212 . 13 1 1 A 108 108 GLU CB C 108 32.135 29.936 2.199 1
1 1214 . 13 1 1 A 108 108 GLU N N 108 114.661 118.043 -3.382 1
1 1215 . 13 1 1 A 109 109 ARG H H 109 7.412 8.680 -1.268 1
1 1216 . 13 1 1 A 109 109 ARG HA H 109 3.682 4.153 -0.471 1
1 1223 . 13 1 1 A 109 109 ARG C C 109 176.917 179.154 -2.237 1
1 1224 . 13 1 1 A 109 109 ARG CA C 109 61.600 59.862 1.738 1
1 1225 . 13 1 1 A 109 109 ARG CB C 109 28.845 30.230 -1.385 1
1 1228 . 13 1 1 A 109 109 ARG N N 109 120.954 120.897 0.057 1
1 1229 . 13 1 1 A 110 110 GLY H H 110 8.833 8.087 0.746 1
1 1230 . 13 1 1 A 110 110 GLY HA2 H 110 3.872 3.774 0.098 1
1 1231 . 13 1 1 A 110 110 GLY HA3 H 110 3.685 3.793 -0.108 1
1 1232 . 13 1 1 A 110 110 GLY C C 110 175.997 175.782 0.215 1
1 1233 . 13 1 1 A 110 110 GLY CA C 110 47.323 47.555 -0.232 1
1 1234 . 13 1 1 A 110 110 GLY N N 110 106.563 107.158 -0.595 1
1 1235 . 13 1 1 A 111 111 ASP H H 111 7.882 8.025 -0.143 1
1 1236 . 13 1 1 A 111 111 ASP HA H 111 4.312 4.320 -0.008 1
1 1239 . 13 1 1 A 111 111 ASP C C 111 179.467 178.834 0.633 1
1 1240 . 13 1 1 A 111 111 ASP CA C 111 56.976 56.653 0.323 1
1 1241 . 13 1 1 A 111 111 ASP CB C 111 40.648 40.746 -0.098 1
1 1242 . 13 1 1 A 111 111 ASP N N 111 121.402 121.462 -0.060 1
1 1243 . 13 1 1 A 112 112 TRP H H 112 7.804 8.256 -0.452 1
1 1244 . 13 1 1 A 112 112 TRP HA H 112 3.831 4.194 -0.363 1
1 1253 . 13 1 1 A 112 112 TRP C C 112 177.547 178.804 -1.257 1
1 1254 . 13 1 1 A 112 112 TRP CA C 112 62.006 60.039 1.967 1
1 1255 . 13 1 1 A 112 112 TRP CB C 112 29.421 29.293 0.128 1
1 1261 . 13 1 1 A 112 112 TRP N N 112 119.904 120.120 -0.216 1
1 1263 . 13 1 1 A 113 113 VAL H H 113 7.982 8.118 -0.136 1
1 1264 . 13 1 1 A 113 113 VAL HA H 113 3.072 3.664 -0.592 1
1 1272 . 13 1 1 A 113 113 VAL C C 113 178.015 178.449 -0.434 1
1 1273 . 13 1 1 A 113 113 VAL CA C 113 67.407 66.686 0.721 1
1 1274 . 13 1 1 A 113 113 VAL CB C 113 31.724 31.540 0.184 1
1 1277 . 13 1 1 A 113 113 VAL N N 113 117.575 119.377 -1.802 1
1 1278 . 13 1 1 A 114 114 GLN H H 114 8.268 7.968 0.300 1
1 1279 . 13 1 1 A 114 114 GLN HA H 114 3.994 4.059 -0.065 1
1 1286 . 13 1 1 A 114 114 GLN C C 114 178.021 177.888 0.133 1
1 1287 . 13 1 1 A 114 114 GLN CA C 114 59.112 58.827 0.285 1
1 1288 . 13 1 1 A 114 114 GLN CB C 114 28.685 28.768 -0.083 1
1 1290 . 13 1 1 A 114 114 GLN N N 114 117.479 120.308 -2.829 1
1 1292 . 13 1 1 A 115 115 ALA H H 115 7.915 8.415 -0.500 1
1 1293 . 13 1 1 A 115 115 ALA HA H 115 3.972 4.080 -0.108 1
1 1297 . 13 1 1 A 115 115 ALA C C 115 180.030 179.993 0.037 1
1 1298 . 13 1 1 A 115 115 ALA CA C 115 55.142 55.076 0.066 1
1 1299 . 13 1 1 A 115 115 ALA CB C 115 18.152 18.410 -0.258 1
1 1300 . 13 1 1 A 115 115 ALA N N 115 120.858 120.665 0.193 1
1 1301 . 13 1 1 A 116 116 ILE H H 116 8.172 8.376 -0.204 1
1 1302 . 13 1 1 A 116 116 ILE HA H 116 3.482 3.799 -0.317 1
1 1312 . 13 1 1 A 116 116 ILE C C 116 177.739 178.061 -0.322 1
1 1313 . 13 1 1 A 116 116 ILE CA C 116 66.119 65.399 0.720 1
1 1314 . 13 1 1 A 116 116 ILE CB C 116 38.222 37.698 0.524 1
1 1318 . 13 1 1 A 116 116 ILE N N 116 115.977 117.856 -1.879 1
1 1319 . 13 1 1 A 117 117 CYS H H 117 8.449 8.159 0.290 1
1 1320 . 13 1 1 A 117 117 CYS HA H 117 4.032 4.681 -0.649 1
1 1323 . 13 1 1 A 117 117 CYS C C 117 177.321 177.800 -0.479 1
1 1324 . 13 1 1 A 117 117 CYS CA C 117 64.777 62.077 2.700 1
1 1325 . 13 1 1 A 117 117 CYS CB C 117 26.871 27.749 -0.878 1
1 1326 . 13 1 1 A 117 117 CYS N N 117 117.253 120.541 -3.288 1
1 1327 . 13 1 1 A 118 118 LEU H H 118 8.182 8.121 0.061 1
1 1328 . 13 1 1 A 118 118 LEU HA H 118 4.052 4.113 -0.061 1
1 1338 . 13 1 1 A 118 118 LEU C C 118 179.217 178.275 0.942 1
1 1339 . 13 1 1 A 118 118 LEU CA C 118 57.877 57.699 0.178 1
1 1340 . 13 1 1 A 118 118 LEU CB C 118 42.088 41.777 0.311 1
1 1344 . 13 1 1 A 118 118 LEU N N 118 119.665 122.937 -3.272 1
1 1345 . 13 1 1 A 119 119 LEU H H 119 7.142 7.504 -0.362 1
1 1346 . 13 1 1 A 119 119 LEU HA H 119 4.192 4.327 -0.135 1
1 1356 . 13 1 1 A 119 119 LEU C C 119 178.492 178.337 0.155 1
1 1357 . 13 1 1 A 119 119 LEU CA C 119 56.259 56.527 -0.268 1
1 1358 . 13 1 1 A 119 119 LEU CB C 119 43.568 42.479 1.089 1
1 1362 . 13 1 1 A 119 119 LEU N N 119 116.244 117.953 -1.709 1
1 1363 . 13 1 1 A 120 120 ALA H H 120 8.513 8.278 0.235 1
1 1364 . 13 1 1 A 120 120 ALA HA H 120 3.878 3.895 -0.017 1
1 1368 . 13 1 1 A 120 120 ALA C C 120 178.358 178.119 0.239 1
1 1369 . 13 1 1 A 120 120 ALA CA C 120 53.765 54.844 -1.079 1
1 1370 . 13 1 1 A 120 120 ALA CB C 120 18.687 18.554 0.133 1
1 1371 . 13 1 1 A 120 120 ALA N N 120 120.009 121.011 -1.002 1
1 1372 . 13 1 1 A 121 121 PHE H H 121 7.822 7.947 -0.125 1
1 1373 . 13 1 1 A 121 121 PHE HA H 121 5.156 5.025 0.131 1
1 1381 . 13 1 1 A 121 121 PHE C C 121 176.273 175.952 0.321 1
1 1382 . 13 1 1 A 121 121 PHE CA C 121 55.741 56.619 -0.878 1
1 1383 . 13 1 1 A 121 121 PHE CB C 121 39.455 38.501 0.954 1
1 1389 . 13 1 1 A 121 121 PHE N N 121 113.981 114.759 -0.778 1
1 1390 . 13 1 1 A 122 122 SER H H 122 7.765 8.135 -0.370 1
1 1391 . 13 1 1 A 122 122 SER HA H 122 4.579 4.298 0.281 1
1 1394 . 13 1 1 A 122 122 SER C C 122 174.595 175.408 -0.813 1
1 1395 . 13 1 1 A 122 122 SER CA C 122 58.777 60.302 -1.525 1
1 1396 . 13 1 1 A 122 122 SER CB C 122 63.719 63.872 -0.153 1
1 1397 . 13 1 1 A 122 122 SER N N 122 115.069 114.784 0.285 1
1 1398 . 13 1 1 A 123 123 GLY H H 123 8.223 8.183 0.040 1
1 1399 . 13 1 1 A 123 123 GLY HA2 H 123 4.174 3.852 0.322 1
1 1400 . 13 1 1 A 123 123 GLY HA3 H 123 4.100 3.863 0.237 1
1 1401 . 13 1 1 A 123 123 GLY C C 123 171.678 174.253 -2.575 1
1 1402 . 13 1 1 A 123 123 GLY CA C 123 44.815 46.979 -2.164 1
1 1403 . 13 1 1 A 123 123 GLY N N 123 110.151 111.512 -1.361 1
1 1404 . 13 1 1 A 124 124 PRO HA H 124 4.482 4.637 -0.155 1
1 1411 . 13 1 1 A 124 124 PRO C C 124 177.314 175.598 1.716 1
1 1412 . 13 1 1 A 124 124 PRO CA C 124 63.206 62.809 0.397 1
1 1413 . 13 1 1 A 124 124 PRO CB C 124 32.176 31.694 0.482 1
1 1416 . 13 1 1 A 125 125 SER H H 125 8.485 8.590 -0.105 1
1 1417 . 13 1 1 A 125 125 SER HA H 125 4.472 4.840 -0.368 1
1 1420 . 13 1 1 A 125 125 SER C C 125 174.728 174.836 -0.108 1
1 1421 . 13 1 1 A 125 125 SER CA C 125 58.353 57.031 1.322 1
1 1422 . 13 1 1 A 125 125 SER CB C 125 64.048 64.001 0.047 1
1 1423 . 13 1 1 A 125 125 SER N N 125 116.081 118.997 -2.916 1
1 1424 . 13 1 1 A 126 126 SER H H 126 8.332 8.824 -0.492 1
1 1425 . 13 1 1 A 126 126 SER HA H 126 4.464 4.592 -0.128 1
1 1428 . 13 1 1 A 126 126 SER C C 126 173.980 175.108 -1.128 1
1 1429 . 13 1 1 A 126 126 SER CA C 126 58.336 58.859 -0.523 1
1 1430 . 13 1 1 A 126 126 SER CB C 126 63.925 63.669 0.256 1
1 1431 . 13 1 1 A 126 126 SER N N 126 118.037 121.854 -3.817 1
1 1 . 14 1 1 A 6 6 SER HA H 6 4.458 4.265 0.193 1
1 3 . 14 1 1 A 6 6 SER C C 6 175.108 175.251 -0.143 1
1 4 . 14 1 1 A 6 6 SER CA C 6 58.689 60.896 -2.207 1
1 5 . 14 1 1 A 6 6 SER CB C 6 63.678 63.586 0.092 1
1 6 . 14 1 1 A 7 7 GLY H H 7 8.449 7.635 0.814 1
1 7 . 14 1 1 A 7 7 GLY HA2 H 7 3.965 4.083 -0.118 1
1 8 . 14 1 1 A 7 7 GLY HA3 H 7 3.965 4.085 -0.120 1
1 9 . 14 1 1 A 7 7 GLY C C 7 174.380 174.090 0.290 1
1 10 . 14 1 1 A 7 7 GLY CA C 7 45.435 45.299 0.136 1
1 11 . 14 1 1 A 7 7 GLY N N 7 110.792 105.281 5.511 1
1 12 . 14 1 1 A 8 8 MET H H 8 8.259 8.199 0.060 1
1 13 . 14 1 1 A 8 8 MET HA H 8 4.487 4.235 0.252 1
1 21 . 14 1 1 A 8 8 MET C C 8 176.961 176.445 0.516 1
1 22 . 14 1 1 A 8 8 MET CA C 8 55.565 56.926 -1.361 1
1 23 . 14 1 1 A 8 8 MET CB C 8 32.835 32.800 0.035 1
1 26 . 14 1 1 A 8 8 MET N N 8 119.639 121.440 -1.801 1
1 27 . 14 1 1 A 9 9 GLY H H 9 8.472 8.197 0.275 1
1 28 . 14 1 1 A 9 9 GLY HA2 H 9 3.946 4.065 -0.119 1
1 29 . 14 1 1 A 9 9 GLY HA3 H 9 3.946 4.067 -0.121 1
1 30 . 14 1 1 A 9 9 GLY C C 9 174.005 175.432 -1.427 1
1 31 . 14 1 1 A 9 9 GLY CA C 9 45.488 46.163 -0.675 1
1 32 . 14 1 1 A 9 9 GLY N N 9 110.107 112.337 -2.230 1
1 33 . 14 1 1 A 10 10 ASP H H 10 8.292 8.534 -0.242 1
1 34 . 14 1 1 A 10 10 ASP HA H 10 4.636 4.339 0.297 1
1 37 . 14 1 1 A 10 10 ASP C C 10 176.768 176.444 0.324 1
1 38 . 14 1 1 A 10 10 ASP CA C 10 54.206 57.007 -2.801 1
1 39 . 14 1 1 A 10 10 ASP CB C 10 41.306 40.989 0.317 1
1 40 . 14 1 1 A 10 10 ASP N N 10 120.370 121.663 -1.293 1
1 41 . 14 1 1 A 11 11 GLY H H 11 8.452 7.597 0.855 1
1 42 . 14 1 1 A 11 11 GLY HA2 H 11 3.980 4.050 -0.070 1
1 43 . 14 1 1 A 11 11 GLY HA3 H 11 4.022 4.091 -0.069 1
1 44 . 14 1 1 A 11 11 GLY C C 11 174.102 174.544 -0.442 1
1 45 . 14 1 1 A 11 11 GLY CA C 11 45.170 45.549 -0.379 1
1 46 . 14 1 1 A 11 11 GLY N N 11 108.391 104.913 3.478 1
1 47 . 14 1 1 A 12 12 ALA H H 12 8.293 8.023 0.270 1
1 48 . 14 1 1 A 12 12 ALA HA H 12 3.777 4.473 -0.696 1
1 52 . 14 1 1 A 12 12 ALA C C 12 178.193 178.272 -0.079 1
1 53 . 14 1 1 A 12 12 ALA CA C 12 52.759 52.526 0.233 1
1 54 . 14 1 1 A 12 12 ALA CB C 12 17.855 19.054 -1.199 1
1 55 . 14 1 1 A 12 12 ALA N N 12 124.185 124.081 0.104 1
1 56 . 14 1 1 A 13 13 VAL H H 13 8.822 8.388 0.434 1
1 57 . 14 1 1 A 13 13 VAL HA H 13 3.912 3.667 0.245 1
1 65 . 14 1 1 A 13 13 VAL C C 13 176.073 175.749 0.324 1
1 66 . 14 1 1 A 13 13 VAL CA C 13 63.100 66.629 -3.529 1
1 67 . 14 1 1 A 13 13 VAL CB C 13 32.711 31.931 0.780 1
1 70 . 14 1 1 A 13 13 VAL N N 13 120.877 124.594 -3.717 1
1 71 . 14 1 1 A 14 14 LYS H H 14 7.093 7.646 -0.553 1
1 72 . 14 1 1 A 14 14 LYS HA H 14 4.169 4.652 -0.483 1
1 81 . 14 1 1 A 14 14 LYS C C 14 173.291 173.957 -0.666 1
1 82 . 14 1 1 A 14 14 LYS CA C 14 56.465 54.879 1.586 1
1 83 . 14 1 1 A 14 14 LYS CB C 14 35.960 35.538 0.422 1
1 87 . 14 1 1 A 14 14 LYS N N 14 118.693 119.359 -0.666 1
1 88 . 14 1 1 A 15 15 GLN H H 15 8.522 8.436 0.086 1
1 89 . 14 1 1 A 15 15 GLN HA H 15 5.542 5.144 0.398 1
1 96 . 14 1 1 A 15 15 GLN C C 15 174.992 175.836 -0.844 1
1 97 . 14 1 1 A 15 15 GLN CA C 15 54.312 54.091 0.221 1
1 98 . 14 1 1 A 15 15 GLN CB C 15 33.585 31.225 2.360 1
1 100 . 14 1 1 A 15 15 GLN N N 15 124.024 125.062 -1.038 1
1 102 . 14 1 1 A 16 16 GLY H H 16 8.740 8.087 0.653 1
1 103 . 14 1 1 A 16 16 GLY HA2 H 16 4.511 4.068 0.443 1
1 104 . 14 1 1 A 16 16 GLY HA3 H 16 4.064 4.564 -0.500 1
1 105 . 14 1 1 A 16 16 GLY C C 16 171.431 171.371 0.060 1
1 106 . 14 1 1 A 16 16 GLY CA C 16 46.106 46.091 0.015 1
1 107 . 14 1 1 A 16 16 GLY N N 16 109.611 109.262 0.349 1
1 108 . 14 1 1 A 17 17 PHE H H 17 8.886 8.133 0.753 1
1 109 . 14 1 1 A 17 17 PHE HA H 17 5.466 5.250 0.216 1
1 114 . 14 1 1 A 17 17 PHE C C 17 174.795 174.419 0.376 1
1 115 . 14 1 1 A 17 17 PHE CA C 17 57.788 56.081 1.707 1
1 116 . 14 1 1 A 17 17 PHE CB C 17 41.315 42.484 -1.169 1
1 119 . 14 1 1 A 17 17 PHE N N 17 122.684 119.191 3.493 1
1 120 . 14 1 1 A 18 18 LEU H H 18 8.762 8.659 0.103 1
1 121 . 14 1 1 A 18 18 LEU HA H 18 4.946 4.851 0.095 1
1 131 . 14 1 1 A 18 18 LEU C C 18 175.461 175.181 0.280 1
1 132 . 14 1 1 A 18 18 LEU CA C 18 52.970 53.372 -0.402 1
1 133 . 14 1 1 A 18 18 LEU CB C 18 47.945 44.221 3.724 1
1 137 . 14 1 1 A 18 18 LEU N N 18 119.045 123.894 -4.849 1
1 138 . 14 1 1 A 19 19 TYR H H 19 9.272 8.496 0.776 1
1 139 . 14 1 1 A 19 19 TYR HA H 19 5.682 5.397 0.285 1
1 146 . 14 1 1 A 19 19 TYR C C 19 174.829 174.861 -0.032 1
1 147 . 14 1 1 A 19 19 TYR CA C 19 56.482 56.998 -0.516 1
1 148 . 14 1 1 A 19 19 TYR CB C 19 41.717 41.086 0.631 1
1 153 . 14 1 1 A 19 19 TYR N N 19 118.024 124.108 -6.084 1
1 154 . 14 1 1 A 20 20 LEU H H 20 9.441 8.758 0.683 1
1 155 . 14 1 1 A 20 20 LEU HA H 20 5.283 5.495 -0.212 1
1 165 . 14 1 1 A 20 20 LEU C C 20 175.935 174.265 1.670 1
1 166 . 14 1 1 A 20 20 LEU CA C 20 53.464 53.916 -0.452 1
1 167 . 14 1 1 A 20 20 LEU CB C 20 46.570 46.293 0.277 1
1 171 . 14 1 1 A 20 20 LEU N N 20 122.838 124.730 -1.892 1
1 172 . 14 1 1 A 21 21 GLN H H 21 8.391 8.917 -0.526 1
1 173 . 14 1 1 A 21 21 GLN HA H 21 3.791 4.457 -0.666 1
1 180 . 14 1 1 A 21 21 GLN C C 21 175.157 174.437 0.720 1
1 181 . 14 1 1 A 21 21 GLN CA C 21 56.094 53.972 2.122 1
1 182 . 14 1 1 A 21 21 GLN CB C 21 28.434 29.971 -1.537 1
1 184 . 14 1 1 A 21 21 GLN N N 21 129.943 127.248 2.695 1
1 186 . 14 1 1 A 22 22 GLN H H 22 8.829 8.685 0.144 1
1 187 . 14 1 1 A 22 22 GLN HA H 22 4.553 4.951 -0.398 1
1 194 . 14 1 1 A 22 22 GLN C C 22 174.998 175.690 -0.692 1
1 195 . 14 1 1 A 22 22 GLN CA C 22 54.912 54.748 0.164 1
1 196 . 14 1 1 A 22 22 GLN CB C 22 31.930 31.126 0.804 1
1 198 . 14 1 1 A 22 22 GLN N N 22 127.199 125.898 1.301 1
1 200 . 14 1 1 A 23 23 GLN HA H 23 4.142 4.417 -0.275 1
1 207 . 14 1 1 A 23 23 GLN CA C 23 56.427 56.260 0.167 1
1 208 . 14 1 1 A 23 23 GLN CB C 23 29.227 30.028 -0.801 1
1 211 . 14 1 1 A 24 24 GLN HA H 24 4.523 4.142 0.381 1
1 218 . 14 1 1 A 24 24 GLN CB C 24 29.759 28.344 1.415 1
1 221 . 14 1 1 A 25 25 THR HA H 25 3.870 4.573 -0.703 1
1 226 . 14 1 1 A 25 25 THR CA C 25 65.096 60.401 4.695 1
1 227 . 14 1 1 A 25 25 THR CB C 25 68.924 71.052 -2.128 1
1 229 . 14 1 1 A 26 26 PHE HA H 26 4.690 4.280 0.410 1
1 236 . 14 1 1 A 26 26 PHE C C 26 175.523 175.900 -0.377 1
1 237 . 14 1 1 A 26 26 PHE CA C 26 57.312 58.044 -0.732 1
1 238 . 14 1 1 A 26 26 PHE CB C 26 39.003 38.924 0.079 1
1 243 . 14 1 1 A 27 27 GLY H H 27 7.755 9.080 -1.325 1
1 244 . 14 1 1 A 27 27 GLY HA2 H 27 4.172 3.908 0.264 1
1 245 . 14 1 1 A 27 27 GLY HA3 H 27 3.783 4.047 -0.264 1
1 246 . 14 1 1 A 27 27 GLY C C 27 172.557 173.138 -0.581 1
1 247 . 14 1 1 A 27 27 GLY CA C 27 44.924 44.724 0.200 1
1 248 . 14 1 1 A 27 27 GLY N N 27 109.216 109.793 -0.577 1
1 249 . 14 1 1 A 28 28 LYS H H 28 8.241 8.780 -0.539 1
1 250 . 14 1 1 A 28 28 LYS HA H 28 4.530 4.738 -0.208 1
1 259 . 14 1 1 A 28 28 LYS C C 28 176.204 174.618 1.586 1
1 260 . 14 1 1 A 28 28 LYS CA C 28 55.741 55.011 0.730 1
1 261 . 14 1 1 A 28 28 LYS CB C 28 33.904 32.706 1.198 1
1 265 . 14 1 1 A 28 28 LYS N N 28 118.743 121.766 -3.023 1
1 266 . 14 1 1 A 29 29 LYS H H 29 8.356 8.258 0.098 1
1 267 . 14 1 1 A 29 29 LYS HA H 29 4.559 4.763 -0.204 1
1 274 . 14 1 1 A 29 29 LYS C C 29 175.420 174.960 0.460 1
1 275 . 14 1 1 A 29 29 LYS CA C 29 55.406 55.186 0.220 1
1 276 . 14 1 1 A 29 29 LYS CB C 29 35.618 36.568 -0.950 1
1 280 . 14 1 1 A 29 29 LYS N N 29 121.198 124.354 -3.156 1
1 281 . 14 1 1 A 30 30 TRP H H 30 8.891 8.614 0.277 1
1 282 . 14 1 1 A 30 30 TRP HA H 30 4.951 4.901 0.050 1
1 291 . 14 1 1 A 30 30 TRP C C 30 175.902 175.976 -0.074 1
1 292 . 14 1 1 A 30 30 TRP CA C 30 56.677 57.680 -1.003 1
1 293 . 14 1 1 A 30 30 TRP CB C 30 30.614 30.495 0.119 1
1 299 . 14 1 1 A 30 30 TRP N N 30 123.304 122.718 0.586 1
1 301 . 14 1 1 A 31 31 ARG H H 31 8.712 8.835 -0.123 1
1 302 . 14 1 1 A 31 31 ARG HA H 31 4.820 5.028 -0.208 1
1 309 . 14 1 1 A 31 31 ARG C C 31 174.026 173.488 0.538 1
1 310 . 14 1 1 A 31 31 ARG CA C 31 54.895 53.917 0.978 1
1 311 . 14 1 1 A 31 31 ARG CB C 31 34.045 34.031 0.014 1
1 314 . 14 1 1 A 31 31 ARG N N 31 123.973 121.837 2.136 1
1 315 . 14 1 1 A 32 32 ARG H H 32 8.820 8.442 0.378 1
1 316 . 14 1 1 A 32 32 ARG HA H 32 3.965 5.309 -1.344 1
1 323 . 14 1 1 A 32 32 ARG C C 32 174.785 174.353 0.432 1
1 324 . 14 1 1 A 32 32 ARG CA C 32 56.924 54.346 2.578 1
1 325 . 14 1 1 A 32 32 ARG CB C 32 31.806 33.025 -1.219 1
1 328 . 14 1 1 A 32 32 ARG N N 32 127.041 124.702 2.339 1
1 329 . 14 1 1 A 33 33 PHE H H 33 9.372 8.558 0.814 1
1 330 . 14 1 1 A 33 33 PHE HA H 33 4.863 5.000 -0.137 1
1 338 . 14 1 1 A 33 33 PHE C C 33 176.359 175.168 1.191 1
1 339 . 14 1 1 A 33 33 PHE CA C 33 57.224 56.662 0.562 1
1 340 . 14 1 1 A 33 33 PHE CB C 33 43.385 42.194 1.191 1
1 346 . 14 1 1 A 33 33 PHE N N 33 125.882 124.622 1.260 1
1 347 . 14 1 1 A 34 34 GLY H H 34 9.160 9.185 -0.025 1
1 348 . 14 1 1 A 34 34 GLY HA2 H 34 4.182 4.154 0.028 1
1 349 . 14 1 1 A 34 34 GLY HA3 H 34 3.714 4.290 -0.576 1
1 350 . 14 1 1 A 34 34 GLY C C 34 172.920 173.045 -0.125 1
1 351 . 14 1 1 A 34 34 GLY CA C 34 46.247 46.011 0.236 1
1 352 . 14 1 1 A 34 34 GLY N N 34 108.654 111.157 -2.503 1
1 353 . 14 1 1 A 35 35 ALA H H 35 8.982 8.048 0.934 1
1 354 . 14 1 1 A 35 35 ALA HA H 35 5.660 5.435 0.225 1
1 358 . 14 1 1 A 35 35 ALA C C 35 176.547 176.020 0.527 1
1 359 . 14 1 1 A 35 35 ALA CA C 35 50.500 50.409 0.091 1
1 360 . 14 1 1 A 35 35 ALA CB C 35 24.034 20.673 3.361 1
1 361 . 14 1 1 A 35 35 ALA N N 35 130.076 127.506 2.570 1
1 362 . 14 1 1 A 36 36 SER H H 36 8.852 8.588 0.264 1
1 363 . 14 1 1 A 36 36 SER HA H 36 5.203 4.959 0.244 1
1 366 . 14 1 1 A 36 36 SER C C 36 170.939 172.482 -1.543 1
1 367 . 14 1 1 A 36 36 SER CA C 36 57.806 57.420 0.386 1
1 368 . 14 1 1 A 36 36 SER CB C 36 66.986 64.807 2.179 1
1 369 . 14 1 1 A 36 36 SER N N 36 116.620 119.817 -3.197 1
1 370 . 14 1 1 A 37 37 LEU H H 37 8.862 8.536 0.326 1
1 371 . 14 1 1 A 37 37 LEU HA H 37 5.163 4.816 0.347 1
1 381 . 14 1 1 A 37 37 LEU C C 37 173.525 174.199 -0.674 1
1 382 . 14 1 1 A 37 37 LEU CA C 37 53.112 53.521 -0.409 1
1 383 . 14 1 1 A 37 37 LEU CB C 37 46.077 43.350 2.727 1
1 387 . 14 1 1 A 37 37 LEU N N 37 127.638 129.098 -1.460 1
1 388 . 14 1 1 A 38 38 TYR H H 38 9.280 8.403 0.877 1
1 389 . 14 1 1 A 38 38 TYR HA H 38 4.820 5.258 -0.438 1
1 396 . 14 1 1 A 38 38 TYR C C 38 175.430 175.254 0.176 1
1 397 . 14 1 1 A 38 38 TYR CA C 38 57.436 56.228 1.208 1
1 398 . 14 1 1 A 38 38 TYR CB C 38 42.128 41.350 0.778 1
1 403 . 14 1 1 A 38 38 TYR N N 38 125.215 126.977 -1.762 1
1 404 . 14 1 1 A 39 39 GLY H H 39 8.532 8.605 -0.073 1
1 405 . 14 1 1 A 39 39 GLY HA2 H 39 4.220 4.210 0.010 1
1 406 . 14 1 1 A 39 39 GLY HA3 H 39 3.941 4.211 -0.270 1
1 407 . 14 1 1 A 39 39 GLY C C 39 172.950 174.284 -1.334 1
1 408 . 14 1 1 A 39 39 GLY CA C 39 44.817 44.276 0.541 1
1 409 . 14 1 1 A 39 39 GLY N N 39 106.424 110.270 -3.846 1
1 410 . 14 1 1 A 40 40 GLY H H 40 8.477 8.614 -0.137 1
1 411 . 14 1 1 A 40 40 GLY HA2 H 40 4.102 4.041 0.061 1
1 412 . 14 1 1 A 40 40 GLY HA3 H 40 3.927 4.043 -0.116 1
1 413 . 14 1 1 A 40 40 GLY C C 40 174.002 174.187 -0.185 1
1 414 . 14 1 1 A 40 40 GLY CA C 40 44.694 45.692 -0.998 1
1 415 . 14 1 1 A 40 40 GLY N N 40 106.881 108.356 -1.475 1
1 416 . 14 1 1 A 41 41 SER H H 41 8.600 7.937 0.663 1
1 417 . 14 1 1 A 41 41 SER HA H 41 4.520 4.299 0.221 1
1 420 . 14 1 1 A 41 41 SER C C 41 174.355 174.874 -0.519 1
1 421 . 14 1 1 A 41 41 SER CA C 41 58.565 59.071 -0.506 1
1 422 . 14 1 1 A 41 41 SER CB C 41 64.413 62.865 1.548 1
1 423 . 14 1 1 A 41 41 SER N N 41 115.751 117.685 -1.934 1
1 424 . 14 1 1 A 42 42 ASP H H 42 8.533 9.231 -0.698 1
1 425 . 14 1 1 A 42 42 ASP HA H 42 4.560 4.291 0.269 1
1 428 . 14 1 1 A 42 42 ASP CA C 42 55.230 54.990 0.240 1
1 429 . 14 1 1 A 42 42 ASP CB C 42 40.648 39.454 1.194 1
1 430 . 14 1 1 A 42 42 ASP N N 42 119.037 127.877 -8.840 1
1 431 . 14 1 1 A 43 43 CYS H H 43 8.152 8.052 0.100 1
1 432 . 14 1 1 A 43 43 CYS HA H 43 4.541 4.047 0.494 1
1 435 . 14 1 1 A 43 43 CYS C C 43 173.975 174.360 -0.385 1
1 436 . 14 1 1 A 43 43 CYS CA C 43 58.265 60.464 -2.199 1
1 437 . 14 1 1 A 43 43 CYS CB C 43 28.393 26.226 2.167 1
1 438 . 14 1 1 A 43 43 CYS N N 43 116.881 111.363 5.518 1
1 439 . 14 1 1 A 44 44 ALA H H 44 8.047 7.421 0.626 1
1 440 . 14 1 1 A 44 44 ALA HA H 44 4.395 4.447 -0.052 1
1 444 . 14 1 1 A 44 44 ALA C C 44 176.472 177.502 -1.030 1
1 445 . 14 1 1 A 44 44 ALA CA C 44 52.688 51.992 0.696 1
1 446 . 14 1 1 A 44 44 ALA CB C 44 20.579 19.746 0.833 1
1 447 . 14 1 1 A 44 44 ALA N N 44 125.989 120.607 5.382 1
1 448 . 14 1 1 A 45 45 LEU H H 45 8.052 8.358 -0.306 1
1 449 . 14 1 1 A 45 45 LEU HA H 45 4.452 4.209 0.243 1
1 459 . 14 1 1 A 45 45 LEU C C 45 176.196 176.385 -0.189 1
1 460 . 14 1 1 A 45 45 LEU CA C 45 53.771 55.893 -2.122 1
1 461 . 14 1 1 A 45 45 LEU CB C 45 43.116 42.268 0.848 1
1 465 . 14 1 1 A 45 45 LEU N N 45 119.889 121.337 -1.448 1
1 466 . 14 1 1 A 46 46 ALA H H 46 8.381 8.353 0.028 1
1 467 . 14 1 1 A 46 46 ALA HA H 46 4.449 5.711 -1.262 1
1 471 . 14 1 1 A 46 46 ALA C C 46 179.093 176.085 3.008 1
1 472 . 14 1 1 A 46 46 ALA CA C 46 52.829 50.092 2.737 1
1 473 . 14 1 1 A 46 46 ALA CB C 46 18.687 22.445 -3.758 1
1 474 . 14 1 1 A 46 46 ALA N N 46 125.635 124.264 1.371 1
1 475 . 14 1 1 A 47 47 ARG H H 47 9.012 8.832 0.180 1
1 476 . 14 1 1 A 47 47 ARG HA H 47 5.192 5.116 0.076 1
1 484 . 14 1 1 A 47 47 ARG C C 47 171.524 173.844 -2.320 1
1 485 . 14 1 1 A 47 47 ARG CA C 47 55.265 55.009 0.256 1
1 486 . 14 1 1 A 47 47 ARG CB C 47 30.970 33.951 -2.981 1
1 489 . 14 1 1 A 47 47 ARG N N 47 120.048 118.698 1.350 1
1 491 . 14 1 1 A 48 48 LEU H H 48 9.029 8.428 0.601 1
1 492 . 14 1 1 A 48 48 LEU HA H 48 5.221 4.982 0.239 1
1 502 . 14 1 1 A 48 48 LEU C C 48 174.348 175.144 -0.796 1
1 503 . 14 1 1 A 48 48 LEU CA C 48 53.253 53.956 -0.703 1
1 504 . 14 1 1 A 48 48 LEU CB C 48 45.419 43.921 1.498 1
1 508 . 14 1 1 A 48 48 LEU N N 48 123.315 123.950 -0.635 1
1 509 . 14 1 1 A 49 49 GLU H H 49 9.473 8.484 0.989 1
1 510 . 14 1 1 A 49 49 GLU HA H 49 5.222 5.033 0.189 1
1 515 . 14 1 1 A 49 49 GLU C C 49 175.507 175.773 -0.266 1
1 516 . 14 1 1 A 49 49 GLU CA C 49 55.159 55.560 -0.401 1
1 517 . 14 1 1 A 49 49 GLU CB C 49 32.341 31.979 0.362 1
1 519 . 14 1 1 A 49 49 GLU N N 49 124.751 126.934 -2.183 1
1 520 . 14 1 1 A 50 50 LEU H H 50 9.088 8.175 0.913 1
1 521 . 14 1 1 A 50 50 LEU HA H 50 5.382 5.523 -0.141 1
1 531 . 14 1 1 A 50 50 LEU C C 50 175.474 175.175 0.299 1
1 532 . 14 1 1 A 50 50 LEU CA C 50 52.865 53.925 -1.060 1
1 533 . 14 1 1 A 50 50 LEU CB C 50 43.239 45.816 -2.577 1
1 537 . 14 1 1 A 50 50 LEU N N 50 124.221 121.092 3.129 1
1 538 . 14 1 1 A 51 51 GLN H H 51 9.602 8.483 1.119 1
1 539 . 14 1 1 A 51 51 GLN HA H 51 5.095 5.241 -0.146 1
1 546 . 14 1 1 A 51 51 GLN C C 51 175.306 175.029 0.277 1
1 547 . 14 1 1 A 51 51 GLN CA C 51 54.576 54.808 -0.232 1
1 548 . 14 1 1 A 51 51 GLN CB C 51 32.177 32.648 -0.471 1
1 550 . 14 1 1 A 51 51 GLN N N 51 123.268 121.562 1.706 1
1 552 . 14 1 1 A 52 52 GLU H H 52 9.172 9.433 -0.261 1
1 553 . 14 1 1 A 52 52 GLU HA H 52 4.092 4.568 -0.476 1
1 558 . 14 1 1 A 52 52 GLU C C 52 176.523 176.989 -0.466 1
1 559 . 14 1 1 A 52 52 GLU CA C 52 57.500 58.138 -0.638 1
1 560 . 14 1 1 A 52 52 GLU CB C 52 30.696 31.859 -1.163 1
1 562 . 14 1 1 A 52 52 GLU N N 52 128.982 121.520 7.462 1
1 563 . 14 1 1 A 53 53 GLY H H 53 8.644 8.032 0.612 1
1 564 . 14 1 1 A 53 53 GLY HA2 H 53 4.261 4.095 0.166 1
1 565 . 14 1 1 A 53 53 GLY HA3 H 53 3.993 4.105 -0.112 1
1 566 . 14 1 1 A 53 53 GLY C C 53 172.550 174.240 -1.690 1
1 567 . 14 1 1 A 53 53 GLY CA C 53 45.911 45.384 0.527 1
1 568 . 14 1 1 A 53 53 GLY N N 53 110.844 106.879 3.965 1
1 569 . 14 1 1 A 54 54 PRO HA H 54 4.392 4.682 -0.290 1
1 576 . 14 1 1 A 54 54 PRO C C 54 176.828 175.637 1.191 1
1 577 . 14 1 1 A 54 54 PRO CA C 54 63.665 62.643 1.022 1
1 578 . 14 1 1 A 54 54 PRO CB C 54 32.012 33.577 -1.565 1
1 581 . 14 1 1 A 55 55 GLU H H 55 8.934 8.261 0.673 1
1 582 . 14 1 1 A 55 55 GLU HA H 55 4.193 4.753 -0.560 1
1 587 . 14 1 1 A 55 55 GLU C C 55 176.189 175.576 0.613 1
1 588 . 14 1 1 A 55 55 GLU CA C 55 57.383 55.606 1.777 1
1 589 . 14 1 1 A 55 55 GLU CB C 55 28.945 29.489 -0.544 1
1 591 . 14 1 1 A 55 55 GLU N N 55 120.312 116.694 3.618 1
1 592 . 14 1 1 A 56 56 LYS H H 56 7.937 7.747 0.190 1
1 593 . 14 1 1 A 56 56 LYS HA H 56 4.578 4.827 -0.249 1
1 602 . 14 1 1 A 56 56 LYS C C 56 174.295 176.208 -1.913 1
1 603 . 14 1 1 A 56 56 LYS CA C 56 54.171 52.840 1.331 1
1 604 . 14 1 1 A 56 56 LYS CB C 56 32.555 33.966 -1.411 1
1 608 . 14 1 1 A 56 56 LYS N N 56 122.008 122.486 -0.478 1
1 609 . 14 1 1 A 57 57 PRO HA H 57 4.370 4.489 -0.119 1
1 616 . 14 1 1 A 57 57 PRO CA C 57 63.431 64.057 -0.626 1
1 617 . 14 1 1 A 57 57 PRO CB C 57 32.072 31.883 0.189 1
1 620 . 14 1 1 A 58 58 ARG H H 58 8.310 7.571 0.739 1
1 621 . 14 1 1 A 58 58 ARG HA H 58 4.295 4.889 -0.594 1
1 628 . 14 1 1 A 58 58 ARG CA C 58 56.570 55.514 1.056 1
1 629 . 14 1 1 A 58 58 ARG CB C 58 30.860 33.148 -2.288 1
1 632 . 14 1 1 A 58 58 ARG N N 58 120.045 117.269 2.776 1
1 633 . 14 1 1 A 60 60 CYS HA H 60 4.482 4.257 0.225 1
1 636 . 14 1 1 A 60 60 CYS CA C 60 58.621 62.557 -3.936 1
1 637 . 14 1 1 A 60 60 CYS CB C 60 28.267 27.815 0.452 1
1 638 . 14 1 1 A 61 61 GLU HA H 61 4.226 4.790 -0.564 1
1 643 . 14 1 1 A 61 61 GLU C C 61 176.299 175.701 0.598 1
1 644 . 14 1 1 A 61 61 GLU CA C 61 57.100 54.893 2.207 1
1 645 . 14 1 1 A 61 61 GLU CB C 61 29.873 33.954 -4.081 1
1 647 . 14 1 1 A 62 62 ALA H H 62 8.282 8.602 -0.320 1
1 648 . 14 1 1 A 62 62 ALA HA H 62 4.302 4.332 -0.030 1
1 652 . 14 1 1 A 62 62 ALA C C 62 177.277 176.423 0.854 1
1 653 . 14 1 1 A 62 62 ALA CA C 62 52.512 52.224 0.288 1
1 654 . 14 1 1 A 62 62 ALA CB C 62 19.592 18.408 1.184 1
1 655 . 14 1 1 A 62 62 ALA N N 62 124.386 125.841 -1.455 1
1 656 . 14 1 1 A 63 63 ALA H H 63 8.399 8.546 -0.147 1
1 657 . 14 1 1 A 63 63 ALA HA H 63 4.375 4.581 -0.206 1
1 661 . 14 1 1 A 63 63 ALA C C 63 176.843 176.229 0.614 1
1 662 . 14 1 1 A 63 63 ALA CA C 63 52.658 51.248 1.410 1
1 663 . 14 1 1 A 63 63 ALA CB C 63 19.592 19.194 0.398 1
1 664 . 14 1 1 A 63 63 ALA N N 63 123.892 127.117 -3.225 1
1 665 . 14 1 1 A 64 64 ARG H H 64 8.152 8.796 -0.644 1
1 666 . 14 1 1 A 64 64 ARG HA H 64 5.008 4.991 0.017 1
1 673 . 14 1 1 A 64 64 ARG C C 64 175.594 173.660 1.934 1
1 674 . 14 1 1 A 64 64 ARG CA C 64 55.282 54.378 0.904 1
1 675 . 14 1 1 A 64 64 ARG CB C 64 32.506 33.594 -1.088 1
1 678 . 14 1 1 A 64 64 ARG N N 64 119.787 124.437 -4.650 1
1 679 . 14 1 1 A 65 65 LYS H H 65 8.945 8.480 0.465 1
1 680 . 14 1 1 A 65 65 LYS HA H 65 4.602 4.890 -0.288 1
1 689 . 14 1 1 A 65 65 LYS C C 65 174.657 174.476 0.181 1
1 690 . 14 1 1 A 65 65 LYS CA C 65 54.948 54.693 0.255 1
1 691 . 14 1 1 A 65 65 LYS CB C 65 34.068 34.320 -0.252 1
1 695 . 14 1 1 A 65 65 LYS N N 65 124.171 127.468 -3.297 1
1 696 . 14 1 1 A 66 66 VAL H H 66 8.672 8.911 -0.239 1
1 697 . 14 1 1 A 66 66 VAL HA H 66 4.532 5.078 -0.546 1
1 705 . 14 1 1 A 66 66 VAL C C 66 175.078 173.852 1.226 1
1 706 . 14 1 1 A 66 66 VAL CA C 66 61.865 59.889 1.976 1
1 707 . 14 1 1 A 66 66 VAL CB C 66 33.835 34.564 -0.729 1
1 710 . 14 1 1 A 66 66 VAL N N 66 124.380 126.065 -1.685 1
1 711 . 14 1 1 A 67 67 ILE H H 67 9.071 9.110 -0.039 1
1 712 . 14 1 1 A 67 67 ILE HA H 67 4.142 4.686 -0.544 1
1 722 . 14 1 1 A 67 67 ILE C C 67 175.819 175.288 0.531 1
1 723 . 14 1 1 A 67 67 ILE CA C 67 60.383 60.434 -0.051 1
1 724 . 14 1 1 A 67 67 ILE CB C 67 39.908 39.148 0.760 1
1 728 . 14 1 1 A 67 67 ILE N N 67 129.537 129.626 -0.089 1
1 729 . 14 1 1 A 68 68 ARG H H 68 9.203 8.600 0.603 1
1 730 . 14 1 1 A 68 68 ARG HA H 68 4.198 4.300 -0.102 1
1 737 . 14 1 1 A 68 68 ARG C C 68 177.769 177.115 0.654 1
1 738 . 14 1 1 A 68 68 ARG CA C 68 56.835 56.543 0.292 1
1 739 . 14 1 1 A 68 68 ARG CB C 68 29.832 30.700 -0.868 1
1 742 . 14 1 1 A 68 68 ARG N N 68 128.484 128.517 -0.033 1
1 743 . 14 1 1 A 69 69 LEU H H 69 8.212 8.564 -0.352 1
1 744 . 14 1 1 A 69 69 LEU HA H 69 4.221 4.022 0.199 1
1 754 . 14 1 1 A 69 69 LEU C C 69 178.996 178.477 0.519 1
1 755 . 14 1 1 A 69 69 LEU CA C 69 57.136 57.743 -0.607 1
1 756 . 14 1 1 A 69 69 LEU CB C 69 39.455 41.157 -1.702 1
1 760 . 14 1 1 A 69 69 LEU N N 69 123.807 124.097 -0.290 1
1 761 . 14 1 1 A 70 70 SER H H 70 8.823 7.915 0.908 1
1 762 . 14 1 1 A 70 70 SER HA H 70 4.331 3.981 0.350 1
1 765 . 14 1 1 A 70 70 SER C C 70 175.076 175.726 -0.650 1
1 766 . 14 1 1 A 70 70 SER CA C 70 60.329 62.214 -1.885 1
1 767 . 14 1 1 A 70 70 SER CB C 70 62.362 62.828 -0.466 1
1 768 . 14 1 1 A 70 70 SER N N 70 115.162 114.021 1.141 1
1 769 . 14 1 1 A 71 71 ASP H H 71 7.602 8.556 -0.954 1
1 770 . 14 1 1 A 71 71 ASP HA H 71 4.820 4.391 0.429 1
1 773 . 14 1 1 A 71 71 ASP C C 71 176.478 176.600 -0.122 1
1 774 . 14 1 1 A 71 71 ASP CA C 71 54.241 56.784 -2.543 1
1 775 . 14 1 1 A 71 71 ASP CB C 71 41.347 40.661 0.686 1
1 776 . 14 1 1 A 71 71 ASP N N 71 119.590 122.089 -2.499 1
1 777 . 14 1 1 A 72 72 CYS H H 72 7.715 7.740 -0.025 1
1 778 . 14 1 1 A 72 72 CYS HA H 72 4.372 4.500 -0.128 1
1 781 . 14 1 1 A 72 72 CYS C C 72 173.690 174.581 -0.891 1
1 782 . 14 1 1 A 72 72 CYS CA C 72 60.836 58.043 2.793 1
1 783 . 14 1 1 A 72 72 CYS CB C 72 27.655 26.355 1.300 1
1 784 . 14 1 1 A 72 72 CYS N N 72 118.346 116.911 1.435 1
1 785 . 14 1 1 A 73 73 LEU H H 73 9.472 8.415 1.057 1
1 786 . 14 1 1 A 73 73 LEU HA H 73 4.593 4.023 0.570 1
1 796 . 14 1 1 A 73 73 LEU C C 73 177.562 176.816 0.746 1
1 797 . 14 1 1 A 73 73 LEU CA C 73 55.724 57.641 -1.917 1
1 798 . 14 1 1 A 73 73 LEU CB C 73 43.774 42.038 1.736 1
1 802 . 14 1 1 A 73 73 LEU N N 73 124.752 128.707 -3.955 1
1 803 . 14 1 1 A 74 74 ARG H H 74 7.658 7.448 0.210 1
1 804 . 14 1 1 A 74 74 ARG HA H 74 4.592 5.237 -0.645 1
1 811 . 14 1 1 A 74 74 ARG C C 74 173.605 174.605 -1.000 1
1 812 . 14 1 1 A 74 74 ARG CA C 74 56.465 55.711 0.754 1
1 813 . 14 1 1 A 74 74 ARG CB C 74 34.068 33.804 0.264 1
1 816 . 14 1 1 A 74 74 ARG N N 74 115.565 115.824 -0.259 1
1 817 . 14 1 1 A 75 75 VAL H H 75 8.622 8.837 -0.215 1
1 818 . 14 1 1 A 75 75 VAL HA H 75 5.170 5.245 -0.075 1
1 826 . 14 1 1 A 75 75 VAL C C 75 173.985 174.396 -0.411 1
1 827 . 14 1 1 A 75 75 VAL CA C 75 60.930 59.796 1.134 1
1 828 . 14 1 1 A 75 75 VAL CB C 75 35.073 36.371 -1.298 1
1 831 . 14 1 1 A 75 75 VAL N N 75 124.278 119.573 4.705 1
1 832 . 14 1 1 A 76 76 ALA H H 76 8.272 8.547 -0.275 1
1 833 . 14 1 1 A 76 76 ALA HA H 76 4.648 4.981 -0.333 1
1 837 . 14 1 1 A 76 76 ALA C C 76 175.630 175.819 -0.189 1
1 838 . 14 1 1 A 76 76 ALA CA C 76 51.294 51.280 0.014 1
1 839 . 14 1 1 A 76 76 ALA CB C 76 22.759 24.097 -1.338 1
1 840 . 14 1 1 A 76 76 ALA N N 76 126.015 124.060 1.955 1
1 841 . 14 1 1 A 77 77 GLU H H 77 9.184 8.673 0.511 1
1 842 . 14 1 1 A 77 77 GLU HA H 77 4.060 5.231 -1.171 1
1 847 . 14 1 1 A 77 77 GLU C C 77 174.949 176.288 -1.339 1
1 848 . 14 1 1 A 77 77 GLU CA C 77 58.424 55.218 3.206 1
1 849 . 14 1 1 A 77 77 GLU CB C 77 30.161 31.834 -1.673 1
1 851 . 14 1 1 A 77 77 GLU N N 77 120.223 118.440 1.783 1
1 852 . 14 1 1 A 78 78 ALA H H 78 7.985 8.753 -0.768 1
1 853 . 14 1 1 A 78 78 ALA HA H 78 4.776 5.337 -0.561 1
1 857 . 14 1 1 A 78 78 ALA C C 78 177.250 176.675 0.575 1
1 858 . 14 1 1 A 78 78 ALA CA C 78 50.888 50.831 0.057 1
1 859 . 14 1 1 A 78 78 ALA CB C 78 20.851 22.557 -1.706 1
1 860 . 14 1 1 A 78 78 ALA N N 78 125.143 126.171 -1.028 1
1 861 . 14 1 1 A 79 79 GLY H H 79 8.604 8.400 0.204 1
1 862 . 14 1 1 A 79 79 GLY HA2 H 79 4.327 4.214 0.113 1
1 863 . 14 1 1 A 79 79 GLY HA3 H 79 3.963 4.234 -0.271 1
1 864 . 14 1 1 A 79 79 GLY C C 79 175.360 174.293 1.067 1
1 865 . 14 1 1 A 79 79 GLY CA C 79 44.925 45.907 -0.982 1
1 866 . 14 1 1 A 79 79 GLY N N 79 109.420 105.084 4.336 1
1 867 . 14 1 1 A 80 80 GLY H H 80 8.649 8.633 0.016 1
1 868 . 14 1 1 A 80 80 GLY HA2 H 80 3.962 3.873 0.089 1
1 869 . 14 1 1 A 80 80 GLY HA3 H 80 3.962 3.881 0.081 1
1 870 . 14 1 1 A 80 80 GLY C C 80 175.052 174.602 0.450 1
1 871 . 14 1 1 A 80 80 GLY CA C 80 45.955 47.301 -1.346 1
1 872 . 14 1 1 A 80 80 GLY N N 80 108.295 108.620 -0.325 1
1 873 . 14 1 1 A 81 81 GLU H H 81 8.921 8.276 0.645 1
1 874 . 14 1 1 A 81 81 GLU HA H 81 4.298 4.371 -0.073 1
1 879 . 14 1 1 A 81 81 GLU C C 81 176.532 175.388 1.144 1
1 880 . 14 1 1 A 81 81 GLU CA C 81 57.118 56.072 1.046 1
1 881 . 14 1 1 A 81 81 GLU CB C 81 28.599 28.288 0.311 1
1 883 . 14 1 1 A 81 81 GLU N N 81 121.170 125.661 -4.491 1
1 884 . 14 1 1 A 82 82 ALA H H 82 8.032 8.130 -0.098 1
1 885 . 14 1 1 A 82 82 ALA HA H 82 4.371 4.657 -0.286 1
1 889 . 14 1 1 A 82 82 ALA C C 82 177.160 177.440 -0.280 1
1 890 . 14 1 1 A 82 82 ALA CA C 82 52.653 51.840 0.813 1
1 891 . 14 1 1 A 82 82 ALA CB C 82 19.304 22.429 -3.125 1
1 892 . 14 1 1 A 82 82 ALA N N 82 124.988 125.913 -0.925 1
1 893 . 14 1 1 A 83 83 SER H H 83 8.319 8.994 -0.675 1
1 894 . 14 1 1 A 83 83 SER HA H 83 4.331 4.201 0.130 1
1 897 . 14 1 1 A 83 83 SER C C 83 174.045 175.242 -1.197 1
1 898 . 14 1 1 A 83 83 SER CA C 83 58.053 62.119 -4.066 1
1 899 . 14 1 1 A 83 83 SER CB C 83 63.184 62.946 0.238 1
1 900 . 14 1 1 A 83 83 SER N N 83 114.181 117.799 -3.618 1
1 901 . 14 1 1 A 84 84 SER H H 84 7.823 7.716 0.107 1
1 902 . 14 1 1 A 84 84 SER HA H 84 3.194 4.102 -0.908 1
1 905 . 14 1 1 A 84 84 SER C C 84 171.072 174.118 -3.046 1
1 906 . 14 1 1 A 84 84 SER CA C 84 57.206 56.958 0.248 1
1 907 . 14 1 1 A 84 84 SER CB C 84 61.622 63.465 -1.843 1
1 908 . 14 1 1 A 84 84 SER N N 84 117.302 114.912 2.390 1
1 909 . 14 1 1 A 85 85 PRO HA H 85 3.922 4.557 -0.635 1
1 916 . 14 1 1 A 85 85 PRO CA C 85 62.691 62.125 0.566 1
1 917 . 14 1 1 A 85 85 PRO CB C 85 31.515 32.782 -1.267 1
1 920 . 14 1 1 A 86 86 ARG HA H 86 3.882 4.174 -0.292 1
1 927 . 14 1 1 A 86 86 ARG C C 86 175.712 176.414 -0.702 1
1 928 . 14 1 1 A 86 86 ARG CA C 86 57.877 56.140 1.737 1
1 929 . 14 1 1 A 86 86 ARG CB C 86 29.791 30.987 -1.196 1
1 932 . 14 1 1 A 87 87 ASP H H 87 8.903 9.124 -0.221 1
1 933 . 14 1 1 A 87 87 ASP HA H 87 4.342 4.192 0.150 1
1 936 . 14 1 1 A 87 87 ASP C C 87 175.723 174.747 0.976 1
1 937 . 14 1 1 A 87 87 ASP CA C 87 56.377 55.098 1.279 1
1 938 . 14 1 1 A 87 87 ASP CB C 87 39.208 39.897 -0.689 1
1 939 . 14 1 1 A 87 87 ASP N N 87 117.520 124.947 -7.427 1
1 940 . 14 1 1 A 88 88 THR H H 88 7.776 7.395 0.381 1
1 941 . 14 1 1 A 88 88 THR HA H 88 5.101 5.165 -0.064 1
1 946 . 14 1 1 A 88 88 THR C C 88 173.825 172.787 1.038 1
1 947 . 14 1 1 A 88 88 THR CA C 88 60.154 60.023 0.131 1
1 948 . 14 1 1 A 88 88 THR CB C 88 72.702 72.606 0.096 1
1 950 . 14 1 1 A 88 88 THR N N 88 108.770 108.362 0.408 1
1 951 . 14 1 1 A 89 89 SER H H 89 9.006 8.958 0.048 1
1 952 . 14 1 1 A 89 89 SER HA H 89 4.718 5.179 -0.461 1
1 955 . 14 1 1 A 89 89 SER C C 89 173.728 173.006 0.722 1
1 956 . 14 1 1 A 89 89 SER CA C 89 57.453 57.801 -0.348 1
1 957 . 14 1 1 A 89 89 SER CB C 89 65.611 65.693 -0.082 1
1 958 . 14 1 1 A 89 89 SER N N 89 114.151 117.315 -3.164 1
1 959 . 14 1 1 A 90 90 ALA H H 90 9.001 8.838 0.163 1
1 960 . 14 1 1 A 90 90 ALA HA H 90 5.660 4.736 0.924 1
1 964 . 14 1 1 A 90 90 ALA C C 90 177.669 177.438 0.231 1
1 965 . 14 1 1 A 90 90 ALA CA C 90 51.670 52.029 -0.359 1
1 966 . 14 1 1 A 90 90 ALA CB C 90 22.265 20.004 2.261 1
1 967 . 14 1 1 A 90 90 ALA N N 90 126.177 129.217 -3.040 1
1 968 . 14 1 1 A 91 91 PHE H H 91 9.672 8.400 1.272 1
1 969 . 14 1 1 A 91 91 PHE HA H 91 5.039 5.508 -0.469 1
1 977 . 14 1 1 A 91 91 PHE C C 91 170.731 173.544 -2.813 1
1 978 . 14 1 1 A 91 91 PHE CA C 91 56.271 55.064 1.207 1
1 979 . 14 1 1 A 91 91 PHE CB C 91 41.553 42.196 -0.643 1
1 985 . 14 1 1 A 91 91 PHE N N 91 118.968 116.346 2.622 1
1 986 . 14 1 1 A 92 92 PHE H H 92 9.422 9.307 0.115 1
1 987 . 14 1 1 A 92 92 PHE HA H 92 5.674 5.200 0.474 1
1 995 . 14 1 1 A 92 92 PHE C C 92 174.570 175.329 -0.759 1
1 996 . 14 1 1 A 92 92 PHE CA C 92 55.917 57.216 -1.299 1
1 997 . 14 1 1 A 92 92 PHE CB C 92 42.787 41.649 1.138 1
1 1003 . 14 1 1 A 92 92 PHE N N 92 117.543 117.655 -0.112 1
1 1004 . 14 1 1 A 93 93 LEU H H 93 9.021 8.818 0.203 1
1 1005 . 14 1 1 A 93 93 LEU HA H 93 5.122 5.005 0.117 1
1 1015 . 14 1 1 A 93 93 LEU C C 93 174.799 174.421 0.378 1
1 1016 . 14 1 1 A 93 93 LEU CA C 93 54.912 54.646 0.266 1
1 1017 . 14 1 1 A 93 93 LEU CB C 93 45.254 45.172 0.082 1
1 1021 . 14 1 1 A 93 93 LEU N N 93 121.719 122.545 -0.826 1
1 1022 . 14 1 1 A 94 94 GLU H H 94 9.294 9.379 -0.085 1
1 1023 . 14 1 1 A 94 94 GLU HA H 94 5.043 5.219 -0.176 1
1 1028 . 14 1 1 A 94 94 GLU C C 94 175.754 175.464 0.290 1
1 1029 . 14 1 1 A 94 94 GLU CA C 94 56.018 54.959 1.059 1
1 1030 . 14 1 1 A 94 94 GLU CB C 94 32.752 32.887 -0.135 1
1 1032 . 14 1 1 A 94 94 GLU N N 94 127.032 128.065 -1.033 1
1 1033 . 14 1 1 A 95 95 THR H H 95 8.822 8.406 0.416 1
1 1034 . 14 1 1 A 95 95 THR HA H 95 5.398 5.030 0.368 1
1 1039 . 14 1 1 A 95 95 THR C C 95 173.860 175.647 -1.787 1
1 1040 . 14 1 1 A 95 95 THR CA C 95 59.588 59.624 -0.036 1
1 1041 . 14 1 1 A 95 95 THR CB C 95 72.191 72.247 -0.056 1
1 1043 . 14 1 1 A 95 95 THR N N 95 118.685 118.160 0.525 1
1 1044 . 14 1 1 A 96 96 LYS H H 96 8.823 9.093 -0.270 1
1 1045 . 14 1 1 A 96 96 LYS HA H 96 4.022 3.987 0.035 1
1 1054 . 14 1 1 A 96 96 LYS C C 96 177.330 178.781 -1.451 1
1 1055 . 14 1 1 A 96 96 LYS CA C 96 59.588 59.802 -0.214 1
1 1056 . 14 1 1 A 96 96 LYS CB C 96 32.588 32.043 0.545 1
1 1060 . 14 1 1 A 96 96 LYS N N 96 118.801 120.847 -2.046 1
1 1061 . 14 1 1 A 97 97 GLU H H 97 8.092 7.746 0.346 1
1 1062 . 14 1 1 A 97 97 GLU HA H 97 4.282 4.262 0.020 1
1 1067 . 14 1 1 A 97 97 GLU C C 97 176.290 176.782 -0.492 1
1 1068 . 14 1 1 A 97 97 GLU CA C 97 57.365 58.583 -1.218 1
1 1069 . 14 1 1 A 97 97 GLU CB C 97 31.559 30.414 1.145 1
1 1071 . 14 1 1 A 97 97 GLU N N 97 113.992 118.794 -4.802 1
1 1072 . 14 1 1 A 98 98 ARG H H 98 7.482 7.097 0.385 1
1 1073 . 14 1 1 A 98 98 ARG HA H 98 4.397 4.526 -0.129 1
1 1080 . 14 1 1 A 98 98 ARG C C 98 172.792 172.995 -0.203 1
1 1081 . 14 1 1 A 98 98 ARG CA C 98 55.689 54.685 1.004 1
1 1082 . 14 1 1 A 98 98 ARG CB C 98 32.711 31.558 1.153 1
1 1085 . 14 1 1 A 98 98 ARG N N 98 116.022 113.076 2.946 1
1 1086 . 14 1 1 A 99 99 LEU H H 99 8.423 8.174 0.249 1
1 1087 . 14 1 1 A 99 99 LEU HA H 99 4.807 4.708 0.099 1
1 1097 . 14 1 1 A 99 99 LEU C C 99 175.903 174.100 1.803 1
1 1098 . 14 1 1 A 99 99 LEU CA C 99 54.383 53.802 0.581 1
1 1099 . 14 1 1 A 99 99 LEU CB C 99 43.362 43.848 -0.486 1
1 1103 . 14 1 1 A 99 99 LEU N N 99 124.983 121.764 3.219 1
1 1104 . 14 1 1 A 100 100 TYR H H 100 9.144 9.193 -0.049 1
1 1105 . 14 1 1 A 100 100 TYR HA H 100 4.542 5.165 -0.623 1
1 1112 . 14 1 1 A 100 100 TYR C C 100 173.479 174.626 -1.147 1
1 1113 . 14 1 1 A 100 100 TYR CA C 100 57.735 56.453 1.282 1
1 1114 . 14 1 1 A 100 100 TYR CB C 100 39.291 40.294 -1.003 1
1 1119 . 14 1 1 A 100 100 TYR N N 100 126.679 127.166 -0.487 1
1 1120 . 14 1 1 A 101 101 LEU H H 101 9.043 8.924 0.119 1
1 1121 . 14 1 1 A 101 101 LEU HA H 101 4.747 4.784 -0.037 1
1 1131 . 14 1 1 A 101 101 LEU C C 101 173.530 174.990 -1.460 1
1 1132 . 14 1 1 A 101 101 LEU CA C 101 54.524 53.880 0.644 1
1 1133 . 14 1 1 A 101 101 LEU CB C 101 42.499 43.638 -1.139 1
1 1137 . 14 1 1 A 101 101 LEU N N 101 127.422 126.647 0.775 1
1 1138 . 14 1 1 A 102 102 LEU H H 102 8.493 8.550 -0.057 1
1 1139 . 14 1 1 A 102 102 LEU HA H 102 5.612 5.488 0.124 1
1 1149 . 14 1 1 A 102 102 LEU C C 102 175.794 176.189 -0.395 1
1 1150 . 14 1 1 A 102 102 LEU CA C 102 53.076 53.309 -0.233 1
1 1151 . 14 1 1 A 102 102 LEU CB C 102 45.994 44.292 1.702 1
1 1155 . 14 1 1 A 102 102 LEU N N 102 126.021 128.702 -2.681 1
1 1156 . 14 1 1 A 103 103 ALA H H 103 9.073 9.039 0.034 1
1 1157 . 14 1 1 A 103 103 ALA HA H 103 5.081 5.354 -0.273 1
1 1161 . 14 1 1 A 103 103 ALA C C 103 175.133 176.058 -0.925 1
1 1162 . 14 1 1 A 103 103 ALA CA C 103 51.688 49.940 1.748 1
1 1163 . 14 1 1 A 103 103 ALA CB C 103 21.689 22.630 -0.941 1
1 1164 . 14 1 1 A 103 103 ALA N N 103 117.679 123.483 -5.804 1
1 1165 . 14 1 1 A 104 104 ALA H H 104 8.582 8.587 -0.005 1
1 1166 . 14 1 1 A 104 104 ALA HA H 104 5.220 4.891 0.329 1
1 1170 . 14 1 1 A 104 104 ALA C C 104 173.471 174.171 -0.700 1
1 1171 . 14 1 1 A 104 104 ALA CA C 104 47.959 49.929 -1.970 1
1 1172 . 14 1 1 A 104 104 ALA CB C 104 21.359 22.464 -1.105 1
1 1173 . 14 1 1 A 104 104 ALA N N 104 123.419 121.413 2.006 1
1 1174 . 14 1 1 A 105 105 PRO HA H 105 4.542 4.800 -0.258 1
1 1181 . 14 1 1 A 105 105 PRO C C 105 178.409 177.884 0.525 1
1 1182 . 14 1 1 A 105 105 PRO CA C 105 64.301 62.864 1.437 1
1 1183 . 14 1 1 A 105 105 PRO CB C 105 32.094 31.649 0.445 1
1 1186 . 14 1 1 A 106 106 ALA H H 106 8.302 8.690 -0.388 1
1 1187 . 14 1 1 A 106 106 ALA HA H 106 4.022 4.025 -0.003 1
1 1191 . 14 1 1 A 106 106 ALA C C 106 179.641 179.612 0.029 1
1 1192 . 14 1 1 A 106 106 ALA CA C 106 56.341 55.200 1.141 1
1 1193 . 14 1 1 A 106 106 ALA CB C 106 18.523 18.245 0.278 1
1 1194 . 14 1 1 A 106 106 ALA N N 106 127.733 127.959 -0.226 1
1 1195 . 14 1 1 A 107 107 ALA H H 107 9.035 8.212 0.823 1
1 1196 . 14 1 1 A 107 107 ALA HA H 107 4.331 3.999 0.332 1
1 1200 . 14 1 1 A 107 107 ALA C C 107 178.586 180.110 -1.524 1
1 1201 . 14 1 1 A 107 107 ALA CA C 107 53.765 55.379 -1.614 1
1 1202 . 14 1 1 A 107 107 ALA CB C 107 18.728 18.269 0.459 1
1 1203 . 14 1 1 A 107 107 ALA N N 107 118.203 120.082 -1.879 1
1 1204 . 14 1 1 A 108 108 GLU H H 108 8.399 8.134 0.265 1
1 1205 . 14 1 1 A 108 108 GLU HA H 108 4.631 4.059 0.572 1
1 1210 . 14 1 1 A 108 108 GLU C C 108 177.127 178.771 -1.644 1
1 1211 . 14 1 1 A 108 108 GLU CA C 108 55.847 59.235 -3.388 1
1 1212 . 14 1 1 A 108 108 GLU CB C 108 32.135 29.436 2.699 1
1 1214 . 14 1 1 A 108 108 GLU N N 108 114.661 117.664 -3.003 1
1 1215 . 14 1 1 A 109 109 ARG H H 109 7.412 8.547 -1.135 1
1 1216 . 14 1 1 A 109 109 ARG HA H 109 3.682 4.074 -0.392 1
1 1223 . 14 1 1 A 109 109 ARG C C 109 176.917 179.165 -2.248 1
1 1224 . 14 1 1 A 109 109 ARG CA C 109 61.600 59.773 1.827 1
1 1225 . 14 1 1 A 109 109 ARG CB C 109 28.845 30.469 -1.624 1
1 1228 . 14 1 1 A 109 109 ARG N N 109 120.954 120.767 0.187 1
1 1229 . 14 1 1 A 110 110 GLY H H 110 8.833 8.007 0.826 1
1 1230 . 14 1 1 A 110 110 GLY HA2 H 110 3.872 3.790 0.082 1
1 1231 . 14 1 1 A 110 110 GLY HA3 H 110 3.685 3.801 -0.116 1
1 1232 . 14 1 1 A 110 110 GLY C C 110 175.997 175.820 0.177 1
1 1233 . 14 1 1 A 110 110 GLY CA C 110 47.323 47.396 -0.073 1
1 1234 . 14 1 1 A 110 110 GLY N N 110 106.563 107.310 -0.747 1
1 1235 . 14 1 1 A 111 111 ASP H H 111 7.882 8.215 -0.333 1
1 1236 . 14 1 1 A 111 111 ASP HA H 111 4.312 4.403 -0.091 1
1 1239 . 14 1 1 A 111 111 ASP C C 111 179.467 178.770 0.697 1
1 1240 . 14 1 1 A 111 111 ASP CA C 111 56.976 56.651 0.325 1
1 1241 . 14 1 1 A 111 111 ASP CB C 111 40.648 40.862 -0.214 1
1 1242 . 14 1 1 A 111 111 ASP N N 111 121.402 121.588 -0.186 1
1 1243 . 14 1 1 A 112 112 TRP H H 112 7.804 8.389 -0.585 1
1 1244 . 14 1 1 A 112 112 TRP HA H 112 3.831 4.205 -0.374 1
1 1253 . 14 1 1 A 112 112 TRP C C 112 177.547 178.702 -1.155 1
1 1254 . 14 1 1 A 112 112 TRP CA C 112 62.006 60.008 1.998 1
1 1255 . 14 1 1 A 112 112 TRP CB C 112 29.421 29.339 0.082 1
1 1261 . 14 1 1 A 112 112 TRP N N 112 119.904 119.863 0.041 1
1 1263 . 14 1 1 A 113 113 VAL H H 113 7.982 8.112 -0.130 1
1 1264 . 14 1 1 A 113 113 VAL HA H 113 3.072 3.604 -0.532 1
1 1272 . 14 1 1 A 113 113 VAL C C 113 178.015 178.452 -0.437 1
1 1273 . 14 1 1 A 113 113 VAL CA C 113 67.407 66.586 0.821 1
1 1274 . 14 1 1 A 113 113 VAL CB C 113 31.724 31.360 0.364 1
1 1277 . 14 1 1 A 113 113 VAL N N 113 117.575 119.376 -1.801 1
1 1278 . 14 1 1 A 114 114 GLN H H 114 8.268 8.129 0.139 1
1 1279 . 14 1 1 A 114 114 GLN HA H 114 3.994 4.042 -0.048 1
1 1286 . 14 1 1 A 114 114 GLN C C 114 178.021 177.794 0.227 1
1 1287 . 14 1 1 A 114 114 GLN CA C 114 59.112 58.662 0.450 1
1 1288 . 14 1 1 A 114 114 GLN CB C 114 28.685 28.743 -0.058 1
1 1290 . 14 1 1 A 114 114 GLN N N 114 117.479 120.241 -2.762 1
1 1292 . 14 1 1 A 115 115 ALA H H 115 7.915 8.537 -0.622 1
1 1293 . 14 1 1 A 115 115 ALA HA H 115 3.972 4.032 -0.060 1
1 1297 . 14 1 1 A 115 115 ALA C C 115 180.030 180.114 -0.084 1
1 1298 . 14 1 1 A 115 115 ALA CA C 115 55.142 55.123 0.019 1
1 1299 . 14 1 1 A 115 115 ALA CB C 115 18.152 18.479 -0.327 1
1 1300 . 14 1 1 A 115 115 ALA N N 115 120.858 120.740 0.118 1
1 1301 . 14 1 1 A 116 116 ILE H H 116 8.172 8.423 -0.251 1
1 1302 . 14 1 1 A 116 116 ILE HA H 116 3.482 3.726 -0.244 1
1 1312 . 14 1 1 A 116 116 ILE C C 116 177.739 177.771 -0.032 1
1 1313 . 14 1 1 A 116 116 ILE CA C 116 66.119 65.146 0.973 1
1 1314 . 14 1 1 A 116 116 ILE CB C 116 38.222 37.725 0.497 1
1 1318 . 14 1 1 A 116 116 ILE N N 116 115.977 117.643 -1.666 1
1 1319 . 14 1 1 A 117 117 CYS H H 117 8.449 8.277 0.172 1
1 1320 . 14 1 1 A 117 117 CYS HA H 117 4.032 4.357 -0.325 1
1 1323 . 14 1 1 A 117 117 CYS C C 117 177.321 177.056 0.265 1
1 1324 . 14 1 1 A 117 117 CYS CA C 117 64.777 62.560 2.217 1
1 1325 . 14 1 1 A 117 117 CYS CB C 117 26.871 27.064 -0.193 1
1 1326 . 14 1 1 A 117 117 CYS N N 117 117.253 121.125 -3.872 1
1 1327 . 14 1 1 A 118 118 LEU H H 118 8.182 8.191 -0.009 1
1 1328 . 14 1 1 A 118 118 LEU HA H 118 4.052 4.040 0.012 1
1 1338 . 14 1 1 A 118 118 LEU C C 118 179.217 179.354 -0.137 1
1 1339 . 14 1 1 A 118 118 LEU CA C 118 57.877 58.014 -0.137 1
1 1340 . 14 1 1 A 118 118 LEU CB C 118 42.088 42.322 -0.234 1
1 1344 . 14 1 1 A 118 118 LEU N N 118 119.665 120.917 -1.252 1
1 1345 . 14 1 1 A 119 119 LEU H H 119 7.142 8.054 -0.912 1
1 1346 . 14 1 1 A 119 119 LEU HA H 119 4.192 3.870 0.322 1
1 1356 . 14 1 1 A 119 119 LEU C C 119 178.492 178.692 -0.200 1
1 1357 . 14 1 1 A 119 119 LEU CA C 119 56.259 58.231 -1.972 1
1 1358 . 14 1 1 A 119 119 LEU CB C 119 43.568 41.951 1.617 1
1 1362 . 14 1 1 A 119 119 LEU N N 119 116.244 117.502 -1.258 1
1 1363 . 14 1 1 A 120 120 ALA H H 120 8.513 8.368 0.145 1
1 1364 . 14 1 1 A 120 120 ALA HA H 120 3.878 3.992 -0.114 1
1 1368 . 14 1 1 A 120 120 ALA C C 120 178.358 178.433 -0.075 1
1 1369 . 14 1 1 A 120 120 ALA CA C 120 53.765 54.968 -1.203 1
1 1370 . 14 1 1 A 120 120 ALA CB C 120 18.687 18.698 -0.011 1
1 1371 . 14 1 1 A 120 120 ALA N N 120 120.009 120.780 -0.771 1
1 1372 . 14 1 1 A 121 121 PHE H H 121 7.822 8.295 -0.473 1
1 1373 . 14 1 1 A 121 121 PHE HA H 121 5.156 4.966 0.190 1
1 1381 . 14 1 1 A 121 121 PHE C C 121 176.273 176.322 -0.049 1
1 1382 . 14 1 1 A 121 121 PHE CA C 121 55.741 56.623 -0.882 1
1 1383 . 14 1 1 A 121 121 PHE CB C 121 39.455 38.187 1.268 1
1 1389 . 14 1 1 A 121 121 PHE N N 121 113.981 115.279 -1.298 1
1 1390 . 14 1 1 A 122 122 SER H H 122 7.765 8.159 -0.394 1
1 1391 . 14 1 1 A 122 122 SER HA H 122 4.579 4.341 0.238 1
1 1394 . 14 1 1 A 122 122 SER C C 122 174.595 175.792 -1.197 1
1 1395 . 14 1 1 A 122 122 SER CA C 122 58.777 61.114 -2.337 1
1 1396 . 14 1 1 A 122 122 SER CB C 122 63.719 62.910 0.809 1
1 1397 . 14 1 1 A 122 122 SER N N 122 115.069 116.234 -1.165 1
1 1398 . 14 1 1 A 123 123 GLY H H 123 8.223 8.139 0.084 1
1 1399 . 14 1 1 A 123 123 GLY HA2 H 123 4.174 4.110 0.064 1
1 1400 . 14 1 1 A 123 123 GLY HA3 H 123 4.100 4.116 -0.016 1
1 1401 . 14 1 1 A 123 123 GLY C C 123 171.678 174.889 -3.211 1
1 1402 . 14 1 1 A 123 123 GLY CA C 123 44.815 44.316 0.499 1
1 1403 . 14 1 1 A 123 123 GLY N N 123 110.151 109.481 0.670 1
1 1404 . 14 1 1 A 124 124 PRO HA H 124 4.482 4.503 -0.021 1
1 1411 . 14 1 1 A 124 124 PRO C C 124 177.314 176.385 0.929 1
1 1412 . 14 1 1 A 124 124 PRO CA C 124 63.206 64.485 -1.279 1
1 1413 . 14 1 1 A 124 124 PRO CB C 124 32.176 31.851 0.325 1
1 1416 . 14 1 1 A 125 125 SER H H 125 8.485 7.751 0.734 1
1 1417 . 14 1 1 A 125 125 SER HA H 125 4.472 4.364 0.108 1
1 1420 . 14 1 1 A 125 125 SER C C 125 174.728 174.242 0.486 1
1 1421 . 14 1 1 A 125 125 SER CA C 125 58.353 60.308 -1.955 1
1 1422 . 14 1 1 A 125 125 SER CB C 125 64.048 63.728 0.320 1
1 1423 . 14 1 1 A 125 125 SER N N 125 116.081 115.928 0.153 1
1 1424 . 14 1 1 A 126 126 SER H H 126 8.332 8.678 -0.346 1
1 1425 . 14 1 1 A 126 126 SER HA H 126 4.464 4.999 -0.535 1
1 1428 . 14 1 1 A 126 126 SER C C 126 173.980 174.297 -0.317 1
1 1429 . 14 1 1 A 126 126 SER CA C 126 58.336 56.634 1.702 1
1 1430 . 14 1 1 A 126 126 SER CB C 126 63.925 65.631 -1.706 1
1 1431 . 14 1 1 A 126 126 SER N N 126 118.037 118.198 -0.161 1
1 1 . 15 1 1 A 6 6 SER HA H 6 4.458 4.944 -0.486 1
1 3 . 15 1 1 A 6 6 SER C C 6 175.108 174.078 1.030 1
1 4 . 15 1 1 A 6 6 SER CA C 6 58.689 58.474 0.215 1
1 5 . 15 1 1 A 6 6 SER CB C 6 63.678 63.922 -0.244 1
1 6 . 15 1 1 A 7 7 GLY H H 7 8.449 8.408 0.041 1
1 7 . 15 1 1 A 7 7 GLY HA2 H 7 3.965 4.198 -0.233 1
1 8 . 15 1 1 A 7 7 GLY HA3 H 7 3.965 4.199 -0.234 1
1 9 . 15 1 1 A 7 7 GLY C C 7 174.380 172.379 2.001 1
1 10 . 15 1 1 A 7 7 GLY CA C 7 45.435 45.467 -0.032 1
1 11 . 15 1 1 A 7 7 GLY N N 7 110.792 110.165 0.627 1
1 12 . 15 1 1 A 8 8 MET H H 8 8.259 8.242 0.017 1
1 13 . 15 1 1 A 8 8 MET HA H 8 4.487 5.155 -0.668 1
1 21 . 15 1 1 A 8 8 MET C C 8 176.961 177.007 -0.046 1
1 22 . 15 1 1 A 8 8 MET CA C 8 55.565 54.464 1.101 1
1 23 . 15 1 1 A 8 8 MET CB C 8 32.835 34.584 -1.749 1
1 26 . 15 1 1 A 8 8 MET N N 8 119.639 122.218 -2.579 1
1 27 . 15 1 1 A 9 9 GLY H H 9 8.472 8.400 0.072 1
1 28 . 15 1 1 A 9 9 GLY HA2 H 9 3.946 4.091 -0.145 1
1 29 . 15 1 1 A 9 9 GLY HA3 H 9 3.946 4.095 -0.149 1
1 30 . 15 1 1 A 9 9 GLY C C 9 174.005 172.652 1.353 1
1 31 . 15 1 1 A 9 9 GLY CA C 9 45.488 44.391 1.097 1
1 32 . 15 1 1 A 9 9 GLY N N 9 110.107 108.300 1.807 1
1 33 . 15 1 1 A 10 10 ASP H H 10 8.292 8.575 -0.283 1
1 34 . 15 1 1 A 10 10 ASP HA H 10 4.636 4.765 -0.129 1
1 37 . 15 1 1 A 10 10 ASP C C 10 176.768 176.108 0.660 1
1 38 . 15 1 1 A 10 10 ASP CA C 10 54.206 53.165 1.041 1
1 39 . 15 1 1 A 10 10 ASP CB C 10 41.306 40.148 1.158 1
1 40 . 15 1 1 A 10 10 ASP N N 10 120.370 119.915 0.455 1
1 41 . 15 1 1 A 11 11 GLY H H 11 8.452 8.340 0.112 1
1 42 . 15 1 1 A 11 11 GLY HA2 H 11 3.980 4.060 -0.080 1
1 43 . 15 1 1 A 11 11 GLY HA3 H 11 4.022 4.071 -0.049 1
1 44 . 15 1 1 A 11 11 GLY C C 11 174.102 173.671 0.431 1
1 45 . 15 1 1 A 11 11 GLY CA C 11 45.170 44.663 0.507 1
1 46 . 15 1 1 A 11 11 GLY N N 11 108.391 111.932 -3.541 1
1 47 . 15 1 1 A 12 12 ALA H H 12 8.293 8.132 0.161 1
1 48 . 15 1 1 A 12 12 ALA HA H 12 3.777 4.219 -0.442 1
1 52 . 15 1 1 A 12 12 ALA C C 12 178.193 178.767 -0.574 1
1 53 . 15 1 1 A 12 12 ALA CA C 12 52.759 52.635 0.124 1
1 54 . 15 1 1 A 12 12 ALA CB C 12 17.855 19.472 -1.617 1
1 55 . 15 1 1 A 12 12 ALA N N 12 124.185 126.896 -2.711 1
1 56 . 15 1 1 A 13 13 VAL H H 13 8.822 8.390 0.432 1
1 57 . 15 1 1 A 13 13 VAL HA H 13 3.912 3.681 0.231 1
1 65 . 15 1 1 A 13 13 VAL C C 13 176.073 176.025 0.048 1
1 66 . 15 1 1 A 13 13 VAL CA C 13 63.100 66.550 -3.450 1
1 67 . 15 1 1 A 13 13 VAL CB C 13 32.711 31.908 0.803 1
1 70 . 15 1 1 A 13 13 VAL N N 13 120.877 124.696 -3.819 1
1 71 . 15 1 1 A 14 14 LYS H H 14 7.093 7.507 -0.414 1
1 72 . 15 1 1 A 14 14 LYS HA H 14 4.169 4.573 -0.404 1
1 81 . 15 1 1 A 14 14 LYS C C 14 173.291 173.797 -0.506 1
1 82 . 15 1 1 A 14 14 LYS CA C 14 56.465 55.762 0.703 1
1 83 . 15 1 1 A 14 14 LYS CB C 14 35.960 35.611 0.349 1
1 87 . 15 1 1 A 14 14 LYS N N 14 118.693 119.247 -0.554 1
1 88 . 15 1 1 A 15 15 GLN H H 15 8.522 8.493 0.029 1
1 89 . 15 1 1 A 15 15 GLN HA H 15 5.542 5.221 0.321 1
1 96 . 15 1 1 A 15 15 GLN C C 15 174.992 175.747 -0.755 1
1 97 . 15 1 1 A 15 15 GLN CA C 15 54.312 54.011 0.301 1
1 98 . 15 1 1 A 15 15 GLN CB C 15 33.585 31.329 2.256 1
1 100 . 15 1 1 A 15 15 GLN N N 15 124.024 124.884 -0.860 1
1 102 . 15 1 1 A 16 16 GLY H H 16 8.740 8.246 0.494 1
1 103 . 15 1 1 A 16 16 GLY HA2 H 16 4.511 4.012 0.499 1
1 104 . 15 1 1 A 16 16 GLY HA3 H 16 4.064 4.509 -0.445 1
1 105 . 15 1 1 A 16 16 GLY C C 16 171.431 171.544 -0.113 1
1 106 . 15 1 1 A 16 16 GLY CA C 16 46.106 45.288 0.818 1
1 107 . 15 1 1 A 16 16 GLY N N 16 109.611 109.949 -0.338 1
1 108 . 15 1 1 A 17 17 PHE H H 17 8.886 8.318 0.568 1
1 109 . 15 1 1 A 17 17 PHE HA H 17 5.466 4.832 0.634 1
1 114 . 15 1 1 A 17 17 PHE C C 17 174.795 174.941 -0.146 1
1 115 . 15 1 1 A 17 17 PHE CA C 17 57.788 57.726 0.062 1
1 116 . 15 1 1 A 17 17 PHE CB C 17 41.315 39.925 1.390 1
1 119 . 15 1 1 A 17 17 PHE N N 17 122.684 119.623 3.061 1
1 120 . 15 1 1 A 18 18 LEU H H 18 8.762 9.034 -0.272 1
1 121 . 15 1 1 A 18 18 LEU HA H 18 4.946 4.795 0.151 1
1 131 . 15 1 1 A 18 18 LEU C C 18 175.461 175.188 0.273 1
1 132 . 15 1 1 A 18 18 LEU CA C 18 52.970 53.466 -0.496 1
1 133 . 15 1 1 A 18 18 LEU CB C 18 47.945 44.680 3.265 1
1 137 . 15 1 1 A 18 18 LEU N N 18 119.045 124.210 -5.165 1
1 138 . 15 1 1 A 19 19 TYR H H 19 9.272 8.491 0.781 1
1 139 . 15 1 1 A 19 19 TYR HA H 19 5.682 5.626 0.056 1
1 146 . 15 1 1 A 19 19 TYR C C 19 174.829 174.592 0.237 1
1 147 . 15 1 1 A 19 19 TYR CA C 19 56.482 56.428 0.054 1
1 148 . 15 1 1 A 19 19 TYR CB C 19 41.717 41.440 0.277 1
1 153 . 15 1 1 A 19 19 TYR N N 19 118.024 123.115 -5.091 1
1 154 . 15 1 1 A 20 20 LEU H H 20 9.441 9.535 -0.094 1
1 155 . 15 1 1 A 20 20 LEU HA H 20 5.283 5.230 0.053 1
1 165 . 15 1 1 A 20 20 LEU C C 20 175.935 174.955 0.980 1
1 166 . 15 1 1 A 20 20 LEU CA C 20 53.464 53.862 -0.398 1
1 167 . 15 1 1 A 20 20 LEU CB C 20 46.570 45.813 0.757 1
1 171 . 15 1 1 A 20 20 LEU N N 20 122.838 125.039 -2.201 1
1 172 . 15 1 1 A 21 21 GLN H H 21 8.391 8.558 -0.167 1
1 173 . 15 1 1 A 21 21 GLN HA H 21 3.791 4.341 -0.550 1
1 180 . 15 1 1 A 21 21 GLN C C 21 175.157 174.417 0.740 1
1 181 . 15 1 1 A 21 21 GLN CA C 21 56.094 55.009 1.085 1
1 182 . 15 1 1 A 21 21 GLN CB C 21 28.434 29.092 -0.658 1
1 184 . 15 1 1 A 21 21 GLN N N 21 129.943 127.837 2.106 1
1 186 . 15 1 1 A 22 22 GLN H H 22 8.829 8.014 0.815 1
1 187 . 15 1 1 A 22 22 GLN HA H 22 4.553 4.670 -0.117 1
1 194 . 15 1 1 A 22 22 GLN C C 22 174.998 175.806 -0.808 1
1 195 . 15 1 1 A 22 22 GLN CA C 22 54.912 53.921 0.991 1
1 196 . 15 1 1 A 22 22 GLN CB C 22 31.930 28.917 3.013 1
1 198 . 15 1 1 A 22 22 GLN N N 22 127.199 125.286 1.913 1
1 200 . 15 1 1 A 23 23 GLN HA H 23 4.142 3.996 0.146 1
1 207 . 15 1 1 A 23 23 GLN CA C 23 56.427 58.434 -2.007 1
1 208 . 15 1 1 A 23 23 GLN CB C 23 29.227 28.757 0.470 1
1 211 . 15 1 1 A 24 24 GLN HA H 24 4.523 3.947 0.576 1
1 218 . 15 1 1 A 24 24 GLN CB C 24 29.759 28.369 1.390 1
1 221 . 15 1 1 A 25 25 THR HA H 25 3.870 4.319 -0.449 1
1 226 . 15 1 1 A 25 25 THR CA C 25 65.096 61.444 3.652 1
1 227 . 15 1 1 A 25 25 THR CB C 25 68.924 70.204 -1.280 1
1 229 . 15 1 1 A 26 26 PHE HA H 26 4.690 3.955 0.735 1
1 236 . 15 1 1 A 26 26 PHE C C 26 175.523 176.805 -1.282 1
1 237 . 15 1 1 A 26 26 PHE CA C 26 57.312 60.044 -2.732 1
1 238 . 15 1 1 A 26 26 PHE CB C 26 39.003 38.824 0.179 1
1 243 . 15 1 1 A 27 27 GLY H H 27 7.755 8.991 -1.236 1
1 244 . 15 1 1 A 27 27 GLY HA2 H 27 4.172 4.006 0.166 1
1 245 . 15 1 1 A 27 27 GLY HA3 H 27 3.783 4.010 -0.227 1
1 246 . 15 1 1 A 27 27 GLY C C 27 172.557 174.998 -2.441 1
1 247 . 15 1 1 A 27 27 GLY CA C 27 44.924 45.478 -0.554 1
1 248 . 15 1 1 A 27 27 GLY N N 27 109.216 112.367 -3.151 1
1 249 . 15 1 1 A 28 28 LYS H H 28 8.241 7.783 0.458 1
1 250 . 15 1 1 A 28 28 LYS HA H 28 4.530 3.685 0.845 1
1 259 . 15 1 1 A 28 28 LYS C C 28 176.204 174.556 1.648 1
1 260 . 15 1 1 A 28 28 LYS CA C 28 55.741 57.239 -1.498 1
1 261 . 15 1 1 A 28 28 LYS CB C 28 33.904 29.534 4.370 1
1 265 . 15 1 1 A 28 28 LYS N N 28 118.743 116.525 2.218 1
1 266 . 15 1 1 A 29 29 LYS H H 29 8.356 7.624 0.732 1
1 267 . 15 1 1 A 29 29 LYS HA H 29 4.559 4.679 -0.120 1
1 274 . 15 1 1 A 29 29 LYS C C 29 175.420 174.708 0.712 1
1 275 . 15 1 1 A 29 29 LYS CA C 29 55.406 54.672 0.734 1
1 276 . 15 1 1 A 29 29 LYS CB C 29 35.618 35.802 -0.184 1
1 280 . 15 1 1 A 29 29 LYS N N 29 121.198 118.112 3.086 1
1 281 . 15 1 1 A 30 30 TRP H H 30 8.891 8.777 0.114 1
1 282 . 15 1 1 A 30 30 TRP HA H 30 4.951 4.864 0.087 1
1 291 . 15 1 1 A 30 30 TRP C C 30 175.902 176.563 -0.661 1
1 292 . 15 1 1 A 30 30 TRP CA C 30 56.677 57.535 -0.858 1
1 293 . 15 1 1 A 30 30 TRP CB C 30 30.614 30.476 0.138 1
1 299 . 15 1 1 A 30 30 TRP N N 30 123.304 124.563 -1.259 1
1 301 . 15 1 1 A 31 31 ARG H H 31 8.712 8.949 -0.237 1
1 302 . 15 1 1 A 31 31 ARG HA H 31 4.820 4.705 0.115 1
1 309 . 15 1 1 A 31 31 ARG C C 31 174.026 174.647 -0.621 1
1 310 . 15 1 1 A 31 31 ARG CA C 31 54.895 54.335 0.560 1
1 311 . 15 1 1 A 31 31 ARG CB C 31 34.045 33.079 0.966 1
1 314 . 15 1 1 A 31 31 ARG N N 31 123.973 123.055 0.918 1
1 315 . 15 1 1 A 32 32 ARG H H 32 8.820 8.625 0.195 1
1 316 . 15 1 1 A 32 32 ARG HA H 32 3.965 4.858 -0.893 1
1 323 . 15 1 1 A 32 32 ARG C C 32 174.785 174.247 0.538 1
1 324 . 15 1 1 A 32 32 ARG CA C 32 56.924 55.597 1.327 1
1 325 . 15 1 1 A 32 32 ARG CB C 32 31.806 31.563 0.243 1
1 328 . 15 1 1 A 32 32 ARG N N 32 127.041 125.075 1.966 1
1 329 . 15 1 1 A 33 33 PHE H H 33 9.372 8.577 0.795 1
1 330 . 15 1 1 A 33 33 PHE HA H 33 4.863 5.166 -0.303 1
1 338 . 15 1 1 A 33 33 PHE C C 33 176.359 175.205 1.154 1
1 339 . 15 1 1 A 33 33 PHE CA C 33 57.224 56.395 0.829 1
1 340 . 15 1 1 A 33 33 PHE CB C 33 43.385 41.634 1.751 1
1 346 . 15 1 1 A 33 33 PHE N N 33 125.882 123.676 2.206 1
1 347 . 15 1 1 A 34 34 GLY H H 34 9.160 8.751 0.409 1
1 348 . 15 1 1 A 34 34 GLY HA2 H 34 4.182 4.083 0.099 1
1 349 . 15 1 1 A 34 34 GLY HA3 H 34 3.714 4.178 -0.464 1
1 350 . 15 1 1 A 34 34 GLY C C 34 172.920 173.196 -0.276 1
1 351 . 15 1 1 A 34 34 GLY CA C 34 46.247 46.185 0.062 1
1 352 . 15 1 1 A 34 34 GLY N N 34 108.654 111.328 -2.674 1
1 353 . 15 1 1 A 35 35 ALA H H 35 8.982 8.365 0.617 1
1 354 . 15 1 1 A 35 35 ALA HA H 35 5.660 5.706 -0.046 1
1 358 . 15 1 1 A 35 35 ALA C C 35 176.547 175.703 0.844 1
1 359 . 15 1 1 A 35 35 ALA CA C 35 50.500 50.402 0.098 1
1 360 . 15 1 1 A 35 35 ALA CB C 35 24.034 21.030 3.004 1
1 361 . 15 1 1 A 35 35 ALA N N 35 130.076 128.064 2.012 1
1 362 . 15 1 1 A 36 36 SER H H 36 8.852 8.617 0.235 1
1 363 . 15 1 1 A 36 36 SER HA H 36 5.203 5.239 -0.036 1
1 366 . 15 1 1 A 36 36 SER C C 36 170.939 172.168 -1.229 1
1 367 . 15 1 1 A 36 36 SER CA C 36 57.806 56.318 1.488 1
1 368 . 15 1 1 A 36 36 SER CB C 36 66.986 64.990 1.996 1
1 369 . 15 1 1 A 36 36 SER N N 36 116.620 116.899 -0.279 1
1 370 . 15 1 1 A 37 37 LEU H H 37 8.862 8.556 0.306 1
1 371 . 15 1 1 A 37 37 LEU HA H 37 5.163 5.019 0.144 1
1 381 . 15 1 1 A 37 37 LEU C C 37 173.525 174.149 -0.624 1
1 382 . 15 1 1 A 37 37 LEU CA C 37 53.112 53.201 -0.089 1
1 383 . 15 1 1 A 37 37 LEU CB C 37 46.077 44.059 2.018 1
1 387 . 15 1 1 A 37 37 LEU N N 37 127.638 128.351 -0.713 1
1 388 . 15 1 1 A 38 38 TYR H H 38 9.280 8.426 0.854 1
1 389 . 15 1 1 A 38 38 TYR HA H 38 4.820 5.284 -0.464 1
1 396 . 15 1 1 A 38 38 TYR C C 38 175.430 175.145 0.285 1
1 397 . 15 1 1 A 38 38 TYR CA C 38 57.436 56.369 1.067 1
1 398 . 15 1 1 A 38 38 TYR CB C 38 42.128 41.259 0.869 1
1 403 . 15 1 1 A 38 38 TYR N N 38 125.215 127.033 -1.818 1
1 404 . 15 1 1 A 39 39 GLY H H 39 8.532 8.529 0.003 1
1 405 . 15 1 1 A 39 39 GLY HA2 H 39 4.220 4.182 0.038 1
1 406 . 15 1 1 A 39 39 GLY HA3 H 39 3.941 4.184 -0.243 1
1 407 . 15 1 1 A 39 39 GLY C C 39 172.950 174.351 -1.401 1
1 408 . 15 1 1 A 39 39 GLY CA C 39 44.817 44.225 0.592 1
1 409 . 15 1 1 A 39 39 GLY N N 39 106.424 110.374 -3.950 1
1 410 . 15 1 1 A 40 40 GLY H H 40 8.477 8.702 -0.225 1
1 411 . 15 1 1 A 40 40 GLY HA2 H 40 4.102 3.879 0.223 1
1 412 . 15 1 1 A 40 40 GLY HA3 H 40 3.927 3.884 0.043 1
1 413 . 15 1 1 A 40 40 GLY C C 40 174.002 173.595 0.407 1
1 414 . 15 1 1 A 40 40 GLY CA C 40 44.694 46.861 -2.167 1
1 415 . 15 1 1 A 40 40 GLY N N 40 106.881 108.354 -1.473 1
1 416 . 15 1 1 A 41 41 SER H H 41 8.600 7.790 0.810 1
1 417 . 15 1 1 A 41 41 SER HA H 41 4.520 4.838 -0.318 1
1 420 . 15 1 1 A 41 41 SER C C 41 174.355 173.712 0.643 1
1 421 . 15 1 1 A 41 41 SER CA C 41 58.565 56.525 2.040 1
1 422 . 15 1 1 A 41 41 SER CB C 41 64.413 65.443 -1.030 1
1 423 . 15 1 1 A 41 41 SER N N 41 115.751 114.643 1.108 1
1 424 . 15 1 1 A 42 42 ASP H H 42 8.533 8.452 0.081 1
1 425 . 15 1 1 A 42 42 ASP HA H 42 4.560 4.376 0.184 1
1 428 . 15 1 1 A 42 42 ASP CA C 42 55.230 57.923 -2.693 1
1 429 . 15 1 1 A 42 42 ASP CB C 42 40.648 41.096 -0.448 1
1 430 . 15 1 1 A 42 42 ASP N N 42 119.037 123.256 -4.219 1
1 431 . 15 1 1 A 43 43 CYS H H 43 8.152 7.759 0.393 1
1 432 . 15 1 1 A 43 43 CYS HA H 43 4.541 5.097 -0.556 1
1 435 . 15 1 1 A 43 43 CYS C C 43 173.975 173.482 0.493 1
1 436 . 15 1 1 A 43 43 CYS CA C 43 58.265 57.831 0.434 1
1 437 . 15 1 1 A 43 43 CYS CB C 43 28.393 29.187 -0.794 1
1 438 . 15 1 1 A 43 43 CYS N N 43 116.881 116.569 0.312 1
1 439 . 15 1 1 A 44 44 ALA H H 44 8.047 8.764 -0.717 1
1 440 . 15 1 1 A 44 44 ALA HA H 44 4.395 4.852 -0.457 1
1 444 . 15 1 1 A 44 44 ALA C C 44 176.472 175.692 0.780 1
1 445 . 15 1 1 A 44 44 ALA CA C 44 52.688 51.733 0.955 1
1 446 . 15 1 1 A 44 44 ALA CB C 44 20.579 23.399 -2.820 1
1 447 . 15 1 1 A 44 44 ALA N N 44 125.989 126.569 -0.580 1
1 448 . 15 1 1 A 45 45 LEU H H 45 8.052 8.828 -0.776 1
1 449 . 15 1 1 A 45 45 LEU HA H 45 4.452 4.826 -0.374 1
1 459 . 15 1 1 A 45 45 LEU C C 45 176.196 176.589 -0.393 1
1 460 . 15 1 1 A 45 45 LEU CA C 45 53.771 53.853 -0.082 1
1 461 . 15 1 1 A 45 45 LEU CB C 45 43.116 41.665 1.451 1
1 465 . 15 1 1 A 45 45 LEU N N 45 119.889 121.089 -1.200 1
1 466 . 15 1 1 A 46 46 ALA H H 46 8.381 8.498 -0.117 1
1 467 . 15 1 1 A 46 46 ALA HA H 46 4.449 4.675 -0.226 1
1 471 . 15 1 1 A 46 46 ALA C C 46 179.093 177.487 1.606 1
1 472 . 15 1 1 A 46 46 ALA CA C 46 52.829 53.304 -0.475 1
1 473 . 15 1 1 A 46 46 ALA CB C 46 18.687 19.165 -0.478 1
1 474 . 15 1 1 A 46 46 ALA N N 46 125.635 127.276 -1.641 1
1 475 . 15 1 1 A 47 47 ARG H H 47 9.012 8.780 0.232 1
1 476 . 15 1 1 A 47 47 ARG HA H 47 5.192 5.168 0.024 1
1 484 . 15 1 1 A 47 47 ARG C C 47 171.524 174.004 -2.480 1
1 485 . 15 1 1 A 47 47 ARG CA C 47 55.265 54.701 0.564 1
1 486 . 15 1 1 A 47 47 ARG CB C 47 30.970 34.023 -3.053 1
1 489 . 15 1 1 A 47 47 ARG N N 47 120.048 120.603 -0.555 1
1 491 . 15 1 1 A 48 48 LEU H H 48 9.029 8.929 0.100 1
1 492 . 15 1 1 A 48 48 LEU HA H 48 5.221 5.072 0.149 1
1 502 . 15 1 1 A 48 48 LEU C C 48 174.348 176.112 -1.764 1
1 503 . 15 1 1 A 48 48 LEU CA C 48 53.253 53.904 -0.651 1
1 504 . 15 1 1 A 48 48 LEU CB C 48 45.419 44.346 1.073 1
1 508 . 15 1 1 A 48 48 LEU N N 48 123.315 124.601 -1.286 1
1 509 . 15 1 1 A 49 49 GLU H H 49 9.473 8.403 1.070 1
1 510 . 15 1 1 A 49 49 GLU HA H 49 5.222 4.926 0.296 1
1 515 . 15 1 1 A 49 49 GLU C C 49 175.507 175.564 -0.057 1
1 516 . 15 1 1 A 49 49 GLU CA C 49 55.159 55.684 -0.525 1
1 517 . 15 1 1 A 49 49 GLU CB C 49 32.341 31.521 0.820 1
1 519 . 15 1 1 A 49 49 GLU N N 49 124.751 126.439 -1.688 1
1 520 . 15 1 1 A 50 50 LEU H H 50 9.088 8.581 0.507 1
1 521 . 15 1 1 A 50 50 LEU HA H 50 5.382 5.159 0.223 1
1 531 . 15 1 1 A 50 50 LEU C C 50 175.474 175.681 -0.207 1
1 532 . 15 1 1 A 50 50 LEU CA C 50 52.865 53.389 -0.524 1
1 533 . 15 1 1 A 50 50 LEU CB C 50 43.239 45.806 -2.567 1
1 537 . 15 1 1 A 50 50 LEU N N 50 124.221 122.111 2.110 1
1 538 . 15 1 1 A 51 51 GLN H H 51 9.602 8.730 0.872 1
1 539 . 15 1 1 A 51 51 GLN HA H 51 5.095 5.334 -0.239 1
1 546 . 15 1 1 A 51 51 GLN C C 51 175.306 175.111 0.195 1
1 547 . 15 1 1 A 51 51 GLN CA C 51 54.576 54.277 0.299 1
1 548 . 15 1 1 A 51 51 GLN CB C 51 32.177 32.496 -0.319 1
1 550 . 15 1 1 A 51 51 GLN N N 51 123.268 121.354 1.914 1
1 552 . 15 1 1 A 52 52 GLU H H 52 9.172 9.186 -0.014 1
1 553 . 15 1 1 A 52 52 GLU HA H 52 4.092 5.513 -1.421 1
1 558 . 15 1 1 A 52 52 GLU C C 52 176.523 175.487 1.036 1
1 559 . 15 1 1 A 52 52 GLU CA C 52 57.500 54.786 2.714 1
1 560 . 15 1 1 A 52 52 GLU CB C 52 30.696 34.306 -3.610 1
1 562 . 15 1 1 A 52 52 GLU N N 52 128.982 119.662 9.320 1
1 563 . 15 1 1 A 53 53 GLY H H 53 8.644 8.487 0.157 1
1 564 . 15 1 1 A 53 53 GLY HA2 H 53 4.261 4.352 -0.091 1
1 565 . 15 1 1 A 53 53 GLY HA3 H 53 3.993 4.362 -0.369 1
1 566 . 15 1 1 A 53 53 GLY C C 53 172.550 171.805 0.745 1
1 567 . 15 1 1 A 53 53 GLY CA C 53 45.911 45.873 0.038 1
1 568 . 15 1 1 A 53 53 GLY N N 53 110.844 106.984 3.860 1
1 569 . 15 1 1 A 54 54 PRO HA H 54 4.392 4.654 -0.262 1
1 576 . 15 1 1 A 54 54 PRO C C 54 176.828 176.510 0.318 1
1 577 . 15 1 1 A 54 54 PRO CA C 54 63.665 62.507 1.158 1
1 578 . 15 1 1 A 54 54 PRO CB C 54 32.012 33.276 -1.264 1
1 581 . 15 1 1 A 55 55 GLU H H 55 8.934 9.025 -0.091 1
1 582 . 15 1 1 A 55 55 GLU HA H 55 4.193 4.153 0.040 1
1 587 . 15 1 1 A 55 55 GLU C C 55 176.189 177.117 -0.928 1
1 588 . 15 1 1 A 55 55 GLU CA C 55 57.383 59.764 -2.381 1
1 589 . 15 1 1 A 55 55 GLU CB C 55 28.945 30.735 -1.790 1
1 591 . 15 1 1 A 55 55 GLU N N 55 120.312 119.660 0.652 1
1 592 . 15 1 1 A 56 56 LYS H H 56 7.937 7.859 0.078 1
1 593 . 15 1 1 A 56 56 LYS HA H 56 4.578 4.572 0.006 1
1 602 . 15 1 1 A 56 56 LYS C C 56 174.295 174.354 -0.059 1
1 603 . 15 1 1 A 56 56 LYS CA C 56 54.171 53.442 0.729 1
1 604 . 15 1 1 A 56 56 LYS CB C 56 32.555 32.670 -0.115 1
1 608 . 15 1 1 A 56 56 LYS N N 56 122.008 118.735 3.273 1
1 609 . 15 1 1 A 57 57 PRO HA H 57 4.370 4.621 -0.251 1
1 616 . 15 1 1 A 57 57 PRO CA C 57 63.431 62.918 0.513 1
1 617 . 15 1 1 A 57 57 PRO CB C 57 32.072 31.909 0.163 1
1 620 . 15 1 1 A 58 58 ARG H H 58 8.310 8.575 -0.265 1
1 621 . 15 1 1 A 58 58 ARG HA H 58 4.295 4.219 0.076 1
1 628 . 15 1 1 A 58 58 ARG CA C 58 56.570 56.480 0.090 1
1 629 . 15 1 1 A 58 58 ARG CB C 58 30.860 31.676 -0.816 1
1 632 . 15 1 1 A 58 58 ARG N N 58 120.045 122.524 -2.479 1
1 633 . 15 1 1 A 60 60 CYS HA H 60 4.482 4.810 -0.328 1
1 636 . 15 1 1 A 60 60 CYS CA C 60 58.621 57.862 0.759 1
1 637 . 15 1 1 A 60 60 CYS CB C 60 28.267 29.222 -0.955 1
1 638 . 15 1 1 A 61 61 GLU HA H 61 4.226 4.378 -0.152 1
1 643 . 15 1 1 A 61 61 GLU C C 61 176.299 176.730 -0.431 1
1 644 . 15 1 1 A 61 61 GLU CA C 61 57.100 57.124 -0.024 1
1 645 . 15 1 1 A 61 61 GLU CB C 61 29.873 30.063 -0.190 1
1 647 . 15 1 1 A 62 62 ALA H H 62 8.282 7.781 0.501 1
1 648 . 15 1 1 A 62 62 ALA HA H 62 4.302 4.559 -0.257 1
1 652 . 15 1 1 A 62 62 ALA C C 62 177.277 177.345 -0.068 1
1 653 . 15 1 1 A 62 62 ALA CA C 62 52.512 51.096 1.416 1
1 654 . 15 1 1 A 62 62 ALA CB C 62 19.592 19.109 0.483 1
1 655 . 15 1 1 A 62 62 ALA N N 62 124.386 122.881 1.505 1
1 656 . 15 1 1 A 63 63 ALA H H 63 8.399 7.533 0.866 1
1 657 . 15 1 1 A 63 63 ALA HA H 63 4.375 4.289 0.086 1
1 661 . 15 1 1 A 63 63 ALA C C 63 176.843 175.893 0.950 1
1 662 . 15 1 1 A 63 63 ALA CA C 63 52.658 51.714 0.944 1
1 663 . 15 1 1 A 63 63 ALA CB C 63 19.592 17.375 2.217 1
1 664 . 15 1 1 A 63 63 ALA N N 63 123.892 122.166 1.726 1
1 665 . 15 1 1 A 64 64 ARG H H 64 8.152 8.662 -0.510 1
1 666 . 15 1 1 A 64 64 ARG HA H 64 5.008 4.868 0.140 1
1 673 . 15 1 1 A 64 64 ARG C C 64 175.594 174.923 0.671 1
1 674 . 15 1 1 A 64 64 ARG CA C 64 55.282 55.055 0.227 1
1 675 . 15 1 1 A 64 64 ARG CB C 64 32.506 33.321 -0.815 1
1 678 . 15 1 1 A 64 64 ARG N N 64 119.787 120.136 -0.349 1
1 679 . 15 1 1 A 65 65 LYS H H 65 8.945 8.883 0.062 1
1 680 . 15 1 1 A 65 65 LYS HA H 65 4.602 4.820 -0.218 1
1 689 . 15 1 1 A 65 65 LYS C C 65 174.657 174.377 0.280 1
1 690 . 15 1 1 A 65 65 LYS CA C 65 54.948 54.933 0.015 1
1 691 . 15 1 1 A 65 65 LYS CB C 65 34.068 33.790 0.278 1
1 695 . 15 1 1 A 65 65 LYS N N 65 124.171 123.497 0.674 1
1 696 . 15 1 1 A 66 66 VAL H H 66 8.672 8.903 -0.231 1
1 697 . 15 1 1 A 66 66 VAL HA H 66 4.532 5.085 -0.553 1
1 705 . 15 1 1 A 66 66 VAL C C 66 175.078 173.901 1.177 1
1 706 . 15 1 1 A 66 66 VAL CA C 66 61.865 60.250 1.615 1
1 707 . 15 1 1 A 66 66 VAL CB C 66 33.835 34.107 -0.272 1
1 710 . 15 1 1 A 66 66 VAL N N 66 124.380 124.653 -0.273 1
1 711 . 15 1 1 A 67 67 ILE H H 67 9.071 9.438 -0.367 1
1 712 . 15 1 1 A 67 67 ILE HA H 67 4.142 4.676 -0.534 1
1 722 . 15 1 1 A 67 67 ILE C C 67 175.819 175.739 0.080 1
1 723 . 15 1 1 A 67 67 ILE CA C 67 60.383 59.962 0.421 1
1 724 . 15 1 1 A 67 67 ILE CB C 67 39.908 38.558 1.350 1
1 728 . 15 1 1 A 67 67 ILE N N 67 129.537 130.180 -0.643 1
1 729 . 15 1 1 A 68 68 ARG H H 68 9.203 8.756 0.447 1
1 730 . 15 1 1 A 68 68 ARG HA H 68 4.198 4.306 -0.108 1
1 737 . 15 1 1 A 68 68 ARG C C 68 177.769 177.303 0.466 1
1 738 . 15 1 1 A 68 68 ARG CA C 68 56.835 56.699 0.136 1
1 739 . 15 1 1 A 68 68 ARG CB C 68 29.832 30.490 -0.658 1
1 742 . 15 1 1 A 68 68 ARG N N 68 128.484 128.491 -0.007 1
1 743 . 15 1 1 A 69 69 LEU H H 69 8.212 8.667 -0.455 1
1 744 . 15 1 1 A 69 69 LEU HA H 69 4.221 4.228 -0.007 1
1 754 . 15 1 1 A 69 69 LEU C C 69 178.996 178.526 0.470 1
1 755 . 15 1 1 A 69 69 LEU CA C 69 57.136 57.103 0.033 1
1 756 . 15 1 1 A 69 69 LEU CB C 69 39.455 41.840 -2.385 1
1 760 . 15 1 1 A 69 69 LEU N N 69 123.807 124.480 -0.673 1
1 761 . 15 1 1 A 70 70 SER H H 70 8.823 8.314 0.509 1
1 762 . 15 1 1 A 70 70 SER HA H 70 4.331 4.319 0.012 1
1 765 . 15 1 1 A 70 70 SER C C 70 175.076 175.842 -0.766 1
1 766 . 15 1 1 A 70 70 SER CA C 70 60.329 61.012 -0.683 1
1 767 . 15 1 1 A 70 70 SER CB C 70 62.362 63.403 -1.041 1
1 768 . 15 1 1 A 70 70 SER N N 70 115.162 116.021 -0.859 1
1 769 . 15 1 1 A 71 71 ASP H H 71 7.602 8.021 -0.419 1
1 770 . 15 1 1 A 71 71 ASP HA H 71 4.820 4.524 0.296 1
1 773 . 15 1 1 A 71 71 ASP C C 71 176.478 176.868 -0.390 1
1 774 . 15 1 1 A 71 71 ASP CA C 71 54.241 55.805 -1.564 1
1 775 . 15 1 1 A 71 71 ASP CB C 71 41.347 41.124 0.223 1
1 776 . 15 1 1 A 71 71 ASP N N 71 119.590 119.076 0.514 1
1 777 . 15 1 1 A 72 72 CYS H H 72 7.715 7.364 0.351 1
1 778 . 15 1 1 A 72 72 CYS HA H 72 4.372 4.649 -0.277 1
1 781 . 15 1 1 A 72 72 CYS C C 72 173.690 174.297 -0.607 1
1 782 . 15 1 1 A 72 72 CYS CA C 72 60.836 58.943 1.893 1
1 783 . 15 1 1 A 72 72 CYS CB C 72 27.655 27.601 0.054 1
1 784 . 15 1 1 A 72 72 CYS N N 72 118.346 118.386 -0.040 1
1 785 . 15 1 1 A 73 73 LEU H H 73 9.472 9.138 0.334 1
1 786 . 15 1 1 A 73 73 LEU HA H 73 4.593 4.194 0.399 1
1 796 . 15 1 1 A 73 73 LEU C C 73 177.562 176.476 1.086 1
1 797 . 15 1 1 A 73 73 LEU CA C 73 55.724 56.265 -0.541 1
1 798 . 15 1 1 A 73 73 LEU CB C 73 43.774 42.569 1.205 1
1 802 . 15 1 1 A 73 73 LEU N N 73 124.752 128.555 -3.803 1
1 803 . 15 1 1 A 74 74 ARG H H 74 7.658 7.116 0.542 1
1 804 . 15 1 1 A 74 74 ARG HA H 74 4.592 4.898 -0.306 1
1 811 . 15 1 1 A 74 74 ARG C C 74 173.605 174.286 -0.681 1
1 812 . 15 1 1 A 74 74 ARG CA C 74 56.465 55.972 0.493 1
1 813 . 15 1 1 A 74 74 ARG CB C 74 34.068 34.070 -0.002 1
1 816 . 15 1 1 A 74 74 ARG N N 74 115.565 116.425 -0.860 1
1 817 . 15 1 1 A 75 75 VAL H H 75 8.622 8.985 -0.363 1
1 818 . 15 1 1 A 75 75 VAL HA H 75 5.170 5.289 -0.119 1
1 826 . 15 1 1 A 75 75 VAL C C 75 173.985 174.369 -0.384 1
1 827 . 15 1 1 A 75 75 VAL CA C 75 60.930 59.396 1.534 1
1 828 . 15 1 1 A 75 75 VAL CB C 75 35.073 36.433 -1.360 1
1 831 . 15 1 1 A 75 75 VAL N N 75 124.278 119.222 5.056 1
1 832 . 15 1 1 A 76 76 ALA H H 76 8.272 8.918 -0.646 1
1 833 . 15 1 1 A 76 76 ALA HA H 76 4.648 4.960 -0.312 1
1 837 . 15 1 1 A 76 76 ALA C C 76 175.630 175.525 0.105 1
1 838 . 15 1 1 A 76 76 ALA CA C 76 51.294 51.377 -0.083 1
1 839 . 15 1 1 A 76 76 ALA CB C 76 22.759 23.792 -1.033 1
1 840 . 15 1 1 A 76 76 ALA N N 76 126.015 123.755 2.260 1
1 841 . 15 1 1 A 77 77 GLU H H 77 9.184 8.666 0.518 1
1 842 . 15 1 1 A 77 77 GLU HA H 77 4.060 5.311 -1.251 1
1 847 . 15 1 1 A 77 77 GLU C C 77 174.949 175.895 -0.946 1
1 848 . 15 1 1 A 77 77 GLU CA C 77 58.424 54.979 3.445 1
1 849 . 15 1 1 A 77 77 GLU CB C 77 30.161 32.018 -1.857 1
1 851 . 15 1 1 A 77 77 GLU N N 77 120.223 118.390 1.833 1
1 852 . 15 1 1 A 78 78 ALA H H 78 7.985 9.345 -1.360 1
1 853 . 15 1 1 A 78 78 ALA HA H 78 4.776 5.381 -0.605 1
1 857 . 15 1 1 A 78 78 ALA C C 78 177.250 177.155 0.095 1
1 858 . 15 1 1 A 78 78 ALA CA C 78 50.888 51.118 -0.230 1
1 859 . 15 1 1 A 78 78 ALA CB C 78 20.851 21.847 -0.996 1
1 860 . 15 1 1 A 78 78 ALA N N 78 125.143 128.136 -2.993 1
1 861 . 15 1 1 A 79 79 GLY H H 79 8.604 8.322 0.282 1
1 862 . 15 1 1 A 79 79 GLY HA2 H 79 4.327 4.276 0.051 1
1 863 . 15 1 1 A 79 79 GLY HA3 H 79 3.963 4.286 -0.323 1
1 864 . 15 1 1 A 79 79 GLY C C 79 175.360 174.416 0.944 1
1 865 . 15 1 1 A 79 79 GLY CA C 79 44.925 46.169 -1.244 1
1 866 . 15 1 1 A 79 79 GLY N N 79 109.420 105.463 3.957 1
1 867 . 15 1 1 A 80 80 GLY H H 80 8.649 8.703 -0.054 1
1 868 . 15 1 1 A 80 80 GLY HA2 H 80 3.962 3.878 0.084 1
1 869 . 15 1 1 A 80 80 GLY HA3 H 80 3.962 3.882 0.080 1
1 870 . 15 1 1 A 80 80 GLY C C 80 175.052 174.691 0.361 1
1 871 . 15 1 1 A 80 80 GLY CA C 80 45.955 47.354 -1.399 1
1 872 . 15 1 1 A 80 80 GLY N N 80 108.295 111.945 -3.650 1
1 873 . 15 1 1 A 81 81 GLU H H 81 8.921 8.331 0.590 1
1 874 . 15 1 1 A 81 81 GLU HA H 81 4.298 4.331 -0.033 1
1 879 . 15 1 1 A 81 81 GLU C C 81 176.532 175.783 0.749 1
1 880 . 15 1 1 A 81 81 GLU CA C 81 57.118 56.477 0.641 1
1 881 . 15 1 1 A 81 81 GLU CB C 81 28.599 28.842 -0.243 1
1 883 . 15 1 1 A 81 81 GLU N N 81 121.170 116.771 4.399 1
1 884 . 15 1 1 A 82 82 ALA H H 82 8.032 8.073 -0.041 1
1 885 . 15 1 1 A 82 82 ALA HA H 82 4.371 4.625 -0.254 1
1 889 . 15 1 1 A 82 82 ALA C C 82 177.160 177.081 0.079 1
1 890 . 15 1 1 A 82 82 ALA CA C 82 52.653 51.467 1.186 1
1 891 . 15 1 1 A 82 82 ALA CB C 82 19.304 22.281 -2.977 1
1 892 . 15 1 1 A 82 82 ALA N N 82 124.988 121.899 3.089 1
1 893 . 15 1 1 A 83 83 SER H H 83 8.319 8.930 -0.611 1
1 894 . 15 1 1 A 83 83 SER HA H 83 4.331 4.453 -0.122 1
1 897 . 15 1 1 A 83 83 SER C C 83 174.045 175.604 -1.559 1
1 898 . 15 1 1 A 83 83 SER CA C 83 58.053 61.565 -3.512 1
1 899 . 15 1 1 A 83 83 SER CB C 83 63.184 63.380 -0.196 1
1 900 . 15 1 1 A 83 83 SER N N 83 114.181 116.098 -1.917 1
1 901 . 15 1 1 A 84 84 SER H H 84 7.823 7.889 -0.066 1
1 902 . 15 1 1 A 84 84 SER HA H 84 3.194 4.179 -0.985 1
1 905 . 15 1 1 A 84 84 SER C C 84 171.072 172.926 -1.854 1
1 906 . 15 1 1 A 84 84 SER CA C 84 57.206 57.905 -0.699 1
1 907 . 15 1 1 A 84 84 SER CB C 84 61.622 63.380 -1.758 1
1 908 . 15 1 1 A 84 84 SER N N 84 117.302 118.780 -1.478 1
1 909 . 15 1 1 A 85 85 PRO HA H 85 3.922 4.568 -0.646 1
1 916 . 15 1 1 A 85 85 PRO CA C 85 62.691 62.177 0.514 1
1 917 . 15 1 1 A 85 85 PRO CB C 85 31.515 32.867 -1.352 1
1 920 . 15 1 1 A 86 86 ARG HA H 86 3.882 4.201 -0.319 1
1 927 . 15 1 1 A 86 86 ARG C C 86 175.712 176.501 -0.789 1
1 928 . 15 1 1 A 86 86 ARG CA C 86 57.877 56.428 1.449 1
1 929 . 15 1 1 A 86 86 ARG CB C 86 29.791 30.907 -1.116 1
1 932 . 15 1 1 A 87 87 ASP H H 87 8.903 9.086 -0.183 1
1 933 . 15 1 1 A 87 87 ASP HA H 87 4.342 4.240 0.102 1
1 936 . 15 1 1 A 87 87 ASP C C 87 175.723 174.883 0.840 1
1 937 . 15 1 1 A 87 87 ASP CA C 87 56.377 55.387 0.990 1
1 938 . 15 1 1 A 87 87 ASP CB C 87 39.208 40.164 -0.956 1
1 939 . 15 1 1 A 87 87 ASP N N 87 117.520 125.509 -7.989 1
1 940 . 15 1 1 A 88 88 THR H H 88 7.776 7.436 0.340 1
1 941 . 15 1 1 A 88 88 THR HA H 88 5.101 5.188 -0.087 1
1 946 . 15 1 1 A 88 88 THR C C 88 173.825 173.088 0.737 1
1 947 . 15 1 1 A 88 88 THR CA C 88 60.154 59.675 0.479 1
1 948 . 15 1 1 A 88 88 THR CB C 88 72.702 72.938 -0.236 1
1 950 . 15 1 1 A 88 88 THR N N 88 108.770 108.885 -0.115 1
1 951 . 15 1 1 A 89 89 SER H H 89 9.006 8.742 0.264 1
1 952 . 15 1 1 A 89 89 SER HA H 89 4.718 5.049 -0.331 1
1 955 . 15 1 1 A 89 89 SER C C 89 173.728 172.972 0.756 1
1 956 . 15 1 1 A 89 89 SER CA C 89 57.453 56.978 0.475 1
1 957 . 15 1 1 A 89 89 SER CB C 89 65.611 65.910 -0.299 1
1 958 . 15 1 1 A 89 89 SER N N 89 114.151 115.854 -1.703 1
1 959 . 15 1 1 A 90 90 ALA H H 90 9.001 8.787 0.214 1
1 960 . 15 1 1 A 90 90 ALA HA H 90 5.660 5.196 0.464 1
1 964 . 15 1 1 A 90 90 ALA C C 90 177.669 177.288 0.381 1
1 965 . 15 1 1 A 90 90 ALA CA C 90 51.670 50.711 0.959 1
1 966 . 15 1 1 A 90 90 ALA CB C 90 22.265 21.390 0.875 1
1 967 . 15 1 1 A 90 90 ALA N N 90 126.177 126.973 -0.796 1
1 968 . 15 1 1 A 91 91 PHE H H 91 9.672 8.428 1.244 1
1 969 . 15 1 1 A 91 91 PHE HA H 91 5.039 5.797 -0.758 1
1 977 . 15 1 1 A 91 91 PHE C C 91 170.731 173.769 -3.038 1
1 978 . 15 1 1 A 91 91 PHE CA C 91 56.271 55.146 1.125 1
1 979 . 15 1 1 A 91 91 PHE CB C 91 41.553 42.469 -0.916 1
1 985 . 15 1 1 A 91 91 PHE N N 91 118.968 116.438 2.530 1
1 986 . 15 1 1 A 92 92 PHE H H 92 9.422 9.661 -0.239 1
1 987 . 15 1 1 A 92 92 PHE HA H 92 5.674 5.076 0.598 1
1 995 . 15 1 1 A 92 92 PHE C C 92 174.570 175.274 -0.704 1
1 996 . 15 1 1 A 92 92 PHE CA C 92 55.917 57.448 -1.531 1
1 997 . 15 1 1 A 92 92 PHE CB C 92 42.787 41.303 1.484 1
1 1003 . 15 1 1 A 92 92 PHE N N 92 117.543 118.610 -1.067 1
1 1004 . 15 1 1 A 93 93 LEU H H 93 9.021 8.424 0.597 1
1 1005 . 15 1 1 A 93 93 LEU HA H 93 5.122 5.055 0.067 1
1 1015 . 15 1 1 A 93 93 LEU C C 93 174.799 174.216 0.583 1
1 1016 . 15 1 1 A 93 93 LEU CA C 93 54.912 54.656 0.256 1
1 1017 . 15 1 1 A 93 93 LEU CB C 93 45.254 44.937 0.317 1
1 1021 . 15 1 1 A 93 93 LEU N N 93 121.719 122.816 -1.097 1
1 1022 . 15 1 1 A 94 94 GLU H H 94 9.294 9.478 -0.184 1
1 1023 . 15 1 1 A 94 94 GLU HA H 94 5.043 5.249 -0.206 1
1 1028 . 15 1 1 A 94 94 GLU C C 94 175.754 175.538 0.216 1
1 1029 . 15 1 1 A 94 94 GLU CA C 94 56.018 55.010 1.008 1
1 1030 . 15 1 1 A 94 94 GLU CB C 94 32.752 32.556 0.196 1
1 1032 . 15 1 1 A 94 94 GLU N N 94 127.032 128.649 -1.617 1
1 1033 . 15 1 1 A 95 95 THR H H 95 8.822 8.500 0.322 1
1 1034 . 15 1 1 A 95 95 THR HA H 95 5.398 5.123 0.275 1
1 1039 . 15 1 1 A 95 95 THR C C 95 173.860 175.465 -1.605 1
1 1040 . 15 1 1 A 95 95 THR CA C 95 59.588 59.476 0.112 1
1 1041 . 15 1 1 A 95 95 THR CB C 95 72.191 72.458 -0.267 1
1 1043 . 15 1 1 A 95 95 THR N N 95 118.685 117.005 1.680 1
1 1044 . 15 1 1 A 96 96 LYS H H 96 8.823 9.213 -0.390 1
1 1045 . 15 1 1 A 96 96 LYS HA H 96 4.022 3.959 0.063 1
1 1054 . 15 1 1 A 96 96 LYS C C 96 177.330 178.818 -1.488 1
1 1055 . 15 1 1 A 96 96 LYS CA C 96 59.588 59.745 -0.157 1
1 1056 . 15 1 1 A 96 96 LYS CB C 96 32.588 32.071 0.517 1
1 1060 . 15 1 1 A 96 96 LYS N N 96 118.801 121.312 -2.511 1
1 1061 . 15 1 1 A 97 97 GLU H H 97 8.092 7.773 0.319 1
1 1062 . 15 1 1 A 97 97 GLU HA H 97 4.282 4.213 0.069 1
1 1067 . 15 1 1 A 97 97 GLU C C 97 176.290 176.188 0.102 1
1 1068 . 15 1 1 A 97 97 GLU CA C 97 57.365 58.816 -1.451 1
1 1069 . 15 1 1 A 97 97 GLU CB C 97 31.559 30.799 0.760 1
1 1071 . 15 1 1 A 97 97 GLU N N 97 113.992 118.952 -4.960 1
1 1072 . 15 1 1 A 98 98 ARG H H 98 7.482 7.150 0.332 1
1 1073 . 15 1 1 A 98 98 ARG HA H 98 4.397 4.582 -0.185 1
1 1080 . 15 1 1 A 98 98 ARG C C 98 172.792 173.207 -0.415 1
1 1081 . 15 1 1 A 98 98 ARG CA C 98 55.689 54.451 1.238 1
1 1082 . 15 1 1 A 98 98 ARG CB C 98 32.711 31.826 0.885 1
1 1085 . 15 1 1 A 98 98 ARG N N 98 116.022 114.712 1.310 1
1 1086 . 15 1 1 A 99 99 LEU H H 99 8.423 8.162 0.261 1
1 1087 . 15 1 1 A 99 99 LEU HA H 99 4.807 4.716 0.091 1
1 1097 . 15 1 1 A 99 99 LEU C C 99 175.903 174.086 1.817 1
1 1098 . 15 1 1 A 99 99 LEU CA C 99 54.383 53.987 0.396 1
1 1099 . 15 1 1 A 99 99 LEU CB C 99 43.362 44.106 -0.744 1
1 1103 . 15 1 1 A 99 99 LEU N N 99 124.983 121.754 3.229 1
1 1104 . 15 1 1 A 100 100 TYR H H 100 9.144 9.701 -0.557 1
1 1105 . 15 1 1 A 100 100 TYR HA H 100 4.542 5.255 -0.713 1
1 1112 . 15 1 1 A 100 100 TYR C C 100 173.479 174.238 -0.759 1
1 1113 . 15 1 1 A 100 100 TYR CA C 100 57.735 56.135 1.600 1
1 1114 . 15 1 1 A 100 100 TYR CB C 100 39.291 41.585 -2.294 1
1 1119 . 15 1 1 A 100 100 TYR N N 100 126.679 126.285 0.394 1
1 1120 . 15 1 1 A 101 101 LEU H H 101 9.043 8.824 0.219 1
1 1121 . 15 1 1 A 101 101 LEU HA H 101 4.747 4.874 -0.127 1
1 1131 . 15 1 1 A 101 101 LEU C C 101 173.530 175.056 -1.526 1
1 1132 . 15 1 1 A 101 101 LEU CA C 101 54.524 53.574 0.950 1
1 1133 . 15 1 1 A 101 101 LEU CB C 101 42.499 43.722 -1.223 1
1 1137 . 15 1 1 A 101 101 LEU N N 101 127.422 125.236 2.186 1
1 1138 . 15 1 1 A 102 102 LEU H H 102 8.493 8.503 -0.010 1
1 1139 . 15 1 1 A 102 102 LEU HA H 102 5.612 5.389 0.223 1
1 1149 . 15 1 1 A 102 102 LEU C C 102 175.794 176.186 -0.392 1
1 1150 . 15 1 1 A 102 102 LEU CA C 102 53.076 53.276 -0.200 1
1 1151 . 15 1 1 A 102 102 LEU CB C 102 45.994 44.262 1.732 1
1 1155 . 15 1 1 A 102 102 LEU N N 102 126.021 128.799 -2.778 1
1 1156 . 15 1 1 A 103 103 ALA H H 103 9.073 8.819 0.254 1
1 1157 . 15 1 1 A 103 103 ALA HA H 103 5.081 5.309 -0.228 1
1 1161 . 15 1 1 A 103 103 ALA C C 103 175.133 176.032 -0.899 1
1 1162 . 15 1 1 A 103 103 ALA CA C 103 51.688 49.749 1.939 1
1 1163 . 15 1 1 A 103 103 ALA CB C 103 21.689 22.078 -0.389 1
1 1164 . 15 1 1 A 103 103 ALA N N 103 117.679 122.920 -5.241 1
1 1165 . 15 1 1 A 104 104 ALA H H 104 8.582 8.715 -0.133 1
1 1166 . 15 1 1 A 104 104 ALA HA H 104 5.220 4.916 0.304 1
1 1170 . 15 1 1 A 104 104 ALA C C 104 173.471 174.237 -0.766 1
1 1171 . 15 1 1 A 104 104 ALA CA C 104 47.959 49.904 -1.945 1
1 1172 . 15 1 1 A 104 104 ALA CB C 104 21.359 22.585 -1.226 1
1 1173 . 15 1 1 A 104 104 ALA N N 104 123.419 122.102 1.317 1
1 1174 . 15 1 1 A 105 105 PRO HA H 105 4.542 4.747 -0.205 1
1 1181 . 15 1 1 A 105 105 PRO C C 105 178.409 177.936 0.473 1
1 1182 . 15 1 1 A 105 105 PRO CA C 105 64.301 62.849 1.452 1
1 1183 . 15 1 1 A 105 105 PRO CB C 105 32.094 31.658 0.436 1
1 1186 . 15 1 1 A 106 106 ALA H H 106 8.302 8.682 -0.380 1
1 1187 . 15 1 1 A 106 106 ALA HA H 106 4.022 4.028 -0.006 1
1 1191 . 15 1 1 A 106 106 ALA C C 106 179.641 179.595 0.046 1
1 1192 . 15 1 1 A 106 106 ALA CA C 106 56.341 55.267 1.074 1
1 1193 . 15 1 1 A 106 106 ALA CB C 106 18.523 18.239 0.284 1
1 1194 . 15 1 1 A 106 106 ALA N N 106 127.733 128.157 -0.424 1
1 1195 . 15 1 1 A 107 107 ALA H H 107 9.035 8.342 0.693 1
1 1196 . 15 1 1 A 107 107 ALA HA H 107 4.331 4.002 0.329 1
1 1200 . 15 1 1 A 107 107 ALA C C 107 178.586 179.294 -0.708 1
1 1201 . 15 1 1 A 107 107 ALA CA C 107 53.765 55.339 -1.574 1
1 1202 . 15 1 1 A 107 107 ALA CB C 107 18.728 18.370 0.358 1
1 1203 . 15 1 1 A 107 107 ALA N N 107 118.203 119.665 -1.462 1
1 1204 . 15 1 1 A 108 108 GLU H H 108 8.399 8.005 0.394 1
1 1205 . 15 1 1 A 108 108 GLU HA H 108 4.631 4.180 0.451 1
1 1210 . 15 1 1 A 108 108 GLU C C 108 177.127 178.890 -1.763 1
1 1211 . 15 1 1 A 108 108 GLU CA C 108 55.847 58.269 -2.422 1
1 1212 . 15 1 1 A 108 108 GLU CB C 108 32.135 30.429 1.706 1
1 1214 . 15 1 1 A 108 108 GLU N N 108 114.661 117.970 -3.309 1
1 1215 . 15 1 1 A 109 109 ARG H H 109 7.412 8.686 -1.274 1
1 1216 . 15 1 1 A 109 109 ARG HA H 109 3.682 4.205 -0.523 1
1 1223 . 15 1 1 A 109 109 ARG C C 109 176.917 179.161 -2.244 1
1 1224 . 15 1 1 A 109 109 ARG CA C 109 61.600 59.840 1.760 1
1 1225 . 15 1 1 A 109 109 ARG CB C 109 28.845 30.367 -1.522 1
1 1228 . 15 1 1 A 109 109 ARG N N 109 120.954 121.019 -0.065 1
1 1229 . 15 1 1 A 110 110 GLY H H 110 8.833 8.114 0.719 1
1 1230 . 15 1 1 A 110 110 GLY HA2 H 110 3.872 3.793 0.079 1
1 1231 . 15 1 1 A 110 110 GLY HA3 H 110 3.685 3.812 -0.127 1
1 1232 . 15 1 1 A 110 110 GLY C C 110 175.997 175.785 0.212 1
1 1233 . 15 1 1 A 110 110 GLY CA C 110 47.323 47.569 -0.246 1
1 1234 . 15 1 1 A 110 110 GLY N N 110 106.563 107.159 -0.596 1
1 1235 . 15 1 1 A 111 111 ASP H H 111 7.882 8.155 -0.273 1
1 1236 . 15 1 1 A 111 111 ASP HA H 111 4.312 4.291 0.021 1
1 1239 . 15 1 1 A 111 111 ASP C C 111 179.467 178.862 0.605 1
1 1240 . 15 1 1 A 111 111 ASP CA C 111 56.976 56.480 0.496 1
1 1241 . 15 1 1 A 111 111 ASP CB C 111 40.648 40.661 -0.013 1
1 1242 . 15 1 1 A 111 111 ASP N N 111 121.402 121.484 -0.082 1
1 1243 . 15 1 1 A 112 112 TRP H H 112 7.804 8.394 -0.590 1
1 1244 . 15 1 1 A 112 112 TRP HA H 112 3.831 4.216 -0.385 1
1 1253 . 15 1 1 A 112 112 TRP C C 112 177.547 178.514 -0.967 1
1 1254 . 15 1 1 A 112 112 TRP CA C 112 62.006 59.811 2.195 1
1 1255 . 15 1 1 A 112 112 TRP CB C 112 29.421 29.425 -0.004 1
1 1261 . 15 1 1 A 112 112 TRP N N 112 119.904 120.153 -0.249 1
1 1263 . 15 1 1 A 113 113 VAL H H 113 7.982 7.850 0.132 1
1 1264 . 15 1 1 A 113 113 VAL HA H 113 3.072 3.659 -0.587 1
1 1272 . 15 1 1 A 113 113 VAL C C 113 178.015 178.451 -0.436 1
1 1273 . 15 1 1 A 113 113 VAL CA C 113 67.407 66.643 0.764 1
1 1274 . 15 1 1 A 113 113 VAL CB C 113 31.724 31.566 0.158 1
1 1277 . 15 1 1 A 113 113 VAL N N 113 117.575 118.935 -1.360 1
1 1278 . 15 1 1 A 114 114 GLN H H 114 8.268 7.973 0.295 1
1 1279 . 15 1 1 A 114 114 GLN HA H 114 3.994 4.026 -0.032 1
1 1286 . 15 1 1 A 114 114 GLN C C 114 178.021 178.017 0.004 1
1 1287 . 15 1 1 A 114 114 GLN CA C 114 59.112 58.596 0.516 1
1 1288 . 15 1 1 A 114 114 GLN CB C 114 28.685 28.931 -0.246 1
1 1290 . 15 1 1 A 114 114 GLN N N 114 117.479 120.411 -2.932 1
1 1292 . 15 1 1 A 115 115 ALA H H 115 7.915 8.065 -0.150 1
1 1293 . 15 1 1 A 115 115 ALA HA H 115 3.972 4.070 -0.098 1
1 1297 . 15 1 1 A 115 115 ALA C C 115 180.030 179.899 0.131 1
1 1298 . 15 1 1 A 115 115 ALA CA C 115 55.142 55.127 0.015 1
1 1299 . 15 1 1 A 115 115 ALA CB C 115 18.152 18.663 -0.511 1
1 1300 . 15 1 1 A 115 115 ALA N N 115 120.858 120.877 -0.019 1
1 1301 . 15 1 1 A 116 116 ILE H H 116 8.172 8.411 -0.239 1
1 1302 . 15 1 1 A 116 116 ILE HA H 116 3.482 3.852 -0.370 1
1 1312 . 15 1 1 A 116 116 ILE C C 116 177.739 178.333 -0.594 1
1 1313 . 15 1 1 A 116 116 ILE CA C 116 66.119 65.013 1.106 1
1 1314 . 15 1 1 A 116 116 ILE CB C 116 38.222 38.037 0.185 1
1 1318 . 15 1 1 A 116 116 ILE N N 116 115.977 117.918 -1.941 1
1 1319 . 15 1 1 A 117 117 CYS H H 117 8.449 8.142 0.307 1
1 1320 . 15 1 1 A 117 117 CYS HA H 117 4.032 4.583 -0.551 1
1 1323 . 15 1 1 A 117 117 CYS C C 117 177.321 177.192 0.129 1
1 1324 . 15 1 1 A 117 117 CYS CA C 117 64.777 62.101 2.676 1
1 1325 . 15 1 1 A 117 117 CYS CB C 117 26.871 27.099 -0.228 1
1 1326 . 15 1 1 A 117 117 CYS N N 117 117.253 121.126 -3.873 1
1 1327 . 15 1 1 A 118 118 LEU H H 118 8.182 8.132 0.050 1
1 1328 . 15 1 1 A 118 118 LEU HA H 118 4.052 4.022 0.030 1
1 1338 . 15 1 1 A 118 118 LEU C C 118 179.217 179.058 0.159 1
1 1339 . 15 1 1 A 118 118 LEU CA C 118 57.877 57.786 0.091 1
1 1340 . 15 1 1 A 118 118 LEU CB C 118 42.088 41.560 0.528 1
1 1344 . 15 1 1 A 118 118 LEU N N 118 119.665 121.365 -1.700 1
1 1345 . 15 1 1 A 119 119 LEU H H 119 7.142 7.883 -0.741 1
1 1346 . 15 1 1 A 119 119 LEU HA H 119 4.192 4.516 -0.324 1
1 1356 . 15 1 1 A 119 119 LEU C C 119 178.492 178.600 -0.108 1
1 1357 . 15 1 1 A 119 119 LEU CA C 119 56.259 57.781 -1.522 1
1 1358 . 15 1 1 A 119 119 LEU CB C 119 43.568 42.283 1.285 1
1 1362 . 15 1 1 A 119 119 LEU N N 119 116.244 118.902 -2.658 1
1 1363 . 15 1 1 A 120 120 ALA H H 120 8.513 8.349 0.164 1
1 1364 . 15 1 1 A 120 120 ALA HA H 120 3.878 4.401 -0.523 1
1 1368 . 15 1 1 A 120 120 ALA C C 120 178.358 178.787 -0.429 1
1 1369 . 15 1 1 A 120 120 ALA CA C 120 53.765 55.133 -1.368 1
1 1370 . 15 1 1 A 120 120 ALA CB C 120 18.687 18.800 -0.113 1
1 1371 . 15 1 1 A 120 120 ALA N N 120 120.009 120.580 -0.571 1
1 1372 . 15 1 1 A 121 121 PHE H H 121 7.822 7.920 -0.098 1
1 1373 . 15 1 1 A 121 121 PHE HA H 121 5.156 4.816 0.340 1
1 1381 . 15 1 1 A 121 121 PHE C C 121 176.273 174.585 1.688 1
1 1382 . 15 1 1 A 121 121 PHE CA C 121 55.741 56.681 -0.940 1
1 1383 . 15 1 1 A 121 121 PHE CB C 121 39.455 37.849 1.606 1
1 1389 . 15 1 1 A 121 121 PHE N N 121 113.981 115.241 -1.260 1
1 1390 . 15 1 1 A 122 122 SER H H 122 7.765 7.930 -0.165 1
1 1391 . 15 1 1 A 122 122 SER HA H 122 4.579 5.106 -0.527 1
1 1394 . 15 1 1 A 122 122 SER C C 122 174.595 173.325 1.270 1
1 1395 . 15 1 1 A 122 122 SER CA C 122 58.777 57.964 0.813 1
1 1396 . 15 1 1 A 122 122 SER CB C 122 63.719 63.357 0.362 1
1 1397 . 15 1 1 A 122 122 SER N N 122 115.069 116.797 -1.728 1
1 1398 . 15 1 1 A 123 123 GLY H H 123 8.223 9.004 -0.781 1
1 1399 . 15 1 1 A 123 123 GLY HA2 H 123 4.174 4.212 -0.038 1
1 1400 . 15 1 1 A 123 123 GLY HA3 H 123 4.100 4.219 -0.119 1
1 1401 . 15 1 1 A 123 123 GLY C C 123 171.678 174.201 -2.523 1
1 1402 . 15 1 1 A 123 123 GLY CA C 123 44.815 46.373 -1.558 1
1 1403 . 15 1 1 A 123 123 GLY N N 123 110.151 115.231 -5.080 1
1 1404 . 15 1 1 A 124 124 PRO HA H 124 4.482 4.565 -0.083 1
1 1411 . 15 1 1 A 124 124 PRO C C 124 177.314 176.064 1.250 1
1 1412 . 15 1 1 A 124 124 PRO CA C 124 63.206 64.212 -1.006 1
1 1413 . 15 1 1 A 124 124 PRO CB C 124 32.176 31.662 0.514 1
1 1416 . 15 1 1 A 125 125 SER H H 125 8.485 7.808 0.677 1
1 1417 . 15 1 1 A 125 125 SER HA H 125 4.472 4.668 -0.196 1
1 1420 . 15 1 1 A 125 125 SER C C 125 174.728 174.587 0.141 1
1 1421 . 15 1 1 A 125 125 SER CA C 125 58.353 56.983 1.370 1
1 1422 . 15 1 1 A 125 125 SER CB C 125 64.048 63.833 0.215 1
1 1423 . 15 1 1 A 125 125 SER N N 125 116.081 114.298 1.783 1
1 1424 . 15 1 1 A 126 126 SER H H 126 8.332 8.985 -0.653 1
1 1425 . 15 1 1 A 126 126 SER HA H 126 4.464 4.177 0.287 1
1 1428 . 15 1 1 A 126 126 SER C C 126 173.980 175.021 -1.041 1
1 1429 . 15 1 1 A 126 126 SER CA C 126 58.336 61.104 -2.768 1
1 1430 . 15 1 1 A 126 126 SER CB C 126 63.925 63.473 0.452 1
1 1431 . 15 1 1 A 126 126 SER N N 126 118.037 123.171 -5.134 1
1 1 . 16 1 1 A 6 6 SER HA H 6 4.458 4.208 0.250 1
1 3 . 16 1 1 A 6 6 SER C C 6 175.108 174.754 0.354 1
1 4 . 16 1 1 A 6 6 SER CA C 6 58.689 60.999 -2.310 1
1 5 . 16 1 1 A 6 6 SER CB C 6 63.678 63.868 -0.190 1
1 6 . 16 1 1 A 7 7 GLY H H 7 8.449 7.357 1.092 1
1 7 . 16 1 1 A 7 7 GLY HA2 H 7 3.965 4.141 -0.176 1
1 8 . 16 1 1 A 7 7 GLY HA3 H 7 3.965 4.142 -0.177 1
1 9 . 16 1 1 A 7 7 GLY C C 7 174.380 174.717 -0.337 1
1 10 . 16 1 1 A 7 7 GLY CA C 7 45.435 45.630 -0.195 1
1 11 . 16 1 1 A 7 7 GLY N N 7 110.792 107.359 3.433 1
1 12 . 16 1 1 A 8 8 MET H H 8 8.259 8.891 -0.632 1
1 13 . 16 1 1 A 8 8 MET HA H 8 4.487 4.274 0.213 1
1 21 . 16 1 1 A 8 8 MET C C 8 176.961 176.196 0.765 1
1 22 . 16 1 1 A 8 8 MET CA C 8 55.565 57.547 -1.982 1
1 23 . 16 1 1 A 8 8 MET CB C 8 32.835 33.322 -0.487 1
1 26 . 16 1 1 A 8 8 MET N N 8 119.639 123.843 -4.204 1
1 27 . 16 1 1 A 9 9 GLY H H 9 8.472 7.606 0.866 1
1 28 . 16 1 1 A 9 9 GLY HA2 H 9 3.946 4.072 -0.126 1
1 29 . 16 1 1 A 9 9 GLY HA3 H 9 3.946 4.079 -0.133 1
1 30 . 16 1 1 A 9 9 GLY C C 9 174.005 175.072 -1.067 1
1 31 . 16 1 1 A 9 9 GLY CA C 9 45.488 45.622 -0.134 1
1 32 . 16 1 1 A 9 9 GLY N N 9 110.107 104.827 5.280 1
1 33 . 16 1 1 A 10 10 ASP H H 10 8.292 8.650 -0.358 1
1 34 . 16 1 1 A 10 10 ASP HA H 10 4.636 4.267 0.369 1
1 37 . 16 1 1 A 10 10 ASP C C 10 176.768 176.856 -0.088 1
1 38 . 16 1 1 A 10 10 ASP CA C 10 54.206 56.574 -2.368 1
1 39 . 16 1 1 A 10 10 ASP CB C 10 41.306 41.249 0.057 1
1 40 . 16 1 1 A 10 10 ASP N N 10 120.370 126.354 -5.984 1
1 41 . 16 1 1 A 11 11 GLY H H 11 8.452 8.126 0.326 1
1 42 . 16 1 1 A 11 11 GLY HA2 H 11 3.980 4.034 -0.054 1
1 43 . 16 1 1 A 11 11 GLY HA3 H 11 4.022 4.049 -0.027 1
1 44 . 16 1 1 A 11 11 GLY C C 11 174.102 174.706 -0.604 1
1 45 . 16 1 1 A 11 11 GLY CA C 11 45.170 46.374 -1.204 1
1 46 . 16 1 1 A 11 11 GLY N N 11 108.391 106.133 2.258 1
1 47 . 16 1 1 A 12 12 ALA H H 12 8.293 8.131 0.162 1
1 48 . 16 1 1 A 12 12 ALA HA H 12 3.777 4.561 -0.784 1
1 52 . 16 1 1 A 12 12 ALA C C 12 178.193 177.854 0.339 1
1 53 . 16 1 1 A 12 12 ALA CA C 12 52.759 51.475 1.284 1
1 54 . 16 1 1 A 12 12 ALA CB C 12 17.855 18.861 -1.006 1
1 55 . 16 1 1 A 12 12 ALA N N 12 124.185 122.601 1.584 1
1 56 . 16 1 1 A 13 13 VAL H H 13 8.822 8.242 0.580 1
1 57 . 16 1 1 A 13 13 VAL HA H 13 3.912 3.689 0.223 1
1 65 . 16 1 1 A 13 13 VAL C C 13 176.073 175.711 0.362 1
1 66 . 16 1 1 A 13 13 VAL CA C 13 63.100 66.306 -3.206 1
1 67 . 16 1 1 A 13 13 VAL CB C 13 32.711 31.977 0.734 1
1 70 . 16 1 1 A 13 13 VAL N N 13 120.877 125.585 -4.708 1
1 71 . 16 1 1 A 14 14 LYS H H 14 7.093 7.721 -0.628 1
1 72 . 16 1 1 A 14 14 LYS HA H 14 4.169 4.727 -0.558 1
1 81 . 16 1 1 A 14 14 LYS C C 14 173.291 174.387 -1.096 1
1 82 . 16 1 1 A 14 14 LYS CA C 14 56.465 54.387 2.078 1
1 83 . 16 1 1 A 14 14 LYS CB C 14 35.960 35.674 0.286 1
1 87 . 16 1 1 A 14 14 LYS N N 14 118.693 118.928 -0.235 1
1 88 . 16 1 1 A 15 15 GLN H H 15 8.522 8.447 0.075 1
1 89 . 16 1 1 A 15 15 GLN HA H 15 5.542 5.093 0.449 1
1 96 . 16 1 1 A 15 15 GLN C C 15 174.992 175.255 -0.263 1
1 97 . 16 1 1 A 15 15 GLN CA C 15 54.312 54.077 0.235 1
1 98 . 16 1 1 A 15 15 GLN CB C 15 33.585 32.378 1.207 1
1 100 . 16 1 1 A 15 15 GLN N N 15 124.024 123.725 0.299 1
1 102 . 16 1 1 A 16 16 GLY H H 16 8.740 7.809 0.931 1
1 103 . 16 1 1 A 16 16 GLY HA2 H 16 4.511 4.123 0.388 1
1 104 . 16 1 1 A 16 16 GLY HA3 H 16 4.064 4.379 -0.315 1
1 105 . 16 1 1 A 16 16 GLY C C 16 171.431 171.180 0.251 1
1 106 . 16 1 1 A 16 16 GLY CA C 16 46.106 46.042 0.064 1
1 107 . 16 1 1 A 16 16 GLY N N 16 109.611 108.464 1.147 1
1 108 . 16 1 1 A 17 17 PHE H H 17 8.886 8.624 0.262 1
1 109 . 16 1 1 A 17 17 PHE HA H 17 5.466 5.291 0.175 1
1 114 . 16 1 1 A 17 17 PHE C C 17 174.795 174.758 0.037 1
1 115 . 16 1 1 A 17 17 PHE CA C 17 57.788 56.167 1.621 1
1 116 . 16 1 1 A 17 17 PHE CB C 17 41.315 42.998 -1.683 1
1 119 . 16 1 1 A 17 17 PHE N N 17 122.684 118.974 3.710 1
1 120 . 16 1 1 A 18 18 LEU H H 18 8.762 8.712 0.050 1
1 121 . 16 1 1 A 18 18 LEU HA H 18 4.946 4.779 0.167 1
1 131 . 16 1 1 A 18 18 LEU C C 18 175.461 174.971 0.490 1
1 132 . 16 1 1 A 18 18 LEU CA C 18 52.970 53.088 -0.118 1
1 133 . 16 1 1 A 18 18 LEU CB C 18 47.945 45.080 2.865 1
1 137 . 16 1 1 A 18 18 LEU N N 18 119.045 122.847 -3.802 1
1 138 . 16 1 1 A 19 19 TYR H H 19 9.272 8.203 1.069 1
1 139 . 16 1 1 A 19 19 TYR HA H 19 5.682 5.736 -0.054 1
1 146 . 16 1 1 A 19 19 TYR C C 19 174.829 174.567 0.262 1
1 147 . 16 1 1 A 19 19 TYR CA C 19 56.482 56.071 0.411 1
1 148 . 16 1 1 A 19 19 TYR CB C 19 41.717 40.829 0.888 1
1 153 . 16 1 1 A 19 19 TYR N N 19 118.024 121.715 -3.691 1
1 154 . 16 1 1 A 20 20 LEU H H 20 9.441 8.953 0.488 1
1 155 . 16 1 1 A 20 20 LEU HA H 20 5.283 5.348 -0.065 1
1 165 . 16 1 1 A 20 20 LEU C C 20 175.935 175.762 0.173 1
1 166 . 16 1 1 A 20 20 LEU CA C 20 53.464 53.832 -0.368 1
1 167 . 16 1 1 A 20 20 LEU CB C 20 46.570 46.091 0.479 1
1 171 . 16 1 1 A 20 20 LEU N N 20 122.838 125.578 -2.740 1
1 172 . 16 1 1 A 21 21 GLN H H 21 8.391 8.286 0.105 1
1 173 . 16 1 1 A 21 21 GLN HA H 21 3.791 4.131 -0.340 1
1 180 . 16 1 1 A 21 21 GLN C C 21 175.157 174.575 0.582 1
1 181 . 16 1 1 A 21 21 GLN CA C 21 56.094 55.319 0.775 1
1 182 . 16 1 1 A 21 21 GLN CB C 21 28.434 28.805 -0.371 1
1 184 . 16 1 1 A 21 21 GLN N N 21 129.943 127.624 2.319 1
1 186 . 16 1 1 A 22 22 GLN H H 22 8.829 8.891 -0.062 1
1 187 . 16 1 1 A 22 22 GLN HA H 22 4.553 5.039 -0.486 1
1 194 . 16 1 1 A 22 22 GLN C C 22 174.998 174.636 0.362 1
1 195 . 16 1 1 A 22 22 GLN CA C 22 54.912 54.312 0.600 1
1 196 . 16 1 1 A 22 22 GLN CB C 22 31.930 31.524 0.406 1
1 198 . 16 1 1 A 22 22 GLN N N 22 127.199 125.383 1.816 1
1 200 . 16 1 1 A 23 23 GLN HA H 23 4.142 4.568 -0.426 1
1 207 . 16 1 1 A 23 23 GLN CA C 23 56.427 54.252 2.175 1
1 208 . 16 1 1 A 23 23 GLN CB C 23 29.227 29.074 0.153 1
1 211 . 16 1 1 A 24 24 GLN HA H 24 4.523 4.059 0.464 1
1 218 . 16 1 1 A 24 24 GLN CB C 24 29.759 29.473 0.286 1
1 221 . 16 1 1 A 25 25 THR HA H 25 3.870 4.782 -0.912 1
1 226 . 16 1 1 A 25 25 THR CA C 25 65.096 59.813 5.283 1
1 227 . 16 1 1 A 25 25 THR CB C 25 68.924 71.184 -2.260 1
1 229 . 16 1 1 A 26 26 PHE HA H 26 4.690 4.263 0.427 1
1 236 . 16 1 1 A 26 26 PHE C C 26 175.523 175.865 -0.342 1
1 237 . 16 1 1 A 26 26 PHE CA C 26 57.312 58.972 -1.660 1
1 238 . 16 1 1 A 26 26 PHE CB C 26 39.003 38.573 0.430 1
1 243 . 16 1 1 A 27 27 GLY H H 27 7.755 8.797 -1.042 1
1 244 . 16 1 1 A 27 27 GLY HA2 H 27 4.172 3.957 0.215 1
1 245 . 16 1 1 A 27 27 GLY HA3 H 27 3.783 4.036 -0.253 1
1 246 . 16 1 1 A 27 27 GLY C C 27 172.557 173.309 -0.752 1
1 247 . 16 1 1 A 27 27 GLY CA C 27 44.924 44.638 0.286 1
1 248 . 16 1 1 A 27 27 GLY N N 27 109.216 110.779 -1.563 1
1 249 . 16 1 1 A 28 28 LYS H H 28 8.241 8.376 -0.135 1
1 250 . 16 1 1 A 28 28 LYS HA H 28 4.530 4.559 -0.029 1
1 259 . 16 1 1 A 28 28 LYS C C 28 176.204 175.624 0.580 1
1 260 . 16 1 1 A 28 28 LYS CA C 28 55.741 55.759 -0.018 1
1 261 . 16 1 1 A 28 28 LYS CB C 28 33.904 32.931 0.973 1
1 265 . 16 1 1 A 28 28 LYS N N 28 118.743 121.301 -2.558 1
1 266 . 16 1 1 A 29 29 LYS H H 29 8.356 8.839 -0.483 1
1 267 . 16 1 1 A 29 29 LYS HA H 29 4.559 4.680 -0.121 1
1 274 . 16 1 1 A 29 29 LYS C C 29 175.420 175.970 -0.550 1
1 275 . 16 1 1 A 29 29 LYS CA C 29 55.406 54.289 1.117 1
1 276 . 16 1 1 A 29 29 LYS CB C 29 35.618 36.828 -1.210 1
1 280 . 16 1 1 A 29 29 LYS N N 29 121.198 121.488 -0.290 1
1 281 . 16 1 1 A 30 30 TRP H H 30 8.891 8.677 0.214 1
1 282 . 16 1 1 A 30 30 TRP HA H 30 4.951 4.836 0.115 1
1 291 . 16 1 1 A 30 30 TRP C C 30 175.902 176.054 -0.152 1
1 292 . 16 1 1 A 30 30 TRP CA C 30 56.677 57.559 -0.882 1
1 293 . 16 1 1 A 30 30 TRP CB C 30 30.614 29.716 0.898 1
1 299 . 16 1 1 A 30 30 TRP N N 30 123.304 121.280 2.024 1
1 301 . 16 1 1 A 31 31 ARG H H 31 8.712 8.514 0.198 1
1 302 . 16 1 1 A 31 31 ARG HA H 31 4.820 4.645 0.175 1
1 309 . 16 1 1 A 31 31 ARG C C 31 174.026 174.733 -0.707 1
1 310 . 16 1 1 A 31 31 ARG CA C 31 54.895 54.486 0.409 1
1 311 . 16 1 1 A 31 31 ARG CB C 31 34.045 32.658 1.387 1
1 314 . 16 1 1 A 31 31 ARG N N 31 123.973 124.467 -0.494 1
1 315 . 16 1 1 A 32 32 ARG H H 32 8.820 8.416 0.404 1
1 316 . 16 1 1 A 32 32 ARG HA H 32 3.965 4.809 -0.844 1
1 323 . 16 1 1 A 32 32 ARG C C 32 174.785 174.691 0.094 1
1 324 . 16 1 1 A 32 32 ARG CA C 32 56.924 55.282 1.642 1
1 325 . 16 1 1 A 32 32 ARG CB C 32 31.806 31.290 0.516 1
1 328 . 16 1 1 A 32 32 ARG N N 32 127.041 122.869 4.172 1
1 329 . 16 1 1 A 33 33 PHE H H 33 9.372 8.630 0.742 1
1 330 . 16 1 1 A 33 33 PHE HA H 33 4.863 4.977 -0.114 1
1 338 . 16 1 1 A 33 33 PHE C C 33 176.359 175.464 0.895 1
1 339 . 16 1 1 A 33 33 PHE CA C 33 57.224 56.782 0.442 1
1 340 . 16 1 1 A 33 33 PHE CB C 33 43.385 43.109 0.276 1
1 346 . 16 1 1 A 33 33 PHE N N 33 125.882 124.120 1.762 1
1 347 . 16 1 1 A 34 34 GLY H H 34 9.160 8.568 0.592 1
1 348 . 16 1 1 A 34 34 GLY HA2 H 34 4.182 4.089 0.093 1
1 349 . 16 1 1 A 34 34 GLY HA3 H 34 3.714 4.125 -0.411 1
1 350 . 16 1 1 A 34 34 GLY C C 34 172.920 172.811 0.109 1
1 351 . 16 1 1 A 34 34 GLY CA C 34 46.247 45.733 0.514 1
1 352 . 16 1 1 A 34 34 GLY N N 34 108.654 111.132 -2.478 1
1 353 . 16 1 1 A 35 35 ALA H H 35 8.982 8.258 0.724 1
1 354 . 16 1 1 A 35 35 ALA HA H 35 5.660 5.383 0.277 1
1 358 . 16 1 1 A 35 35 ALA C C 35 176.547 175.986 0.561 1
1 359 . 16 1 1 A 35 35 ALA CA C 35 50.500 50.421 0.079 1
1 360 . 16 1 1 A 35 35 ALA CB C 35 24.034 21.081 2.953 1
1 361 . 16 1 1 A 35 35 ALA N N 35 130.076 126.929 3.147 1
1 362 . 16 1 1 A 36 36 SER H H 36 8.852 8.520 0.332 1
1 363 . 16 1 1 A 36 36 SER HA H 36 5.203 4.962 0.241 1
1 366 . 16 1 1 A 36 36 SER C C 36 170.939 172.506 -1.567 1
1 367 . 16 1 1 A 36 36 SER CA C 36 57.806 57.434 0.372 1
1 368 . 16 1 1 A 36 36 SER CB C 36 66.986 65.291 1.695 1
1 369 . 16 1 1 A 36 36 SER N N 36 116.620 119.408 -2.788 1
1 370 . 16 1 1 A 37 37 LEU H H 37 8.862 8.474 0.388 1
1 371 . 16 1 1 A 37 37 LEU HA H 37 5.163 4.850 0.313 1
1 381 . 16 1 1 A 37 37 LEU C C 37 173.525 174.010 -0.485 1
1 382 . 16 1 1 A 37 37 LEU CA C 37 53.112 53.429 -0.317 1
1 383 . 16 1 1 A 37 37 LEU CB C 37 46.077 43.411 2.666 1
1 387 . 16 1 1 A 37 37 LEU N N 37 127.638 129.208 -1.570 1
1 388 . 16 1 1 A 38 38 TYR H H 38 9.280 8.524 0.756 1
1 389 . 16 1 1 A 38 38 TYR HA H 38 4.820 5.293 -0.473 1
1 396 . 16 1 1 A 38 38 TYR C C 38 175.430 175.041 0.389 1
1 397 . 16 1 1 A 38 38 TYR CA C 38 57.436 56.112 1.324 1
1 398 . 16 1 1 A 38 38 TYR CB C 38 42.128 41.354 0.774 1
1 403 . 16 1 1 A 38 38 TYR N N 38 125.215 126.908 -1.693 1
1 404 . 16 1 1 A 39 39 GLY H H 39 8.532 8.505 0.027 1
1 405 . 16 1 1 A 39 39 GLY HA2 H 39 4.220 4.193 0.027 1
1 406 . 16 1 1 A 39 39 GLY HA3 H 39 3.941 4.195 -0.254 1
1 407 . 16 1 1 A 39 39 GLY C C 39 172.950 174.011 -1.061 1
1 408 . 16 1 1 A 39 39 GLY CA C 39 44.817 44.308 0.509 1
1 409 . 16 1 1 A 39 39 GLY N N 39 106.424 109.948 -3.524 1
1 410 . 16 1 1 A 40 40 GLY H H 40 8.477 8.468 0.009 1
1 411 . 16 1 1 A 40 40 GLY HA2 H 40 4.102 4.020 0.082 1
1 412 . 16 1 1 A 40 40 GLY HA3 H 40 3.927 4.022 -0.095 1
1 413 . 16 1 1 A 40 40 GLY C C 40 174.002 174.432 -0.430 1
1 414 . 16 1 1 A 40 40 GLY CA C 40 44.694 45.151 -0.457 1
1 415 . 16 1 1 A 40 40 GLY N N 40 106.881 108.070 -1.189 1
1 416 . 16 1 1 A 41 41 SER H H 41 8.600 7.878 0.722 1
1 417 . 16 1 1 A 41 41 SER HA H 41 4.520 4.509 0.011 1
1 420 . 16 1 1 A 41 41 SER C C 41 174.355 175.048 -0.693 1
1 421 . 16 1 1 A 41 41 SER CA C 41 58.565 58.282 0.283 1
1 422 . 16 1 1 A 41 41 SER CB C 41 64.413 64.148 0.265 1
1 423 . 16 1 1 A 41 41 SER N N 41 115.751 117.238 -1.487 1
1 424 . 16 1 1 A 42 42 ASP H H 42 8.533 8.892 -0.359 1
1 425 . 16 1 1 A 42 42 ASP HA H 42 4.560 4.677 -0.117 1
1 428 . 16 1 1 A 42 42 ASP CA C 42 55.230 54.070 1.160 1
1 429 . 16 1 1 A 42 42 ASP CB C 42 40.648 40.015 0.633 1
1 430 . 16 1 1 A 42 42 ASP N N 42 119.037 123.447 -4.410 1
1 431 . 16 1 1 A 43 43 CYS H H 43 8.152 7.723 0.429 1
1 432 . 16 1 1 A 43 43 CYS HA H 43 4.541 4.977 -0.436 1
1 435 . 16 1 1 A 43 43 CYS C C 43 173.975 174.571 -0.596 1
1 436 . 16 1 1 A 43 43 CYS CA C 43 58.265 57.157 1.108 1
1 437 . 16 1 1 A 43 43 CYS CB C 43 28.393 32.747 -4.354 1
1 438 . 16 1 1 A 43 43 CYS N N 43 116.881 118.363 -1.482 1
1 439 . 16 1 1 A 44 44 ALA H H 44 8.047 8.552 -0.505 1
1 440 . 16 1 1 A 44 44 ALA HA H 44 4.395 4.481 -0.086 1
1 444 . 16 1 1 A 44 44 ALA C C 44 176.472 177.176 -0.704 1
1 445 . 16 1 1 A 44 44 ALA CA C 44 52.688 52.400 0.288 1
1 446 . 16 1 1 A 44 44 ALA CB C 44 20.579 18.911 1.668 1
1 447 . 16 1 1 A 44 44 ALA N N 44 125.989 124.197 1.792 1
1 448 . 16 1 1 A 45 45 LEU H H 45 8.052 7.541 0.511 1
1 449 . 16 1 1 A 45 45 LEU HA H 45 4.452 4.488 -0.036 1
1 459 . 16 1 1 A 45 45 LEU C C 45 176.196 175.063 1.133 1
1 460 . 16 1 1 A 45 45 LEU CA C 45 53.771 54.353 -0.582 1
1 461 . 16 1 1 A 45 45 LEU CB C 45 43.116 40.204 2.912 1
1 465 . 16 1 1 A 45 45 LEU N N 45 119.889 121.193 -1.304 1
1 466 . 16 1 1 A 46 46 ALA H H 46 8.381 7.749 0.632 1
1 467 . 16 1 1 A 46 46 ALA HA H 46 4.449 5.083 -0.634 1
1 471 . 16 1 1 A 46 46 ALA C C 46 179.093 175.758 3.335 1
1 472 . 16 1 1 A 46 46 ALA CA C 46 52.829 51.608 1.221 1
1 473 . 16 1 1 A 46 46 ALA CB C 46 18.687 22.167 -3.480 1
1 474 . 16 1 1 A 46 46 ALA N N 46 125.635 126.298 -0.663 1
1 475 . 16 1 1 A 47 47 ARG H H 47 9.012 8.852 0.160 1
1 476 . 16 1 1 A 47 47 ARG HA H 47 5.192 5.155 0.037 1
1 484 . 16 1 1 A 47 47 ARG C C 47 171.524 174.033 -2.509 1
1 485 . 16 1 1 A 47 47 ARG CA C 47 55.265 54.581 0.684 1
1 486 . 16 1 1 A 47 47 ARG CB C 47 30.970 34.212 -3.242 1
1 489 . 16 1 1 A 47 47 ARG N N 47 120.048 119.369 0.679 1
1 491 . 16 1 1 A 48 48 LEU H H 48 9.029 8.682 0.347 1
1 492 . 16 1 1 A 48 48 LEU HA H 48 5.221 4.992 0.229 1
1 502 . 16 1 1 A 48 48 LEU C C 48 174.348 175.193 -0.845 1
1 503 . 16 1 1 A 48 48 LEU CA C 48 53.253 53.871 -0.618 1
1 504 . 16 1 1 A 48 48 LEU CB C 48 45.419 44.194 1.225 1
1 508 . 16 1 1 A 48 48 LEU N N 48 123.315 123.017 0.298 1
1 509 . 16 1 1 A 49 49 GLU H H 49 9.473 8.546 0.927 1
1 510 . 16 1 1 A 49 49 GLU HA H 49 5.222 4.875 0.347 1
1 515 . 16 1 1 A 49 49 GLU C C 49 175.507 175.700 -0.193 1
1 516 . 16 1 1 A 49 49 GLU CA C 49 55.159 56.233 -1.074 1
1 517 . 16 1 1 A 49 49 GLU CB C 49 32.341 31.647 0.694 1
1 519 . 16 1 1 A 49 49 GLU N N 49 124.751 126.956 -2.205 1
1 520 . 16 1 1 A 50 50 LEU H H 50 9.088 8.369 0.719 1
1 521 . 16 1 1 A 50 50 LEU HA H 50 5.382 5.322 0.060 1
1 531 . 16 1 1 A 50 50 LEU C C 50 175.474 174.767 0.707 1
1 532 . 16 1 1 A 50 50 LEU CA C 50 52.865 53.941 -1.076 1
1 533 . 16 1 1 A 50 50 LEU CB C 50 43.239 45.232 -1.993 1
1 537 . 16 1 1 A 50 50 LEU N N 50 124.221 122.284 1.937 1
1 538 . 16 1 1 A 51 51 GLN H H 51 9.602 8.518 1.084 1
1 539 . 16 1 1 A 51 51 GLN HA H 51 5.095 4.757 0.338 1
1 546 . 16 1 1 A 51 51 GLN C C 51 175.306 176.463 -1.157 1
1 547 . 16 1 1 A 51 51 GLN CA C 51 54.576 54.485 0.091 1
1 548 . 16 1 1 A 51 51 GLN CB C 51 32.177 30.819 1.358 1
1 550 . 16 1 1 A 51 51 GLN N N 51 123.268 124.856 -1.588 1
1 552 . 16 1 1 A 52 52 GLU H H 52 9.172 8.960 0.212 1
1 553 . 16 1 1 A 52 52 GLU HA H 52 4.092 4.214 -0.122 1
1 558 . 16 1 1 A 52 52 GLU C C 52 176.523 177.530 -1.007 1
1 559 . 16 1 1 A 52 52 GLU CA C 52 57.500 58.819 -1.319 1
1 560 . 16 1 1 A 52 52 GLU CB C 52 30.696 29.681 1.015 1
1 562 . 16 1 1 A 52 52 GLU N N 52 128.982 125.653 3.329 1
1 563 . 16 1 1 A 53 53 GLY H H 53 8.644 8.157 0.487 1
1 564 . 16 1 1 A 53 53 GLY HA2 H 53 4.261 4.004 0.257 1
1 565 . 16 1 1 A 53 53 GLY HA3 H 53 3.993 4.031 -0.038 1
1 566 . 16 1 1 A 53 53 GLY C C 53 172.550 174.345 -1.795 1
1 567 . 16 1 1 A 53 53 GLY CA C 53 45.911 47.014 -1.103 1
1 568 . 16 1 1 A 53 53 GLY N N 53 110.844 108.055 2.789 1
1 569 . 16 1 1 A 54 54 PRO HA H 54 4.392 4.619 -0.227 1
1 576 . 16 1 1 A 54 54 PRO C C 54 176.828 176.825 0.003 1
1 577 . 16 1 1 A 54 54 PRO CA C 54 63.665 62.733 0.932 1
1 578 . 16 1 1 A 54 54 PRO CB C 54 32.012 32.970 -0.958 1
1 581 . 16 1 1 A 55 55 GLU H H 55 8.934 8.717 0.217 1
1 582 . 16 1 1 A 55 55 GLU HA H 55 4.193 4.295 -0.102 1
1 587 . 16 1 1 A 55 55 GLU C C 55 176.189 176.463 -0.274 1
1 588 . 16 1 1 A 55 55 GLU CA C 55 57.383 58.998 -1.615 1
1 589 . 16 1 1 A 55 55 GLU CB C 55 28.945 30.675 -1.730 1
1 591 . 16 1 1 A 55 55 GLU N N 55 120.312 120.486 -0.174 1
1 592 . 16 1 1 A 56 56 LYS H H 56 7.937 7.798 0.139 1
1 593 . 16 1 1 A 56 56 LYS HA H 56 4.578 4.537 0.041 1
1 602 . 16 1 1 A 56 56 LYS C C 56 174.295 176.161 -1.866 1
1 603 . 16 1 1 A 56 56 LYS CA C 56 54.171 54.130 0.041 1
1 604 . 16 1 1 A 56 56 LYS CB C 56 32.555 34.261 -1.706 1
1 608 . 16 1 1 A 56 56 LYS N N 56 122.008 119.573 2.435 1
1 609 . 16 1 1 A 57 57 PRO HA H 57 4.370 4.418 -0.048 1
1 616 . 16 1 1 A 57 57 PRO CA C 57 63.431 65.165 -1.734 1
1 617 . 16 1 1 A 57 57 PRO CB C 57 32.072 31.994 0.078 1
1 620 . 16 1 1 A 58 58 ARG H H 58 8.310 8.157 0.153 1
1 621 . 16 1 1 A 58 58 ARG HA H 58 4.295 4.531 -0.236 1
1 628 . 16 1 1 A 58 58 ARG CA C 58 56.570 55.900 0.670 1
1 629 . 16 1 1 A 58 58 ARG CB C 58 30.860 30.981 -0.121 1
1 632 . 16 1 1 A 58 58 ARG N N 58 120.045 118.799 1.246 1
1 633 . 16 1 1 A 60 60 CYS HA H 60 4.482 4.413 0.069 1
1 636 . 16 1 1 A 60 60 CYS CA C 60 58.621 59.781 -1.160 1
1 637 . 16 1 1 A 60 60 CYS CB C 60 28.267 28.304 -0.037 1
1 638 . 16 1 1 A 61 61 GLU HA H 61 4.226 4.185 0.041 1
1 643 . 16 1 1 A 61 61 GLU C C 61 176.299 176.128 0.171 1
1 644 . 16 1 1 A 61 61 GLU CA C 61 57.100 56.756 0.344 1
1 645 . 16 1 1 A 61 61 GLU CB C 61 29.873 29.915 -0.042 1
1 647 . 16 1 1 A 62 62 ALA H H 62 8.282 8.453 -0.171 1
1 648 . 16 1 1 A 62 62 ALA HA H 62 4.302 5.175 -0.873 1
1 652 . 16 1 1 A 62 62 ALA C C 62 177.277 176.252 1.025 1
1 653 . 16 1 1 A 62 62 ALA CA C 62 52.512 50.552 1.960 1
1 654 . 16 1 1 A 62 62 ALA CB C 62 19.592 22.257 -2.665 1
1 655 . 16 1 1 A 62 62 ALA N N 62 124.386 123.527 0.859 1
1 656 . 16 1 1 A 63 63 ALA H H 63 8.399 8.571 -0.172 1
1 657 . 16 1 1 A 63 63 ALA HA H 63 4.375 4.296 0.079 1
1 661 . 16 1 1 A 63 63 ALA C C 63 176.843 177.478 -0.635 1
1 662 . 16 1 1 A 63 63 ALA CA C 63 52.658 53.076 -0.418 1
1 663 . 16 1 1 A 63 63 ALA CB C 63 19.592 19.076 0.516 1
1 664 . 16 1 1 A 63 63 ALA N N 63 123.892 125.642 -1.750 1
1 665 . 16 1 1 A 64 64 ARG H H 64 8.152 8.598 -0.446 1
1 666 . 16 1 1 A 64 64 ARG HA H 64 5.008 4.757 0.251 1
1 673 . 16 1 1 A 64 64 ARG C C 64 175.594 174.156 1.438 1
1 674 . 16 1 1 A 64 64 ARG CA C 64 55.282 55.305 -0.023 1
1 675 . 16 1 1 A 64 64 ARG CB C 64 32.506 32.743 -0.237 1
1 678 . 16 1 1 A 64 64 ARG N N 64 119.787 122.836 -3.049 1
1 679 . 16 1 1 A 65 65 LYS H H 65 8.945 8.861 0.084 1
1 680 . 16 1 1 A 65 65 LYS HA H 65 4.602 4.991 -0.389 1
1 689 . 16 1 1 A 65 65 LYS C C 65 174.657 174.418 0.239 1
1 690 . 16 1 1 A 65 65 LYS CA C 65 54.948 54.706 0.242 1
1 691 . 16 1 1 A 65 65 LYS CB C 65 34.068 34.586 -0.518 1
1 695 . 16 1 1 A 65 65 LYS N N 65 124.171 124.601 -0.430 1
1 696 . 16 1 1 A 66 66 VAL H H 66 8.672 8.979 -0.307 1
1 697 . 16 1 1 A 66 66 VAL HA H 66 4.532 5.087 -0.555 1
1 705 . 16 1 1 A 66 66 VAL C C 66 175.078 173.671 1.407 1
1 706 . 16 1 1 A 66 66 VAL CA C 66 61.865 60.026 1.839 1
1 707 . 16 1 1 A 66 66 VAL CB C 66 33.835 34.531 -0.696 1
1 710 . 16 1 1 A 66 66 VAL N N 66 124.380 125.897 -1.517 1
1 711 . 16 1 1 A 67 67 ILE H H 67 9.071 8.927 0.144 1
1 712 . 16 1 1 A 67 67 ILE HA H 67 4.142 4.512 -0.370 1
1 722 . 16 1 1 A 67 67 ILE C C 67 175.819 175.434 0.385 1
1 723 . 16 1 1 A 67 67 ILE CA C 67 60.383 60.371 0.012 1
1 724 . 16 1 1 A 67 67 ILE CB C 67 39.908 37.797 2.111 1
1 728 . 16 1 1 A 67 67 ILE N N 67 129.537 129.542 -0.005 1
1 729 . 16 1 1 A 68 68 ARG H H 68 9.203 8.656 0.547 1
1 730 . 16 1 1 A 68 68 ARG HA H 68 4.198 4.271 -0.073 1
1 737 . 16 1 1 A 68 68 ARG C C 68 177.769 177.104 0.665 1
1 738 . 16 1 1 A 68 68 ARG CA C 68 56.835 56.550 0.285 1
1 739 . 16 1 1 A 68 68 ARG CB C 68 29.832 30.697 -0.865 1
1 742 . 16 1 1 A 68 68 ARG N N 68 128.484 128.547 -0.063 1
1 743 . 16 1 1 A 69 69 LEU H H 69 8.212 8.562 -0.350 1
1 744 . 16 1 1 A 69 69 LEU HA H 69 4.221 4.003 0.218 1
1 754 . 16 1 1 A 69 69 LEU C C 69 178.996 178.612 0.384 1
1 755 . 16 1 1 A 69 69 LEU CA C 69 57.136 57.712 -0.576 1
1 756 . 16 1 1 A 69 69 LEU CB C 69 39.455 40.984 -1.529 1
1 760 . 16 1 1 A 69 69 LEU N N 69 123.807 124.149 -0.342 1
1 761 . 16 1 1 A 70 70 SER H H 70 8.823 8.112 0.711 1
1 762 . 16 1 1 A 70 70 SER HA H 70 4.331 4.000 0.331 1
1 765 . 16 1 1 A 70 70 SER C C 70 175.076 176.701 -1.625 1
1 766 . 16 1 1 A 70 70 SER CA C 70 60.329 61.385 -1.056 1
1 767 . 16 1 1 A 70 70 SER CB C 70 62.362 63.003 -0.641 1
1 768 . 16 1 1 A 70 70 SER N N 70 115.162 113.475 1.687 1
1 769 . 16 1 1 A 71 71 ASP H H 71 7.602 8.337 -0.735 1
1 770 . 16 1 1 A 71 71 ASP HA H 71 4.820 4.454 0.366 1
1 773 . 16 1 1 A 71 71 ASP C C 71 176.478 177.264 -0.786 1
1 774 . 16 1 1 A 71 71 ASP CA C 71 54.241 57.093 -2.852 1
1 775 . 16 1 1 A 71 71 ASP CB C 71 41.347 40.273 1.074 1
1 776 . 16 1 1 A 71 71 ASP N N 71 119.590 120.449 -0.859 1
1 777 . 16 1 1 A 72 72 CYS H H 72 7.715 7.575 0.140 1
1 778 . 16 1 1 A 72 72 CYS HA H 72 4.372 4.774 -0.402 1
1 781 . 16 1 1 A 72 72 CYS C C 72 173.690 174.576 -0.886 1
1 782 . 16 1 1 A 72 72 CYS CA C 72 60.836 58.220 2.616 1
1 783 . 16 1 1 A 72 72 CYS CB C 72 27.655 26.815 0.840 1
1 784 . 16 1 1 A 72 72 CYS N N 72 118.346 117.637 0.709 1
1 785 . 16 1 1 A 73 73 LEU H H 73 9.472 8.975 0.497 1
1 786 . 16 1 1 A 73 73 LEU HA H 73 4.593 4.054 0.539 1
1 796 . 16 1 1 A 73 73 LEU C C 73 177.562 176.831 0.731 1
1 797 . 16 1 1 A 73 73 LEU CA C 73 55.724 57.552 -1.828 1
1 798 . 16 1 1 A 73 73 LEU CB C 73 43.774 42.198 1.576 1
1 802 . 16 1 1 A 73 73 LEU N N 73 124.752 129.117 -4.365 1
1 803 . 16 1 1 A 74 74 ARG H H 74 7.658 7.716 -0.058 1
1 804 . 16 1 1 A 74 74 ARG HA H 74 4.592 5.244 -0.652 1
1 811 . 16 1 1 A 74 74 ARG C C 74 173.605 174.667 -1.062 1
1 812 . 16 1 1 A 74 74 ARG CA C 74 56.465 55.693 0.772 1
1 813 . 16 1 1 A 74 74 ARG CB C 74 34.068 33.860 0.208 1
1 816 . 16 1 1 A 74 74 ARG N N 74 115.565 115.870 -0.305 1
1 817 . 16 1 1 A 75 75 VAL H H 75 8.622 8.747 -0.125 1
1 818 . 16 1 1 A 75 75 VAL HA H 75 5.170 5.160 0.010 1
1 826 . 16 1 1 A 75 75 VAL C C 75 173.985 174.427 -0.442 1
1 827 . 16 1 1 A 75 75 VAL CA C 75 60.930 59.952 0.978 1
1 828 . 16 1 1 A 75 75 VAL CB C 75 35.073 36.159 -1.086 1
1 831 . 16 1 1 A 75 75 VAL N N 75 124.278 119.431 4.847 1
1 832 . 16 1 1 A 76 76 ALA H H 76 8.272 8.868 -0.596 1
1 833 . 16 1 1 A 76 76 ALA HA H 76 4.648 5.163 -0.515 1
1 837 . 16 1 1 A 76 76 ALA C C 76 175.630 176.899 -1.269 1
1 838 . 16 1 1 A 76 76 ALA CA C 76 51.294 51.138 0.156 1
1 839 . 16 1 1 A 76 76 ALA CB C 76 22.759 22.748 0.011 1
1 840 . 16 1 1 A 76 76 ALA N N 76 126.015 124.781 1.234 1
1 841 . 16 1 1 A 77 77 GLU H H 77 9.184 8.865 0.319 1
1 842 . 16 1 1 A 77 77 GLU HA H 77 4.060 4.514 -0.454 1
1 847 . 16 1 1 A 77 77 GLU C C 77 174.949 176.281 -1.332 1
1 848 . 16 1 1 A 77 77 GLU CA C 77 58.424 58.010 0.414 1
1 849 . 16 1 1 A 77 77 GLU CB C 77 30.161 30.404 -0.243 1
1 851 . 16 1 1 A 77 77 GLU N N 77 120.223 122.510 -2.287 1
1 852 . 16 1 1 A 78 78 ALA H H 78 7.985 8.612 -0.627 1
1 853 . 16 1 1 A 78 78 ALA HA H 78 4.776 4.971 -0.195 1
1 857 . 16 1 1 A 78 78 ALA C C 78 177.250 175.939 1.311 1
1 858 . 16 1 1 A 78 78 ALA CA C 78 50.888 51.173 -0.285 1
1 859 . 16 1 1 A 78 78 ALA CB C 78 20.851 22.852 -2.001 1
1 860 . 16 1 1 A 78 78 ALA N N 78 125.143 124.273 0.870 1
1 861 . 16 1 1 A 79 79 GLY H H 79 8.604 8.432 0.172 1
1 862 . 16 1 1 A 79 79 GLY HA2 H 79 4.327 4.202 0.125 1
1 863 . 16 1 1 A 79 79 GLY HA3 H 79 3.963 4.227 -0.264 1
1 864 . 16 1 1 A 79 79 GLY C C 79 175.360 173.917 1.443 1
1 865 . 16 1 1 A 79 79 GLY CA C 79 44.925 45.426 -0.501 1
1 866 . 16 1 1 A 79 79 GLY N N 79 109.420 105.440 3.980 1
1 867 . 16 1 1 A 80 80 GLY H H 80 8.649 8.549 0.100 1
1 868 . 16 1 1 A 80 80 GLY HA2 H 80 3.962 3.869 0.093 1
1 869 . 16 1 1 A 80 80 GLY HA3 H 80 3.962 3.878 0.084 1
1 870 . 16 1 1 A 80 80 GLY C C 80 175.052 175.094 -0.042 1
1 871 . 16 1 1 A 80 80 GLY CA C 80 45.955 47.237 -1.282 1
1 872 . 16 1 1 A 80 80 GLY N N 80 108.295 108.178 0.117 1
1 873 . 16 1 1 A 81 81 GLU H H 81 8.921 8.907 0.014 1
1 874 . 16 1 1 A 81 81 GLU HA H 81 4.298 4.041 0.257 1
1 879 . 16 1 1 A 81 81 GLU C C 81 176.532 177.914 -1.382 1
1 880 . 16 1 1 A 81 81 GLU CA C 81 57.118 59.663 -2.545 1
1 881 . 16 1 1 A 81 81 GLU CB C 81 28.599 29.517 -0.918 1
1 883 . 16 1 1 A 81 81 GLU N N 81 121.170 126.088 -4.918 1
1 884 . 16 1 1 A 82 82 ALA H H 82 8.032 7.408 0.624 1
1 885 . 16 1 1 A 82 82 ALA HA H 82 4.371 4.174 0.197 1
1 889 . 16 1 1 A 82 82 ALA C C 82 177.160 178.703 -1.543 1
1 890 . 16 1 1 A 82 82 ALA CA C 82 52.653 52.994 -0.341 1
1 891 . 16 1 1 A 82 82 ALA CB C 82 19.304 19.817 -0.513 1
1 892 . 16 1 1 A 82 82 ALA N N 82 124.988 122.386 2.602 1
1 893 . 16 1 1 A 83 83 SER H H 83 8.319 9.000 -0.681 1
1 894 . 16 1 1 A 83 83 SER HA H 83 4.331 4.246 0.085 1
1 897 . 16 1 1 A 83 83 SER C C 83 174.045 175.195 -1.150 1
1 898 . 16 1 1 A 83 83 SER CA C 83 58.053 62.250 -4.197 1
1 899 . 16 1 1 A 83 83 SER CB C 83 63.184 62.911 0.273 1
1 900 . 16 1 1 A 83 83 SER N N 83 114.181 119.307 -5.126 1
1 901 . 16 1 1 A 84 84 SER H H 84 7.823 7.654 0.169 1
1 902 . 16 1 1 A 84 84 SER HA H 84 3.194 4.060 -0.866 1
1 905 . 16 1 1 A 84 84 SER C C 84 171.072 174.080 -3.008 1
1 906 . 16 1 1 A 84 84 SER CA C 84 57.206 56.935 0.271 1
1 907 . 16 1 1 A 84 84 SER CB C 84 61.622 63.450 -1.828 1
1 908 . 16 1 1 A 84 84 SER N N 84 117.302 114.975 2.327 1
1 909 . 16 1 1 A 85 85 PRO HA H 85 3.922 4.525 -0.603 1
1 916 . 16 1 1 A 85 85 PRO CA C 85 62.691 62.124 0.567 1
1 917 . 16 1 1 A 85 85 PRO CB C 85 31.515 32.837 -1.322 1
1 920 . 16 1 1 A 86 86 ARG HA H 86 3.882 4.281 -0.399 1
1 927 . 16 1 1 A 86 86 ARG C C 86 175.712 176.542 -0.830 1
1 928 . 16 1 1 A 86 86 ARG CA C 86 57.877 55.881 1.996 1
1 929 . 16 1 1 A 86 86 ARG CB C 86 29.791 31.359 -1.568 1
1 932 . 16 1 1 A 87 87 ASP H H 87 8.903 8.822 0.081 1
1 933 . 16 1 1 A 87 87 ASP HA H 87 4.342 4.209 0.133 1
1 936 . 16 1 1 A 87 87 ASP C C 87 175.723 175.027 0.696 1
1 937 . 16 1 1 A 87 87 ASP CA C 87 56.377 55.257 1.120 1
1 938 . 16 1 1 A 87 87 ASP CB C 87 39.208 39.796 -0.588 1
1 939 . 16 1 1 A 87 87 ASP N N 87 117.520 120.598 -3.078 1
1 940 . 16 1 1 A 88 88 THR H H 88 7.776 7.482 0.294 1
1 941 . 16 1 1 A 88 88 THR HA H 88 5.101 5.112 -0.011 1
1 946 . 16 1 1 A 88 88 THR C C 88 173.825 172.984 0.841 1
1 947 . 16 1 1 A 88 88 THR CA C 88 60.154 59.447 0.707 1
1 948 . 16 1 1 A 88 88 THR CB C 88 72.702 72.931 -0.229 1
1 950 . 16 1 1 A 88 88 THR N N 88 108.770 108.108 0.662 1
1 951 . 16 1 1 A 89 89 SER H H 89 9.006 9.132 -0.126 1
1 952 . 16 1 1 A 89 89 SER HA H 89 4.718 5.175 -0.457 1
1 955 . 16 1 1 A 89 89 SER C C 89 173.728 173.243 0.485 1
1 956 . 16 1 1 A 89 89 SER CA C 89 57.453 57.975 -0.522 1
1 957 . 16 1 1 A 89 89 SER CB C 89 65.611 65.420 0.191 1
1 958 . 16 1 1 A 89 89 SER N N 89 114.151 116.740 -2.589 1
1 959 . 16 1 1 A 90 90 ALA H H 90 9.001 8.849 0.152 1
1 960 . 16 1 1 A 90 90 ALA HA H 90 5.660 4.626 1.034 1
1 964 . 16 1 1 A 90 90 ALA C C 90 177.669 177.247 0.422 1
1 965 . 16 1 1 A 90 90 ALA CA C 90 51.670 51.992 -0.322 1
1 966 . 16 1 1 A 90 90 ALA CB C 90 22.265 20.097 2.168 1
1 967 . 16 1 1 A 90 90 ALA N N 90 126.177 128.947 -2.770 1
1 968 . 16 1 1 A 91 91 PHE H H 91 9.672 8.158 1.514 1
1 969 . 16 1 1 A 91 91 PHE HA H 91 5.039 5.595 -0.556 1
1 977 . 16 1 1 A 91 91 PHE C C 91 170.731 173.307 -2.576 1
1 978 . 16 1 1 A 91 91 PHE CA C 91 56.271 55.326 0.945 1
1 979 . 16 1 1 A 91 91 PHE CB C 91 41.553 41.918 -0.365 1
1 985 . 16 1 1 A 91 91 PHE N N 91 118.968 116.447 2.521 1
1 986 . 16 1 1 A 92 92 PHE H H 92 9.422 9.581 -0.159 1
1 987 . 16 1 1 A 92 92 PHE HA H 92 5.674 5.103 0.571 1
1 995 . 16 1 1 A 92 92 PHE C C 92 174.570 175.301 -0.731 1
1 996 . 16 1 1 A 92 92 PHE CA C 92 55.917 57.542 -1.625 1
1 997 . 16 1 1 A 92 92 PHE CB C 92 42.787 41.321 1.466 1
1 1003 . 16 1 1 A 92 92 PHE N N 92 117.543 118.275 -0.732 1
1 1004 . 16 1 1 A 93 93 LEU H H 93 9.021 8.903 0.118 1
1 1005 . 16 1 1 A 93 93 LEU HA H 93 5.122 5.064 0.058 1
1 1015 . 16 1 1 A 93 93 LEU C C 93 174.799 174.235 0.564 1
1 1016 . 16 1 1 A 93 93 LEU CA C 93 54.912 54.719 0.193 1
1 1017 . 16 1 1 A 93 93 LEU CB C 93 45.254 45.119 0.135 1
1 1021 . 16 1 1 A 93 93 LEU N N 93 121.719 121.779 -0.060 1
1 1022 . 16 1 1 A 94 94 GLU H H 94 9.294 9.377 -0.083 1
1 1023 . 16 1 1 A 94 94 GLU HA H 94 5.043 5.201 -0.158 1
1 1028 . 16 1 1 A 94 94 GLU C C 94 175.754 175.442 0.312 1
1 1029 . 16 1 1 A 94 94 GLU CA C 94 56.018 54.964 1.054 1
1 1030 . 16 1 1 A 94 94 GLU CB C 94 32.752 32.909 -0.157 1
1 1032 . 16 1 1 A 94 94 GLU N N 94 127.032 128.691 -1.659 1
1 1033 . 16 1 1 A 95 95 THR H H 95 8.822 8.427 0.395 1
1 1034 . 16 1 1 A 95 95 THR HA H 95 5.398 5.315 0.083 1
1 1039 . 16 1 1 A 95 95 THR C C 95 173.860 175.329 -1.469 1
1 1040 . 16 1 1 A 95 95 THR CA C 95 59.588 59.517 0.071 1
1 1041 . 16 1 1 A 95 95 THR CB C 95 72.191 72.337 -0.146 1
1 1043 . 16 1 1 A 95 95 THR N N 95 118.685 118.080 0.605 1
1 1044 . 16 1 1 A 96 96 LYS H H 96 8.823 8.672 0.151 1
1 1045 . 16 1 1 A 96 96 LYS HA H 96 4.022 3.981 0.041 1
1 1054 . 16 1 1 A 96 96 LYS C C 96 177.330 178.448 -1.118 1
1 1055 . 16 1 1 A 96 96 LYS CA C 96 59.588 60.213 -0.625 1
1 1056 . 16 1 1 A 96 96 LYS CB C 96 32.588 32.074 0.514 1
1 1060 . 16 1 1 A 96 96 LYS N N 96 118.801 122.392 -3.591 1
1 1061 . 16 1 1 A 97 97 GLU H H 97 8.092 7.828 0.264 1
1 1062 . 16 1 1 A 97 97 GLU HA H 97 4.282 4.217 0.065 1
1 1067 . 16 1 1 A 97 97 GLU C C 97 176.290 176.845 -0.555 1
1 1068 . 16 1 1 A 97 97 GLU CA C 97 57.365 58.918 -1.553 1
1 1069 . 16 1 1 A 97 97 GLU CB C 97 31.559 30.071 1.488 1
1 1071 . 16 1 1 A 97 97 GLU N N 97 113.992 119.430 -5.438 1
1 1072 . 16 1 1 A 98 98 ARG H H 98 7.482 7.145 0.337 1
1 1073 . 16 1 1 A 98 98 ARG HA H 98 4.397 4.569 -0.172 1
1 1080 . 16 1 1 A 98 98 ARG C C 98 172.792 173.064 -0.272 1
1 1081 . 16 1 1 A 98 98 ARG CA C 98 55.689 54.588 1.101 1
1 1082 . 16 1 1 A 98 98 ARG CB C 98 32.711 31.710 1.001 1
1 1085 . 16 1 1 A 98 98 ARG N N 98 116.022 113.449 2.573 1
1 1086 . 16 1 1 A 99 99 LEU H H 99 8.423 8.128 0.295 1
1 1087 . 16 1 1 A 99 99 LEU HA H 99 4.807 4.674 0.133 1
1 1097 . 16 1 1 A 99 99 LEU C C 99 175.903 174.115 1.788 1
1 1098 . 16 1 1 A 99 99 LEU CA C 99 54.383 54.069 0.314 1
1 1099 . 16 1 1 A 99 99 LEU CB C 99 43.362 44.200 -0.838 1
1 1103 . 16 1 1 A 99 99 LEU N N 99 124.983 121.889 3.094 1
1 1104 . 16 1 1 A 100 100 TYR H H 100 9.144 9.745 -0.601 1
1 1105 . 16 1 1 A 100 100 TYR HA H 100 4.542 5.162 -0.620 1
1 1112 . 16 1 1 A 100 100 TYR C C 100 173.479 174.181 -0.702 1
1 1113 . 16 1 1 A 100 100 TYR CA C 100 57.735 56.271 1.464 1
1 1114 . 16 1 1 A 100 100 TYR CB C 100 39.291 41.779 -2.488 1
1 1119 . 16 1 1 A 100 100 TYR N N 100 126.679 125.815 0.864 1
1 1120 . 16 1 1 A 101 101 LEU H H 101 9.043 8.844 0.199 1
1 1121 . 16 1 1 A 101 101 LEU HA H 101 4.747 4.978 -0.231 1
1 1131 . 16 1 1 A 101 101 LEU C C 101 173.530 175.055 -1.525 1
1 1132 . 16 1 1 A 101 101 LEU CA C 101 54.524 53.637 0.887 1
1 1133 . 16 1 1 A 101 101 LEU CB C 101 42.499 43.951 -1.452 1
1 1137 . 16 1 1 A 101 101 LEU N N 101 127.422 125.401 2.021 1
1 1138 . 16 1 1 A 102 102 LEU H H 102 8.493 8.605 -0.112 1
1 1139 . 16 1 1 A 102 102 LEU HA H 102 5.612 5.567 0.045 1
1 1149 . 16 1 1 A 102 102 LEU C C 102 175.794 175.861 -0.067 1
1 1150 . 16 1 1 A 102 102 LEU CA C 102 53.076 53.268 -0.192 1
1 1151 . 16 1 1 A 102 102 LEU CB C 102 45.994 44.656 1.338 1
1 1155 . 16 1 1 A 102 102 LEU N N 102 126.021 129.061 -3.040 1
1 1156 . 16 1 1 A 103 103 ALA H H 103 9.073 8.929 0.144 1
1 1157 . 16 1 1 A 103 103 ALA HA H 103 5.081 5.311 -0.230 1
1 1161 . 16 1 1 A 103 103 ALA C C 103 175.133 175.879 -0.746 1
1 1162 . 16 1 1 A 103 103 ALA CA C 103 51.688 49.788 1.900 1
1 1163 . 16 1 1 A 103 103 ALA CB C 103 21.689 22.399 -0.710 1
1 1164 . 16 1 1 A 103 103 ALA N N 103 117.679 122.817 -5.138 1
1 1165 . 16 1 1 A 104 104 ALA H H 104 8.582 8.537 0.045 1
1 1166 . 16 1 1 A 104 104 ALA HA H 104 5.220 4.869 0.351 1
1 1170 . 16 1 1 A 104 104 ALA C C 104 173.471 174.163 -0.692 1
1 1171 . 16 1 1 A 104 104 ALA CA C 104 47.959 49.941 -1.982 1
1 1172 . 16 1 1 A 104 104 ALA CB C 104 21.359 22.470 -1.111 1
1 1173 . 16 1 1 A 104 104 ALA N N 104 123.419 121.282 2.137 1
1 1174 . 16 1 1 A 105 105 PRO HA H 105 4.542 4.801 -0.259 1
1 1181 . 16 1 1 A 105 105 PRO C C 105 178.409 177.945 0.464 1
1 1182 . 16 1 1 A 105 105 PRO CA C 105 64.301 62.902 1.399 1
1 1183 . 16 1 1 A 105 105 PRO CB C 105 32.094 31.665 0.429 1
1 1186 . 16 1 1 A 106 106 ALA H H 106 8.302 8.685 -0.383 1
1 1187 . 16 1 1 A 106 106 ALA HA H 106 4.022 4.043 -0.021 1
1 1191 . 16 1 1 A 106 106 ALA C C 106 179.641 179.788 -0.147 1
1 1192 . 16 1 1 A 106 106 ALA CA C 106 56.341 55.127 1.214 1
1 1193 . 16 1 1 A 106 106 ALA CB C 106 18.523 18.206 0.317 1
1 1194 . 16 1 1 A 106 106 ALA N N 106 127.733 128.217 -0.484 1
1 1195 . 16 1 1 A 107 107 ALA H H 107 9.035 8.045 0.990 1
1 1196 . 16 1 1 A 107 107 ALA HA H 107 4.331 4.050 0.281 1
1 1200 . 16 1 1 A 107 107 ALA C C 107 178.586 179.448 -0.862 1
1 1201 . 16 1 1 A 107 107 ALA CA C 107 53.765 55.260 -1.495 1
1 1202 . 16 1 1 A 107 107 ALA CB C 107 18.728 18.413 0.315 1
1 1203 . 16 1 1 A 107 107 ALA N N 107 118.203 119.952 -1.749 1
1 1204 . 16 1 1 A 108 108 GLU H H 108 8.399 8.131 0.268 1
1 1205 . 16 1 1 A 108 108 GLU HA H 108 4.631 4.098 0.533 1
1 1210 . 16 1 1 A 108 108 GLU C C 108 177.127 178.792 -1.665 1
1 1211 . 16 1 1 A 108 108 GLU CA C 108 55.847 58.654 -2.807 1
1 1212 . 16 1 1 A 108 108 GLU CB C 108 32.135 29.952 2.183 1
1 1214 . 16 1 1 A 108 108 GLU N N 108 114.661 118.298 -3.637 1
1 1215 . 16 1 1 A 109 109 ARG H H 109 7.412 8.702 -1.290 1
1 1216 . 16 1 1 A 109 109 ARG HA H 109 3.682 4.133 -0.451 1
1 1223 . 16 1 1 A 109 109 ARG C C 109 176.917 179.325 -2.408 1
1 1224 . 16 1 1 A 109 109 ARG CA C 109 61.600 59.807 1.793 1
1 1225 . 16 1 1 A 109 109 ARG CB C 109 28.845 30.433 -1.588 1
1 1228 . 16 1 1 A 109 109 ARG N N 109 120.954 121.232 -0.278 1
1 1229 . 16 1 1 A 110 110 GLY H H 110 8.833 8.485 0.348 1
1 1230 . 16 1 1 A 110 110 GLY HA2 H 110 3.872 3.797 0.075 1
1 1231 . 16 1 1 A 110 110 GLY HA3 H 110 3.685 3.809 -0.124 1
1 1232 . 16 1 1 A 110 110 GLY C C 110 175.997 175.814 0.183 1
1 1233 . 16 1 1 A 110 110 GLY CA C 110 47.323 47.536 -0.213 1
1 1234 . 16 1 1 A 110 110 GLY N N 110 106.563 107.342 -0.779 1
1 1235 . 16 1 1 A 111 111 ASP H H 111 7.882 8.084 -0.202 1
1 1236 . 16 1 1 A 111 111 ASP HA H 111 4.312 4.379 -0.067 1
1 1239 . 16 1 1 A 111 111 ASP C C 111 179.467 178.722 0.745 1
1 1240 . 16 1 1 A 111 111 ASP CA C 111 56.976 56.648 0.328 1
1 1241 . 16 1 1 A 111 111 ASP CB C 111 40.648 40.921 -0.273 1
1 1242 . 16 1 1 A 111 111 ASP N N 111 121.402 121.496 -0.094 1
1 1243 . 16 1 1 A 112 112 TRP H H 112 7.804 8.441 -0.637 1
1 1244 . 16 1 1 A 112 112 TRP HA H 112 3.831 4.209 -0.378 1
1 1253 . 16 1 1 A 112 112 TRP C C 112 177.547 178.750 -1.203 1
1 1254 . 16 1 1 A 112 112 TRP CA C 112 62.006 59.940 2.066 1
1 1255 . 16 1 1 A 112 112 TRP CB C 112 29.421 29.280 0.141 1
1 1261 . 16 1 1 A 112 112 TRP N N 112 119.904 120.173 -0.269 1
1 1263 . 16 1 1 A 113 113 VAL H H 113 7.982 8.005 -0.023 1
1 1264 . 16 1 1 A 113 113 VAL HA H 113 3.072 3.575 -0.503 1
1 1272 . 16 1 1 A 113 113 VAL C C 113 178.015 178.418 -0.403 1
1 1273 . 16 1 1 A 113 113 VAL CA C 113 67.407 66.734 0.673 1
1 1274 . 16 1 1 A 113 113 VAL CB C 113 31.724 31.573 0.151 1
1 1277 . 16 1 1 A 113 113 VAL N N 113 117.575 119.039 -1.464 1
1 1278 . 16 1 1 A 114 114 GLN H H 114 8.268 8.211 0.057 1
1 1279 . 16 1 1 A 114 114 GLN HA H 114 3.994 3.981 0.013 1
1 1286 . 16 1 1 A 114 114 GLN C C 114 178.021 178.033 -0.012 1
1 1287 . 16 1 1 A 114 114 GLN CA C 114 59.112 59.092 0.020 1
1 1288 . 16 1 1 A 114 114 GLN CB C 114 28.685 28.741 -0.056 1
1 1290 . 16 1 1 A 114 114 GLN N N 114 117.479 119.968 -2.489 1
1 1292 . 16 1 1 A 115 115 ALA H H 115 7.915 8.450 -0.535 1
1 1293 . 16 1 1 A 115 115 ALA HA H 115 3.972 4.085 -0.113 1
1 1297 . 16 1 1 A 115 115 ALA C C 115 180.030 179.957 0.073 1
1 1298 . 16 1 1 A 115 115 ALA CA C 115 55.142 55.102 0.040 1
1 1299 . 16 1 1 A 115 115 ALA CB C 115 18.152 18.483 -0.331 1
1 1300 . 16 1 1 A 115 115 ALA N N 115 120.858 120.606 0.252 1
1 1301 . 16 1 1 A 116 116 ILE H H 116 8.172 8.313 -0.141 1
1 1302 . 16 1 1 A 116 116 ILE HA H 116 3.482 3.775 -0.293 1
1 1312 . 16 1 1 A 116 116 ILE C C 116 177.739 177.797 -0.058 1
1 1313 . 16 1 1 A 116 116 ILE CA C 116 66.119 65.018 1.101 1
1 1314 . 16 1 1 A 116 116 ILE CB C 116 38.222 37.656 0.566 1
1 1318 . 16 1 1 A 116 116 ILE N N 116 115.977 117.408 -1.431 1
1 1319 . 16 1 1 A 117 117 CYS H H 117 8.449 8.694 -0.245 1
1 1320 . 16 1 1 A 117 117 CYS HA H 117 4.032 4.427 -0.395 1
1 1323 . 16 1 1 A 117 117 CYS C C 117 177.321 177.411 -0.090 1
1 1324 . 16 1 1 A 117 117 CYS CA C 117 64.777 62.515 2.262 1
1 1325 . 16 1 1 A 117 117 CYS CB C 117 26.871 27.305 -0.434 1
1 1326 . 16 1 1 A 117 117 CYS N N 117 117.253 121.038 -3.785 1
1 1327 . 16 1 1 A 118 118 LEU H H 118 8.182 8.145 0.037 1
1 1328 . 16 1 1 A 118 118 LEU HA H 118 4.052 4.132 -0.080 1
1 1338 . 16 1 1 A 118 118 LEU C C 118 179.217 179.342 -0.125 1
1 1339 . 16 1 1 A 118 118 LEU CA C 118 57.877 57.637 0.240 1
1 1340 . 16 1 1 A 118 118 LEU CB C 118 42.088 41.570 0.518 1
1 1344 . 16 1 1 A 118 118 LEU N N 118 119.665 121.871 -2.206 1
1 1345 . 16 1 1 A 119 119 LEU H H 119 7.142 8.312 -1.170 1
1 1346 . 16 1 1 A 119 119 LEU HA H 119 4.192 3.947 0.245 1
1 1356 . 16 1 1 A 119 119 LEU C C 119 178.492 178.833 -0.341 1
1 1357 . 16 1 1 A 119 119 LEU CA C 119 56.259 58.040 -1.781 1
1 1358 . 16 1 1 A 119 119 LEU CB C 119 43.568 41.849 1.719 1
1 1362 . 16 1 1 A 119 119 LEU N N 119 116.244 119.055 -2.811 1
1 1363 . 16 1 1 A 120 120 ALA H H 120 8.513 8.352 0.161 1
1 1364 . 16 1 1 A 120 120 ALA HA H 120 3.878 3.962 -0.084 1
1 1368 . 16 1 1 A 120 120 ALA C C 120 178.358 178.338 0.020 1
1 1369 . 16 1 1 A 120 120 ALA CA C 120 53.765 54.927 -1.162 1
1 1370 . 16 1 1 A 120 120 ALA CB C 120 18.687 18.596 0.091 1
1 1371 . 16 1 1 A 120 120 ALA N N 120 120.009 120.246 -0.237 1
1 1372 . 16 1 1 A 121 121 PHE H H 121 7.822 8.316 -0.494 1
1 1373 . 16 1 1 A 121 121 PHE HA H 121 5.156 5.018 0.138 1
1 1381 . 16 1 1 A 121 121 PHE C C 121 176.273 176.008 0.265 1
1 1382 . 16 1 1 A 121 121 PHE CA C 121 55.741 56.637 -0.896 1
1 1383 . 16 1 1 A 121 121 PHE CB C 121 39.455 38.246 1.209 1
1 1389 . 16 1 1 A 121 121 PHE N N 121 113.981 115.606 -1.625 1
1 1390 . 16 1 1 A 122 122 SER H H 122 7.765 8.267 -0.502 1
1 1391 . 16 1 1 A 122 122 SER HA H 122 4.579 4.529 0.050 1
1 1394 . 16 1 1 A 122 122 SER C C 122 174.595 175.679 -1.084 1
1 1395 . 16 1 1 A 122 122 SER CA C 122 58.777 61.379 -2.602 1
1 1396 . 16 1 1 A 122 122 SER CB C 122 63.719 62.806 0.913 1
1 1397 . 16 1 1 A 122 122 SER N N 122 115.069 113.737 1.332 1
1 1398 . 16 1 1 A 123 123 GLY H H 123 8.223 8.015 0.208 1
1 1399 . 16 1 1 A 123 123 GLY HA2 H 123 4.174 4.065 0.109 1
1 1400 . 16 1 1 A 123 123 GLY HA3 H 123 4.100 4.066 0.034 1
1 1401 . 16 1 1 A 123 123 GLY C C 123 171.678 174.516 -2.838 1
1 1402 . 16 1 1 A 123 123 GLY CA C 123 44.815 45.277 -0.462 1
1 1403 . 16 1 1 A 123 123 GLY N N 123 110.151 109.001 1.150 1
1 1404 . 16 1 1 A 124 124 PRO HA H 124 4.482 4.538 -0.056 1
1 1411 . 16 1 1 A 124 124 PRO C C 124 177.314 176.246 1.068 1
1 1412 . 16 1 1 A 124 124 PRO CA C 124 63.206 64.106 -0.900 1
1 1413 . 16 1 1 A 124 124 PRO CB C 124 32.176 31.747 0.429 1
1 1416 . 16 1 1 A 125 125 SER H H 125 8.485 7.962 0.523 1
1 1417 . 16 1 1 A 125 125 SER HA H 125 4.472 4.878 -0.406 1
1 1420 . 16 1 1 A 125 125 SER C C 125 174.728 173.700 1.028 1
1 1421 . 16 1 1 A 125 125 SER CA C 125 58.353 58.367 -0.014 1
1 1422 . 16 1 1 A 125 125 SER CB C 125 64.048 65.412 -1.364 1
1 1423 . 16 1 1 A 125 125 SER N N 125 116.081 115.393 0.688 1
1 1424 . 16 1 1 A 126 126 SER H H 126 8.332 8.602 -0.270 1
1 1425 . 16 1 1 A 126 126 SER HA H 126 4.464 5.051 -0.587 1
1 1428 . 16 1 1 A 126 126 SER C C 126 173.980 174.332 -0.352 1
1 1429 . 16 1 1 A 126 126 SER CA C 126 58.336 57.105 1.231 1
1 1430 . 16 1 1 A 126 126 SER CB C 126 63.925 66.080 -2.155 1
1 1431 . 16 1 1 A 126 126 SER N N 126 118.037 116.229 1.808 1
1 1 . 17 1 1 A 6 6 SER HA H 6 4.458 5.182 -0.724 1
1 3 . 17 1 1 A 6 6 SER C C 6 175.108 173.223 1.885 1
1 4 . 17 1 1 A 6 6 SER CA C 6 58.689 56.463 2.226 1
1 5 . 17 1 1 A 6 6 SER CB C 6 63.678 66.218 -2.540 1
1 6 . 17 1 1 A 7 7 GLY H H 7 8.449 8.389 0.060 1
1 7 . 17 1 1 A 7 7 GLY HA2 H 7 3.965 4.175 -0.210 1
1 8 . 17 1 1 A 7 7 GLY HA3 H 7 3.965 4.176 -0.211 1
1 9 . 17 1 1 A 7 7 GLY C C 7 174.380 171.940 2.440 1
1 10 . 17 1 1 A 7 7 GLY CA C 7 45.435 45.707 -0.272 1
1 11 . 17 1 1 A 7 7 GLY N N 7 110.792 107.862 2.930 1
1 12 . 17 1 1 A 8 8 MET H H 8 8.259 8.436 -0.177 1
1 13 . 17 1 1 A 8 8 MET HA H 8 4.487 4.655 -0.168 1
1 21 . 17 1 1 A 8 8 MET C C 8 176.961 175.276 1.685 1
1 22 . 17 1 1 A 8 8 MET CA C 8 55.565 54.338 1.227 1
1 23 . 17 1 1 A 8 8 MET CB C 8 32.835 32.114 0.721 1
1 26 . 17 1 1 A 8 8 MET N N 8 119.639 120.749 -1.110 1
1 27 . 17 1 1 A 9 9 GLY H H 9 8.472 8.251 0.221 1
1 28 . 17 1 1 A 9 9 GLY HA2 H 9 3.946 4.137 -0.191 1
1 29 . 17 1 1 A 9 9 GLY HA3 H 9 3.946 4.140 -0.194 1
1 30 . 17 1 1 A 9 9 GLY C C 9 174.005 172.291 1.714 1
1 31 . 17 1 1 A 9 9 GLY CA C 9 45.488 44.804 0.684 1
1 32 . 17 1 1 A 9 9 GLY N N 9 110.107 109.974 0.133 1
1 33 . 17 1 1 A 10 10 ASP H H 10 8.292 9.096 -0.804 1
1 34 . 17 1 1 A 10 10 ASP HA H 10 4.636 4.955 -0.319 1
1 37 . 17 1 1 A 10 10 ASP C C 10 176.768 176.224 0.544 1
1 38 . 17 1 1 A 10 10 ASP CA C 10 54.206 53.767 0.439 1
1 39 . 17 1 1 A 10 10 ASP CB C 10 41.306 40.391 0.915 1
1 40 . 17 1 1 A 10 10 ASP N N 10 120.370 126.370 -6.000 1
1 41 . 17 1 1 A 11 11 GLY H H 11 8.452 8.526 -0.074 1
1 42 . 17 1 1 A 11 11 GLY HA2 H 11 3.980 4.067 -0.087 1
1 43 . 17 1 1 A 11 11 GLY HA3 H 11 4.022 4.076 -0.054 1
1 44 . 17 1 1 A 11 11 GLY C C 11 174.102 173.483 0.619 1
1 45 . 17 1 1 A 11 11 GLY CA C 11 45.170 46.307 -1.137 1
1 46 . 17 1 1 A 11 11 GLY N N 11 108.391 111.938 -3.547 1
1 47 . 17 1 1 A 12 12 ALA H H 12 8.293 7.879 0.414 1
1 48 . 17 1 1 A 12 12 ALA HA H 12 3.777 4.342 -0.565 1
1 52 . 17 1 1 A 12 12 ALA C C 12 178.193 178.569 -0.376 1
1 53 . 17 1 1 A 12 12 ALA CA C 12 52.759 52.570 0.189 1
1 54 . 17 1 1 A 12 12 ALA CB C 12 17.855 19.227 -1.372 1
1 55 . 17 1 1 A 12 12 ALA N N 12 124.185 122.380 1.805 1
1 56 . 17 1 1 A 13 13 VAL H H 13 8.822 8.303 0.519 1
1 57 . 17 1 1 A 13 13 VAL HA H 13 3.912 3.668 0.244 1
1 65 . 17 1 1 A 13 13 VAL C C 13 176.073 176.176 -0.103 1
1 66 . 17 1 1 A 13 13 VAL CA C 13 63.100 66.631 -3.531 1
1 67 . 17 1 1 A 13 13 VAL CB C 13 32.711 31.950 0.761 1
1 70 . 17 1 1 A 13 13 VAL N N 13 120.877 124.870 -3.993 1
1 71 . 17 1 1 A 14 14 LYS H H 14 7.093 7.511 -0.418 1
1 72 . 17 1 1 A 14 14 LYS HA H 14 4.169 4.488 -0.319 1
1 81 . 17 1 1 A 14 14 LYS C C 14 173.291 174.185 -0.894 1
1 82 . 17 1 1 A 14 14 LYS CA C 14 56.465 55.712 0.753 1
1 83 . 17 1 1 A 14 14 LYS CB C 14 35.960 35.248 0.712 1
1 87 . 17 1 1 A 14 14 LYS N N 14 118.693 118.204 0.489 1
1 88 . 17 1 1 A 15 15 GLN H H 15 8.522 8.774 -0.252 1
1 89 . 17 1 1 A 15 15 GLN HA H 15 5.542 5.320 0.222 1
1 96 . 17 1 1 A 15 15 GLN C C 15 174.992 174.533 0.459 1
1 97 . 17 1 1 A 15 15 GLN CA C 15 54.312 53.905 0.407 1
1 98 . 17 1 1 A 15 15 GLN CB C 15 33.585 32.785 0.800 1
1 100 . 17 1 1 A 15 15 GLN N N 15 124.024 123.945 0.079 1
1 102 . 17 1 1 A 16 16 GLY H H 16 8.740 8.171 0.569 1
1 103 . 17 1 1 A 16 16 GLY HA2 H 16 4.511 3.765 0.746 1
1 104 . 17 1 1 A 16 16 GLY HA3 H 16 4.064 4.170 -0.106 1
1 105 . 17 1 1 A 16 16 GLY C C 16 171.431 171.285 0.146 1
1 106 . 17 1 1 A 16 16 GLY CA C 16 46.106 46.056 0.050 1
1 107 . 17 1 1 A 16 16 GLY N N 16 109.611 107.142 2.469 1
1 108 . 17 1 1 A 17 17 PHE H H 17 8.886 8.380 0.506 1
1 109 . 17 1 1 A 17 17 PHE HA H 17 5.466 5.273 0.193 1
1 114 . 17 1 1 A 17 17 PHE C C 17 174.795 174.560 0.235 1
1 115 . 17 1 1 A 17 17 PHE CA C 17 57.788 55.976 1.812 1
1 116 . 17 1 1 A 17 17 PHE CB C 17 41.315 42.430 -1.115 1
1 119 . 17 1 1 A 17 17 PHE N N 17 122.684 119.952 2.732 1
1 120 . 17 1 1 A 18 18 LEU H H 18 8.762 8.946 -0.184 1
1 121 . 17 1 1 A 18 18 LEU HA H 18 4.946 4.704 0.242 1
1 131 . 17 1 1 A 18 18 LEU C C 18 175.461 174.916 0.545 1
1 132 . 17 1 1 A 18 18 LEU CA C 18 52.970 53.027 -0.057 1
1 133 . 17 1 1 A 18 18 LEU CB C 18 47.945 45.394 2.551 1
1 137 . 17 1 1 A 18 18 LEU N N 18 119.045 123.489 -4.444 1
1 138 . 17 1 1 A 19 19 TYR H H 19 9.272 8.097 1.175 1
1 139 . 17 1 1 A 19 19 TYR HA H 19 5.682 5.765 -0.083 1
1 146 . 17 1 1 A 19 19 TYR C C 19 174.829 174.413 0.416 1
1 147 . 17 1 1 A 19 19 TYR CA C 19 56.482 56.124 0.358 1
1 148 . 17 1 1 A 19 19 TYR CB C 19 41.717 40.600 1.117 1
1 153 . 17 1 1 A 19 19 TYR N N 19 118.024 121.048 -3.024 1
1 154 . 17 1 1 A 20 20 LEU H H 20 9.441 8.962 0.479 1
1 155 . 17 1 1 A 20 20 LEU HA H 20 5.283 5.292 -0.009 1
1 165 . 17 1 1 A 20 20 LEU C C 20 175.935 175.394 0.541 1
1 166 . 17 1 1 A 20 20 LEU CA C 20 53.464 53.879 -0.415 1
1 167 . 17 1 1 A 20 20 LEU CB C 20 46.570 46.152 0.418 1
1 171 . 17 1 1 A 20 20 LEU N N 20 122.838 125.128 -2.290 1
1 172 . 17 1 1 A 21 21 GLN H H 21 8.391 8.347 0.044 1
1 173 . 17 1 1 A 21 21 GLN HA H 21 3.791 4.093 -0.302 1
1 180 . 17 1 1 A 21 21 GLN C C 21 175.157 174.542 0.615 1
1 181 . 17 1 1 A 21 21 GLN CA C 21 56.094 55.508 0.586 1
1 182 . 17 1 1 A 21 21 GLN CB C 21 28.434 29.183 -0.749 1
1 184 . 17 1 1 A 21 21 GLN N N 21 129.943 127.463 2.480 1
1 186 . 17 1 1 A 22 22 GLN H H 22 8.829 8.519 0.310 1
1 187 . 17 1 1 A 22 22 GLN HA H 22 4.553 4.721 -0.168 1
1 194 . 17 1 1 A 22 22 GLN C C 22 174.998 175.783 -0.785 1
1 195 . 17 1 1 A 22 22 GLN CA C 22 54.912 54.151 0.761 1
1 196 . 17 1 1 A 22 22 GLN CB C 22 31.930 29.482 2.448 1
1 198 . 17 1 1 A 22 22 GLN N N 22 127.199 124.849 2.350 1
1 200 . 17 1 1 A 23 23 GLN HA H 23 4.142 4.149 -0.007 1
1 207 . 17 1 1 A 23 23 GLN CA C 23 56.427 58.156 -1.729 1
1 208 . 17 1 1 A 23 23 GLN CB C 23 29.227 28.489 0.738 1
1 211 . 17 1 1 A 24 24 GLN HA H 24 4.523 4.041 0.482 1
1 218 . 17 1 1 A 24 24 GLN CB C 24 29.759 28.845 0.914 1
1 221 . 17 1 1 A 25 25 THR HA H 25 3.870 4.402 -0.532 1
1 226 . 17 1 1 A 25 25 THR CA C 25 65.096 62.696 2.400 1
1 227 . 17 1 1 A 25 25 THR CB C 25 68.924 69.698 -0.774 1
1 229 . 17 1 1 A 26 26 PHE HA H 26 4.690 4.294 0.396 1
1 236 . 17 1 1 A 26 26 PHE C C 26 175.523 176.019 -0.496 1
1 237 . 17 1 1 A 26 26 PHE CA C 26 57.312 57.895 -0.583 1
1 238 . 17 1 1 A 26 26 PHE CB C 26 39.003 39.100 -0.097 1
1 243 . 17 1 1 A 27 27 GLY H H 27 7.755 8.825 -1.070 1
1 244 . 17 1 1 A 27 27 GLY HA2 H 27 4.172 3.817 0.355 1
1 245 . 17 1 1 A 27 27 GLY HA3 H 27 3.783 3.895 -0.112 1
1 246 . 17 1 1 A 27 27 GLY C C 27 172.557 173.181 -0.624 1
1 247 . 17 1 1 A 27 27 GLY CA C 27 44.924 44.946 -0.022 1
1 248 . 17 1 1 A 27 27 GLY N N 27 109.216 109.730 -0.514 1
1 249 . 17 1 1 A 28 28 LYS H H 28 8.241 8.206 0.035 1
1 250 . 17 1 1 A 28 28 LYS HA H 28 4.530 5.135 -0.605 1
1 259 . 17 1 1 A 28 28 LYS C C 28 176.204 174.503 1.701 1
1 260 . 17 1 1 A 28 28 LYS CA C 28 55.741 54.793 0.948 1
1 261 . 17 1 1 A 28 28 LYS CB C 28 33.904 35.772 -1.868 1
1 265 . 17 1 1 A 28 28 LYS N N 28 118.743 116.105 2.638 1
1 266 . 17 1 1 A 29 29 LYS H H 29 8.356 8.840 -0.484 1
1 267 . 17 1 1 A 29 29 LYS HA H 29 4.559 4.796 -0.237 1
1 274 . 17 1 1 A 29 29 LYS C C 29 175.420 174.721 0.699 1
1 275 . 17 1 1 A 29 29 LYS CA C 29 55.406 54.470 0.936 1
1 276 . 17 1 1 A 29 29 LYS CB C 29 35.618 36.313 -0.695 1
1 280 . 17 1 1 A 29 29 LYS N N 29 121.198 120.809 0.389 1
1 281 . 17 1 1 A 30 30 TRP H H 30 8.891 8.649 0.242 1
1 282 . 17 1 1 A 30 30 TRP HA H 30 4.951 4.773 0.178 1
1 291 . 17 1 1 A 30 30 TRP C C 30 175.902 175.731 0.171 1
1 292 . 17 1 1 A 30 30 TRP CA C 30 56.677 57.905 -1.228 1
1 293 . 17 1 1 A 30 30 TRP CB C 30 30.614 30.378 0.236 1
1 299 . 17 1 1 A 30 30 TRP N N 30 123.304 122.389 0.915 1
1 301 . 17 1 1 A 31 31 ARG H H 31 8.712 9.145 -0.433 1
1 302 . 17 1 1 A 31 31 ARG HA H 31 4.820 5.014 -0.194 1
1 309 . 17 1 1 A 31 31 ARG C C 31 174.026 174.354 -0.328 1
1 310 . 17 1 1 A 31 31 ARG CA C 31 54.895 53.726 1.169 1
1 311 . 17 1 1 A 31 31 ARG CB C 31 34.045 33.955 0.090 1
1 314 . 17 1 1 A 31 31 ARG N N 31 123.973 124.112 -0.139 1
1 315 . 17 1 1 A 32 32 ARG H H 32 8.820 8.428 0.392 1
1 316 . 17 1 1 A 32 32 ARG HA H 32 3.965 4.830 -0.865 1
1 323 . 17 1 1 A 32 32 ARG C C 32 174.785 174.690 0.095 1
1 324 . 17 1 1 A 32 32 ARG CA C 32 56.924 55.432 1.492 1
1 325 . 17 1 1 A 32 32 ARG CB C 32 31.806 31.375 0.431 1
1 328 . 17 1 1 A 32 32 ARG N N 32 127.041 127.360 -0.319 1
1 329 . 17 1 1 A 33 33 PHE H H 33 9.372 9.173 0.199 1
1 330 . 17 1 1 A 33 33 PHE HA H 33 4.863 4.973 -0.110 1
1 338 . 17 1 1 A 33 33 PHE C C 33 176.359 175.182 1.177 1
1 339 . 17 1 1 A 33 33 PHE CA C 33 57.224 56.606 0.618 1
1 340 . 17 1 1 A 33 33 PHE CB C 33 43.385 43.010 0.375 1
1 346 . 17 1 1 A 33 33 PHE N N 33 125.882 123.860 2.022 1
1 347 . 17 1 1 A 34 34 GLY H H 34 9.160 8.502 0.658 1
1 348 . 17 1 1 A 34 34 GLY HA2 H 34 4.182 4.102 0.080 1
1 349 . 17 1 1 A 34 34 GLY HA3 H 34 3.714 4.111 -0.397 1
1 350 . 17 1 1 A 34 34 GLY C C 34 172.920 172.981 -0.061 1
1 351 . 17 1 1 A 34 34 GLY CA C 34 46.247 45.948 0.299 1
1 352 . 17 1 1 A 34 34 GLY N N 34 108.654 111.834 -3.180 1
1 353 . 17 1 1 A 35 35 ALA H H 35 8.982 8.778 0.204 1
1 354 . 17 1 1 A 35 35 ALA HA H 35 5.660 5.495 0.165 1
1 358 . 17 1 1 A 35 35 ALA C C 35 176.547 176.105 0.442 1
1 359 . 17 1 1 A 35 35 ALA CA C 35 50.500 50.470 0.030 1
1 360 . 17 1 1 A 35 35 ALA CB C 35 24.034 20.384 3.650 1
1 361 . 17 1 1 A 35 35 ALA N N 35 130.076 128.588 1.488 1
1 362 . 17 1 1 A 36 36 SER H H 36 8.852 8.671 0.181 1
1 363 . 17 1 1 A 36 36 SER HA H 36 5.203 5.055 0.148 1
1 366 . 17 1 1 A 36 36 SER C C 36 170.939 172.357 -1.418 1
1 367 . 17 1 1 A 36 36 SER CA C 36 57.806 56.365 1.441 1
1 368 . 17 1 1 A 36 36 SER CB C 36 66.986 64.233 2.753 1
1 369 . 17 1 1 A 36 36 SER N N 36 116.620 118.737 -2.117 1
1 370 . 17 1 1 A 37 37 LEU H H 37 8.862 8.730 0.132 1
1 371 . 17 1 1 A 37 37 LEU HA H 37 5.163 5.044 0.119 1
1 381 . 17 1 1 A 37 37 LEU C C 37 173.525 174.309 -0.784 1
1 382 . 17 1 1 A 37 37 LEU CA C 37 53.112 53.185 -0.073 1
1 383 . 17 1 1 A 37 37 LEU CB C 37 46.077 44.250 1.827 1
1 387 . 17 1 1 A 37 37 LEU N N 37 127.638 128.549 -0.911 1
1 388 . 17 1 1 A 38 38 TYR H H 38 9.280 8.383 0.897 1
1 389 . 17 1 1 A 38 38 TYR HA H 38 4.820 5.187 -0.367 1
1 396 . 17 1 1 A 38 38 TYR C C 38 175.430 175.686 -0.256 1
1 397 . 17 1 1 A 38 38 TYR CA C 38 57.436 56.432 1.004 1
1 398 . 17 1 1 A 38 38 TYR CB C 38 42.128 41.266 0.862 1
1 403 . 17 1 1 A 38 38 TYR N N 38 125.215 127.115 -1.900 1
1 404 . 17 1 1 A 39 39 GLY H H 39 8.532 8.591 -0.059 1
1 405 . 17 1 1 A 39 39 GLY HA2 H 39 4.220 4.175 0.045 1
1 406 . 17 1 1 A 39 39 GLY HA3 H 39 3.941 4.178 -0.237 1
1 407 . 17 1 1 A 39 39 GLY C C 39 172.950 172.949 0.001 1
1 408 . 17 1 1 A 39 39 GLY CA C 39 44.817 43.982 0.835 1
1 409 . 17 1 1 A 39 39 GLY N N 39 106.424 110.025 -3.601 1
1 410 . 17 1 1 A 40 40 GLY H H 40 8.477 8.268 0.209 1
1 411 . 17 1 1 A 40 40 GLY HA2 H 40 4.102 4.219 -0.117 1
1 412 . 17 1 1 A 40 40 GLY HA3 H 40 3.927 4.224 -0.297 1
1 413 . 17 1 1 A 40 40 GLY C C 40 174.002 171.809 2.193 1
1 414 . 17 1 1 A 40 40 GLY CA C 40 44.694 46.138 -1.444 1
1 415 . 17 1 1 A 40 40 GLY N N 40 106.881 109.129 -2.248 1
1 416 . 17 1 1 A 41 41 SER H H 41 8.600 8.231 0.369 1
1 417 . 17 1 1 A 41 41 SER HA H 41 4.520 4.873 -0.353 1
1 420 . 17 1 1 A 41 41 SER C C 41 174.355 172.764 1.591 1
1 421 . 17 1 1 A 41 41 SER CA C 41 58.565 56.745 1.820 1
1 422 . 17 1 1 A 41 41 SER CB C 41 64.413 66.601 -2.188 1
1 423 . 17 1 1 A 41 41 SER N N 41 115.751 114.830 0.921 1
1 424 . 17 1 1 A 42 42 ASP H H 42 8.533 8.730 -0.197 1
1 425 . 17 1 1 A 42 42 ASP HA H 42 4.560 4.118 0.442 1
1 428 . 17 1 1 A 42 42 ASP CA C 42 55.230 55.193 0.037 1
1 429 . 17 1 1 A 42 42 ASP CB C 42 40.648 39.463 1.185 1
1 430 . 17 1 1 A 42 42 ASP N N 42 119.037 123.377 -4.340 1
1 431 . 17 1 1 A 43 43 CYS H H 43 8.152 7.775 0.377 1
1 432 . 17 1 1 A 43 43 CYS HA H 43 4.541 4.640 -0.099 1
1 435 . 17 1 1 A 43 43 CYS C C 43 173.975 174.708 -0.733 1
1 436 . 17 1 1 A 43 43 CYS CA C 43 58.265 57.881 0.384 1
1 437 . 17 1 1 A 43 43 CYS CB C 43 28.393 29.444 -1.051 1
1 438 . 17 1 1 A 43 43 CYS N N 43 116.881 117.011 -0.130 1
1 439 . 17 1 1 A 44 44 ALA H H 44 8.047 8.454 -0.407 1
1 440 . 17 1 1 A 44 44 ALA HA H 44 4.395 4.637 -0.242 1
1 444 . 17 1 1 A 44 44 ALA C C 44 176.472 177.775 -1.303 1
1 445 . 17 1 1 A 44 44 ALA CA C 44 52.688 51.285 1.403 1
1 446 . 17 1 1 A 44 44 ALA CB C 44 20.579 19.249 1.330 1
1 447 . 17 1 1 A 44 44 ALA N N 44 125.989 127.246 -1.257 1
1 448 . 17 1 1 A 45 45 LEU H H 45 8.052 7.707 0.345 1
1 449 . 17 1 1 A 45 45 LEU HA H 45 4.452 4.469 -0.017 1
1 459 . 17 1 1 A 45 45 LEU C C 45 176.196 176.856 -0.660 1
1 460 . 17 1 1 A 45 45 LEU CA C 45 53.771 54.406 -0.635 1
1 461 . 17 1 1 A 45 45 LEU CB C 45 43.116 42.959 0.157 1
1 465 . 17 1 1 A 45 45 LEU N N 45 119.889 116.858 3.031 1
1 466 . 17 1 1 A 46 46 ALA H H 46 8.381 7.430 0.951 1
1 467 . 17 1 1 A 46 46 ALA HA H 46 4.449 4.507 -0.058 1
1 471 . 17 1 1 A 46 46 ALA C C 46 179.093 177.414 1.679 1
1 472 . 17 1 1 A 46 46 ALA CA C 46 52.829 53.166 -0.337 1
1 473 . 17 1 1 A 46 46 ALA CB C 46 18.687 18.873 -0.186 1
1 474 . 17 1 1 A 46 46 ALA N N 46 125.635 123.303 2.332 1
1 475 . 17 1 1 A 47 47 ARG H H 47 9.012 8.814 0.198 1
1 476 . 17 1 1 A 47 47 ARG HA H 47 5.192 5.031 0.161 1
1 484 . 17 1 1 A 47 47 ARG C C 47 171.524 174.110 -2.586 1
1 485 . 17 1 1 A 47 47 ARG CA C 47 55.265 54.616 0.649 1
1 486 . 17 1 1 A 47 47 ARG CB C 47 30.970 33.748 -2.778 1
1 489 . 17 1 1 A 47 47 ARG N N 47 120.048 120.807 -0.759 1
1 491 . 17 1 1 A 48 48 LEU H H 48 9.029 8.814 0.215 1
1 492 . 17 1 1 A 48 48 LEU HA H 48 5.221 5.093 0.128 1
1 502 . 17 1 1 A 48 48 LEU C C 48 174.348 175.934 -1.586 1
1 503 . 17 1 1 A 48 48 LEU CA C 48 53.253 54.013 -0.760 1
1 504 . 17 1 1 A 48 48 LEU CB C 48 45.419 43.701 1.718 1
1 508 . 17 1 1 A 48 48 LEU N N 48 123.315 123.865 -0.550 1
1 509 . 17 1 1 A 49 49 GLU H H 49 9.473 8.520 0.953 1
1 510 . 17 1 1 A 49 49 GLU HA H 49 5.222 4.962 0.260 1
1 515 . 17 1 1 A 49 49 GLU C C 49 175.507 175.324 0.183 1
1 516 . 17 1 1 A 49 49 GLU CA C 49 55.159 55.345 -0.186 1
1 517 . 17 1 1 A 49 49 GLU CB C 49 32.341 31.872 0.469 1
1 519 . 17 1 1 A 49 49 GLU N N 49 124.751 125.436 -0.685 1
1 520 . 17 1 1 A 50 50 LEU H H 50 9.088 8.633 0.455 1
1 521 . 17 1 1 A 50 50 LEU HA H 50 5.382 5.282 0.100 1
1 531 . 17 1 1 A 50 50 LEU C C 50 175.474 175.558 -0.084 1
1 532 . 17 1 1 A 50 50 LEU CA C 50 52.865 53.537 -0.672 1
1 533 . 17 1 1 A 50 50 LEU CB C 50 43.239 45.676 -2.437 1
1 537 . 17 1 1 A 50 50 LEU N N 50 124.221 122.513 1.708 1
1 538 . 17 1 1 A 51 51 GLN H H 51 9.602 8.759 0.843 1
1 539 . 17 1 1 A 51 51 GLN HA H 51 5.095 5.219 -0.124 1
1 546 . 17 1 1 A 51 51 GLN C C 51 175.306 174.139 1.167 1
1 547 . 17 1 1 A 51 51 GLN CA C 51 54.576 54.216 0.360 1
1 548 . 17 1 1 A 51 51 GLN CB C 51 32.177 32.783 -0.606 1
1 550 . 17 1 1 A 51 51 GLN N N 51 123.268 121.631 1.637 1
1 552 . 17 1 1 A 52 52 GLU H H 52 9.172 9.278 -0.106 1
1 553 . 17 1 1 A 52 52 GLU HA H 52 4.092 5.251 -1.159 1
1 558 . 17 1 1 A 52 52 GLU C C 52 176.523 175.341 1.182 1
1 559 . 17 1 1 A 52 52 GLU CA C 52 57.500 54.840 2.660 1
1 560 . 17 1 1 A 52 52 GLU CB C 52 30.696 33.003 -2.307 1
1 562 . 17 1 1 A 52 52 GLU N N 52 128.982 122.185 6.797 1
1 563 . 17 1 1 A 53 53 GLY H H 53 8.644 9.180 -0.536 1
1 564 . 17 1 1 A 53 53 GLY HA2 H 53 4.261 4.473 -0.212 1
1 565 . 17 1 1 A 53 53 GLY HA3 H 53 3.993 4.475 -0.482 1
1 566 . 17 1 1 A 53 53 GLY C C 53 172.550 172.627 -0.077 1
1 567 . 17 1 1 A 53 53 GLY CA C 53 45.911 45.885 0.026 1
1 568 . 17 1 1 A 53 53 GLY N N 53 110.844 109.858 0.986 1
1 569 . 17 1 1 A 54 54 PRO HA H 54 4.392 4.673 -0.281 1
1 576 . 17 1 1 A 54 54 PRO C C 54 176.828 177.944 -1.116 1
1 577 . 17 1 1 A 54 54 PRO CA C 54 63.665 62.817 0.848 1
1 578 . 17 1 1 A 54 54 PRO CB C 54 32.012 31.728 0.284 1
1 581 . 17 1 1 A 55 55 GLU H H 55 8.934 8.990 -0.056 1
1 582 . 17 1 1 A 55 55 GLU HA H 55 4.193 4.049 0.144 1
1 587 . 17 1 1 A 55 55 GLU C C 55 176.189 175.956 0.233 1
1 588 . 17 1 1 A 55 55 GLU CA C 55 57.383 59.461 -2.078 1
1 589 . 17 1 1 A 55 55 GLU CB C 55 28.945 29.787 -0.842 1
1 591 . 17 1 1 A 55 55 GLU N N 55 120.312 124.379 -4.067 1
1 592 . 17 1 1 A 56 56 LYS H H 56 7.937 7.818 0.119 1
1 593 . 17 1 1 A 56 56 LYS HA H 56 4.578 4.742 -0.164 1
1 602 . 17 1 1 A 56 56 LYS C C 56 174.295 176.185 -1.890 1
1 603 . 17 1 1 A 56 56 LYS CA C 56 54.171 52.939 1.232 1
1 604 . 17 1 1 A 56 56 LYS CB C 56 32.555 34.369 -1.814 1
1 608 . 17 1 1 A 56 56 LYS N N 56 122.008 116.743 5.265 1
1 609 . 17 1 1 A 57 57 PRO HA H 57 4.370 4.307 0.063 1
1 616 . 17 1 1 A 57 57 PRO CA C 57 63.431 65.067 -1.636 1
1 617 . 17 1 1 A 57 57 PRO CB C 57 32.072 32.144 -0.072 1
1 620 . 17 1 1 A 58 58 ARG H H 58 8.310 8.892 -0.582 1
1 621 . 17 1 1 A 58 58 ARG HA H 58 4.295 4.051 0.244 1
1 628 . 17 1 1 A 58 58 ARG CA C 58 56.570 59.104 -2.534 1
1 629 . 17 1 1 A 58 58 ARG CB C 58 30.860 29.779 1.081 1
1 632 . 17 1 1 A 58 58 ARG N N 58 120.045 116.989 3.056 1
1 633 . 17 1 1 A 60 60 CYS HA H 60 4.482 4.806 -0.324 1
1 636 . 17 1 1 A 60 60 CYS CA C 60 58.621 57.671 0.950 1
1 637 . 17 1 1 A 60 60 CYS CB C 60 28.267 30.863 -2.596 1
1 638 . 17 1 1 A 61 61 GLU HA H 61 4.226 4.384 -0.158 1
1 643 . 17 1 1 A 61 61 GLU C C 61 176.299 176.617 -0.318 1
1 644 . 17 1 1 A 61 61 GLU CA C 61 57.100 56.624 0.476 1
1 645 . 17 1 1 A 61 61 GLU CB C 61 29.873 30.337 -0.464 1
1 647 . 17 1 1 A 62 62 ALA H H 62 8.282 8.228 0.054 1
1 648 . 17 1 1 A 62 62 ALA HA H 62 4.302 4.351 -0.049 1
1 652 . 17 1 1 A 62 62 ALA C C 62 177.277 177.283 -0.006 1
1 653 . 17 1 1 A 62 62 ALA CA C 62 52.512 52.701 -0.189 1
1 654 . 17 1 1 A 62 62 ALA CB C 62 19.592 19.268 0.324 1
1 655 . 17 1 1 A 62 62 ALA N N 62 124.386 126.562 -2.176 1
1 656 . 17 1 1 A 63 63 ALA H H 63 8.399 8.758 -0.359 1
1 657 . 17 1 1 A 63 63 ALA HA H 63 4.375 4.895 -0.520 1
1 661 . 17 1 1 A 63 63 ALA C C 63 176.843 175.127 1.716 1
1 662 . 17 1 1 A 63 63 ALA CA C 63 52.658 51.345 1.313 1
1 663 . 17 1 1 A 63 63 ALA CB C 63 19.592 23.664 -4.072 1
1 664 . 17 1 1 A 63 63 ALA N N 63 123.892 123.250 0.642 1
1 665 . 17 1 1 A 64 64 ARG H H 64 8.152 8.572 -0.420 1
1 666 . 17 1 1 A 64 64 ARG HA H 64 5.008 5.134 -0.126 1
1 673 . 17 1 1 A 64 64 ARG C C 64 175.594 175.055 0.539 1
1 674 . 17 1 1 A 64 64 ARG CA C 64 55.282 54.327 0.955 1
1 675 . 17 1 1 A 64 64 ARG CB C 64 32.506 32.654 -0.148 1
1 678 . 17 1 1 A 64 64 ARG N N 64 119.787 118.945 0.842 1
1 679 . 17 1 1 A 65 65 LYS H H 65 8.945 8.949 -0.004 1
1 680 . 17 1 1 A 65 65 LYS HA H 65 4.602 5.038 -0.436 1
1 689 . 17 1 1 A 65 65 LYS C C 65 174.657 174.583 0.074 1
1 690 . 17 1 1 A 65 65 LYS CA C 65 54.948 54.835 0.113 1
1 691 . 17 1 1 A 65 65 LYS CB C 65 34.068 34.920 -0.852 1
1 695 . 17 1 1 A 65 65 LYS N N 65 124.171 124.033 0.138 1
1 696 . 17 1 1 A 66 66 VAL H H 66 8.672 9.003 -0.331 1
1 697 . 17 1 1 A 66 66 VAL HA H 66 4.532 4.907 -0.375 1
1 705 . 17 1 1 A 66 66 VAL C C 66 175.078 173.808 1.270 1
1 706 . 17 1 1 A 66 66 VAL CA C 66 61.865 60.406 1.459 1
1 707 . 17 1 1 A 66 66 VAL CB C 66 33.835 34.507 -0.672 1
1 710 . 17 1 1 A 66 66 VAL N N 66 124.380 122.576 1.804 1
1 711 . 17 1 1 A 67 67 ILE H H 67 9.071 9.386 -0.315 1
1 712 . 17 1 1 A 67 67 ILE HA H 67 4.142 4.690 -0.548 1
1 722 . 17 1 1 A 67 67 ILE C C 67 175.819 175.618 0.201 1
1 723 . 17 1 1 A 67 67 ILE CA C 67 60.383 60.340 0.043 1
1 724 . 17 1 1 A 67 67 ILE CB C 67 39.908 38.453 1.455 1
1 728 . 17 1 1 A 67 67 ILE N N 67 129.537 129.562 -0.025 1
1 729 . 17 1 1 A 68 68 ARG H H 68 9.203 8.682 0.521 1
1 730 . 17 1 1 A 68 68 ARG HA H 68 4.198 4.328 -0.130 1
1 737 . 17 1 1 A 68 68 ARG C C 68 177.769 177.203 0.566 1
1 738 . 17 1 1 A 68 68 ARG CA C 68 56.835 57.139 -0.304 1
1 739 . 17 1 1 A 68 68 ARG CB C 68 29.832 30.886 -1.054 1
1 742 . 17 1 1 A 68 68 ARG N N 68 128.484 128.075 0.409 1
1 743 . 17 1 1 A 69 69 LEU H H 69 8.212 8.338 -0.126 1
1 744 . 17 1 1 A 69 69 LEU HA H 69 4.221 4.301 -0.080 1
1 754 . 17 1 1 A 69 69 LEU C C 69 178.996 178.239 0.757 1
1 755 . 17 1 1 A 69 69 LEU CA C 69 57.136 56.258 0.878 1
1 756 . 17 1 1 A 69 69 LEU CB C 69 39.455 41.964 -2.509 1
1 760 . 17 1 1 A 69 69 LEU N N 69 123.807 123.285 0.522 1
1 761 . 17 1 1 A 70 70 SER H H 70 8.823 7.860 0.963 1
1 762 . 17 1 1 A 70 70 SER HA H 70 4.331 4.324 0.007 1
1 765 . 17 1 1 A 70 70 SER C C 70 175.076 174.853 0.223 1
1 766 . 17 1 1 A 70 70 SER CA C 70 60.329 59.981 0.348 1
1 767 . 17 1 1 A 70 70 SER CB C 70 62.362 63.219 -0.857 1
1 768 . 17 1 1 A 70 70 SER N N 70 115.162 113.069 2.093 1
1 769 . 17 1 1 A 71 71 ASP H H 71 7.602 7.811 -0.209 1
1 770 . 17 1 1 A 71 71 ASP HA H 71 4.820 4.604 0.216 1
1 773 . 17 1 1 A 71 71 ASP C C 71 176.478 176.335 0.143 1
1 774 . 17 1 1 A 71 71 ASP CA C 71 54.241 54.464 -0.223 1
1 775 . 17 1 1 A 71 71 ASP CB C 71 41.347 41.666 -0.319 1
1 776 . 17 1 1 A 71 71 ASP N N 71 119.590 119.487 0.103 1
1 777 . 17 1 1 A 72 72 CYS H H 72 7.715 7.354 0.361 1
1 778 . 17 1 1 A 72 72 CYS HA H 72 4.372 4.799 -0.427 1
1 781 . 17 1 1 A 72 72 CYS C C 72 173.690 174.602 -0.912 1
1 782 . 17 1 1 A 72 72 CYS CA C 72 60.836 58.360 2.476 1
1 783 . 17 1 1 A 72 72 CYS CB C 72 27.655 27.078 0.577 1
1 784 . 17 1 1 A 72 72 CYS N N 72 118.346 118.722 -0.376 1
1 785 . 17 1 1 A 73 73 LEU H H 73 9.472 8.810 0.662 1
1 786 . 17 1 1 A 73 73 LEU HA H 73 4.593 4.018 0.575 1
1 796 . 17 1 1 A 73 73 LEU C C 73 177.562 176.763 0.799 1
1 797 . 17 1 1 A 73 73 LEU CA C 73 55.724 57.519 -1.795 1
1 798 . 17 1 1 A 73 73 LEU CB C 73 43.774 42.138 1.636 1
1 802 . 17 1 1 A 73 73 LEU N N 73 124.752 128.983 -4.231 1
1 803 . 17 1 1 A 74 74 ARG H H 74 7.658 7.695 -0.037 1
1 804 . 17 1 1 A 74 74 ARG HA H 74 4.592 5.117 -0.525 1
1 811 . 17 1 1 A 74 74 ARG C C 74 173.605 174.575 -0.970 1
1 812 . 17 1 1 A 74 74 ARG CA C 74 56.465 55.924 0.541 1
1 813 . 17 1 1 A 74 74 ARG CB C 74 34.068 33.943 0.125 1
1 816 . 17 1 1 A 74 74 ARG N N 74 115.565 115.671 -0.106 1
1 817 . 17 1 1 A 75 75 VAL H H 75 8.622 8.929 -0.307 1
1 818 . 17 1 1 A 75 75 VAL HA H 75 5.170 5.248 -0.078 1
1 826 . 17 1 1 A 75 75 VAL C C 75 173.985 174.387 -0.402 1
1 827 . 17 1 1 A 75 75 VAL CA C 75 60.930 59.740 1.190 1
1 828 . 17 1 1 A 75 75 VAL CB C 75 35.073 36.355 -1.282 1
1 831 . 17 1 1 A 75 75 VAL N N 75 124.278 119.686 4.592 1
1 832 . 17 1 1 A 76 76 ALA H H 76 8.272 8.906 -0.634 1
1 833 . 17 1 1 A 76 76 ALA HA H 76 4.648 4.906 -0.258 1
1 837 . 17 1 1 A 76 76 ALA C C 76 175.630 175.501 0.129 1
1 838 . 17 1 1 A 76 76 ALA CA C 76 51.294 51.370 -0.076 1
1 839 . 17 1 1 A 76 76 ALA CB C 76 22.759 23.622 -0.863 1
1 840 . 17 1 1 A 76 76 ALA N N 76 126.015 123.485 2.530 1
1 841 . 17 1 1 A 77 77 GLU H H 77 9.184 8.691 0.493 1
1 842 . 17 1 1 A 77 77 GLU HA H 77 4.060 5.236 -1.176 1
1 847 . 17 1 1 A 77 77 GLU C C 77 174.949 175.548 -0.599 1
1 848 . 17 1 1 A 77 77 GLU CA C 77 58.424 54.882 3.542 1
1 849 . 17 1 1 A 77 77 GLU CB C 77 30.161 32.358 -2.197 1
1 851 . 17 1 1 A 77 77 GLU N N 77 120.223 118.077 2.146 1
1 852 . 17 1 1 A 78 78 ALA H H 78 7.985 9.099 -1.114 1
1 853 . 17 1 1 A 78 78 ALA HA H 78 4.776 5.044 -0.268 1
1 857 . 17 1 1 A 78 78 ALA C C 78 177.250 177.273 -0.023 1
1 858 . 17 1 1 A 78 78 ALA CA C 78 50.888 50.844 0.044 1
1 859 . 17 1 1 A 78 78 ALA CB C 78 20.851 20.230 0.621 1
1 860 . 17 1 1 A 78 78 ALA N N 78 125.143 128.383 -3.240 1
1 861 . 17 1 1 A 79 79 GLY H H 79 8.604 8.723 -0.119 1
1 862 . 17 1 1 A 79 79 GLY HA2 H 79 4.327 4.168 0.159 1
1 863 . 17 1 1 A 79 79 GLY HA3 H 79 3.963 4.178 -0.215 1
1 864 . 17 1 1 A 79 79 GLY C C 79 175.360 174.636 0.724 1
1 865 . 17 1 1 A 79 79 GLY CA C 79 44.925 45.970 -1.045 1
1 866 . 17 1 1 A 79 79 GLY N N 79 109.420 112.870 -3.450 1
1 867 . 17 1 1 A 80 80 GLY H H 80 8.649 8.386 0.263 1
1 868 . 17 1 1 A 80 80 GLY HA2 H 80 3.962 4.043 -0.081 1
1 869 . 17 1 1 A 80 80 GLY HA3 H 80 3.962 4.053 -0.091 1
1 870 . 17 1 1 A 80 80 GLY C C 80 175.052 173.663 1.389 1
1 871 . 17 1 1 A 80 80 GLY CA C 80 45.955 46.093 -0.138 1
1 872 . 17 1 1 A 80 80 GLY N N 80 108.295 108.968 -0.673 1
1 873 . 17 1 1 A 81 81 GLU H H 81 8.921 7.738 1.183 1
1 874 . 17 1 1 A 81 81 GLU HA H 81 4.298 4.815 -0.517 1
1 879 . 17 1 1 A 81 81 GLU C C 81 176.532 174.642 1.890 1
1 880 . 17 1 1 A 81 81 GLU CA C 81 57.118 55.321 1.797 1
1 881 . 17 1 1 A 81 81 GLU CB C 81 28.599 33.736 -5.137 1
1 883 . 17 1 1 A 81 81 GLU N N 81 121.170 117.326 3.844 1
1 884 . 17 1 1 A 82 82 ALA H H 82 8.032 8.325 -0.293 1
1 885 . 17 1 1 A 82 82 ALA HA H 82 4.371 4.668 -0.297 1
1 889 . 17 1 1 A 82 82 ALA C C 82 177.160 177.141 0.019 1
1 890 . 17 1 1 A 82 82 ALA CA C 82 52.653 51.289 1.364 1
1 891 . 17 1 1 A 82 82 ALA CB C 82 19.304 22.213 -2.909 1
1 892 . 17 1 1 A 82 82 ALA N N 82 124.988 124.319 0.669 1
1 893 . 17 1 1 A 83 83 SER H H 83 8.319 8.878 -0.559 1
1 894 . 17 1 1 A 83 83 SER HA H 83 4.331 4.265 0.066 1
1 897 . 17 1 1 A 83 83 SER C C 83 174.045 175.437 -1.392 1
1 898 . 17 1 1 A 83 83 SER CA C 83 58.053 62.149 -4.096 1
1 899 . 17 1 1 A 83 83 SER CB C 83 63.184 63.020 0.164 1
1 900 . 17 1 1 A 83 83 SER N N 83 114.181 116.414 -2.233 1
1 901 . 17 1 1 A 84 84 SER H H 84 7.823 7.694 0.129 1
1 902 . 17 1 1 A 84 84 SER HA H 84 3.194 4.076 -0.882 1
1 905 . 17 1 1 A 84 84 SER C C 84 171.072 173.895 -2.823 1
1 906 . 17 1 1 A 84 84 SER CA C 84 57.206 56.881 0.325 1
1 907 . 17 1 1 A 84 84 SER CB C 84 61.622 63.155 -1.533 1
1 908 . 17 1 1 A 84 84 SER N N 84 117.302 114.871 2.431 1
1 909 . 17 1 1 A 85 85 PRO HA H 85 3.922 4.518 -0.596 1
1 916 . 17 1 1 A 85 85 PRO CA C 85 62.691 62.100 0.591 1
1 917 . 17 1 1 A 85 85 PRO CB C 85 31.515 32.675 -1.160 1
1 920 . 17 1 1 A 86 86 ARG HA H 86 3.882 4.360 -0.478 1
1 927 . 17 1 1 A 86 86 ARG C C 86 175.712 176.310 -0.598 1
1 928 . 17 1 1 A 86 86 ARG CA C 86 57.877 55.827 2.050 1
1 929 . 17 1 1 A 86 86 ARG CB C 86 29.791 31.284 -1.493 1
1 932 . 17 1 1 A 87 87 ASP H H 87 8.903 9.068 -0.165 1
1 933 . 17 1 1 A 87 87 ASP HA H 87 4.342 4.226 0.116 1
1 936 . 17 1 1 A 87 87 ASP C C 87 175.723 174.826 0.897 1
1 937 . 17 1 1 A 87 87 ASP CA C 87 56.377 55.363 1.014 1
1 938 . 17 1 1 A 87 87 ASP CB C 87 39.208 40.232 -1.024 1
1 939 . 17 1 1 A 87 87 ASP N N 87 117.520 124.701 -7.181 1
1 940 . 17 1 1 A 88 88 THR H H 88 7.776 7.438 0.338 1
1 941 . 17 1 1 A 88 88 THR HA H 88 5.101 5.118 -0.017 1
1 946 . 17 1 1 A 88 88 THR C C 88 173.825 172.886 0.939 1
1 947 . 17 1 1 A 88 88 THR CA C 88 60.154 59.594 0.560 1
1 948 . 17 1 1 A 88 88 THR CB C 88 72.702 72.983 -0.281 1
1 950 . 17 1 1 A 88 88 THR N N 88 108.770 108.810 -0.040 1
1 951 . 17 1 1 A 89 89 SER H H 89 9.006 9.135 -0.129 1
1 952 . 17 1 1 A 89 89 SER HA H 89 4.718 5.183 -0.465 1
1 955 . 17 1 1 A 89 89 SER C C 89 173.728 173.063 0.665 1
1 956 . 17 1 1 A 89 89 SER CA C 89 57.453 57.835 -0.382 1
1 957 . 17 1 1 A 89 89 SER CB C 89 65.611 65.401 0.210 1
1 958 . 17 1 1 A 89 89 SER N N 89 114.151 117.229 -3.078 1
1 959 . 17 1 1 A 90 90 ALA H H 90 9.001 8.770 0.231 1
1 960 . 17 1 1 A 90 90 ALA HA H 90 5.660 4.602 1.058 1
1 964 . 17 1 1 A 90 90 ALA C C 90 177.669 177.397 0.272 1
1 965 . 17 1 1 A 90 90 ALA CA C 90 51.670 52.006 -0.336 1
1 966 . 17 1 1 A 90 90 ALA CB C 90 22.265 19.854 2.411 1
1 967 . 17 1 1 A 90 90 ALA N N 90 126.177 128.988 -2.811 1
1 968 . 17 1 1 A 91 91 PHE H H 91 9.672 8.359 1.313 1
1 969 . 17 1 1 A 91 91 PHE HA H 91 5.039 5.572 -0.533 1
1 977 . 17 1 1 A 91 91 PHE C C 91 170.731 173.585 -2.854 1
1 978 . 17 1 1 A 91 91 PHE CA C 91 56.271 55.100 1.171 1
1 979 . 17 1 1 A 91 91 PHE CB C 91 41.553 42.088 -0.535 1
1 985 . 17 1 1 A 91 91 PHE N N 91 118.968 116.535 2.433 1
1 986 . 17 1 1 A 92 92 PHE H H 92 9.422 9.370 0.052 1
1 987 . 17 1 1 A 92 92 PHE HA H 92 5.674 5.241 0.433 1
1 995 . 17 1 1 A 92 92 PHE C C 92 174.570 175.325 -0.755 1
1 996 . 17 1 1 A 92 92 PHE CA C 92 55.917 57.360 -1.443 1
1 997 . 17 1 1 A 92 92 PHE CB C 92 42.787 41.746 1.041 1
1 1003 . 17 1 1 A 92 92 PHE N N 92 117.543 117.920 -0.377 1
1 1004 . 17 1 1 A 93 93 LEU H H 93 9.021 8.855 0.166 1
1 1005 . 17 1 1 A 93 93 LEU HA H 93 5.122 4.992 0.130 1
1 1015 . 17 1 1 A 93 93 LEU C C 93 174.799 174.335 0.464 1
1 1016 . 17 1 1 A 93 93 LEU CA C 93 54.912 54.777 0.135 1
1 1017 . 17 1 1 A 93 93 LEU CB C 93 45.254 44.731 0.523 1
1 1021 . 17 1 1 A 93 93 LEU N N 93 121.719 121.766 -0.047 1
1 1022 . 17 1 1 A 94 94 GLU H H 94 9.294 9.277 0.017 1
1 1023 . 17 1 1 A 94 94 GLU HA H 94 5.043 5.175 -0.132 1
1 1028 . 17 1 1 A 94 94 GLU C C 94 175.754 175.536 0.218 1
1 1029 . 17 1 1 A 94 94 GLU CA C 94 56.018 54.951 1.067 1
1 1030 . 17 1 1 A 94 94 GLU CB C 94 32.752 32.367 0.385 1
1 1032 . 17 1 1 A 94 94 GLU N N 94 127.032 128.687 -1.655 1
1 1033 . 17 1 1 A 95 95 THR H H 95 8.822 8.484 0.338 1
1 1034 . 17 1 1 A 95 95 THR HA H 95 5.398 5.133 0.265 1
1 1039 . 17 1 1 A 95 95 THR C C 95 173.860 175.248 -1.388 1
1 1040 . 17 1 1 A 95 95 THR CA C 95 59.588 59.628 -0.040 1
1 1041 . 17 1 1 A 95 95 THR CB C 95 72.191 72.416 -0.225 1
1 1043 . 17 1 1 A 95 95 THR N N 95 118.685 118.121 0.564 1
1 1044 . 17 1 1 A 96 96 LYS H H 96 8.823 8.718 0.105 1
1 1045 . 17 1 1 A 96 96 LYS HA H 96 4.022 3.983 0.039 1
1 1054 . 17 1 1 A 96 96 LYS C C 96 177.330 178.853 -1.523 1
1 1055 . 17 1 1 A 96 96 LYS CA C 96 59.588 60.050 -0.462 1
1 1056 . 17 1 1 A 96 96 LYS CB C 96 32.588 32.088 0.500 1
1 1060 . 17 1 1 A 96 96 LYS N N 96 118.801 122.331 -3.530 1
1 1061 . 17 1 1 A 97 97 GLU H H 97 8.092 7.769 0.323 1
1 1062 . 17 1 1 A 97 97 GLU HA H 97 4.282 4.206 0.076 1
1 1067 . 17 1 1 A 97 97 GLU C C 97 176.290 176.106 0.184 1
1 1068 . 17 1 1 A 97 97 GLU CA C 97 57.365 58.890 -1.525 1
1 1069 . 17 1 1 A 97 97 GLU CB C 97 31.559 30.874 0.685 1
1 1071 . 17 1 1 A 97 97 GLU N N 97 113.992 118.801 -4.809 1
1 1072 . 17 1 1 A 98 98 ARG H H 98 7.482 7.147 0.335 1
1 1073 . 17 1 1 A 98 98 ARG HA H 98 4.397 4.546 -0.149 1
1 1080 . 17 1 1 A 98 98 ARG C C 98 172.792 173.019 -0.227 1
1 1081 . 17 1 1 A 98 98 ARG CA C 98 55.689 54.722 0.967 1
1 1082 . 17 1 1 A 98 98 ARG CB C 98 32.711 31.701 1.010 1
1 1085 . 17 1 1 A 98 98 ARG N N 98 116.022 114.354 1.668 1
1 1086 . 17 1 1 A 99 99 LEU H H 99 8.423 8.230 0.193 1
1 1087 . 17 1 1 A 99 99 LEU HA H 99 4.807 4.722 0.085 1
1 1097 . 17 1 1 A 99 99 LEU C C 99 175.903 174.010 1.893 1
1 1098 . 17 1 1 A 99 99 LEU CA C 99 54.383 53.737 0.646 1
1 1099 . 17 1 1 A 99 99 LEU CB C 99 43.362 44.121 -0.759 1
1 1103 . 17 1 1 A 99 99 LEU N N 99 124.983 121.799 3.184 1
1 1104 . 17 1 1 A 100 100 TYR H H 100 9.144 9.612 -0.468 1
1 1105 . 17 1 1 A 100 100 TYR HA H 100 4.542 5.292 -0.750 1
1 1112 . 17 1 1 A 100 100 TYR C C 100 173.479 174.279 -0.800 1
1 1113 . 17 1 1 A 100 100 TYR CA C 100 57.735 55.959 1.776 1
1 1114 . 17 1 1 A 100 100 TYR CB C 100 39.291 41.035 -1.744 1
1 1119 . 17 1 1 A 100 100 TYR N N 100 126.679 126.775 -0.096 1
1 1120 . 17 1 1 A 101 101 LEU H H 101 9.043 8.855 0.188 1
1 1121 . 17 1 1 A 101 101 LEU HA H 101 4.747 4.989 -0.242 1
1 1131 . 17 1 1 A 101 101 LEU C C 101 173.530 175.008 -1.478 1
1 1132 . 17 1 1 A 101 101 LEU CA C 101 54.524 53.587 0.937 1
1 1133 . 17 1 1 A 101 101 LEU CB C 101 42.499 44.285 -1.786 1
1 1137 . 17 1 1 A 101 101 LEU N N 101 127.422 125.447 1.975 1
1 1138 . 17 1 1 A 102 102 LEU H H 102 8.493 8.591 -0.098 1
1 1139 . 17 1 1 A 102 102 LEU HA H 102 5.612 5.516 0.096 1
1 1149 . 17 1 1 A 102 102 LEU C C 102 175.794 175.862 -0.068 1
1 1150 . 17 1 1 A 102 102 LEU CA C 102 53.076 53.225 -0.149 1
1 1151 . 17 1 1 A 102 102 LEU CB C 102 45.994 44.788 1.206 1
1 1155 . 17 1 1 A 102 102 LEU N N 102 126.021 129.276 -3.255 1
1 1156 . 17 1 1 A 103 103 ALA H H 103 9.073 8.906 0.167 1
1 1157 . 17 1 1 A 103 103 ALA HA H 103 5.081 5.400 -0.319 1
1 1161 . 17 1 1 A 103 103 ALA C C 103 175.133 175.910 -0.777 1
1 1162 . 17 1 1 A 103 103 ALA CA C 103 51.688 49.890 1.798 1
1 1163 . 17 1 1 A 103 103 ALA CB C 103 21.689 22.622 -0.933 1
1 1164 . 17 1 1 A 103 103 ALA N N 103 117.679 122.841 -5.162 1
1 1165 . 17 1 1 A 104 104 ALA H H 104 8.582 8.570 0.012 1
1 1166 . 17 1 1 A 104 104 ALA HA H 104 5.220 4.809 0.411 1
1 1170 . 17 1 1 A 104 104 ALA C C 104 173.471 174.049 -0.578 1
1 1171 . 17 1 1 A 104 104 ALA CA C 104 47.959 49.885 -1.926 1
1 1172 . 17 1 1 A 104 104 ALA CB C 104 21.359 22.212 -0.853 1
1 1173 . 17 1 1 A 104 104 ALA N N 104 123.419 121.305 2.114 1
1 1174 . 17 1 1 A 105 105 PRO HA H 105 4.542 4.744 -0.202 1
1 1181 . 17 1 1 A 105 105 PRO C C 105 178.409 177.924 0.485 1
1 1182 . 17 1 1 A 105 105 PRO CA C 105 64.301 62.840 1.461 1
1 1183 . 17 1 1 A 105 105 PRO CB C 105 32.094 31.608 0.486 1
1 1186 . 17 1 1 A 106 106 ALA H H 106 8.302 8.674 -0.372 1
1 1187 . 17 1 1 A 106 106 ALA HA H 106 4.022 4.028 -0.006 1
1 1191 . 17 1 1 A 106 106 ALA C C 106 179.641 179.688 -0.047 1
1 1192 . 17 1 1 A 106 106 ALA CA C 106 56.341 55.176 1.165 1
1 1193 . 17 1 1 A 106 106 ALA CB C 106 18.523 18.206 0.317 1
1 1194 . 17 1 1 A 106 106 ALA N N 106 127.733 128.222 -0.489 1
1 1195 . 17 1 1 A 107 107 ALA H H 107 9.035 8.206 0.829 1
1 1196 . 17 1 1 A 107 107 ALA HA H 107 4.331 4.050 0.281 1
1 1200 . 17 1 1 A 107 107 ALA C C 107 178.586 179.634 -1.048 1
1 1201 . 17 1 1 A 107 107 ALA CA C 107 53.765 55.349 -1.584 1
1 1202 . 17 1 1 A 107 107 ALA CB C 107 18.728 18.315 0.413 1
1 1203 . 17 1 1 A 107 107 ALA N N 107 118.203 120.044 -1.841 1
1 1204 . 17 1 1 A 108 108 GLU H H 108 8.399 7.973 0.426 1
1 1205 . 17 1 1 A 108 108 GLU HA H 108 4.631 4.135 0.496 1
1 1210 . 17 1 1 A 108 108 GLU C C 108 177.127 178.871 -1.744 1
1 1211 . 17 1 1 A 108 108 GLU CA C 108 55.847 58.677 -2.830 1
1 1212 . 17 1 1 A 108 108 GLU CB C 108 32.135 30.016 2.119 1
1 1214 . 17 1 1 A 108 108 GLU N N 108 114.661 118.034 -3.373 1
1 1215 . 17 1 1 A 109 109 ARG H H 109 7.412 8.677 -1.265 1
1 1216 . 17 1 1 A 109 109 ARG HA H 109 3.682 4.103 -0.421 1
1 1223 . 17 1 1 A 109 109 ARG C C 109 176.917 179.157 -2.240 1
1 1224 . 17 1 1 A 109 109 ARG CA C 109 61.600 59.743 1.857 1
1 1225 . 17 1 1 A 109 109 ARG CB C 109 28.845 30.403 -1.558 1
1 1228 . 17 1 1 A 109 109 ARG N N 109 120.954 121.230 -0.276 1
1 1229 . 17 1 1 A 110 110 GLY H H 110 8.833 8.017 0.816 1
1 1230 . 17 1 1 A 110 110 GLY HA2 H 110 3.872 3.801 0.071 1
1 1231 . 17 1 1 A 110 110 GLY HA3 H 110 3.685 3.812 -0.127 1
1 1232 . 17 1 1 A 110 110 GLY C C 110 175.997 175.859 0.138 1
1 1233 . 17 1 1 A 110 110 GLY CA C 110 47.323 47.541 -0.218 1
1 1234 . 17 1 1 A 110 110 GLY N N 110 106.563 107.300 -0.737 1
1 1235 . 17 1 1 A 111 111 ASP H H 111 7.882 8.276 -0.394 1
1 1236 . 17 1 1 A 111 111 ASP HA H 111 4.312 4.377 -0.065 1
1 1239 . 17 1 1 A 111 111 ASP C C 111 179.467 178.780 0.687 1
1 1240 . 17 1 1 A 111 111 ASP CA C 111 56.976 56.595 0.381 1
1 1241 . 17 1 1 A 111 111 ASP CB C 111 40.648 40.842 -0.194 1
1 1242 . 17 1 1 A 111 111 ASP N N 111 121.402 121.599 -0.197 1
1 1243 . 17 1 1 A 112 112 TRP H H 112 7.804 8.550 -0.746 1
1 1244 . 17 1 1 A 112 112 TRP HA H 112 3.831 4.155 -0.324 1
1 1253 . 17 1 1 A 112 112 TRP C C 112 177.547 178.676 -1.129 1
1 1254 . 17 1 1 A 112 112 TRP CA C 112 62.006 60.053 1.953 1
1 1255 . 17 1 1 A 112 112 TRP CB C 112 29.421 29.405 0.016 1
1 1261 . 17 1 1 A 112 112 TRP N N 112 119.904 120.038 -0.134 1
1 1263 . 17 1 1 A 113 113 VAL H H 113 7.982 7.993 -0.011 1
1 1264 . 17 1 1 A 113 113 VAL HA H 113 3.072 3.628 -0.556 1
1 1272 . 17 1 1 A 113 113 VAL C C 113 178.015 177.924 0.091 1
1 1273 . 17 1 1 A 113 113 VAL CA C 113 67.407 66.765 0.642 1
1 1274 . 17 1 1 A 113 113 VAL CB C 113 31.724 31.486 0.238 1
1 1277 . 17 1 1 A 113 113 VAL N N 113 117.575 119.188 -1.613 1
1 1278 . 17 1 1 A 114 114 GLN H H 114 8.268 8.150 0.118 1
1 1279 . 17 1 1 A 114 114 GLN HA H 114 3.994 3.938 0.056 1
1 1286 . 17 1 1 A 114 114 GLN C C 114 178.021 178.097 -0.076 1
1 1287 . 17 1 1 A 114 114 GLN CA C 114 59.112 58.871 0.241 1
1 1288 . 17 1 1 A 114 114 GLN CB C 114 28.685 28.392 0.293 1
1 1290 . 17 1 1 A 114 114 GLN N N 114 117.479 119.604 -2.125 1
1 1292 . 17 1 1 A 115 115 ALA H H 115 7.915 7.917 -0.002 1
1 1293 . 17 1 1 A 115 115 ALA HA H 115 3.972 4.055 -0.083 1
1 1297 . 17 1 1 A 115 115 ALA C C 115 180.030 179.652 0.378 1
1 1298 . 17 1 1 A 115 115 ALA CA C 115 55.142 55.153 -0.011 1
1 1299 . 17 1 1 A 115 115 ALA CB C 115 18.152 18.639 -0.487 1
1 1300 . 17 1 1 A 115 115 ALA N N 115 120.858 120.710 0.148 1
1 1301 . 17 1 1 A 116 116 ILE H H 116 8.172 8.216 -0.044 1
1 1302 . 17 1 1 A 116 116 ILE HA H 116 3.482 3.859 -0.377 1
1 1312 . 17 1 1 A 116 116 ILE C C 116 177.739 178.597 -0.858 1
1 1313 . 17 1 1 A 116 116 ILE CA C 116 66.119 64.972 1.147 1
1 1314 . 17 1 1 A 116 116 ILE CB C 116 38.222 37.894 0.328 1
1 1318 . 17 1 1 A 116 116 ILE N N 116 115.977 117.492 -1.515 1
1 1319 . 17 1 1 A 117 117 CYS H H 117 8.449 8.349 0.100 1
1 1320 . 17 1 1 A 117 117 CYS HA H 117 4.032 4.510 -0.478 1
1 1323 . 17 1 1 A 117 117 CYS C C 117 177.321 177.391 -0.070 1
1 1324 . 17 1 1 A 117 117 CYS CA C 117 64.777 62.167 2.610 1
1 1325 . 17 1 1 A 117 117 CYS CB C 117 26.871 27.119 -0.248 1
1 1326 . 17 1 1 A 117 117 CYS N N 117 117.253 120.673 -3.420 1
1 1327 . 17 1 1 A 118 118 LEU H H 118 8.182 8.174 0.008 1
1 1328 . 17 1 1 A 118 118 LEU HA H 118 4.052 4.077 -0.025 1
1 1338 . 17 1 1 A 118 118 LEU C C 118 179.217 179.412 -0.195 1
1 1339 . 17 1 1 A 118 118 LEU CA C 118 57.877 57.623 0.254 1
1 1340 . 17 1 1 A 118 118 LEU CB C 118 42.088 41.730 0.358 1
1 1344 . 17 1 1 A 118 118 LEU N N 118 119.665 121.316 -1.651 1
1 1345 . 17 1 1 A 119 119 LEU H H 119 7.142 8.029 -0.887 1
1 1346 . 17 1 1 A 119 119 LEU HA H 119 4.192 4.125 0.067 1
1 1356 . 17 1 1 A 119 119 LEU C C 119 178.492 178.538 -0.046 1
1 1357 . 17 1 1 A 119 119 LEU CA C 119 56.259 58.000 -1.741 1
1 1358 . 17 1 1 A 119 119 LEU CB C 119 43.568 41.877 1.691 1
1 1362 . 17 1 1 A 119 119 LEU N N 119 116.244 119.567 -3.323 1
1 1363 . 17 1 1 A 120 120 ALA H H 120 8.513 8.103 0.410 1
1 1364 . 17 1 1 A 120 120 ALA HA H 120 3.878 4.042 -0.164 1
1 1368 . 17 1 1 A 120 120 ALA C C 120 178.358 178.756 -0.398 1
1 1369 . 17 1 1 A 120 120 ALA CA C 120 53.765 55.121 -1.356 1
1 1370 . 17 1 1 A 120 120 ALA CB C 120 18.687 18.827 -0.140 1
1 1371 . 17 1 1 A 120 120 ALA N N 120 120.009 120.487 -0.478 1
1 1372 . 17 1 1 A 121 121 PHE H H 121 7.822 8.158 -0.336 1
1 1373 . 17 1 1 A 121 121 PHE HA H 121 5.156 4.875 0.281 1
1 1381 . 17 1 1 A 121 121 PHE C C 121 176.273 175.167 1.106 1
1 1382 . 17 1 1 A 121 121 PHE CA C 121 55.741 56.737 -0.996 1
1 1383 . 17 1 1 A 121 121 PHE CB C 121 39.455 38.013 1.442 1
1 1389 . 17 1 1 A 121 121 PHE N N 121 113.981 114.180 -0.199 1
1 1390 . 17 1 1 A 122 122 SER H H 122 7.765 7.975 -0.210 1
1 1391 . 17 1 1 A 122 122 SER HA H 122 4.579 4.746 -0.167 1
1 1394 . 17 1 1 A 122 122 SER C C 122 174.595 173.603 0.992 1
1 1395 . 17 1 1 A 122 122 SER CA C 122 58.777 57.378 1.399 1
1 1396 . 17 1 1 A 122 122 SER CB C 122 63.719 63.438 0.281 1
1 1397 . 17 1 1 A 122 122 SER N N 122 115.069 117.447 -2.378 1
1 1398 . 17 1 1 A 123 123 GLY H H 123 8.223 8.232 -0.009 1
1 1399 . 17 1 1 A 123 123 GLY HA2 H 123 4.174 4.236 -0.062 1
1 1400 . 17 1 1 A 123 123 GLY HA3 H 123 4.100 4.237 -0.137 1
1 1401 . 17 1 1 A 123 123 GLY C C 123 171.678 172.472 -0.794 1
1 1402 . 17 1 1 A 123 123 GLY CA C 123 44.815 45.636 -0.821 1
1 1403 . 17 1 1 A 123 123 GLY N N 123 110.151 113.587 -3.436 1
1 1404 . 17 1 1 A 124 124 PRO HA H 124 4.482 4.594 -0.112 1
1 1411 . 17 1 1 A 124 124 PRO C C 124 177.314 176.521 0.793 1
1 1412 . 17 1 1 A 124 124 PRO CA C 124 63.206 62.609 0.597 1
1 1413 . 17 1 1 A 124 124 PRO CB C 124 32.176 32.865 -0.689 1
1 1416 . 17 1 1 A 125 125 SER H H 125 8.485 8.392 0.093 1
1 1417 . 17 1 1 A 125 125 SER HA H 125 4.472 4.710 -0.238 1
1 1420 . 17 1 1 A 125 125 SER C C 125 174.728 174.260 0.468 1
1 1421 . 17 1 1 A 125 125 SER CA C 125 58.353 56.993 1.360 1
1 1422 . 17 1 1 A 125 125 SER CB C 125 64.048 63.576 0.472 1
1 1423 . 17 1 1 A 125 125 SER N N 125 116.081 115.662 0.419 1
1 1424 . 17 1 1 A 126 126 SER H H 126 8.332 9.143 -0.811 1
1 1425 . 17 1 1 A 126 126 SER HA H 126 4.464 4.649 -0.185 1
1 1428 . 17 1 1 A 126 126 SER C C 126 173.980 175.121 -1.141 1
1 1429 . 17 1 1 A 126 126 SER CA C 126 58.336 59.850 -1.514 1
1 1430 . 17 1 1 A 126 126 SER CB C 126 63.925 64.415 -0.490 1
1 1431 . 17 1 1 A 126 126 SER N N 126 118.037 119.861 -1.824 1
1 1 . 18 1 1 A 6 6 SER HA H 6 4.458 4.920 -0.462 1
1 3 . 18 1 1 A 6 6 SER C C 6 175.108 172.821 2.287 1
1 4 . 18 1 1 A 6 6 SER CA C 6 58.689 57.575 1.114 1
1 5 . 18 1 1 A 6 6 SER CB C 6 63.678 64.959 -1.281 1
1 6 . 18 1 1 A 7 7 GLY H H 7 8.449 8.349 0.100 1
1 7 . 18 1 1 A 7 7 GLY HA2 H 7 3.965 4.019 -0.054 1
1 8 . 18 1 1 A 7 7 GLY HA3 H 7 3.965 4.020 -0.055 1
1 9 . 18 1 1 A 7 7 GLY C C 7 174.380 174.815 -0.435 1
1 10 . 18 1 1 A 7 7 GLY CA C 7 45.435 45.673 -0.238 1
1 11 . 18 1 1 A 7 7 GLY N N 7 110.792 112.205 -1.413 1
1 12 . 18 1 1 A 8 8 MET H H 8 8.259 7.877 0.382 1
1 13 . 18 1 1 A 8 8 MET HA H 8 4.487 4.234 0.253 1
1 21 . 18 1 1 A 8 8 MET C C 8 176.961 176.890 0.071 1
1 22 . 18 1 1 A 8 8 MET CA C 8 55.565 57.526 -1.961 1
1 23 . 18 1 1 A 8 8 MET CB C 8 32.835 32.456 0.379 1
1 26 . 18 1 1 A 8 8 MET N N 8 119.639 120.924 -1.285 1
1 27 . 18 1 1 A 9 9 GLY H H 9 8.472 8.614 -0.142 1
1 28 . 18 1 1 A 9 9 GLY HA2 H 9 3.946 4.136 -0.190 1
1 29 . 18 1 1 A 9 9 GLY HA3 H 9 3.946 4.137 -0.191 1
1 30 . 18 1 1 A 9 9 GLY C C 9 174.005 171.461 2.544 1
1 31 . 18 1 1 A 9 9 GLY CA C 9 45.488 44.992 0.496 1
1 32 . 18 1 1 A 9 9 GLY N N 9 110.107 111.297 -1.190 1
1 33 . 18 1 1 A 10 10 ASP H H 10 8.292 8.573 -0.281 1
1 34 . 18 1 1 A 10 10 ASP HA H 10 4.636 5.481 -0.845 1
1 37 . 18 1 1 A 10 10 ASP C C 10 176.768 174.679 2.089 1
1 38 . 18 1 1 A 10 10 ASP CA C 10 54.206 53.695 0.511 1
1 39 . 18 1 1 A 10 10 ASP CB C 10 41.306 44.076 -2.770 1
1 40 . 18 1 1 A 10 10 ASP N N 10 120.370 123.005 -2.635 1
1 41 . 18 1 1 A 11 11 GLY H H 11 8.452 8.430 0.022 1
1 42 . 18 1 1 A 11 11 GLY HA2 H 11 3.980 4.222 -0.242 1
1 43 . 18 1 1 A 11 11 GLY HA3 H 11 4.022 4.270 -0.248 1
1 44 . 18 1 1 A 11 11 GLY C C 11 174.102 173.226 0.876 1
1 45 . 18 1 1 A 11 11 GLY CA C 11 45.170 44.795 0.375 1
1 46 . 18 1 1 A 11 11 GLY N N 11 108.391 111.135 -2.744 1
1 47 . 18 1 1 A 12 12 ALA H H 12 8.293 8.258 0.035 1
1 48 . 18 1 1 A 12 12 ALA HA H 12 3.777 4.109 -0.332 1
1 52 . 18 1 1 A 12 12 ALA C C 12 178.193 178.450 -0.257 1
1 53 . 18 1 1 A 12 12 ALA CA C 12 52.759 52.588 0.171 1
1 54 . 18 1 1 A 12 12 ALA CB C 12 17.855 19.147 -1.292 1
1 55 . 18 1 1 A 12 12 ALA N N 12 124.185 125.404 -1.219 1
1 56 . 18 1 1 A 13 13 VAL H H 13 8.822 8.611 0.211 1
1 57 . 18 1 1 A 13 13 VAL HA H 13 3.912 3.595 0.317 1
1 65 . 18 1 1 A 13 13 VAL C C 13 176.073 176.119 -0.046 1
1 66 . 18 1 1 A 13 13 VAL CA C 13 63.100 66.602 -3.502 1
1 67 . 18 1 1 A 13 13 VAL CB C 13 32.711 31.828 0.883 1
1 70 . 18 1 1 A 13 13 VAL N N 13 120.877 124.872 -3.995 1
1 71 . 18 1 1 A 14 14 LYS H H 14 7.093 7.245 -0.152 1
1 72 . 18 1 1 A 14 14 LYS HA H 14 4.169 4.615 -0.446 1
1 81 . 18 1 1 A 14 14 LYS C C 14 173.291 173.812 -0.521 1
1 82 . 18 1 1 A 14 14 LYS CA C 14 56.465 55.669 0.796 1
1 83 . 18 1 1 A 14 14 LYS CB C 14 35.960 35.602 0.358 1
1 87 . 18 1 1 A 14 14 LYS N N 14 118.693 118.491 0.202 1
1 88 . 18 1 1 A 15 15 GLN H H 15 8.522 8.618 -0.096 1
1 89 . 18 1 1 A 15 15 GLN HA H 15 5.542 5.260 0.282 1
1 96 . 18 1 1 A 15 15 GLN C C 15 174.992 175.900 -0.908 1
1 97 . 18 1 1 A 15 15 GLN CA C 15 54.312 53.952 0.360 1
1 98 . 18 1 1 A 15 15 GLN CB C 15 33.585 31.707 1.878 1
1 100 . 18 1 1 A 15 15 GLN N N 15 124.024 125.267 -1.243 1
1 102 . 18 1 1 A 16 16 GLY H H 16 8.740 8.206 0.534 1
1 103 . 18 1 1 A 16 16 GLY HA2 H 16 4.511 3.856 0.655 1
1 104 . 18 1 1 A 16 16 GLY HA3 H 16 4.064 4.380 -0.316 1
1 105 . 18 1 1 A 16 16 GLY C C 16 171.431 171.147 0.284 1
1 106 . 18 1 1 A 16 16 GLY CA C 16 46.106 45.917 0.189 1
1 107 . 18 1 1 A 16 16 GLY N N 16 109.611 109.215 0.396 1
1 108 . 18 1 1 A 17 17 PHE H H 17 8.886 8.440 0.446 1
1 109 . 18 1 1 A 17 17 PHE HA H 17 5.466 5.152 0.314 1
1 114 . 18 1 1 A 17 17 PHE C C 17 174.795 174.697 0.098 1
1 115 . 18 1 1 A 17 17 PHE CA C 17 57.788 56.314 1.474 1
1 116 . 18 1 1 A 17 17 PHE CB C 17 41.315 41.461 -0.146 1
1 119 . 18 1 1 A 17 17 PHE N N 17 122.684 119.451 3.233 1
1 120 . 18 1 1 A 18 18 LEU H H 18 8.762 9.008 -0.246 1
1 121 . 18 1 1 A 18 18 LEU HA H 18 4.946 4.622 0.324 1
1 131 . 18 1 1 A 18 18 LEU C C 18 175.461 175.474 -0.013 1
1 132 . 18 1 1 A 18 18 LEU CA C 18 52.970 52.892 0.078 1
1 133 . 18 1 1 A 18 18 LEU CB C 18 47.945 44.727 3.218 1
1 137 . 18 1 1 A 18 18 LEU N N 18 119.045 123.972 -4.927 1
1 138 . 18 1 1 A 19 19 TYR H H 19 9.272 8.255 1.017 1
1 139 . 18 1 1 A 19 19 TYR HA H 19 5.682 5.692 -0.010 1
1 146 . 18 1 1 A 19 19 TYR C C 19 174.829 174.306 0.523 1
1 147 . 18 1 1 A 19 19 TYR CA C 19 56.482 56.650 -0.168 1
1 148 . 18 1 1 A 19 19 TYR CB C 19 41.717 41.269 0.448 1
1 153 . 18 1 1 A 19 19 TYR N N 19 118.024 118.876 -0.852 1
1 154 . 18 1 1 A 20 20 LEU H H 20 9.441 9.066 0.375 1
1 155 . 18 1 1 A 20 20 LEU HA H 20 5.283 5.366 -0.083 1
1 165 . 18 1 1 A 20 20 LEU C C 20 175.935 175.875 0.060 1
1 166 . 18 1 1 A 20 20 LEU CA C 20 53.464 53.875 -0.411 1
1 167 . 18 1 1 A 20 20 LEU CB C 20 46.570 46.188 0.382 1
1 171 . 18 1 1 A 20 20 LEU N N 20 122.838 125.592 -2.754 1
1 172 . 18 1 1 A 21 21 GLN H H 21 8.391 8.917 -0.526 1
1 173 . 18 1 1 A 21 21 GLN HA H 21 3.791 4.295 -0.504 1
1 180 . 18 1 1 A 21 21 GLN C C 21 175.157 174.688 0.469 1
1 181 . 18 1 1 A 21 21 GLN CA C 21 56.094 55.687 0.407 1
1 182 . 18 1 1 A 21 21 GLN CB C 21 28.434 28.739 -0.305 1
1 184 . 18 1 1 A 21 21 GLN N N 21 129.943 127.777 2.166 1
1 186 . 18 1 1 A 22 22 GLN H H 22 8.829 8.048 0.781 1
1 187 . 18 1 1 A 22 22 GLN HA H 22 4.553 4.915 -0.362 1
1 194 . 18 1 1 A 22 22 GLN C C 22 174.998 174.544 0.454 1
1 195 . 18 1 1 A 22 22 GLN CA C 22 54.912 54.491 0.421 1
1 196 . 18 1 1 A 22 22 GLN CB C 22 31.930 32.295 -0.365 1
1 198 . 18 1 1 A 22 22 GLN N N 22 127.199 125.759 1.440 1
1 200 . 18 1 1 A 23 23 GLN HA H 23 4.142 4.293 -0.151 1
1 207 . 18 1 1 A 23 23 GLN CA C 23 56.427 54.832 1.595 1
1 208 . 18 1 1 A 23 23 GLN CB C 23 29.227 27.887 1.340 1
1 211 . 18 1 1 A 24 24 GLN HA H 24 4.523 3.895 0.628 1
1 218 . 18 1 1 A 24 24 GLN CB C 24 29.759 29.606 0.153 1
1 221 . 18 1 1 A 25 25 THR HA H 25 3.870 4.714 -0.844 1
1 226 . 18 1 1 A 25 25 THR CA C 25 65.096 63.239 1.857 1
1 227 . 18 1 1 A 25 25 THR CB C 25 68.924 71.847 -2.923 1
1 229 . 18 1 1 A 26 26 PHE HA H 26 4.690 4.730 -0.040 1
1 236 . 18 1 1 A 26 26 PHE C C 26 175.523 174.552 0.971 1
1 237 . 18 1 1 A 26 26 PHE CA C 26 57.312 56.363 0.949 1
1 238 . 18 1 1 A 26 26 PHE CB C 26 39.003 40.847 -1.844 1
1 243 . 18 1 1 A 27 27 GLY H H 27 7.755 8.675 -0.920 1
1 244 . 18 1 1 A 27 27 GLY HA2 H 27 4.172 3.366 0.806 1
1 245 . 18 1 1 A 27 27 GLY HA3 H 27 3.783 3.593 0.190 1
1 246 . 18 1 1 A 27 27 GLY C C 27 172.557 173.750 -1.193 1
1 247 . 18 1 1 A 27 27 GLY CA C 27 44.924 46.708 -1.784 1
1 248 . 18 1 1 A 27 27 GLY N N 27 109.216 109.533 -0.317 1
1 249 . 18 1 1 A 28 28 LYS H H 28 8.241 7.768 0.473 1
1 250 . 18 1 1 A 28 28 LYS HA H 28 4.530 4.339 0.191 1
1 259 . 18 1 1 A 28 28 LYS C C 28 176.204 175.994 0.210 1
1 260 . 18 1 1 A 28 28 LYS CA C 28 55.741 56.136 -0.395 1
1 261 . 18 1 1 A 28 28 LYS CB C 28 33.904 32.547 1.357 1
1 265 . 18 1 1 A 28 28 LYS N N 28 118.743 120.564 -1.821 1
1 266 . 18 1 1 A 29 29 LYS H H 29 8.356 8.514 -0.158 1
1 267 . 18 1 1 A 29 29 LYS HA H 29 4.559 4.400 0.159 1
1 274 . 18 1 1 A 29 29 LYS C C 29 175.420 176.459 -1.039 1
1 275 . 18 1 1 A 29 29 LYS CA C 29 55.406 54.825 0.581 1
1 276 . 18 1 1 A 29 29 LYS CB C 29 35.618 33.390 2.228 1
1 280 . 18 1 1 A 29 29 LYS N N 29 121.198 124.862 -3.664 1
1 281 . 18 1 1 A 30 30 TRP H H 30 8.891 8.589 0.302 1
1 282 . 18 1 1 A 30 30 TRP HA H 30 4.951 4.948 0.003 1
1 291 . 18 1 1 A 30 30 TRP C C 30 175.902 176.071 -0.169 1
1 292 . 18 1 1 A 30 30 TRP CA C 30 56.677 57.286 -0.609 1
1 293 . 18 1 1 A 30 30 TRP CB C 30 30.614 29.356 1.258 1
1 299 . 18 1 1 A 30 30 TRP N N 30 123.304 120.544 2.760 1
1 301 . 18 1 1 A 31 31 ARG H H 31 8.712 9.119 -0.407 1
1 302 . 18 1 1 A 31 31 ARG HA H 31 4.820 4.789 0.031 1
1 309 . 18 1 1 A 31 31 ARG C C 31 174.026 174.634 -0.608 1
1 310 . 18 1 1 A 31 31 ARG CA C 31 54.895 54.394 0.501 1
1 311 . 18 1 1 A 31 31 ARG CB C 31 34.045 32.538 1.507 1
1 314 . 18 1 1 A 31 31 ARG N N 31 123.973 125.288 -1.315 1
1 315 . 18 1 1 A 32 32 ARG H H 32 8.820 8.391 0.429 1
1 316 . 18 1 1 A 32 32 ARG HA H 32 3.965 5.006 -1.041 1
1 323 . 18 1 1 A 32 32 ARG C C 32 174.785 174.503 0.282 1
1 324 . 18 1 1 A 32 32 ARG CA C 32 56.924 55.054 1.870 1
1 325 . 18 1 1 A 32 32 ARG CB C 32 31.806 31.379 0.427 1
1 328 . 18 1 1 A 32 32 ARG N N 32 127.041 123.088 3.953 1
1 329 . 18 1 1 A 33 33 PHE H H 33 9.372 8.957 0.415 1
1 330 . 18 1 1 A 33 33 PHE HA H 33 4.863 5.440 -0.577 1
1 338 . 18 1 1 A 33 33 PHE C C 33 176.359 175.479 0.880 1
1 339 . 18 1 1 A 33 33 PHE CA C 33 57.224 55.853 1.371 1
1 340 . 18 1 1 A 33 33 PHE CB C 33 43.385 40.312 3.073 1
1 346 . 18 1 1 A 33 33 PHE N N 33 125.882 126.202 -0.320 1
1 347 . 18 1 1 A 34 34 GLY H H 34 9.160 8.501 0.659 1
1 348 . 18 1 1 A 34 34 GLY HA2 H 34 4.182 4.068 0.114 1
1 349 . 18 1 1 A 34 34 GLY HA3 H 34 3.714 4.151 -0.437 1
1 350 . 18 1 1 A 34 34 GLY C C 34 172.920 173.240 -0.320 1
1 351 . 18 1 1 A 34 34 GLY CA C 34 46.247 46.041 0.206 1
1 352 . 18 1 1 A 34 34 GLY N N 34 108.654 111.208 -2.554 1
1 353 . 18 1 1 A 35 35 ALA H H 35 8.982 8.389 0.593 1
1 354 . 18 1 1 A 35 35 ALA HA H 35 5.660 5.500 0.160 1
1 358 . 18 1 1 A 35 35 ALA C C 35 176.547 176.097 0.450 1
1 359 . 18 1 1 A 35 35 ALA CA C 35 50.500 50.279 0.221 1
1 360 . 18 1 1 A 35 35 ALA CB C 35 24.034 21.374 2.660 1
1 361 . 18 1 1 A 35 35 ALA N N 35 130.076 127.810 2.266 1
1 362 . 18 1 1 A 36 36 SER H H 36 8.852 8.450 0.402 1
1 363 . 18 1 1 A 36 36 SER HA H 36 5.203 5.072 0.131 1
1 366 . 18 1 1 A 36 36 SER C C 36 170.939 172.495 -1.556 1
1 367 . 18 1 1 A 36 36 SER CA C 36 57.806 57.280 0.526 1
1 368 . 18 1 1 A 36 36 SER CB C 36 66.986 65.203 1.783 1
1 369 . 18 1 1 A 36 36 SER N N 36 116.620 117.548 -0.928 1
1 370 . 18 1 1 A 37 37 LEU H H 37 8.862 9.127 -0.265 1
1 371 . 18 1 1 A 37 37 LEU HA H 37 5.163 5.007 0.156 1
1 381 . 18 1 1 A 37 37 LEU C C 37 173.525 174.367 -0.842 1
1 382 . 18 1 1 A 37 37 LEU CA C 37 53.112 53.420 -0.308 1
1 383 . 18 1 1 A 37 37 LEU CB C 37 46.077 44.012 2.065 1
1 387 . 18 1 1 A 37 37 LEU N N 37 127.638 128.597 -0.959 1
1 388 . 18 1 1 A 38 38 TYR H H 38 9.280 8.983 0.297 1
1 389 . 18 1 1 A 38 38 TYR HA H 38 4.820 5.230 -0.410 1
1 396 . 18 1 1 A 38 38 TYR C C 38 175.430 175.308 0.122 1
1 397 . 18 1 1 A 38 38 TYR CA C 38 57.436 56.371 1.065 1
1 398 . 18 1 1 A 38 38 TYR CB C 38 42.128 41.291 0.837 1
1 403 . 18 1 1 A 38 38 TYR N N 38 125.215 127.222 -2.007 1
1 404 . 18 1 1 A 39 39 GLY H H 39 8.532 8.541 -0.009 1
1 405 . 18 1 1 A 39 39 GLY HA2 H 39 4.220 4.202 0.018 1
1 406 . 18 1 1 A 39 39 GLY HA3 H 39 3.941 4.202 -0.261 1
1 407 . 18 1 1 A 39 39 GLY C C 39 172.950 174.384 -1.434 1
1 408 . 18 1 1 A 39 39 GLY CA C 39 44.817 44.052 0.765 1
1 409 . 18 1 1 A 39 39 GLY N N 39 106.424 110.167 -3.743 1
1 410 . 18 1 1 A 40 40 GLY H H 40 8.477 8.810 -0.333 1
1 411 . 18 1 1 A 40 40 GLY HA2 H 40 4.102 3.827 0.275 1
1 412 . 18 1 1 A 40 40 GLY HA3 H 40 3.927 3.831 0.096 1
1 413 . 18 1 1 A 40 40 GLY C C 40 174.002 174.226 -0.224 1
1 414 . 18 1 1 A 40 40 GLY CA C 40 44.694 47.131 -2.437 1
1 415 . 18 1 1 A 40 40 GLY N N 40 106.881 108.668 -1.787 1
1 416 . 18 1 1 A 41 41 SER H H 41 8.600 8.529 0.071 1
1 417 . 18 1 1 A 41 41 SER HA H 41 4.520 4.066 0.454 1
1 420 . 18 1 1 A 41 41 SER C C 41 174.355 172.372 1.983 1
1 421 . 18 1 1 A 41 41 SER CA C 41 58.565 59.046 -0.481 1
1 422 . 18 1 1 A 41 41 SER CB C 41 64.413 61.107 3.306 1
1 423 . 18 1 1 A 41 41 SER N N 41 115.751 106.946 8.805 1
1 424 . 18 1 1 A 42 42 ASP H H 42 8.533 8.000 0.533 1
1 425 . 18 1 1 A 42 42 ASP HA H 42 4.560 5.043 -0.483 1
1 428 . 18 1 1 A 42 42 ASP CA C 42 55.230 52.550 2.680 1
1 429 . 18 1 1 A 42 42 ASP CB C 42 40.648 42.876 -2.228 1
1 430 . 18 1 1 A 42 42 ASP N N 42 119.037 118.601 0.436 1
1 431 . 18 1 1 A 43 43 CYS H H 43 8.152 8.989 -0.837 1
1 432 . 18 1 1 A 43 43 CYS HA H 43 4.541 4.179 0.362 1
1 435 . 18 1 1 A 43 43 CYS C C 43 173.975 175.966 -1.991 1
1 436 . 18 1 1 A 43 43 CYS CA C 43 58.265 62.927 -4.662 1
1 437 . 18 1 1 A 43 43 CYS CB C 43 28.393 27.617 0.776 1
1 438 . 18 1 1 A 43 43 CYS N N 43 116.881 122.822 -5.941 1
1 439 . 18 1 1 A 44 44 ALA H H 44 8.047 7.625 0.422 1
1 440 . 18 1 1 A 44 44 ALA HA H 44 4.395 4.331 0.064 1
1 444 . 18 1 1 A 44 44 ALA C C 44 176.472 177.374 -0.902 1
1 445 . 18 1 1 A 44 44 ALA CA C 44 52.688 52.607 0.081 1
1 446 . 18 1 1 A 44 44 ALA CB C 44 20.579 19.045 1.534 1
1 447 . 18 1 1 A 44 44 ALA N N 44 125.989 122.877 3.112 1
1 448 . 18 1 1 A 45 45 LEU H H 45 8.052 8.314 -0.262 1
1 449 . 18 1 1 A 45 45 LEU HA H 45 4.452 4.630 -0.178 1
1 459 . 18 1 1 A 45 45 LEU C C 45 176.196 176.500 -0.304 1
1 460 . 18 1 1 A 45 45 LEU CA C 45 53.771 53.902 -0.131 1
1 461 . 18 1 1 A 45 45 LEU CB C 45 43.116 42.667 0.449 1
1 465 . 18 1 1 A 45 45 LEU N N 45 119.889 121.706 -1.817 1
1 466 . 18 1 1 A 46 46 ALA H H 46 8.381 8.424 -0.043 1
1 467 . 18 1 1 A 46 46 ALA HA H 46 4.449 4.693 -0.244 1
1 471 . 18 1 1 A 46 46 ALA C C 46 179.093 177.459 1.634 1
1 472 . 18 1 1 A 46 46 ALA CA C 46 52.829 53.001 -0.172 1
1 473 . 18 1 1 A 46 46 ALA CB C 46 18.687 18.791 -0.104 1
1 474 . 18 1 1 A 46 46 ALA N N 46 125.635 126.046 -0.411 1
1 475 . 18 1 1 A 47 47 ARG H H 47 9.012 8.783 0.229 1
1 476 . 18 1 1 A 47 47 ARG HA H 47 5.192 5.125 0.067 1
1 484 . 18 1 1 A 47 47 ARG C C 47 171.524 174.050 -2.526 1
1 485 . 18 1 1 A 47 47 ARG CA C 47 55.265 54.680 0.585 1
1 486 . 18 1 1 A 47 47 ARG CB C 47 30.970 33.974 -3.004 1
1 489 . 18 1 1 A 47 47 ARG N N 47 120.048 120.978 -0.930 1
1 491 . 18 1 1 A 48 48 LEU H H 48 9.029 8.575 0.454 1
1 492 . 18 1 1 A 48 48 LEU HA H 48 5.221 4.999 0.222 1
1 502 . 18 1 1 A 48 48 LEU C C 48 174.348 175.169 -0.821 1
1 503 . 18 1 1 A 48 48 LEU CA C 48 53.253 53.925 -0.672 1
1 504 . 18 1 1 A 48 48 LEU CB C 48 45.419 44.067 1.352 1
1 508 . 18 1 1 A 48 48 LEU N N 48 123.315 123.647 -0.332 1
1 509 . 18 1 1 A 49 49 GLU H H 49 9.473 8.452 1.021 1
1 510 . 18 1 1 A 49 49 GLU HA H 49 5.222 5.010 0.212 1
1 515 . 18 1 1 A 49 49 GLU C C 49 175.507 175.586 -0.079 1
1 516 . 18 1 1 A 49 49 GLU CA C 49 55.159 55.302 -0.143 1
1 517 . 18 1 1 A 49 49 GLU CB C 49 32.341 31.750 0.591 1
1 519 . 18 1 1 A 49 49 GLU N N 49 124.751 126.810 -2.059 1
1 520 . 18 1 1 A 50 50 LEU H H 50 9.088 8.522 0.566 1
1 521 . 18 1 1 A 50 50 LEU HA H 50 5.382 5.429 -0.047 1
1 531 . 18 1 1 A 50 50 LEU C C 50 175.474 175.994 -0.520 1
1 532 . 18 1 1 A 50 50 LEU CA C 50 52.865 53.694 -0.829 1
1 533 . 18 1 1 A 50 50 LEU CB C 50 43.239 46.355 -3.116 1
1 537 . 18 1 1 A 50 50 LEU N N 50 124.221 120.994 3.227 1
1 538 . 18 1 1 A 51 51 GLN H H 51 9.602 8.967 0.635 1
1 539 . 18 1 1 A 51 51 GLN HA H 51 5.095 5.209 -0.114 1
1 546 . 18 1 1 A 51 51 GLN C C 51 175.306 175.382 -0.076 1
1 547 . 18 1 1 A 51 51 GLN CA C 51 54.576 54.395 0.181 1
1 548 . 18 1 1 A 51 51 GLN CB C 51 32.177 31.752 0.425 1
1 550 . 18 1 1 A 51 51 GLN N N 51 123.268 120.991 2.277 1
1 552 . 18 1 1 A 52 52 GLU H H 52 9.172 8.789 0.383 1
1 553 . 18 1 1 A 52 52 GLU HA H 52 4.092 4.647 -0.555 1
1 558 . 18 1 1 A 52 52 GLU C C 52 176.523 176.081 0.442 1
1 559 . 18 1 1 A 52 52 GLU CA C 52 57.500 56.339 1.161 1
1 560 . 18 1 1 A 52 52 GLU CB C 52 30.696 28.878 1.818 1
1 562 . 18 1 1 A 52 52 GLU N N 52 128.982 122.455 6.527 1
1 563 . 18 1 1 A 53 53 GLY H H 53 8.644 7.444 1.200 1
1 564 . 18 1 1 A 53 53 GLY HA2 H 53 4.261 4.118 0.143 1
1 565 . 18 1 1 A 53 53 GLY HA3 H 53 3.993 4.147 -0.154 1
1 566 . 18 1 1 A 53 53 GLY C C 53 172.550 173.865 -1.315 1
1 567 . 18 1 1 A 53 53 GLY CA C 53 45.911 45.662 0.249 1
1 568 . 18 1 1 A 53 53 GLY N N 53 110.844 109.077 1.767 1
1 569 . 18 1 1 A 54 54 PRO HA H 54 4.392 4.429 -0.037 1
1 576 . 18 1 1 A 54 54 PRO C C 54 176.828 176.354 0.474 1
1 577 . 18 1 1 A 54 54 PRO CA C 54 63.665 64.606 -0.941 1
1 578 . 18 1 1 A 54 54 PRO CB C 54 32.012 32.056 -0.044 1
1 581 . 18 1 1 A 55 55 GLU H H 55 8.934 7.990 0.944 1
1 582 . 18 1 1 A 55 55 GLU HA H 55 4.193 4.554 -0.361 1
1 587 . 18 1 1 A 55 55 GLU C C 55 176.189 176.221 -0.032 1
1 588 . 18 1 1 A 55 55 GLU CA C 55 57.383 55.881 1.502 1
1 589 . 18 1 1 A 55 55 GLU CB C 55 28.945 30.844 -1.899 1
1 591 . 18 1 1 A 55 55 GLU N N 55 120.312 118.410 1.902 1
1 592 . 18 1 1 A 56 56 LYS H H 56 7.937 8.475 -0.538 1
1 593 . 18 1 1 A 56 56 LYS HA H 56 4.578 4.602 -0.024 1
1 602 . 18 1 1 A 56 56 LYS C C 56 174.295 174.836 -0.541 1
1 603 . 18 1 1 A 56 56 LYS CA C 56 54.171 54.295 -0.124 1
1 604 . 18 1 1 A 56 56 LYS CB C 56 32.555 32.012 0.543 1
1 608 . 18 1 1 A 56 56 LYS N N 56 122.008 121.016 0.992 1
1 609 . 18 1 1 A 57 57 PRO HA H 57 4.370 4.684 -0.314 1
1 616 . 18 1 1 A 57 57 PRO CA C 57 63.431 62.726 0.705 1
1 617 . 18 1 1 A 57 57 PRO CB C 57 32.072 31.900 0.172 1
1 620 . 18 1 1 A 58 58 ARG H H 58 8.310 8.334 -0.024 1
1 621 . 18 1 1 A 58 58 ARG HA H 58 4.295 4.638 -0.343 1
1 628 . 18 1 1 A 58 58 ARG CA C 58 56.570 55.454 1.116 1
1 629 . 18 1 1 A 58 58 ARG CB C 58 30.860 31.113 -0.253 1
1 632 . 18 1 1 A 58 58 ARG N N 58 120.045 118.048 1.997 1
1 633 . 18 1 1 A 60 60 CYS HA H 60 4.482 4.815 -0.333 1
1 636 . 18 1 1 A 60 60 CYS CA C 60 58.621 58.290 0.331 1
1 637 . 18 1 1 A 60 60 CYS CB C 60 28.267 30.654 -2.387 1
1 638 . 18 1 1 A 61 61 GLU HA H 61 4.226 4.493 -0.267 1
1 643 . 18 1 1 A 61 61 GLU C C 61 176.299 176.494 -0.195 1
1 644 . 18 1 1 A 61 61 GLU CA C 61 57.100 55.290 1.810 1
1 645 . 18 1 1 A 61 61 GLU CB C 61 29.873 28.731 1.142 1
1 647 . 18 1 1 A 62 62 ALA H H 62 8.282 8.154 0.128 1
1 648 . 18 1 1 A 62 62 ALA HA H 62 4.302 4.363 -0.061 1
1 652 . 18 1 1 A 62 62 ALA C C 62 177.277 178.071 -0.794 1
1 653 . 18 1 1 A 62 62 ALA CA C 62 52.512 54.421 -1.909 1
1 654 . 18 1 1 A 62 62 ALA CB C 62 19.592 19.670 -0.078 1
1 655 . 18 1 1 A 62 62 ALA N N 62 124.386 127.644 -3.258 1
1 656 . 18 1 1 A 63 63 ALA H H 63 8.399 7.533 0.866 1
1 657 . 18 1 1 A 63 63 ALA HA H 63 4.375 4.251 0.124 1
1 661 . 18 1 1 A 63 63 ALA C C 63 176.843 176.645 0.198 1
1 662 . 18 1 1 A 63 63 ALA CA C 63 52.658 52.158 0.500 1
1 663 . 18 1 1 A 63 63 ALA CB C 63 19.592 18.612 0.980 1
1 664 . 18 1 1 A 63 63 ALA N N 63 123.892 120.259 3.633 1
1 665 . 18 1 1 A 64 64 ARG H H 64 8.152 8.212 -0.060 1
1 666 . 18 1 1 A 64 64 ARG HA H 64 5.008 5.057 -0.049 1
1 673 . 18 1 1 A 64 64 ARG C C 64 175.594 174.724 0.870 1
1 674 . 18 1 1 A 64 64 ARG CA C 64 55.282 55.039 0.243 1
1 675 . 18 1 1 A 64 64 ARG CB C 64 32.506 32.393 0.113 1
1 678 . 18 1 1 A 64 64 ARG N N 64 119.787 120.697 -0.910 1
1 679 . 18 1 1 A 65 65 LYS H H 65 8.945 8.885 0.060 1
1 680 . 18 1 1 A 65 65 LYS HA H 65 4.602 5.079 -0.477 1
1 689 . 18 1 1 A 65 65 LYS C C 65 174.657 174.463 0.194 1
1 690 . 18 1 1 A 65 65 LYS CA C 65 54.948 54.724 0.224 1
1 691 . 18 1 1 A 65 65 LYS CB C 65 34.068 34.826 -0.758 1
1 695 . 18 1 1 A 65 65 LYS N N 65 124.171 122.723 1.448 1
1 696 . 18 1 1 A 66 66 VAL H H 66 8.672 8.973 -0.301 1
1 697 . 18 1 1 A 66 66 VAL HA H 66 4.532 4.975 -0.443 1
1 705 . 18 1 1 A 66 66 VAL C C 66 175.078 173.886 1.192 1
1 706 . 18 1 1 A 66 66 VAL CA C 66 61.865 60.260 1.605 1
1 707 . 18 1 1 A 66 66 VAL CB C 66 33.835 34.526 -0.691 1
1 710 . 18 1 1 A 66 66 VAL N N 66 124.380 125.791 -1.411 1
1 711 . 18 1 1 A 67 67 ILE H H 67 9.071 8.962 0.109 1
1 712 . 18 1 1 A 67 67 ILE HA H 67 4.142 4.530 -0.388 1
1 722 . 18 1 1 A 67 67 ILE C C 67 175.819 175.673 0.146 1
1 723 . 18 1 1 A 67 67 ILE CA C 67 60.383 60.357 0.026 1
1 724 . 18 1 1 A 67 67 ILE CB C 67 39.908 38.044 1.864 1
1 728 . 18 1 1 A 67 67 ILE N N 67 129.537 129.228 0.309 1
1 729 . 18 1 1 A 68 68 ARG H H 68 9.203 8.612 0.591 1
1 730 . 18 1 1 A 68 68 ARG HA H 68 4.198 4.284 -0.086 1
1 737 . 18 1 1 A 68 68 ARG C C 68 177.769 177.093 0.676 1
1 738 . 18 1 1 A 68 68 ARG CA C 68 56.835 56.577 0.258 1
1 739 . 18 1 1 A 68 68 ARG CB C 68 29.832 30.670 -0.838 1
1 742 . 18 1 1 A 68 68 ARG N N 68 128.484 128.530 -0.046 1
1 743 . 18 1 1 A 69 69 LEU H H 69 8.212 8.676 -0.464 1
1 744 . 18 1 1 A 69 69 LEU HA H 69 4.221 4.106 0.115 1
1 754 . 18 1 1 A 69 69 LEU C C 69 178.996 179.129 -0.133 1
1 755 . 18 1 1 A 69 69 LEU CA C 69 57.136 57.210 -0.074 1
1 756 . 18 1 1 A 69 69 LEU CB C 69 39.455 41.529 -2.074 1
1 760 . 18 1 1 A 69 69 LEU N N 69 123.807 123.462 0.345 1
1 761 . 18 1 1 A 70 70 SER H H 70 8.823 7.943 0.880 1
1 762 . 18 1 1 A 70 70 SER HA H 70 4.331 4.148 0.183 1
1 765 . 18 1 1 A 70 70 SER C C 70 175.076 176.617 -1.541 1
1 766 . 18 1 1 A 70 70 SER CA C 70 60.329 60.991 -0.662 1
1 767 . 18 1 1 A 70 70 SER CB C 70 62.362 63.261 -0.899 1
1 768 . 18 1 1 A 70 70 SER N N 70 115.162 114.937 0.225 1
1 769 . 18 1 1 A 71 71 ASP H H 71 7.602 8.182 -0.580 1
1 770 . 18 1 1 A 71 71 ASP HA H 71 4.820 4.340 0.480 1
1 773 . 18 1 1 A 71 71 ASP C C 71 176.478 176.636 -0.158 1
1 774 . 18 1 1 A 71 71 ASP CA C 71 54.241 56.651 -2.410 1
1 775 . 18 1 1 A 71 71 ASP CB C 71 41.347 40.962 0.385 1
1 776 . 18 1 1 A 71 71 ASP N N 71 119.590 120.994 -1.404 1
1 777 . 18 1 1 A 72 72 CYS H H 72 7.715 7.558 0.157 1
1 778 . 18 1 1 A 72 72 CYS HA H 72 4.372 4.554 -0.182 1
1 781 . 18 1 1 A 72 72 CYS C C 72 173.690 174.483 -0.793 1
1 782 . 18 1 1 A 72 72 CYS CA C 72 60.836 58.988 1.848 1
1 783 . 18 1 1 A 72 72 CYS CB C 72 27.655 27.513 0.142 1
1 784 . 18 1 1 A 72 72 CYS N N 72 118.346 116.876 1.470 1
1 785 . 18 1 1 A 73 73 LEU H H 73 9.472 8.773 0.699 1
1 786 . 18 1 1 A 73 73 LEU HA H 73 4.593 4.051 0.542 1
1 796 . 18 1 1 A 73 73 LEU C C 73 177.562 176.645 0.917 1
1 797 . 18 1 1 A 73 73 LEU CA C 73 55.724 56.935 -1.211 1
1 798 . 18 1 1 A 73 73 LEU CB C 73 43.774 42.204 1.570 1
1 802 . 18 1 1 A 73 73 LEU N N 73 124.752 128.889 -4.137 1
1 803 . 18 1 1 A 74 74 ARG H H 74 7.658 7.652 0.006 1
1 804 . 18 1 1 A 74 74 ARG HA H 74 4.592 5.125 -0.533 1
1 811 . 18 1 1 A 74 74 ARG C C 74 173.605 174.587 -0.982 1
1 812 . 18 1 1 A 74 74 ARG CA C 74 56.465 55.729 0.736 1
1 813 . 18 1 1 A 74 74 ARG CB C 74 34.068 33.934 0.134 1
1 816 . 18 1 1 A 74 74 ARG N N 74 115.565 116.178 -0.613 1
1 817 . 18 1 1 A 75 75 VAL H H 75 8.622 8.984 -0.362 1
1 818 . 18 1 1 A 75 75 VAL HA H 75 5.170 5.272 -0.102 1
1 826 . 18 1 1 A 75 75 VAL C C 75 173.985 174.599 -0.614 1
1 827 . 18 1 1 A 75 75 VAL CA C 75 60.930 59.601 1.329 1
1 828 . 18 1 1 A 75 75 VAL CB C 75 35.073 36.246 -1.173 1
1 831 . 18 1 1 A 75 75 VAL N N 75 124.278 119.658 4.620 1
1 832 . 18 1 1 A 76 76 ALA H H 76 8.272 8.904 -0.632 1
1 833 . 18 1 1 A 76 76 ALA HA H 76 4.648 5.056 -0.408 1
1 837 . 18 1 1 A 76 76 ALA C C 76 175.630 175.516 0.114 1
1 838 . 18 1 1 A 76 76 ALA CA C 76 51.294 51.293 0.001 1
1 839 . 18 1 1 A 76 76 ALA CB C 76 22.759 24.223 -1.464 1
1 840 . 18 1 1 A 76 76 ALA N N 76 126.015 124.313 1.702 1
1 841 . 18 1 1 A 77 77 GLU H H 77 9.184 8.696 0.488 1
1 842 . 18 1 1 A 77 77 GLU HA H 77 4.060 5.241 -1.181 1
1 847 . 18 1 1 A 77 77 GLU C C 77 174.949 175.893 -0.944 1
1 848 . 18 1 1 A 77 77 GLU CA C 77 58.424 54.927 3.497 1
1 849 . 18 1 1 A 77 77 GLU CB C 77 30.161 32.054 -1.893 1
1 851 . 18 1 1 A 77 77 GLU N N 77 120.223 118.229 1.994 1
1 852 . 18 1 1 A 78 78 ALA H H 78 7.985 9.205 -1.220 1
1 853 . 18 1 1 A 78 78 ALA HA H 78 4.776 5.263 -0.487 1
1 857 . 18 1 1 A 78 78 ALA C C 78 177.250 177.556 -0.306 1
1 858 . 18 1 1 A 78 78 ALA CA C 78 50.888 50.773 0.115 1
1 859 . 18 1 1 A 78 78 ALA CB C 78 20.851 21.957 -1.106 1
1 860 . 18 1 1 A 78 78 ALA N N 78 125.143 128.442 -3.299 1
1 861 . 18 1 1 A 79 79 GLY H H 79 8.604 8.655 -0.051 1
1 862 . 18 1 1 A 79 79 GLY HA2 H 79 4.327 4.172 0.155 1
1 863 . 18 1 1 A 79 79 GLY HA3 H 79 3.963 4.175 -0.212 1
1 864 . 18 1 1 A 79 79 GLY C C 79 175.360 175.062 0.298 1
1 865 . 18 1 1 A 79 79 GLY CA C 79 44.925 44.641 0.284 1
1 866 . 18 1 1 A 79 79 GLY N N 79 109.420 106.063 3.357 1
1 867 . 18 1 1 A 80 80 GLY H H 80 8.649 8.940 -0.291 1
1 868 . 18 1 1 A 80 80 GLY HA2 H 80 3.962 3.866 0.096 1
1 869 . 18 1 1 A 80 80 GLY HA3 H 80 3.962 3.881 0.081 1
1 870 . 18 1 1 A 80 80 GLY C C 80 175.052 175.441 -0.389 1
1 871 . 18 1 1 A 80 80 GLY CA C 80 45.955 47.133 -1.178 1
1 872 . 18 1 1 A 80 80 GLY N N 80 108.295 108.601 -0.306 1
1 873 . 18 1 1 A 81 81 GLU H H 81 8.921 8.361 0.560 1
1 874 . 18 1 1 A 81 81 GLU HA H 81 4.298 4.054 0.244 1
1 879 . 18 1 1 A 81 81 GLU C C 81 176.532 178.027 -1.495 1
1 880 . 18 1 1 A 81 81 GLU CA C 81 57.118 59.549 -2.431 1
1 881 . 18 1 1 A 81 81 GLU CB C 81 28.599 29.744 -1.145 1
1 883 . 18 1 1 A 81 81 GLU N N 81 121.170 121.452 -0.282 1
1 884 . 18 1 1 A 82 82 ALA H H 82 8.032 7.196 0.836 1
1 885 . 18 1 1 A 82 82 ALA HA H 82 4.371 4.262 0.109 1
1 889 . 18 1 1 A 82 82 ALA C C 82 177.160 177.915 -0.755 1
1 890 . 18 1 1 A 82 82 ALA CA C 82 52.653 52.643 0.010 1
1 891 . 18 1 1 A 82 82 ALA CB C 82 19.304 20.342 -1.038 1
1 892 . 18 1 1 A 82 82 ALA N N 82 124.988 121.999 2.989 1
1 893 . 18 1 1 A 83 83 SER H H 83 8.319 8.931 -0.612 1
1 894 . 18 1 1 A 83 83 SER HA H 83 4.331 4.286 0.045 1
1 897 . 18 1 1 A 83 83 SER C C 83 174.045 174.679 -0.634 1
1 898 . 18 1 1 A 83 83 SER CA C 83 58.053 61.408 -3.355 1
1 899 . 18 1 1 A 83 83 SER CB C 83 63.184 63.000 0.184 1
1 900 . 18 1 1 A 83 83 SER N N 83 114.181 115.398 -1.217 1
1 901 . 18 1 1 A 84 84 SER H H 84 7.823 7.619 0.204 1
1 902 . 18 1 1 A 84 84 SER HA H 84 3.194 4.239 -1.045 1
1 905 . 18 1 1 A 84 84 SER C C 84 171.072 174.094 -3.022 1
1 906 . 18 1 1 A 84 84 SER CA C 84 57.206 56.867 0.339 1
1 907 . 18 1 1 A 84 84 SER CB C 84 61.622 63.290 -1.668 1
1 908 . 18 1 1 A 84 84 SER N N 84 117.302 114.075 3.227 1
1 909 . 18 1 1 A 85 85 PRO HA H 85 3.922 4.564 -0.642 1
1 916 . 18 1 1 A 85 85 PRO CA C 85 62.691 62.173 0.518 1
1 917 . 18 1 1 A 85 85 PRO CB C 85 31.515 32.890 -1.375 1
1 920 . 18 1 1 A 86 86 ARG HA H 86 3.882 4.298 -0.416 1
1 927 . 18 1 1 A 86 86 ARG C C 86 175.712 176.527 -0.815 1
1 928 . 18 1 1 A 86 86 ARG CA C 86 57.877 55.920 1.957 1
1 929 . 18 1 1 A 86 86 ARG CB C 86 29.791 31.285 -1.494 1
1 932 . 18 1 1 A 87 87 ASP H H 87 8.903 8.867 0.036 1
1 933 . 18 1 1 A 87 87 ASP HA H 87 4.342 4.243 0.099 1
1 936 . 18 1 1 A 87 87 ASP C C 87 175.723 175.003 0.720 1
1 937 . 18 1 1 A 87 87 ASP CA C 87 56.377 55.472 0.905 1
1 938 . 18 1 1 A 87 87 ASP CB C 87 39.208 39.653 -0.445 1
1 939 . 18 1 1 A 87 87 ASP N N 87 117.520 120.492 -2.972 1
1 940 . 18 1 1 A 88 88 THR H H 88 7.776 7.528 0.248 1
1 941 . 18 1 1 A 88 88 THR HA H 88 5.101 5.122 -0.021 1
1 946 . 18 1 1 A 88 88 THR C C 88 173.825 173.031 0.794 1
1 947 . 18 1 1 A 88 88 THR CA C 88 60.154 59.532 0.622 1
1 948 . 18 1 1 A 88 88 THR CB C 88 72.702 72.632 0.070 1
1 950 . 18 1 1 A 88 88 THR N N 88 108.770 108.740 0.030 1
1 951 . 18 1 1 A 89 89 SER H H 89 9.006 9.390 -0.384 1
1 952 . 18 1 1 A 89 89 SER HA H 89 4.718 5.164 -0.446 1
1 955 . 18 1 1 A 89 89 SER C C 89 173.728 173.085 0.643 1
1 956 . 18 1 1 A 89 89 SER CA C 89 57.453 57.971 -0.518 1
1 957 . 18 1 1 A 89 89 SER CB C 89 65.611 65.406 0.205 1
1 958 . 18 1 1 A 89 89 SER N N 89 114.151 116.752 -2.601 1
1 959 . 18 1 1 A 90 90 ALA H H 90 9.001 8.828 0.173 1
1 960 . 18 1 1 A 90 90 ALA HA H 90 5.660 4.687 0.973 1
1 964 . 18 1 1 A 90 90 ALA C C 90 177.669 177.230 0.439 1
1 965 . 18 1 1 A 90 90 ALA CA C 90 51.670 51.992 -0.322 1
1 966 . 18 1 1 A 90 90 ALA CB C 90 22.265 19.922 2.343 1
1 967 . 18 1 1 A 90 90 ALA N N 90 126.177 128.940 -2.763 1
1 968 . 18 1 1 A 91 91 PHE H H 91 9.672 8.277 1.395 1
1 969 . 18 1 1 A 91 91 PHE HA H 91 5.039 5.510 -0.471 1
1 977 . 18 1 1 A 91 91 PHE C C 91 170.731 173.464 -2.733 1
1 978 . 18 1 1 A 91 91 PHE CA C 91 56.271 55.220 1.051 1
1 979 . 18 1 1 A 91 91 PHE CB C 91 41.553 41.991 -0.438 1
1 985 . 18 1 1 A 91 91 PHE N N 91 118.968 116.390 2.578 1
1 986 . 18 1 1 A 92 92 PHE H H 92 9.422 9.437 -0.015 1
1 987 . 18 1 1 A 92 92 PHE HA H 92 5.674 5.155 0.519 1
1 995 . 18 1 1 A 92 92 PHE C C 92 174.570 175.279 -0.709 1
1 996 . 18 1 1 A 92 92 PHE CA C 92 55.917 57.508 -1.591 1
1 997 . 18 1 1 A 92 92 PHE CB C 92 42.787 41.608 1.179 1
1 1003 . 18 1 1 A 92 92 PHE N N 92 117.543 117.970 -0.427 1
1 1004 . 18 1 1 A 93 93 LEU H H 93 9.021 8.428 0.593 1
1 1005 . 18 1 1 A 93 93 LEU HA H 93 5.122 4.983 0.139 1
1 1015 . 18 1 1 A 93 93 LEU C C 93 174.799 174.219 0.580 1
1 1016 . 18 1 1 A 93 93 LEU CA C 93 54.912 54.702 0.210 1
1 1017 . 18 1 1 A 93 93 LEU CB C 93 45.254 44.798 0.456 1
1 1021 . 18 1 1 A 93 93 LEU N N 93 121.719 121.706 0.013 1
1 1022 . 18 1 1 A 94 94 GLU H H 94 9.294 9.200 0.094 1
1 1023 . 18 1 1 A 94 94 GLU HA H 94 5.043 5.203 -0.160 1
1 1028 . 18 1 1 A 94 94 GLU C C 94 175.754 175.391 0.363 1
1 1029 . 18 1 1 A 94 94 GLU CA C 94 56.018 54.946 1.072 1
1 1030 . 18 1 1 A 94 94 GLU CB C 94 32.752 32.794 -0.042 1
1 1032 . 18 1 1 A 94 94 GLU N N 94 127.032 128.638 -1.606 1
1 1033 . 18 1 1 A 95 95 THR H H 95 8.822 8.664 0.158 1
1 1034 . 18 1 1 A 95 95 THR HA H 95 5.398 5.036 0.362 1
1 1039 . 18 1 1 A 95 95 THR C C 95 173.860 175.342 -1.482 1
1 1040 . 18 1 1 A 95 95 THR CA C 95 59.588 59.688 -0.100 1
1 1041 . 18 1 1 A 95 95 THR CB C 95 72.191 72.407 -0.216 1
1 1043 . 18 1 1 A 95 95 THR N N 95 118.685 117.685 1.000 1
1 1044 . 18 1 1 A 96 96 LYS H H 96 8.823 9.069 -0.246 1
1 1045 . 18 1 1 A 96 96 LYS HA H 96 4.022 3.945 0.077 1
1 1054 . 18 1 1 A 96 96 LYS C C 96 177.330 178.925 -1.595 1
1 1055 . 18 1 1 A 96 96 LYS CA C 96 59.588 59.782 -0.194 1
1 1056 . 18 1 1 A 96 96 LYS CB C 96 32.588 32.085 0.503 1
1 1060 . 18 1 1 A 96 96 LYS N N 96 118.801 122.368 -3.567 1
1 1061 . 18 1 1 A 97 97 GLU H H 97 8.092 7.769 0.323 1
1 1062 . 18 1 1 A 97 97 GLU HA H 97 4.282 4.208 0.074 1
1 1067 . 18 1 1 A 97 97 GLU C C 97 176.290 176.166 0.124 1
1 1068 . 18 1 1 A 97 97 GLU CA C 97 57.365 58.785 -1.420 1
1 1069 . 18 1 1 A 97 97 GLU CB C 97 31.559 30.839 0.720 1
1 1071 . 18 1 1 A 97 97 GLU N N 97 113.992 118.761 -4.769 1
1 1072 . 18 1 1 A 98 98 ARG H H 98 7.482 7.230 0.252 1
1 1073 . 18 1 1 A 98 98 ARG HA H 98 4.397 4.605 -0.208 1
1 1080 . 18 1 1 A 98 98 ARG C C 98 172.792 173.170 -0.378 1
1 1081 . 18 1 1 A 98 98 ARG CA C 98 55.689 54.492 1.197 1
1 1082 . 18 1 1 A 98 98 ARG CB C 98 32.711 31.845 0.866 1
1 1085 . 18 1 1 A 98 98 ARG N N 98 116.022 114.902 1.120 1
1 1086 . 18 1 1 A 99 99 LEU H H 99 8.423 8.310 0.113 1
1 1087 . 18 1 1 A 99 99 LEU HA H 99 4.807 4.790 0.017 1
1 1097 . 18 1 1 A 99 99 LEU C C 99 175.903 174.184 1.719 1
1 1098 . 18 1 1 A 99 99 LEU CA C 99 54.383 53.496 0.887 1
1 1099 . 18 1 1 A 99 99 LEU CB C 99 43.362 43.439 -0.077 1
1 1103 . 18 1 1 A 99 99 LEU N N 99 124.983 121.679 3.304 1
1 1104 . 18 1 1 A 100 100 TYR H H 100 9.144 9.465 -0.321 1
1 1105 . 18 1 1 A 100 100 TYR HA H 100 4.542 5.068 -0.526 1
1 1112 . 18 1 1 A 100 100 TYR C C 100 173.479 174.752 -1.273 1
1 1113 . 18 1 1 A 100 100 TYR CA C 100 57.735 56.849 0.886 1
1 1114 . 18 1 1 A 100 100 TYR CB C 100 39.291 41.053 -1.762 1
1 1119 . 18 1 1 A 100 100 TYR N N 100 126.679 127.761 -1.082 1
1 1120 . 18 1 1 A 101 101 LEU H H 101 9.043 8.853 0.190 1
1 1121 . 18 1 1 A 101 101 LEU HA H 101 4.747 4.865 -0.118 1
1 1131 . 18 1 1 A 101 101 LEU C C 101 173.530 175.189 -1.659 1
1 1132 . 18 1 1 A 101 101 LEU CA C 101 54.524 53.821 0.703 1
1 1133 . 18 1 1 A 101 101 LEU CB C 101 42.499 44.138 -1.639 1
1 1137 . 18 1 1 A 101 101 LEU N N 101 127.422 124.782 2.640 1
1 1138 . 18 1 1 A 102 102 LEU H H 102 8.493 8.566 -0.073 1
1 1139 . 18 1 1 A 102 102 LEU HA H 102 5.612 5.367 0.245 1
1 1149 . 18 1 1 A 102 102 LEU C C 102 175.794 175.832 -0.038 1
1 1150 . 18 1 1 A 102 102 LEU CA C 102 53.076 53.208 -0.132 1
1 1151 . 18 1 1 A 102 102 LEU CB C 102 45.994 43.840 2.154 1
1 1155 . 18 1 1 A 102 102 LEU N N 102 126.021 128.843 -2.822 1
1 1156 . 18 1 1 A 103 103 ALA H H 103 9.073 8.739 0.334 1
1 1157 . 18 1 1 A 103 103 ALA HA H 103 5.081 5.296 -0.215 1
1 1161 . 18 1 1 A 103 103 ALA C C 103 175.133 175.763 -0.630 1
1 1162 . 18 1 1 A 103 103 ALA CA C 103 51.688 49.861 1.827 1
1 1163 . 18 1 1 A 103 103 ALA CB C 103 21.689 22.439 -0.750 1
1 1164 . 18 1 1 A 103 103 ALA N N 103 117.679 122.175 -4.496 1
1 1165 . 18 1 1 A 104 104 ALA H H 104 8.582 8.542 0.040 1
1 1166 . 18 1 1 A 104 104 ALA HA H 104 5.220 4.729 0.491 1
1 1170 . 18 1 1 A 104 104 ALA C C 104 173.471 174.125 -0.654 1
1 1171 . 18 1 1 A 104 104 ALA CA C 104 47.959 49.976 -2.017 1
1 1172 . 18 1 1 A 104 104 ALA CB C 104 21.359 22.226 -0.867 1
1 1173 . 18 1 1 A 104 104 ALA N N 104 123.419 120.314 3.105 1
1 1174 . 18 1 1 A 105 105 PRO HA H 105 4.542 4.787 -0.245 1
1 1181 . 18 1 1 A 105 105 PRO C C 105 178.409 177.938 0.471 1
1 1182 . 18 1 1 A 105 105 PRO CA C 105 64.301 62.816 1.485 1
1 1183 . 18 1 1 A 105 105 PRO CB C 105 32.094 31.642 0.452 1
1 1186 . 18 1 1 A 106 106 ALA H H 106 8.302 8.677 -0.375 1
1 1187 . 18 1 1 A 106 106 ALA HA H 106 4.022 4.023 -0.001 1
1 1191 . 18 1 1 A 106 106 ALA C C 106 179.641 179.701 -0.060 1
1 1192 . 18 1 1 A 106 106 ALA CA C 106 56.341 55.170 1.171 1
1 1193 . 18 1 1 A 106 106 ALA CB C 106 18.523 18.205 0.318 1
1 1194 . 18 1 1 A 106 106 ALA N N 106 127.733 127.917 -0.184 1
1 1195 . 18 1 1 A 107 107 ALA H H 107 9.035 7.999 1.036 1
1 1196 . 18 1 1 A 107 107 ALA HA H 107 4.331 4.051 0.280 1
1 1200 . 18 1 1 A 107 107 ALA C C 107 178.586 179.790 -1.204 1
1 1201 . 18 1 1 A 107 107 ALA CA C 107 53.765 55.158 -1.393 1
1 1202 . 18 1 1 A 107 107 ALA CB C 107 18.728 18.219 0.509 1
1 1203 . 18 1 1 A 107 107 ALA N N 107 118.203 119.964 -1.761 1
1 1204 . 18 1 1 A 108 108 GLU H H 108 8.399 8.162 0.237 1
1 1205 . 18 1 1 A 108 108 GLU HA H 108 4.631 4.352 0.279 1
1 1210 . 18 1 1 A 108 108 GLU C C 108 177.127 178.817 -1.690 1
1 1211 . 18 1 1 A 108 108 GLU CA C 108 55.847 58.653 -2.806 1
1 1212 . 18 1 1 A 108 108 GLU CB C 108 32.135 30.207 1.928 1
1 1214 . 18 1 1 A 108 108 GLU N N 108 114.661 118.165 -3.504 1
1 1215 . 18 1 1 A 109 109 ARG H H 109 7.412 8.621 -1.209 1
1 1216 . 18 1 1 A 109 109 ARG HA H 109 3.682 4.089 -0.407 1
1 1223 . 18 1 1 A 109 109 ARG C C 109 176.917 179.138 -2.221 1
1 1224 . 18 1 1 A 109 109 ARG CA C 109 61.600 59.627 1.973 1
1 1225 . 18 1 1 A 109 109 ARG CB C 109 28.845 30.387 -1.542 1
1 1228 . 18 1 1 A 109 109 ARG N N 109 120.954 120.966 -0.012 1
1 1229 . 18 1 1 A 110 110 GLY H H 110 8.833 8.549 0.284 1
1 1230 . 18 1 1 A 110 110 GLY HA2 H 110 3.872 3.788 0.084 1
1 1231 . 18 1 1 A 110 110 GLY HA3 H 110 3.685 3.801 -0.116 1
1 1232 . 18 1 1 A 110 110 GLY C C 110 175.997 175.691 0.306 1
1 1233 . 18 1 1 A 110 110 GLY CA C 110 47.323 47.570 -0.247 1
1 1234 . 18 1 1 A 110 110 GLY N N 110 106.563 107.132 -0.569 1
1 1235 . 18 1 1 A 111 111 ASP H H 111 7.882 8.446 -0.564 1
1 1236 . 18 1 1 A 111 111 ASP HA H 111 4.312 4.268 0.044 1
1 1239 . 18 1 1 A 111 111 ASP C C 111 179.467 178.421 1.046 1
1 1240 . 18 1 1 A 111 111 ASP CA C 111 56.976 56.512 0.464 1
1 1241 . 18 1 1 A 111 111 ASP CB C 111 40.648 40.351 0.297 1
1 1242 . 18 1 1 A 111 111 ASP N N 111 121.402 121.716 -0.314 1
1 1243 . 18 1 1 A 112 112 TRP H H 112 7.804 8.266 -0.462 1
1 1244 . 18 1 1 A 112 112 TRP HA H 112 3.831 4.199 -0.368 1
1 1253 . 18 1 1 A 112 112 TRP C C 112 177.547 178.734 -1.187 1
1 1254 . 18 1 1 A 112 112 TRP CA C 112 62.006 60.011 1.995 1
1 1255 . 18 1 1 A 112 112 TRP CB C 112 29.421 29.332 0.089 1
1 1261 . 18 1 1 A 112 112 TRP N N 112 119.904 119.742 0.162 1
1 1263 . 18 1 1 A 113 113 VAL H H 113 7.982 8.202 -0.220 1
1 1264 . 18 1 1 A 113 113 VAL HA H 113 3.072 3.635 -0.563 1
1 1272 . 18 1 1 A 113 113 VAL C C 113 178.015 178.577 -0.562 1
1 1273 . 18 1 1 A 113 113 VAL CA C 113 67.407 66.592 0.815 1
1 1274 . 18 1 1 A 113 113 VAL CB C 113 31.724 31.444 0.280 1
1 1277 . 18 1 1 A 113 113 VAL N N 113 117.575 119.384 -1.809 1
1 1278 . 18 1 1 A 114 114 GLN H H 114 8.268 8.245 0.023 1
1 1279 . 18 1 1 A 114 114 GLN HA H 114 3.994 4.036 -0.042 1
1 1286 . 18 1 1 A 114 114 GLN C C 114 178.021 177.986 0.035 1
1 1287 . 18 1 1 A 114 114 GLN CA C 114 59.112 58.598 0.514 1
1 1288 . 18 1 1 A 114 114 GLN CB C 114 28.685 28.912 -0.227 1
1 1290 . 18 1 1 A 114 114 GLN N N 114 117.479 120.416 -2.937 1
1 1292 . 18 1 1 A 115 115 ALA H H 115 7.915 8.422 -0.507 1
1 1293 . 18 1 1 A 115 115 ALA HA H 115 3.972 4.091 -0.119 1
1 1297 . 18 1 1 A 115 115 ALA C C 115 180.030 179.715 0.315 1
1 1298 . 18 1 1 A 115 115 ALA CA C 115 55.142 55.139 0.003 1
1 1299 . 18 1 1 A 115 115 ALA CB C 115 18.152 18.431 -0.279 1
1 1300 . 18 1 1 A 115 115 ALA N N 115 120.858 120.756 0.102 1
1 1301 . 18 1 1 A 116 116 ILE H H 116 8.172 8.587 -0.415 1
1 1302 . 18 1 1 A 116 116 ILE HA H 116 3.482 3.842 -0.360 1
1 1312 . 18 1 1 A 116 116 ILE C C 116 177.739 178.285 -0.546 1
1 1313 . 18 1 1 A 116 116 ILE CA C 116 66.119 64.913 1.206 1
1 1314 . 18 1 1 A 116 116 ILE CB C 116 38.222 37.697 0.525 1
1 1318 . 18 1 1 A 116 116 ILE N N 116 115.977 117.400 -1.423 1
1 1319 . 18 1 1 A 117 117 CYS H H 117 8.449 7.848 0.601 1
1 1320 . 18 1 1 A 117 117 CYS HA H 117 4.032 4.525 -0.493 1
1 1323 . 18 1 1 A 117 117 CYS C C 117 177.321 177.120 0.201 1
1 1324 . 18 1 1 A 117 117 CYS CA C 117 64.777 62.298 2.479 1
1 1325 . 18 1 1 A 117 117 CYS CB C 117 26.871 26.997 -0.126 1
1 1326 . 18 1 1 A 117 117 CYS N N 117 117.253 120.819 -3.566 1
1 1327 . 18 1 1 A 118 118 LEU H H 118 8.182 7.888 0.294 1
1 1328 . 18 1 1 A 118 118 LEU HA H 118 4.052 3.977 0.075 1
1 1338 . 18 1 1 A 118 118 LEU C C 118 179.217 179.423 -0.206 1
1 1339 . 18 1 1 A 118 118 LEU CA C 118 57.877 57.911 -0.034 1
1 1340 . 18 1 1 A 118 118 LEU CB C 118 42.088 42.007 0.081 1
1 1344 . 18 1 1 A 118 118 LEU N N 118 119.665 121.063 -1.398 1
1 1345 . 18 1 1 A 119 119 LEU H H 119 7.142 7.940 -0.798 1
1 1346 . 18 1 1 A 119 119 LEU HA H 119 4.192 4.375 -0.183 1
1 1356 . 18 1 1 A 119 119 LEU C C 119 178.492 178.954 -0.462 1
1 1357 . 18 1 1 A 119 119 LEU CA C 119 56.259 57.880 -1.621 1
1 1358 . 18 1 1 A 119 119 LEU CB C 119 43.568 41.660 1.908 1
1 1362 . 18 1 1 A 119 119 LEU N N 119 116.244 118.046 -1.802 1
1 1363 . 18 1 1 A 120 120 ALA H H 120 8.513 8.205 0.308 1
1 1364 . 18 1 1 A 120 120 ALA HA H 120 3.878 4.312 -0.434 1
1 1368 . 18 1 1 A 120 120 ALA C C 120 178.358 178.824 -0.466 1
1 1369 . 18 1 1 A 120 120 ALA CA C 120 53.765 55.026 -1.261 1
1 1370 . 18 1 1 A 120 120 ALA CB C 120 18.687 18.886 -0.199 1
1 1371 . 18 1 1 A 120 120 ALA N N 120 120.009 119.751 0.258 1
1 1372 . 18 1 1 A 121 121 PHE H H 121 7.822 8.458 -0.636 1
1 1373 . 18 1 1 A 121 121 PHE HA H 121 5.156 4.827 0.329 1
1 1381 . 18 1 1 A 121 121 PHE C C 121 176.273 175.755 0.518 1
1 1382 . 18 1 1 A 121 121 PHE CA C 121 55.741 56.729 -0.988 1
1 1383 . 18 1 1 A 121 121 PHE CB C 121 39.455 37.964 1.491 1
1 1389 . 18 1 1 A 121 121 PHE N N 121 113.981 114.275 -0.294 1
1 1390 . 18 1 1 A 122 122 SER H H 122 7.765 7.727 0.038 1
1 1391 . 18 1 1 A 122 122 SER HA H 122 4.579 4.409 0.170 1
1 1394 . 18 1 1 A 122 122 SER C C 122 174.595 174.929 -0.334 1
1 1395 . 18 1 1 A 122 122 SER CA C 122 58.777 60.333 -1.556 1
1 1396 . 18 1 1 A 122 122 SER CB C 122 63.719 63.654 0.065 1
1 1397 . 18 1 1 A 122 122 SER N N 122 115.069 116.661 -1.592 1
1 1398 . 18 1 1 A 123 123 GLY H H 123 8.223 8.629 -0.406 1
1 1399 . 18 1 1 A 123 123 GLY HA2 H 123 4.174 4.054 0.120 1
1 1400 . 18 1 1 A 123 123 GLY HA3 H 123 4.100 4.057 0.043 1
1 1401 . 18 1 1 A 123 123 GLY C C 123 171.678 174.063 -2.385 1
1 1402 . 18 1 1 A 123 123 GLY CA C 123 44.815 44.913 -0.098 1
1 1403 . 18 1 1 A 123 123 GLY N N 123 110.151 113.308 -3.157 1
1 1404 . 18 1 1 A 124 124 PRO HA H 124 4.482 4.417 0.065 1
1 1411 . 18 1 1 A 124 124 PRO C C 124 177.314 176.347 0.967 1
1 1412 . 18 1 1 A 124 124 PRO CA C 124 63.206 64.808 -1.602 1
1 1413 . 18 1 1 A 124 124 PRO CB C 124 32.176 31.951 0.225 1
1 1416 . 18 1 1 A 125 125 SER H H 125 8.485 7.836 0.649 1
1 1417 . 18 1 1 A 125 125 SER HA H 125 4.472 4.433 0.039 1
1 1420 . 18 1 1 A 125 125 SER C C 125 174.728 174.052 0.676 1
1 1421 . 18 1 1 A 125 125 SER CA C 125 58.353 60.714 -2.361 1
1 1422 . 18 1 1 A 125 125 SER CB C 125 64.048 63.812 0.236 1
1 1423 . 18 1 1 A 125 125 SER N N 125 116.081 115.346 0.735 1
1 1424 . 18 1 1 A 126 126 SER H H 126 8.332 8.597 -0.265 1
1 1425 . 18 1 1 A 126 126 SER HA H 126 4.464 4.734 -0.270 1
1 1428 . 18 1 1 A 126 126 SER C C 126 173.980 174.433 -0.453 1
1 1429 . 18 1 1 A 126 126 SER CA C 126 58.336 57.123 1.213 1
1 1430 . 18 1 1 A 126 126 SER CB C 126 63.925 63.673 0.252 1
1 1431 . 18 1 1 A 126 126 SER N N 126 118.037 120.244 -2.207 1
1 1 . 19 1 1 A 6 6 SER HA H 6 4.458 4.887 -0.429 1
1 3 . 19 1 1 A 6 6 SER C C 6 175.108 173.639 1.469 1
1 4 . 19 1 1 A 6 6 SER CA C 6 58.689 56.771 1.918 1
1 5 . 19 1 1 A 6 6 SER CB C 6 63.678 63.594 0.084 1
1 6 . 19 1 1 A 7 7 GLY H H 7 8.449 8.640 -0.191 1
1 7 . 19 1 1 A 7 7 GLY HA2 H 7 3.965 4.251 -0.286 1
1 8 . 19 1 1 A 7 7 GLY HA3 H 7 3.965 4.256 -0.291 1
1 9 . 19 1 1 A 7 7 GLY C C 7 174.380 172.839 1.541 1
1 10 . 19 1 1 A 7 7 GLY CA C 7 45.435 44.919 0.516 1
1 11 . 19 1 1 A 7 7 GLY N N 7 110.792 114.393 -3.601 1
1 12 . 19 1 1 A 8 8 MET H H 8 8.259 8.738 -0.479 1
1 13 . 19 1 1 A 8 8 MET HA H 8 4.487 4.177 0.310 1
1 21 . 19 1 1 A 8 8 MET C C 8 176.961 177.222 -0.261 1
1 22 . 19 1 1 A 8 8 MET CA C 8 55.565 56.260 -0.695 1
1 23 . 19 1 1 A 8 8 MET CB C 8 32.835 32.269 0.566 1
1 26 . 19 1 1 A 8 8 MET N N 8 119.639 124.823 -5.184 1
1 27 . 19 1 1 A 9 9 GLY H H 9 8.472 8.882 -0.410 1
1 28 . 19 1 1 A 9 9 GLY HA2 H 9 3.946 3.605 0.341 1
1 29 . 19 1 1 A 9 9 GLY HA3 H 9 3.946 3.663 0.283 1
1 30 . 19 1 1 A 9 9 GLY C C 9 174.005 173.556 0.449 1
1 31 . 19 1 1 A 9 9 GLY CA C 9 45.488 46.794 -1.306 1
1 32 . 19 1 1 A 9 9 GLY N N 9 110.107 113.380 -3.273 1
1 33 . 19 1 1 A 10 10 ASP H H 10 8.292 7.892 0.400 1
1 34 . 19 1 1 A 10 10 ASP HA H 10 4.636 5.182 -0.546 1
1 37 . 19 1 1 A 10 10 ASP C C 10 176.768 176.016 0.752 1
1 38 . 19 1 1 A 10 10 ASP CA C 10 54.206 53.262 0.944 1
1 39 . 19 1 1 A 10 10 ASP CB C 10 41.306 43.246 -1.940 1
1 40 . 19 1 1 A 10 10 ASP N N 10 120.370 119.948 0.422 1
1 41 . 19 1 1 A 11 11 GLY H H 11 8.452 8.622 -0.170 1
1 42 . 19 1 1 A 11 11 GLY HA2 H 11 3.980 4.102 -0.122 1
1 43 . 19 1 1 A 11 11 GLY HA3 H 11 4.022 4.106 -0.084 1
1 44 . 19 1 1 A 11 11 GLY C C 11 174.102 174.866 -0.764 1
1 45 . 19 1 1 A 11 11 GLY CA C 11 45.170 45.956 -0.786 1
1 46 . 19 1 1 A 11 11 GLY N N 11 108.391 112.646 -4.255 1
1 47 . 19 1 1 A 12 12 ALA H H 12 8.293 8.124 0.169 1
1 48 . 19 1 1 A 12 12 ALA HA H 12 3.777 4.001 -0.224 1
1 52 . 19 1 1 A 12 12 ALA C C 12 178.193 178.171 0.022 1
1 53 . 19 1 1 A 12 12 ALA CA C 12 52.759 52.448 0.311 1
1 54 . 19 1 1 A 12 12 ALA CB C 12 17.855 18.868 -1.013 1
1 55 . 19 1 1 A 12 12 ALA N N 12 124.185 122.395 1.790 1
1 56 . 19 1 1 A 13 13 VAL H H 13 8.822 8.327 0.495 1
1 57 . 19 1 1 A 13 13 VAL HA H 13 3.912 3.621 0.291 1
1 65 . 19 1 1 A 13 13 VAL C C 13 176.073 175.880 0.193 1
1 66 . 19 1 1 A 13 13 VAL CA C 13 63.100 66.600 -3.500 1
1 67 . 19 1 1 A 13 13 VAL CB C 13 32.711 31.767 0.944 1
1 70 . 19 1 1 A 13 13 VAL N N 13 120.877 125.246 -4.369 1
1 71 . 19 1 1 A 14 14 LYS H H 14 7.093 7.371 -0.278 1
1 72 . 19 1 1 A 14 14 LYS HA H 14 4.169 4.658 -0.489 1
1 81 . 19 1 1 A 14 14 LYS C C 14 173.291 173.845 -0.554 1
1 82 . 19 1 1 A 14 14 LYS CA C 14 56.465 55.552 0.913 1
1 83 . 19 1 1 A 14 14 LYS CB C 14 35.960 35.534 0.426 1
1 87 . 19 1 1 A 14 14 LYS N N 14 118.693 118.879 -0.186 1
1 88 . 19 1 1 A 15 15 GLN H H 15 8.522 8.518 0.004 1
1 89 . 19 1 1 A 15 15 GLN HA H 15 5.542 5.211 0.331 1
1 96 . 19 1 1 A 15 15 GLN C C 15 174.992 175.902 -0.910 1
1 97 . 19 1 1 A 15 15 GLN CA C 15 54.312 53.915 0.397 1
1 98 . 19 1 1 A 15 15 GLN CB C 15 33.585 31.687 1.898 1
1 100 . 19 1 1 A 15 15 GLN N N 15 124.024 124.718 -0.694 1
1 102 . 19 1 1 A 16 16 GLY H H 16 8.740 8.369 0.371 1
1 103 . 19 1 1 A 16 16 GLY HA2 H 16 4.511 3.847 0.664 1
1 104 . 19 1 1 A 16 16 GLY HA3 H 16 4.064 4.373 -0.309 1
1 105 . 19 1 1 A 16 16 GLY C C 16 171.431 171.300 0.131 1
1 106 . 19 1 1 A 16 16 GLY CA C 16 46.106 45.871 0.235 1
1 107 . 19 1 1 A 16 16 GLY N N 16 109.611 109.165 0.446 1
1 108 . 19 1 1 A 17 17 PHE H H 17 8.886 8.362 0.524 1
1 109 . 19 1 1 A 17 17 PHE HA H 17 5.466 5.234 0.232 1
1 114 . 19 1 1 A 17 17 PHE C C 17 174.795 174.898 -0.103 1
1 115 . 19 1 1 A 17 17 PHE CA C 17 57.788 56.376 1.412 1
1 116 . 19 1 1 A 17 17 PHE CB C 17 41.315 41.813 -0.498 1
1 119 . 19 1 1 A 17 17 PHE N N 17 122.684 119.407 3.277 1
1 120 . 19 1 1 A 18 18 LEU H H 18 8.762 8.358 0.404 1
1 121 . 19 1 1 A 18 18 LEU HA H 18 4.946 4.650 0.296 1
1 131 . 19 1 1 A 18 18 LEU C C 18 175.461 174.840 0.621 1
1 132 . 19 1 1 A 18 18 LEU CA C 18 52.970 53.221 -0.251 1
1 133 . 19 1 1 A 18 18 LEU CB C 18 47.945 45.408 2.537 1
1 137 . 19 1 1 A 18 18 LEU N N 18 119.045 122.752 -3.707 1
1 138 . 19 1 1 A 19 19 TYR H H 19 9.272 8.437 0.835 1
1 139 . 19 1 1 A 19 19 TYR HA H 19 5.682 5.215 0.467 1
1 146 . 19 1 1 A 19 19 TYR C C 19 174.829 174.687 0.142 1
1 147 . 19 1 1 A 19 19 TYR CA C 19 56.482 56.980 -0.498 1
1 148 . 19 1 1 A 19 19 TYR CB C 19 41.717 40.271 1.446 1
1 153 . 19 1 1 A 19 19 TYR N N 19 118.024 123.048 -5.024 1
1 154 . 19 1 1 A 20 20 LEU H H 20 9.441 9.057 0.384 1
1 155 . 19 1 1 A 20 20 LEU HA H 20 5.283 5.290 -0.007 1
1 165 . 19 1 1 A 20 20 LEU C C 20 175.935 175.219 0.716 1
1 166 . 19 1 1 A 20 20 LEU CA C 20 53.464 53.863 -0.399 1
1 167 . 19 1 1 A 20 20 LEU CB C 20 46.570 46.329 0.241 1
1 171 . 19 1 1 A 20 20 LEU N N 20 122.838 125.577 -2.739 1
1 172 . 19 1 1 A 21 21 GLN H H 21 8.391 8.811 -0.420 1
1 173 . 19 1 1 A 21 21 GLN HA H 21 3.791 4.453 -0.662 1
1 180 . 19 1 1 A 21 21 GLN C C 21 175.157 174.853 0.304 1
1 181 . 19 1 1 A 21 21 GLN CA C 21 56.094 55.017 1.077 1
1 182 . 19 1 1 A 21 21 GLN CB C 21 28.434 28.941 -0.507 1
1 184 . 19 1 1 A 21 21 GLN N N 21 129.943 127.700 2.243 1
1 186 . 19 1 1 A 22 22 GLN H H 22 8.829 8.766 0.063 1
1 187 . 19 1 1 A 22 22 GLN HA H 22 4.553 4.895 -0.342 1
1 194 . 19 1 1 A 22 22 GLN C C 22 174.998 175.416 -0.418 1
1 195 . 19 1 1 A 22 22 GLN CA C 22 54.912 54.138 0.774 1
1 196 . 19 1 1 A 22 22 GLN CB C 22 31.930 32.172 -0.242 1
1 198 . 19 1 1 A 22 22 GLN N N 22 127.199 124.946 2.253 1
1 200 . 19 1 1 A 23 23 GLN HA H 23 4.142 4.624 -0.482 1
1 207 . 19 1 1 A 23 23 GLN CA C 23 56.427 54.276 2.151 1
1 208 . 19 1 1 A 23 23 GLN CB C 23 29.227 29.526 -0.299 1
1 211 . 19 1 1 A 24 24 GLN HA H 24 4.523 4.021 0.502 1
1 218 . 19 1 1 A 24 24 GLN CB C 24 29.759 29.746 0.013 1
1 221 . 19 1 1 A 25 25 THR HA H 25 3.870 4.743 -0.873 1
1 226 . 19 1 1 A 25 25 THR CA C 25 65.096 61.461 3.635 1
1 227 . 19 1 1 A 25 25 THR CB C 25 68.924 70.812 -1.888 1
1 229 . 19 1 1 A 26 26 PHE HA H 26 4.690 4.264 0.426 1
1 236 . 19 1 1 A 26 26 PHE C C 26 175.523 176.208 -0.685 1
1 237 . 19 1 1 A 26 26 PHE CA C 26 57.312 59.209 -1.897 1
1 238 . 19 1 1 A 26 26 PHE CB C 26 39.003 38.481 0.522 1
1 243 . 19 1 1 A 27 27 GLY H H 27 7.755 8.929 -1.174 1
1 244 . 19 1 1 A 27 27 GLY HA2 H 27 4.172 3.889 0.283 1
1 245 . 19 1 1 A 27 27 GLY HA3 H 27 3.783 4.028 -0.245 1
1 246 . 19 1 1 A 27 27 GLY C C 27 172.557 174.596 -2.039 1
1 247 . 19 1 1 A 27 27 GLY CA C 27 44.924 45.810 -0.886 1
1 248 . 19 1 1 A 27 27 GLY N N 27 109.216 112.472 -3.256 1
1 249 . 19 1 1 A 28 28 LYS H H 28 8.241 8.064 0.177 1
1 250 . 19 1 1 A 28 28 LYS HA H 28 4.530 4.112 0.418 1
1 259 . 19 1 1 A 28 28 LYS C C 28 176.204 176.136 0.068 1
1 260 . 19 1 1 A 28 28 LYS CA C 28 55.741 57.049 -1.308 1
1 261 . 19 1 1 A 28 28 LYS CB C 28 33.904 32.532 1.372 1
1 265 . 19 1 1 A 28 28 LYS N N 28 118.743 120.896 -2.153 1
1 266 . 19 1 1 A 29 29 LYS H H 29 8.356 8.633 -0.277 1
1 267 . 19 1 1 A 29 29 LYS HA H 29 4.559 4.971 -0.412 1
1 274 . 19 1 1 A 29 29 LYS C C 29 175.420 175.006 0.414 1
1 275 . 19 1 1 A 29 29 LYS CA C 29 55.406 53.934 1.472 1
1 276 . 19 1 1 A 29 29 LYS CB C 29 35.618 35.908 -0.290 1
1 280 . 19 1 1 A 29 29 LYS N N 29 121.198 119.733 1.465 1
1 281 . 19 1 1 A 30 30 TRP H H 30 8.891 8.821 0.070 1
1 282 . 19 1 1 A 30 30 TRP HA H 30 4.951 5.035 -0.084 1
1 291 . 19 1 1 A 30 30 TRP C C 30 175.902 175.639 0.263 1
1 292 . 19 1 1 A 30 30 TRP CA C 30 56.677 56.894 -0.217 1
1 293 . 19 1 1 A 30 30 TRP CB C 30 30.614 29.929 0.685 1
1 299 . 19 1 1 A 30 30 TRP N N 30 123.304 121.551 1.753 1
1 301 . 19 1 1 A 31 31 ARG H H 31 8.712 8.565 0.147 1
1 302 . 19 1 1 A 31 31 ARG HA H 31 4.820 4.596 0.224 1
1 309 . 19 1 1 A 31 31 ARG C C 31 174.026 174.638 -0.612 1
1 310 . 19 1 1 A 31 31 ARG CA C 31 54.895 54.644 0.251 1
1 311 . 19 1 1 A 31 31 ARG CB C 31 34.045 31.877 2.168 1
1 314 . 19 1 1 A 31 31 ARG N N 31 123.973 124.825 -0.852 1
1 315 . 19 1 1 A 32 32 ARG H H 32 8.820 8.667 0.153 1
1 316 . 19 1 1 A 32 32 ARG HA H 32 3.965 4.559 -0.594 1
1 323 . 19 1 1 A 32 32 ARG C C 32 174.785 174.764 0.021 1
1 324 . 19 1 1 A 32 32 ARG CA C 32 56.924 56.008 0.916 1
1 325 . 19 1 1 A 32 32 ARG CB C 32 31.806 31.132 0.674 1
1 328 . 19 1 1 A 32 32 ARG N N 32 127.041 125.559 1.482 1
1 329 . 19 1 1 A 33 33 PHE H H 33 9.372 8.699 0.673 1
1 330 . 19 1 1 A 33 33 PHE HA H 33 4.863 5.025 -0.162 1
1 338 . 19 1 1 A 33 33 PHE C C 33 176.359 175.498 0.861 1
1 339 . 19 1 1 A 33 33 PHE CA C 33 57.224 56.574 0.650 1
1 340 . 19 1 1 A 33 33 PHE CB C 33 43.385 42.478 0.907 1
1 346 . 19 1 1 A 33 33 PHE N N 33 125.882 123.840 2.042 1
1 347 . 19 1 1 A 34 34 GLY H H 34 9.160 8.780 0.380 1
1 348 . 19 1 1 A 34 34 GLY HA2 H 34 4.182 4.076 0.106 1
1 349 . 19 1 1 A 34 34 GLY HA3 H 34 3.714 4.150 -0.436 1
1 350 . 19 1 1 A 34 34 GLY C C 34 172.920 172.996 -0.076 1
1 351 . 19 1 1 A 34 34 GLY CA C 34 46.247 46.010 0.237 1
1 352 . 19 1 1 A 34 34 GLY N N 34 108.654 111.215 -2.561 1
1 353 . 19 1 1 A 35 35 ALA H H 35 8.982 8.589 0.393 1
1 354 . 19 1 1 A 35 35 ALA HA H 35 5.660 5.564 0.096 1
1 358 . 19 1 1 A 35 35 ALA C C 35 176.547 175.861 0.686 1
1 359 . 19 1 1 A 35 35 ALA CA C 35 50.500 50.253 0.247 1
1 360 . 19 1 1 A 35 35 ALA CB C 35 24.034 21.687 2.347 1
1 361 . 19 1 1 A 35 35 ALA N N 35 130.076 126.893 3.183 1
1 362 . 19 1 1 A 36 36 SER H H 36 8.852 8.777 0.075 1
1 363 . 19 1 1 A 36 36 SER HA H 36 5.203 5.055 0.148 1
1 366 . 19 1 1 A 36 36 SER C C 36 170.939 172.474 -1.535 1
1 367 . 19 1 1 A 36 36 SER CA C 36 57.806 57.477 0.329 1
1 368 . 19 1 1 A 36 36 SER CB C 36 66.986 65.512 1.474 1
1 369 . 19 1 1 A 36 36 SER N N 36 116.620 117.527 -0.907 1
1 370 . 19 1 1 A 37 37 LEU H H 37 8.862 9.203 -0.341 1
1 371 . 19 1 1 A 37 37 LEU HA H 37 5.163 5.081 0.082 1
1 381 . 19 1 1 A 37 37 LEU C C 37 173.525 174.096 -0.571 1
1 382 . 19 1 1 A 37 37 LEU CA C 37 53.112 53.283 -0.171 1
1 383 . 19 1 1 A 37 37 LEU CB C 37 46.077 44.034 2.043 1
1 387 . 19 1 1 A 37 37 LEU N N 37 127.638 128.316 -0.678 1
1 388 . 19 1 1 A 38 38 TYR H H 38 9.280 8.642 0.638 1
1 389 . 19 1 1 A 38 38 TYR HA H 38 4.820 5.288 -0.468 1
1 396 . 19 1 1 A 38 38 TYR C C 38 175.430 175.092 0.338 1
1 397 . 19 1 1 A 38 38 TYR CA C 38 57.436 56.175 1.261 1
1 398 . 19 1 1 A 38 38 TYR CB C 38 42.128 41.231 0.897 1
1 403 . 19 1 1 A 38 38 TYR N N 38 125.215 126.900 -1.685 1
1 404 . 19 1 1 A 39 39 GLY H H 39 8.532 8.484 0.048 1
1 405 . 19 1 1 A 39 39 GLY HA2 H 39 4.220 4.154 0.066 1
1 406 . 19 1 1 A 39 39 GLY HA3 H 39 3.941 4.159 -0.218 1
1 407 . 19 1 1 A 39 39 GLY C C 39 172.950 174.045 -1.095 1
1 408 . 19 1 1 A 39 39 GLY CA C 39 44.817 44.658 0.159 1
1 409 . 19 1 1 A 39 39 GLY N N 39 106.424 109.911 -3.487 1
1 410 . 19 1 1 A 40 40 GLY H H 40 8.477 8.588 -0.111 1
1 411 . 19 1 1 A 40 40 GLY HA2 H 40 4.102 3.837 0.265 1
1 412 . 19 1 1 A 40 40 GLY HA3 H 40 3.927 3.840 0.087 1
1 413 . 19 1 1 A 40 40 GLY C C 40 174.002 175.673 -1.671 1
1 414 . 19 1 1 A 40 40 GLY CA C 40 44.694 47.240 -2.546 1
1 415 . 19 1 1 A 40 40 GLY N N 40 106.881 109.356 -2.475 1
1 416 . 19 1 1 A 41 41 SER H H 41 8.600 8.750 -0.150 1
1 417 . 19 1 1 A 41 41 SER HA H 41 4.520 4.155 0.365 1
1 420 . 19 1 1 A 41 41 SER C C 41 174.355 174.935 -0.580 1
1 421 . 19 1 1 A 41 41 SER CA C 41 58.565 62.606 -4.041 1
1 422 . 19 1 1 A 41 41 SER CB C 41 64.413 62.880 1.533 1
1 423 . 19 1 1 A 41 41 SER N N 41 115.751 121.691 -5.940 1
1 424 . 19 1 1 A 42 42 ASP H H 42 8.533 8.259 0.274 1
1 425 . 19 1 1 A 42 42 ASP HA H 42 4.560 4.872 -0.312 1
1 428 . 19 1 1 A 42 42 ASP CA C 42 55.230 53.815 1.415 1
1 429 . 19 1 1 A 42 42 ASP CB C 42 40.648 40.651 -0.003 1
1 430 . 19 1 1 A 42 42 ASP N N 42 119.037 120.730 -1.693 1
1 431 . 19 1 1 A 43 43 CYS H H 43 8.152 9.111 -0.959 1
1 432 . 19 1 1 A 43 43 CYS HA H 43 4.541 4.403 0.138 1
1 435 . 19 1 1 A 43 43 CYS C C 43 173.975 175.101 -1.126 1
1 436 . 19 1 1 A 43 43 CYS CA C 43 58.265 60.188 -1.923 1
1 437 . 19 1 1 A 43 43 CYS CB C 43 28.393 27.480 0.913 1
1 438 . 19 1 1 A 43 43 CYS N N 43 116.881 124.209 -7.328 1
1 439 . 19 1 1 A 44 44 ALA H H 44 8.047 8.096 -0.049 1
1 440 . 19 1 1 A 44 44 ALA HA H 44 4.395 4.360 0.035 1
1 444 . 19 1 1 A 44 44 ALA C C 44 176.472 176.367 0.105 1
1 445 . 19 1 1 A 44 44 ALA CA C 44 52.688 51.745 0.943 1
1 446 . 19 1 1 A 44 44 ALA CB C 44 20.579 19.561 1.018 1
1 447 . 19 1 1 A 44 44 ALA N N 44 125.989 121.968 4.021 1
1 448 . 19 1 1 A 45 45 LEU H H 45 8.052 7.324 0.728 1
1 449 . 19 1 1 A 45 45 LEU HA H 45 4.452 4.966 -0.514 1
1 459 . 19 1 1 A 45 45 LEU C C 45 176.196 175.294 0.902 1
1 460 . 19 1 1 A 45 45 LEU CA C 45 53.771 53.959 -0.188 1
1 461 . 19 1 1 A 45 45 LEU CB C 45 43.116 46.297 -3.181 1
1 465 . 19 1 1 A 45 45 LEU N N 45 119.889 119.150 0.739 1
1 466 . 19 1 1 A 46 46 ALA H H 46 8.381 8.617 -0.236 1
1 467 . 19 1 1 A 46 46 ALA HA H 46 4.449 5.251 -0.802 1
1 471 . 19 1 1 A 46 46 ALA C C 46 179.093 175.474 3.619 1
1 472 . 19 1 1 A 46 46 ALA CA C 46 52.829 52.022 0.807 1
1 473 . 19 1 1 A 46 46 ALA CB C 46 18.687 21.381 -2.694 1
1 474 . 19 1 1 A 46 46 ALA N N 46 125.635 123.967 1.668 1
1 475 . 19 1 1 A 47 47 ARG H H 47 9.012 8.883 0.129 1
1 476 . 19 1 1 A 47 47 ARG HA H 47 5.192 5.234 -0.042 1
1 484 . 19 1 1 A 47 47 ARG C C 47 171.524 174.032 -2.508 1
1 485 . 19 1 1 A 47 47 ARG CA C 47 55.265 54.676 0.589 1
1 486 . 19 1 1 A 47 47 ARG CB C 47 30.970 34.118 -3.148 1
1 489 . 19 1 1 A 47 47 ARG N N 47 120.048 121.613 -1.565 1
1 491 . 19 1 1 A 48 48 LEU H H 48 9.029 8.592 0.437 1
1 492 . 19 1 1 A 48 48 LEU HA H 48 5.221 5.098 0.123 1
1 502 . 19 1 1 A 48 48 LEU C C 48 174.348 175.243 -0.895 1
1 503 . 19 1 1 A 48 48 LEU CA C 48 53.253 53.990 -0.737 1
1 504 . 19 1 1 A 48 48 LEU CB C 48 45.419 43.725 1.694 1
1 508 . 19 1 1 A 48 48 LEU N N 48 123.315 123.523 -0.208 1
1 509 . 19 1 1 A 49 49 GLU H H 49 9.473 8.624 0.849 1
1 510 . 19 1 1 A 49 49 GLU HA H 49 5.222 5.105 0.117 1
1 515 . 19 1 1 A 49 49 GLU C C 49 175.507 175.890 -0.383 1
1 516 . 19 1 1 A 49 49 GLU CA C 49 55.159 55.369 -0.210 1
1 517 . 19 1 1 A 49 49 GLU CB C 49 32.341 31.935 0.406 1
1 519 . 19 1 1 A 49 49 GLU N N 49 124.751 126.875 -2.124 1
1 520 . 19 1 1 A 50 50 LEU H H 50 9.088 8.229 0.859 1
1 521 . 19 1 1 A 50 50 LEU HA H 50 5.382 5.207 0.175 1
1 531 . 19 1 1 A 50 50 LEU C C 50 175.474 175.423 0.051 1
1 532 . 19 1 1 A 50 50 LEU CA C 50 52.865 53.624 -0.759 1
1 533 . 19 1 1 A 50 50 LEU CB C 50 43.239 46.145 -2.906 1
1 537 . 19 1 1 A 50 50 LEU N N 50 124.221 120.948 3.273 1
1 538 . 19 1 1 A 51 51 GLN H H 51 9.602 8.462 1.140 1
1 539 . 19 1 1 A 51 51 GLN HA H 51 5.095 4.843 0.252 1
1 546 . 19 1 1 A 51 51 GLN C C 51 175.306 174.219 1.087 1
1 547 . 19 1 1 A 51 51 GLN CA C 51 54.576 54.493 0.083 1
1 548 . 19 1 1 A 51 51 GLN CB C 51 32.177 30.024 2.153 1
1 550 . 19 1 1 A 51 51 GLN N N 51 123.268 121.859 1.409 1
1 552 . 19 1 1 A 52 52 GLU H H 52 9.172 8.629 0.543 1
1 553 . 19 1 1 A 52 52 GLU HA H 52 4.092 4.147 -0.055 1
1 558 . 19 1 1 A 52 52 GLU C C 52 176.523 175.843 0.680 1
1 559 . 19 1 1 A 52 52 GLU CA C 52 57.500 55.770 1.730 1
1 560 . 19 1 1 A 52 52 GLU CB C 52 30.696 28.470 2.226 1
1 562 . 19 1 1 A 52 52 GLU N N 52 128.982 126.127 2.855 1
1 563 . 19 1 1 A 53 53 GLY H H 53 8.644 8.682 -0.038 1
1 564 . 19 1 1 A 53 53 GLY HA2 H 53 4.261 4.249 0.012 1
1 565 . 19 1 1 A 53 53 GLY HA3 H 53 3.993 4.290 -0.297 1
1 566 . 19 1 1 A 53 53 GLY C C 53 172.550 173.943 -1.393 1
1 567 . 19 1 1 A 53 53 GLY CA C 53 45.911 44.994 0.917 1
1 568 . 19 1 1 A 53 53 GLY N N 53 110.844 113.603 -2.759 1
1 569 . 19 1 1 A 54 54 PRO HA H 54 4.392 4.515 -0.123 1
1 576 . 19 1 1 A 54 54 PRO C C 54 176.828 176.428 0.400 1
1 577 . 19 1 1 A 54 54 PRO CA C 54 63.665 64.780 -1.115 1
1 578 . 19 1 1 A 54 54 PRO CB C 54 32.012 32.108 -0.096 1
1 581 . 19 1 1 A 55 55 GLU H H 55 8.934 8.004 0.930 1
1 582 . 19 1 1 A 55 55 GLU HA H 55 4.193 4.680 -0.487 1
1 587 . 19 1 1 A 55 55 GLU C C 55 176.189 176.136 0.053 1
1 588 . 19 1 1 A 55 55 GLU CA C 55 57.383 55.216 2.167 1
1 589 . 19 1 1 A 55 55 GLU CB C 55 28.945 31.248 -2.303 1
1 591 . 19 1 1 A 55 55 GLU N N 55 120.312 118.231 2.081 1
1 592 . 19 1 1 A 56 56 LYS H H 56 7.937 9.129 -1.192 1
1 593 . 19 1 1 A 56 56 LYS HA H 56 4.578 5.034 -0.456 1
1 602 . 19 1 1 A 56 56 LYS C C 56 174.295 174.946 -0.651 1
1 603 . 19 1 1 A 56 56 LYS CA C 56 54.171 53.243 0.928 1
1 604 . 19 1 1 A 56 56 LYS CB C 56 32.555 35.290 -2.735 1
1 608 . 19 1 1 A 56 56 LYS N N 56 122.008 119.534 2.474 1
1 609 . 19 1 1 A 57 57 PRO HA H 57 4.370 4.617 -0.247 1
1 616 . 19 1 1 A 57 57 PRO CA C 57 63.431 62.307 1.124 1
1 617 . 19 1 1 A 57 57 PRO CB C 57 32.072 33.335 -1.263 1
1 620 . 19 1 1 A 58 58 ARG H H 58 8.310 8.928 -0.618 1
1 621 . 19 1 1 A 58 58 ARG HA H 58 4.295 4.003 0.292 1
1 628 . 19 1 1 A 58 58 ARG CA C 58 56.570 58.797 -2.227 1
1 629 . 19 1 1 A 58 58 ARG CB C 58 30.860 30.496 0.364 1
1 632 . 19 1 1 A 58 58 ARG N N 58 120.045 119.454 0.591 1
1 633 . 19 1 1 A 60 60 CYS HA H 60 4.482 4.066 0.416 1
1 636 . 19 1 1 A 60 60 CYS CA C 60 58.621 62.866 -4.245 1
1 637 . 19 1 1 A 60 60 CYS CB C 60 28.267 27.577 0.690 1
1 638 . 19 1 1 A 61 61 GLU HA H 61 4.226 3.897 0.329 1
1 643 . 19 1 1 A 61 61 GLU C C 61 176.299 175.001 1.298 1
1 644 . 19 1 1 A 61 61 GLU CA C 61 57.100 57.555 -0.455 1
1 645 . 19 1 1 A 61 61 GLU CB C 61 29.873 27.275 2.598 1
1 647 . 19 1 1 A 62 62 ALA H H 62 8.282 7.397 0.885 1
1 648 . 19 1 1 A 62 62 ALA HA H 62 4.302 4.994 -0.692 1
1 652 . 19 1 1 A 62 62 ALA C C 62 177.277 175.473 1.804 1
1 653 . 19 1 1 A 62 62 ALA CA C 62 52.512 51.212 1.300 1
1 654 . 19 1 1 A 62 62 ALA CB C 62 19.592 24.027 -4.435 1
1 655 . 19 1 1 A 62 62 ALA N N 62 124.386 118.483 5.903 1
1 656 . 19 1 1 A 63 63 ALA H H 63 8.399 8.785 -0.386 1
1 657 . 19 1 1 A 63 63 ALA HA H 63 4.375 5.040 -0.665 1
1 661 . 19 1 1 A 63 63 ALA C C 63 176.843 176.476 0.367 1
1 662 . 19 1 1 A 63 63 ALA CA C 63 52.658 50.150 2.508 1
1 663 . 19 1 1 A 63 63 ALA CB C 63 19.592 22.323 -2.731 1
1 664 . 19 1 1 A 63 63 ALA N N 63 123.892 121.940 1.952 1
1 665 . 19 1 1 A 64 64 ARG H H 64 8.152 8.441 -0.289 1
1 666 . 19 1 1 A 64 64 ARG HA H 64 5.008 4.750 0.258 1
1 673 . 19 1 1 A 64 64 ARG C C 64 175.594 174.484 1.110 1
1 674 . 19 1 1 A 64 64 ARG CA C 64 55.282 55.439 -0.157 1
1 675 . 19 1 1 A 64 64 ARG CB C 64 32.506 32.325 0.181 1
1 678 . 19 1 1 A 64 64 ARG N N 64 119.787 119.290 0.497 1
1 679 . 19 1 1 A 65 65 LYS H H 65 8.945 8.607 0.338 1
1 680 . 19 1 1 A 65 65 LYS HA H 65 4.602 5.013 -0.411 1
1 689 . 19 1 1 A 65 65 LYS C C 65 174.657 174.377 0.280 1
1 690 . 19 1 1 A 65 65 LYS CA C 65 54.948 54.799 0.149 1
1 691 . 19 1 1 A 65 65 LYS CB C 65 34.068 35.083 -1.015 1
1 695 . 19 1 1 A 65 65 LYS N N 65 124.171 123.095 1.076 1
1 696 . 19 1 1 A 66 66 VAL H H 66 8.672 8.789 -0.117 1
1 697 . 19 1 1 A 66 66 VAL HA H 66 4.532 5.057 -0.525 1
1 705 . 19 1 1 A 66 66 VAL C C 66 175.078 173.815 1.263 1
1 706 . 19 1 1 A 66 66 VAL CA C 66 61.865 59.964 1.901 1
1 707 . 19 1 1 A 66 66 VAL CB C 66 33.835 35.081 -1.246 1
1 710 . 19 1 1 A 66 66 VAL N N 66 124.380 125.103 -0.723 1
1 711 . 19 1 1 A 67 67 ILE H H 67 9.071 9.100 -0.029 1
1 712 . 19 1 1 A 67 67 ILE HA H 67 4.142 4.658 -0.516 1
1 722 . 19 1 1 A 67 67 ILE C C 67 175.819 175.670 0.149 1
1 723 . 19 1 1 A 67 67 ILE CA C 67 60.383 60.531 -0.148 1
1 724 . 19 1 1 A 67 67 ILE CB C 67 39.908 38.923 0.985 1
1 728 . 19 1 1 A 67 67 ILE N N 67 129.537 129.151 0.386 1
1 729 . 19 1 1 A 68 68 ARG H H 68 9.203 8.787 0.416 1
1 730 . 19 1 1 A 68 68 ARG HA H 68 4.198 4.295 -0.097 1
1 737 . 19 1 1 A 68 68 ARG C C 68 177.769 177.163 0.606 1
1 738 . 19 1 1 A 68 68 ARG CA C 68 56.835 56.506 0.329 1
1 739 . 19 1 1 A 68 68 ARG CB C 68 29.832 30.673 -0.841 1
1 742 . 19 1 1 A 68 68 ARG N N 68 128.484 128.572 -0.088 1
1 743 . 19 1 1 A 69 69 LEU H H 69 8.212 8.673 -0.461 1
1 744 . 19 1 1 A 69 69 LEU HA H 69 4.221 4.090 0.131 1
1 754 . 19 1 1 A 69 69 LEU C C 69 178.996 178.950 0.046 1
1 755 . 19 1 1 A 69 69 LEU CA C 69 57.136 57.114 0.022 1
1 756 . 19 1 1 A 69 69 LEU CB C 69 39.455 41.756 -2.301 1
1 760 . 19 1 1 A 69 69 LEU N N 69 123.807 123.009 0.798 1
1 761 . 19 1 1 A 70 70 SER H H 70 8.823 8.203 0.620 1
1 762 . 19 1 1 A 70 70 SER HA H 70 4.331 4.093 0.238 1
1 765 . 19 1 1 A 70 70 SER C C 70 175.076 176.392 -1.316 1
1 766 . 19 1 1 A 70 70 SER CA C 70 60.329 61.401 -1.072 1
1 767 . 19 1 1 A 70 70 SER CB C 70 62.362 62.517 -0.155 1
1 768 . 19 1 1 A 70 70 SER N N 70 115.162 113.181 1.981 1
1 769 . 19 1 1 A 71 71 ASP H H 71 7.602 8.191 -0.589 1
1 770 . 19 1 1 A 71 71 ASP HA H 71 4.820 4.407 0.413 1
1 773 . 19 1 1 A 71 71 ASP C C 71 176.478 176.748 -0.270 1
1 774 . 19 1 1 A 71 71 ASP CA C 71 54.241 56.458 -2.217 1
1 775 . 19 1 1 A 71 71 ASP CB C 71 41.347 40.821 0.526 1
1 776 . 19 1 1 A 71 71 ASP N N 71 119.590 121.739 -2.149 1
1 777 . 19 1 1 A 72 72 CYS H H 72 7.715 7.530 0.185 1
1 778 . 19 1 1 A 72 72 CYS HA H 72 4.372 4.884 -0.512 1
1 781 . 19 1 1 A 72 72 CYS C C 72 173.690 174.556 -0.866 1
1 782 . 19 1 1 A 72 72 CYS CA C 72 60.836 57.972 2.864 1
1 783 . 19 1 1 A 72 72 CYS CB C 72 27.655 26.506 1.149 1
1 784 . 19 1 1 A 72 72 CYS N N 72 118.346 117.285 1.061 1
1 785 . 19 1 1 A 73 73 LEU H H 73 9.472 8.929 0.543 1
1 786 . 19 1 1 A 73 73 LEU HA H 73 4.593 4.071 0.522 1
1 796 . 19 1 1 A 73 73 LEU C C 73 177.562 176.751 0.811 1
1 797 . 19 1 1 A 73 73 LEU CA C 73 55.724 57.407 -1.683 1
1 798 . 19 1 1 A 73 73 LEU CB C 73 43.774 42.078 1.696 1
1 802 . 19 1 1 A 73 73 LEU N N 73 124.752 129.203 -4.451 1
1 803 . 19 1 1 A 74 74 ARG H H 74 7.658 7.302 0.356 1
1 804 . 19 1 1 A 74 74 ARG HA H 74 4.592 5.202 -0.610 1
1 811 . 19 1 1 A 74 74 ARG C C 74 173.605 174.279 -0.674 1
1 812 . 19 1 1 A 74 74 ARG CA C 74 56.465 55.915 0.550 1
1 813 . 19 1 1 A 74 74 ARG CB C 74 34.068 33.721 0.347 1
1 816 . 19 1 1 A 74 74 ARG N N 74 115.565 115.665 -0.100 1
1 817 . 19 1 1 A 75 75 VAL H H 75 8.622 8.772 -0.150 1
1 818 . 19 1 1 A 75 75 VAL HA H 75 5.170 5.286 -0.116 1
1 826 . 19 1 1 A 75 75 VAL C C 75 173.985 174.241 -0.256 1
1 827 . 19 1 1 A 75 75 VAL CA C 75 60.930 59.237 1.693 1
1 828 . 19 1 1 A 75 75 VAL CB C 75 35.073 36.684 -1.611 1
1 831 . 19 1 1 A 75 75 VAL N N 75 124.278 118.652 5.626 1
1 832 . 19 1 1 A 76 76 ALA H H 76 8.272 8.859 -0.587 1
1 833 . 19 1 1 A 76 76 ALA HA H 76 4.648 4.901 -0.253 1
1 837 . 19 1 1 A 76 76 ALA C C 76 175.630 175.714 -0.084 1
1 838 . 19 1 1 A 76 76 ALA CA C 76 51.294 51.342 -0.048 1
1 839 . 19 1 1 A 76 76 ALA CB C 76 22.759 23.482 -0.723 1
1 840 . 19 1 1 A 76 76 ALA N N 76 126.015 122.938 3.077 1
1 841 . 19 1 1 A 77 77 GLU H H 77 9.184 8.672 0.512 1
1 842 . 19 1 1 A 77 77 GLU HA H 77 4.060 5.152 -1.092 1
1 847 . 19 1 1 A 77 77 GLU C C 77 174.949 175.392 -0.443 1
1 848 . 19 1 1 A 77 77 GLU CA C 77 58.424 55.414 3.010 1
1 849 . 19 1 1 A 77 77 GLU CB C 77 30.161 31.683 -1.522 1
1 851 . 19 1 1 A 77 77 GLU N N 77 120.223 118.660 1.563 1
1 852 . 19 1 1 A 78 78 ALA H H 78 7.985 8.726 -0.741 1
1 853 . 19 1 1 A 78 78 ALA HA H 78 4.776 5.132 -0.356 1
1 857 . 19 1 1 A 78 78 ALA C C 78 177.250 177.438 -0.188 1
1 858 . 19 1 1 A 78 78 ALA CA C 78 50.888 50.646 0.242 1
1 859 . 19 1 1 A 78 78 ALA CB C 78 20.851 20.448 0.403 1
1 860 . 19 1 1 A 78 78 ALA N N 78 125.143 126.550 -1.407 1
1 861 . 19 1 1 A 79 79 GLY H H 79 8.604 8.687 -0.083 1
1 862 . 19 1 1 A 79 79 GLY HA2 H 79 4.327 4.102 0.225 1
1 863 . 19 1 1 A 79 79 GLY HA3 H 79 3.963 4.103 -0.140 1
1 864 . 19 1 1 A 79 79 GLY C C 79 175.360 173.921 1.439 1
1 865 . 19 1 1 A 79 79 GLY CA C 79 44.925 45.243 -0.318 1
1 866 . 19 1 1 A 79 79 GLY N N 79 109.420 110.382 -0.962 1
1 867 . 19 1 1 A 80 80 GLY H H 80 8.649 8.604 0.045 1
1 868 . 19 1 1 A 80 80 GLY HA2 H 80 3.962 3.852 0.110 1
1 869 . 19 1 1 A 80 80 GLY HA3 H 80 3.962 3.861 0.101 1
1 870 . 19 1 1 A 80 80 GLY C C 80 175.052 174.556 0.496 1
1 871 . 19 1 1 A 80 80 GLY CA C 80 45.955 47.121 -1.166 1
1 872 . 19 1 1 A 80 80 GLY N N 80 108.295 108.318 -0.023 1
1 873 . 19 1 1 A 81 81 GLU H H 81 8.921 8.290 0.631 1
1 874 . 19 1 1 A 81 81 GLU HA H 81 4.298 4.565 -0.267 1
1 879 . 19 1 1 A 81 81 GLU C C 81 176.532 174.996 1.536 1
1 880 . 19 1 1 A 81 81 GLU CA C 81 57.118 55.388 1.730 1
1 881 . 19 1 1 A 81 81 GLU CB C 81 28.599 30.381 -1.782 1
1 883 . 19 1 1 A 81 81 GLU N N 81 121.170 120.278 0.892 1
1 884 . 19 1 1 A 82 82 ALA H H 82 8.032 7.450 0.582 1
1 885 . 19 1 1 A 82 82 ALA HA H 82 4.371 4.615 -0.244 1
1 889 . 19 1 1 A 82 82 ALA C C 82 177.160 177.408 -0.248 1
1 890 . 19 1 1 A 82 82 ALA CA C 82 52.653 50.596 2.057 1
1 891 . 19 1 1 A 82 82 ALA CB C 82 19.304 21.942 -2.638 1
1 892 . 19 1 1 A 82 82 ALA N N 82 124.988 121.999 2.989 1
1 893 . 19 1 1 A 83 83 SER H H 83 8.319 9.009 -0.690 1
1 894 . 19 1 1 A 83 83 SER HA H 83 4.331 4.232 0.099 1
1 897 . 19 1 1 A 83 83 SER C C 83 174.045 174.571 -0.526 1
1 898 . 19 1 1 A 83 83 SER CA C 83 58.053 61.422 -3.369 1
1 899 . 19 1 1 A 83 83 SER CB C 83 63.184 62.855 0.329 1
1 900 . 19 1 1 A 83 83 SER N N 83 114.181 115.051 -0.870 1
1 901 . 19 1 1 A 84 84 SER H H 84 7.823 7.687 0.136 1
1 902 . 19 1 1 A 84 84 SER HA H 84 3.194 4.095 -0.901 1
1 905 . 19 1 1 A 84 84 SER C C 84 171.072 174.046 -2.974 1
1 906 . 19 1 1 A 84 84 SER CA C 84 57.206 56.838 0.368 1
1 907 . 19 1 1 A 84 84 SER CB C 84 61.622 63.407 -1.785 1
1 908 . 19 1 1 A 84 84 SER N N 84 117.302 114.149 3.153 1
1 909 . 19 1 1 A 85 85 PRO HA H 85 3.922 4.506 -0.584 1
1 916 . 19 1 1 A 85 85 PRO CA C 85 62.691 62.103 0.588 1
1 917 . 19 1 1 A 85 85 PRO CB C 85 31.515 32.823 -1.308 1
1 920 . 19 1 1 A 86 86 ARG HA H 86 3.882 4.402 -0.520 1
1 927 . 19 1 1 A 86 86 ARG C C 86 175.712 176.036 -0.324 1
1 928 . 19 1 1 A 86 86 ARG CA C 86 57.877 55.500 2.377 1
1 929 . 19 1 1 A 86 86 ARG CB C 86 29.791 31.641 -1.850 1
1 932 . 19 1 1 A 87 87 ASP H H 87 8.903 8.791 0.112 1
1 933 . 19 1 1 A 87 87 ASP HA H 87 4.342 4.216 0.126 1
1 936 . 19 1 1 A 87 87 ASP C C 87 175.723 175.060 0.663 1
1 937 . 19 1 1 A 87 87 ASP CA C 87 56.377 55.137 1.240 1
1 938 . 19 1 1 A 87 87 ASP CB C 87 39.208 39.671 -0.463 1
1 939 . 19 1 1 A 87 87 ASP N N 87 117.520 120.757 -3.237 1
1 940 . 19 1 1 A 88 88 THR H H 88 7.776 7.385 0.391 1
1 941 . 19 1 1 A 88 88 THR HA H 88 5.101 5.091 0.010 1
1 946 . 19 1 1 A 88 88 THR C C 88 173.825 172.872 0.953 1
1 947 . 19 1 1 A 88 88 THR CA C 88 60.154 59.997 0.157 1
1 948 . 19 1 1 A 88 88 THR CB C 88 72.702 72.868 -0.166 1
1 950 . 19 1 1 A 88 88 THR N N 88 108.770 108.160 0.610 1
1 951 . 19 1 1 A 89 89 SER H H 89 9.006 9.250 -0.244 1
1 952 . 19 1 1 A 89 89 SER HA H 89 4.718 5.181 -0.463 1
1 955 . 19 1 1 A 89 89 SER C C 89 173.728 173.005 0.723 1
1 956 . 19 1 1 A 89 89 SER CA C 89 57.453 57.819 -0.366 1
1 957 . 19 1 1 A 89 89 SER CB C 89 65.611 65.414 0.197 1
1 958 . 19 1 1 A 89 89 SER N N 89 114.151 116.915 -2.764 1
1 959 . 19 1 1 A 90 90 ALA H H 90 9.001 8.832 0.169 1
1 960 . 19 1 1 A 90 90 ALA HA H 90 5.660 4.637 1.023 1
1 964 . 19 1 1 A 90 90 ALA C C 90 177.669 177.169 0.500 1
1 965 . 19 1 1 A 90 90 ALA CA C 90 51.670 51.990 -0.320 1
1 966 . 19 1 1 A 90 90 ALA CB C 90 22.265 19.907 2.358 1
1 967 . 19 1 1 A 90 90 ALA N N 90 126.177 129.022 -2.845 1
1 968 . 19 1 1 A 91 91 PHE H H 91 9.672 8.257 1.415 1
1 969 . 19 1 1 A 91 91 PHE HA H 91 5.039 5.409 -0.370 1
1 977 . 19 1 1 A 91 91 PHE C C 91 170.731 172.764 -2.033 1
1 978 . 19 1 1 A 91 91 PHE CA C 91 56.271 55.343 0.928 1
1 979 . 19 1 1 A 91 91 PHE CB C 91 41.553 41.843 -0.290 1
1 985 . 19 1 1 A 91 91 PHE N N 91 118.968 116.512 2.456 1
1 986 . 19 1 1 A 92 92 PHE H H 92 9.422 9.407 0.015 1
1 987 . 19 1 1 A 92 92 PHE HA H 92 5.674 5.268 0.406 1
1 995 . 19 1 1 A 92 92 PHE C C 92 174.570 175.350 -0.780 1
1 996 . 19 1 1 A 92 92 PHE CA C 92 55.917 57.014 -1.097 1
1 997 . 19 1 1 A 92 92 PHE CB C 92 42.787 41.892 0.895 1
1 1003 . 19 1 1 A 92 92 PHE N N 92 117.543 117.640 -0.097 1
1 1004 . 19 1 1 A 93 93 LEU H H 93 9.021 8.896 0.125 1
1 1005 . 19 1 1 A 93 93 LEU HA H 93 5.122 4.994 0.128 1
1 1015 . 19 1 1 A 93 93 LEU C C 93 174.799 174.198 0.601 1
1 1016 . 19 1 1 A 93 93 LEU CA C 93 54.912 54.754 0.158 1
1 1017 . 19 1 1 A 93 93 LEU CB C 93 45.254 44.773 0.481 1
1 1021 . 19 1 1 A 93 93 LEU N N 93 121.719 121.721 -0.002 1
1 1022 . 19 1 1 A 94 94 GLU H H 94 9.294 9.528 -0.234 1
1 1023 . 19 1 1 A 94 94 GLU HA H 94 5.043 5.206 -0.163 1
1 1028 . 19 1 1 A 94 94 GLU C C 94 175.754 175.541 0.213 1
1 1029 . 19 1 1 A 94 94 GLU CA C 94 56.018 54.976 1.042 1
1 1030 . 19 1 1 A 94 94 GLU CB C 94 32.752 32.795 -0.043 1
1 1032 . 19 1 1 A 94 94 GLU N N 94 127.032 128.694 -1.662 1
1 1033 . 19 1 1 A 95 95 THR H H 95 8.822 8.529 0.293 1
1 1034 . 19 1 1 A 95 95 THR HA H 95 5.398 5.389 0.009 1
1 1039 . 19 1 1 A 95 95 THR C C 95 173.860 175.391 -1.531 1
1 1040 . 19 1 1 A 95 95 THR CA C 95 59.588 59.474 0.114 1
1 1041 . 19 1 1 A 95 95 THR CB C 95 72.191 72.425 -0.234 1
1 1043 . 19 1 1 A 95 95 THR N N 95 118.685 118.117 0.568 1
1 1044 . 19 1 1 A 96 96 LYS H H 96 8.823 8.810 0.013 1
1 1045 . 19 1 1 A 96 96 LYS HA H 96 4.022 3.954 0.068 1
1 1054 . 19 1 1 A 96 96 LYS C C 96 177.330 179.015 -1.685 1
1 1055 . 19 1 1 A 96 96 LYS CA C 96 59.588 60.173 -0.585 1
1 1056 . 19 1 1 A 96 96 LYS CB C 96 32.588 32.046 0.542 1
1 1060 . 19 1 1 A 96 96 LYS N N 96 118.801 121.982 -3.181 1
1 1061 . 19 1 1 A 97 97 GLU H H 97 8.092 7.802 0.290 1
1 1062 . 19 1 1 A 97 97 GLU HA H 97 4.282 4.212 0.070 1
1 1067 . 19 1 1 A 97 97 GLU C C 97 176.290 176.123 0.167 1
1 1068 . 19 1 1 A 97 97 GLU CA C 97 57.365 58.910 -1.545 1
1 1069 . 19 1 1 A 97 97 GLU CB C 97 31.559 30.884 0.675 1
1 1071 . 19 1 1 A 97 97 GLU N N 97 113.992 118.832 -4.840 1
1 1072 . 19 1 1 A 98 98 ARG H H 98 7.482 7.204 0.278 1
1 1073 . 19 1 1 A 98 98 ARG HA H 98 4.397 4.567 -0.170 1
1 1080 . 19 1 1 A 98 98 ARG C C 98 172.792 173.088 -0.296 1
1 1081 . 19 1 1 A 98 98 ARG CA C 98 55.689 54.726 0.963 1
1 1082 . 19 1 1 A 98 98 ARG CB C 98 32.711 31.458 1.253 1
1 1085 . 19 1 1 A 98 98 ARG N N 98 116.022 114.373 1.649 1
1 1086 . 19 1 1 A 99 99 LEU H H 99 8.423 8.219 0.204 1
1 1087 . 19 1 1 A 99 99 LEU HA H 99 4.807 4.739 0.068 1
1 1097 . 19 1 1 A 99 99 LEU C C 99 175.903 174.010 1.893 1
1 1098 . 19 1 1 A 99 99 LEU CA C 99 54.383 53.931 0.452 1
1 1099 . 19 1 1 A 99 99 LEU CB C 99 43.362 44.224 -0.862 1
1 1103 . 19 1 1 A 99 99 LEU N N 99 124.983 121.696 3.287 1
1 1104 . 19 1 1 A 100 100 TYR H H 100 9.144 9.702 -0.558 1
1 1105 . 19 1 1 A 100 100 TYR HA H 100 4.542 5.121 -0.579 1
1 1112 . 19 1 1 A 100 100 TYR C C 100 173.479 174.357 -0.878 1
1 1113 . 19 1 1 A 100 100 TYR CA C 100 57.735 56.462 1.273 1
1 1114 . 19 1 1 A 100 100 TYR CB C 100 39.291 41.376 -2.085 1
1 1119 . 19 1 1 A 100 100 TYR N N 100 126.679 125.866 0.813 1
1 1120 . 19 1 1 A 101 101 LEU H H 101 9.043 8.889 0.154 1
1 1121 . 19 1 1 A 101 101 LEU HA H 101 4.747 4.885 -0.138 1
1 1131 . 19 1 1 A 101 101 LEU C C 101 173.530 174.981 -1.451 1
1 1132 . 19 1 1 A 101 101 LEU CA C 101 54.524 53.715 0.809 1
1 1133 . 19 1 1 A 101 101 LEU CB C 101 42.499 44.099 -1.600 1
1 1137 . 19 1 1 A 101 101 LEU N N 101 127.422 126.253 1.169 1
1 1138 . 19 1 1 A 102 102 LEU H H 102 8.493 8.503 -0.010 1
1 1139 . 19 1 1 A 102 102 LEU HA H 102 5.612 5.481 0.131 1
1 1149 . 19 1 1 A 102 102 LEU C C 102 175.794 175.965 -0.171 1
1 1150 . 19 1 1 A 102 102 LEU CA C 102 53.076 53.193 -0.117 1
1 1151 . 19 1 1 A 102 102 LEU CB C 102 45.994 44.620 1.374 1
1 1155 . 19 1 1 A 102 102 LEU N N 102 126.021 128.794 -2.773 1
1 1156 . 19 1 1 A 103 103 ALA H H 103 9.073 9.023 0.050 1
1 1157 . 19 1 1 A 103 103 ALA HA H 103 5.081 5.339 -0.258 1
1 1161 . 19 1 1 A 103 103 ALA C C 103 175.133 176.021 -0.888 1
1 1162 . 19 1 1 A 103 103 ALA CA C 103 51.688 49.768 1.920 1
1 1163 . 19 1 1 A 103 103 ALA CB C 103 21.689 22.472 -0.783 1
1 1164 . 19 1 1 A 103 103 ALA N N 103 117.679 123.354 -5.675 1
1 1165 . 19 1 1 A 104 104 ALA H H 104 8.582 8.743 -0.161 1
1 1166 . 19 1 1 A 104 104 ALA HA H 104 5.220 4.968 0.252 1
1 1170 . 19 1 1 A 104 104 ALA C C 104 173.471 174.329 -0.858 1
1 1171 . 19 1 1 A 104 104 ALA CA C 104 47.959 49.734 -1.775 1
1 1172 . 19 1 1 A 104 104 ALA CB C 104 21.359 22.608 -1.249 1
1 1173 . 19 1 1 A 104 104 ALA N N 104 123.419 122.091 1.328 1
1 1174 . 19 1 1 A 105 105 PRO HA H 105 4.542 4.790 -0.248 1
1 1181 . 19 1 1 A 105 105 PRO C C 105 178.409 177.892 0.517 1
1 1182 . 19 1 1 A 105 105 PRO CA C 105 64.301 62.823 1.478 1
1 1183 . 19 1 1 A 105 105 PRO CB C 105 32.094 31.710 0.384 1
1 1186 . 19 1 1 A 106 106 ALA H H 106 8.302 8.673 -0.371 1
1 1187 . 19 1 1 A 106 106 ALA HA H 106 4.022 4.028 -0.006 1
1 1191 . 19 1 1 A 106 106 ALA C C 106 179.641 179.605 0.036 1
1 1192 . 19 1 1 A 106 106 ALA CA C 106 56.341 55.267 1.074 1
1 1193 . 19 1 1 A 106 106 ALA CB C 106 18.523 18.242 0.281 1
1 1194 . 19 1 1 A 106 106 ALA N N 106 127.733 127.883 -0.150 1
1 1195 . 19 1 1 A 107 107 ALA H H 107 9.035 8.296 0.739 1
1 1196 . 19 1 1 A 107 107 ALA HA H 107 4.331 4.018 0.313 1
1 1200 . 19 1 1 A 107 107 ALA C C 107 178.586 179.760 -1.174 1
1 1201 . 19 1 1 A 107 107 ALA CA C 107 53.765 55.283 -1.518 1
1 1202 . 19 1 1 A 107 107 ALA CB C 107 18.728 18.273 0.455 1
1 1203 . 19 1 1 A 107 107 ALA N N 107 118.203 119.913 -1.710 1
1 1204 . 19 1 1 A 108 108 GLU H H 108 8.399 8.110 0.289 1
1 1205 . 19 1 1 A 108 108 GLU HA H 108 4.631 4.200 0.431 1
1 1210 . 19 1 1 A 108 108 GLU C C 108 177.127 178.977 -1.850 1
1 1211 . 19 1 1 A 108 108 GLU CA C 108 55.847 58.659 -2.812 1
1 1212 . 19 1 1 A 108 108 GLU CB C 108 32.135 30.425 1.710 1
1 1214 . 19 1 1 A 108 108 GLU N N 108 114.661 118.210 -3.549 1
1 1215 . 19 1 1 A 109 109 ARG H H 109 7.412 8.684 -1.272 1
1 1216 . 19 1 1 A 109 109 ARG HA H 109 3.682 4.148 -0.466 1
1 1223 . 19 1 1 A 109 109 ARG C C 109 176.917 179.298 -2.381 1
1 1224 . 19 1 1 A 109 109 ARG CA C 109 61.600 59.816 1.784 1
1 1225 . 19 1 1 A 109 109 ARG CB C 109 28.845 30.437 -1.592 1
1 1228 . 19 1 1 A 109 109 ARG N N 109 120.954 121.026 -0.072 1
1 1229 . 19 1 1 A 110 110 GLY H H 110 8.833 8.095 0.738 1
1 1230 . 19 1 1 A 110 110 GLY HA2 H 110 3.872 3.812 0.060 1
1 1231 . 19 1 1 A 110 110 GLY HA3 H 110 3.685 3.825 -0.140 1
1 1232 . 19 1 1 A 110 110 GLY C C 110 175.997 175.259 0.738 1
1 1233 . 19 1 1 A 110 110 GLY CA C 110 47.323 47.515 -0.192 1
1 1234 . 19 1 1 A 110 110 GLY N N 110 106.563 107.309 -0.746 1
1 1235 . 19 1 1 A 111 111 ASP H H 111 7.882 8.185 -0.303 1
1 1236 . 19 1 1 A 111 111 ASP HA H 111 4.312 4.395 -0.083 1
1 1239 . 19 1 1 A 111 111 ASP C C 111 179.467 178.025 1.442 1
1 1240 . 19 1 1 A 111 111 ASP CA C 111 56.976 56.683 0.293 1
1 1241 . 19 1 1 A 111 111 ASP CB C 111 40.648 41.050 -0.402 1
1 1242 . 19 1 1 A 111 111 ASP N N 111 121.402 120.671 0.731 1
1 1243 . 19 1 1 A 112 112 TRP H H 112 7.804 8.560 -0.756 1
1 1244 . 19 1 1 A 112 112 TRP HA H 112 3.831 4.218 -0.387 1
1 1253 . 19 1 1 A 112 112 TRP C C 112 177.547 178.650 -1.103 1
1 1254 . 19 1 1 A 112 112 TRP CA C 112 62.006 59.957 2.049 1
1 1255 . 19 1 1 A 112 112 TRP CB C 112 29.421 29.414 0.007 1
1 1261 . 19 1 1 A 112 112 TRP N N 112 119.904 120.884 -0.980 1
1 1263 . 19 1 1 A 113 113 VAL H H 113 7.982 7.776 0.206 1
1 1264 . 19 1 1 A 113 113 VAL HA H 113 3.072 3.628 -0.556 1
1 1272 . 19 1 1 A 113 113 VAL C C 113 178.015 178.535 -0.520 1
1 1273 . 19 1 1 A 113 113 VAL CA C 113 67.407 66.872 0.535 1
1 1274 . 19 1 1 A 113 113 VAL CB C 113 31.724 31.611 0.113 1
1 1277 . 19 1 1 A 113 113 VAL N N 113 117.575 118.943 -1.368 1
1 1278 . 19 1 1 A 114 114 GLN H H 114 8.268 8.101 0.167 1
1 1279 . 19 1 1 A 114 114 GLN HA H 114 3.994 4.017 -0.023 1
1 1286 . 19 1 1 A 114 114 GLN C C 114 178.021 177.705 0.316 1
1 1287 . 19 1 1 A 114 114 GLN CA C 114 59.112 58.890 0.222 1
1 1288 . 19 1 1 A 114 114 GLN CB C 114 28.685 28.863 -0.178 1
1 1290 . 19 1 1 A 114 114 GLN N N 114 117.479 120.115 -2.636 1
1 1292 . 19 1 1 A 115 115 ALA H H 115 7.915 8.213 -0.298 1
1 1293 . 19 1 1 A 115 115 ALA HA H 115 3.972 4.087 -0.115 1
1 1297 . 19 1 1 A 115 115 ALA C C 115 180.030 180.142 -0.112 1
1 1298 . 19 1 1 A 115 115 ALA CA C 115 55.142 55.052 0.090 1
1 1299 . 19 1 1 A 115 115 ALA CB C 115 18.152 18.487 -0.335 1
1 1300 . 19 1 1 A 115 115 ALA N N 115 120.858 120.711 0.147 1
1 1301 . 19 1 1 A 116 116 ILE H H 116 8.172 8.290 -0.118 1
1 1302 . 19 1 1 A 116 116 ILE HA H 116 3.482 3.834 -0.352 1
1 1312 . 19 1 1 A 116 116 ILE C C 116 177.739 178.330 -0.591 1
1 1313 . 19 1 1 A 116 116 ILE CA C 116 66.119 64.961 1.158 1
1 1314 . 19 1 1 A 116 116 ILE CB C 116 38.222 37.730 0.492 1
1 1318 . 19 1 1 A 116 116 ILE N N 116 115.977 117.702 -1.725 1
1 1319 . 19 1 1 A 117 117 CYS H H 117 8.449 8.010 0.439 1
1 1320 . 19 1 1 A 117 117 CYS HA H 117 4.032 4.622 -0.590 1
1 1323 . 19 1 1 A 117 117 CYS C C 117 177.321 177.135 0.186 1
1 1324 . 19 1 1 A 117 117 CYS CA C 117 64.777 62.385 2.392 1
1 1325 . 19 1 1 A 117 117 CYS CB C 117 26.871 27.196 -0.325 1
1 1326 . 19 1 1 A 117 117 CYS N N 117 117.253 121.159 -3.906 1
1 1327 . 19 1 1 A 118 118 LEU H H 118 8.182 8.305 -0.123 1
1 1328 . 19 1 1 A 118 118 LEU HA H 118 4.052 4.014 0.038 1
1 1338 . 19 1 1 A 118 118 LEU C C 118 179.217 179.425 -0.208 1
1 1339 . 19 1 1 A 118 118 LEU CA C 118 57.877 57.905 -0.028 1
1 1340 . 19 1 1 A 118 118 LEU CB C 118 42.088 41.546 0.542 1
1 1344 . 19 1 1 A 118 118 LEU N N 118 119.665 120.945 -1.280 1
1 1345 . 19 1 1 A 119 119 LEU H H 119 7.142 7.821 -0.679 1
1 1346 . 19 1 1 A 119 119 LEU HA H 119 4.192 4.132 0.060 1
1 1356 . 19 1 1 A 119 119 LEU C C 119 178.492 178.579 -0.087 1
1 1357 . 19 1 1 A 119 119 LEU CA C 119 56.259 57.915 -1.656 1
1 1358 . 19 1 1 A 119 119 LEU CB C 119 43.568 42.070 1.498 1
1 1362 . 19 1 1 A 119 119 LEU N N 119 116.244 119.649 -3.405 1
1 1363 . 19 1 1 A 120 120 ALA H H 120 8.513 8.548 -0.035 1
1 1364 . 19 1 1 A 120 120 ALA HA H 120 3.878 3.940 -0.062 1
1 1368 . 19 1 1 A 120 120 ALA C C 120 178.358 178.604 -0.246 1
1 1369 . 19 1 1 A 120 120 ALA CA C 120 53.765 55.059 -1.294 1
1 1370 . 19 1 1 A 120 120 ALA CB C 120 18.687 18.620 0.067 1
1 1371 . 19 1 1 A 120 120 ALA N N 120 120.009 120.547 -0.538 1
1 1372 . 19 1 1 A 121 121 PHE H H 121 7.822 8.109 -0.287 1
1 1373 . 19 1 1 A 121 121 PHE HA H 121 5.156 4.848 0.308 1
1 1381 . 19 1 1 A 121 121 PHE C C 121 176.273 174.711 1.562 1
1 1382 . 19 1 1 A 121 121 PHE CA C 121 55.741 56.415 -0.674 1
1 1383 . 19 1 1 A 121 121 PHE CB C 121 39.455 37.658 1.797 1
1 1389 . 19 1 1 A 121 121 PHE N N 121 113.981 114.036 -0.055 1
1 1390 . 19 1 1 A 122 122 SER H H 122 7.765 7.722 0.043 1
1 1391 . 19 1 1 A 122 122 SER HA H 122 4.579 4.564 0.015 1
1 1394 . 19 1 1 A 122 122 SER C C 122 174.595 174.307 0.288 1
1 1395 . 19 1 1 A 122 122 SER CA C 122 58.777 59.653 -0.876 1
1 1396 . 19 1 1 A 122 122 SER CB C 122 63.719 62.942 0.777 1
1 1397 . 19 1 1 A 122 122 SER N N 122 115.069 114.066 1.003 1
1 1398 . 19 1 1 A 123 123 GLY H H 123 8.223 8.544 -0.321 1
1 1399 . 19 1 1 A 123 123 GLY HA2 H 123 4.174 4.131 0.043 1
1 1400 . 19 1 1 A 123 123 GLY HA3 H 123 4.100 4.136 -0.036 1
1 1401 . 19 1 1 A 123 123 GLY C C 123 171.678 172.832 -1.154 1
1 1402 . 19 1 1 A 123 123 GLY CA C 123 44.815 44.127 0.688 1
1 1403 . 19 1 1 A 123 123 GLY N N 123 110.151 110.559 -0.408 1
1 1404 . 19 1 1 A 124 124 PRO HA H 124 4.482 4.700 -0.218 1
1 1411 . 19 1 1 A 124 124 PRO C C 124 177.314 175.780 1.534 1
1 1412 . 19 1 1 A 124 124 PRO CA C 124 63.206 62.855 0.351 1
1 1413 . 19 1 1 A 124 124 PRO CB C 124 32.176 32.066 0.110 1
1 1416 . 19 1 1 A 125 125 SER H H 125 8.485 8.614 -0.129 1
1 1417 . 19 1 1 A 125 125 SER HA H 125 4.472 4.792 -0.320 1
1 1420 . 19 1 1 A 125 125 SER C C 125 174.728 174.677 0.051 1
1 1421 . 19 1 1 A 125 125 SER CA C 125 58.353 57.289 1.064 1
1 1422 . 19 1 1 A 125 125 SER CB C 125 64.048 64.931 -0.883 1
1 1423 . 19 1 1 A 125 125 SER N N 125 116.081 118.733 -2.652 1
1 1424 . 19 1 1 A 126 126 SER H H 126 8.332 8.941 -0.609 1
1 1425 . 19 1 1 A 126 126 SER HA H 126 4.464 4.215 0.249 1
1 1428 . 19 1 1 A 126 126 SER C C 126 173.980 174.129 -0.149 1
1 1429 . 19 1 1 A 126 126 SER CA C 126 58.336 59.057 -0.721 1
1 1430 . 19 1 1 A 126 126 SER CB C 126 63.925 61.309 2.616 1
1 1431 . 19 1 1 A 126 126 SER N N 126 118.037 123.547 -5.510 1
1 1 . 20 1 1 A 6 6 SER HA H 6 4.458 4.633 -0.175 1
1 3 . 20 1 1 A 6 6 SER C C 6 175.108 173.744 1.364 1
1 4 . 20 1 1 A 6 6 SER CA C 6 58.689 57.081 1.608 1
1 5 . 20 1 1 A 6 6 SER CB C 6 63.678 63.391 0.287 1
1 6 . 20 1 1 A 7 7 GLY H H 7 8.449 8.588 -0.139 1
1 7 . 20 1 1 A 7 7 GLY HA2 H 7 3.965 4.050 -0.085 1
1 8 . 20 1 1 A 7 7 GLY HA3 H 7 3.965 4.052 -0.087 1
1 9 . 20 1 1 A 7 7 GLY C C 7 174.380 173.138 1.242 1
1 10 . 20 1 1 A 7 7 GLY CA C 7 45.435 45.182 0.253 1
1 11 . 20 1 1 A 7 7 GLY N N 7 110.792 113.881 -3.089 1
1 12 . 20 1 1 A 8 8 MET H H 8 8.259 8.219 0.040 1
1 13 . 20 1 1 A 8 8 MET HA H 8 4.487 4.431 0.056 1
1 21 . 20 1 1 A 8 8 MET C C 8 176.961 175.662 1.299 1
1 22 . 20 1 1 A 8 8 MET CA C 8 55.565 56.181 -0.616 1
1 23 . 20 1 1 A 8 8 MET CB C 8 32.835 33.222 -0.387 1
1 26 . 20 1 1 A 8 8 MET N N 8 119.639 123.332 -3.693 1
1 27 . 20 1 1 A 9 9 GLY H H 9 8.472 8.436 0.036 1
1 28 . 20 1 1 A 9 9 GLY HA2 H 9 3.946 4.158 -0.212 1
1 29 . 20 1 1 A 9 9 GLY HA3 H 9 3.946 4.165 -0.219 1
1 30 . 20 1 1 A 9 9 GLY C C 9 174.005 174.321 -0.316 1
1 31 . 20 1 1 A 9 9 GLY CA C 9 45.488 45.660 -0.172 1
1 32 . 20 1 1 A 9 9 GLY N N 9 110.107 112.632 -2.525 1
1 33 . 20 1 1 A 10 10 ASP H H 10 8.292 8.925 -0.633 1
1 34 . 20 1 1 A 10 10 ASP HA H 10 4.636 4.528 0.108 1
1 37 . 20 1 1 A 10 10 ASP C C 10 176.768 177.421 -0.653 1
1 38 . 20 1 1 A 10 10 ASP CA C 10 54.206 56.905 -2.699 1
1 39 . 20 1 1 A 10 10 ASP CB C 10 41.306 41.387 -0.081 1
1 40 . 20 1 1 A 10 10 ASP N N 10 120.370 121.495 -1.125 1
1 41 . 20 1 1 A 11 11 GLY H H 11 8.452 7.575 0.877 1
1 42 . 20 1 1 A 11 11 GLY HA2 H 11 3.980 4.117 -0.137 1
1 43 . 20 1 1 A 11 11 GLY HA3 H 11 4.022 4.196 -0.174 1
1 44 . 20 1 1 A 11 11 GLY C C 11 174.102 174.261 -0.159 1
1 45 . 20 1 1 A 11 11 GLY CA C 11 45.170 45.865 -0.695 1
1 46 . 20 1 1 A 11 11 GLY N N 11 108.391 104.489 3.902 1
1 47 . 20 1 1 A 12 12 ALA H H 12 8.293 7.857 0.436 1
1 48 . 20 1 1 A 12 12 ALA HA H 12 3.777 4.188 -0.411 1
1 52 . 20 1 1 A 12 12 ALA C C 12 178.193 177.757 0.436 1
1 53 . 20 1 1 A 12 12 ALA CA C 12 52.759 51.532 1.227 1
1 54 . 20 1 1 A 12 12 ALA CB C 12 17.855 18.621 -0.766 1
1 55 . 20 1 1 A 12 12 ALA N N 12 124.185 124.050 0.135 1
1 56 . 20 1 1 A 13 13 VAL H H 13 8.822 8.382 0.440 1
1 57 . 20 1 1 A 13 13 VAL HA H 13 3.912 3.686 0.226 1
1 65 . 20 1 1 A 13 13 VAL C C 13 176.073 175.663 0.410 1
1 66 . 20 1 1 A 13 13 VAL CA C 13 63.100 66.589 -3.489 1
1 67 . 20 1 1 A 13 13 VAL CB C 13 32.711 31.895 0.816 1
1 70 . 20 1 1 A 13 13 VAL N N 13 120.877 125.474 -4.597 1
1 71 . 20 1 1 A 14 14 LYS H H 14 7.093 7.238 -0.145 1
1 72 . 20 1 1 A 14 14 LYS HA H 14 4.169 4.640 -0.471 1
1 81 . 20 1 1 A 14 14 LYS C C 14 173.291 174.183 -0.892 1
1 82 . 20 1 1 A 14 14 LYS CA C 14 56.465 54.901 1.564 1
1 83 . 20 1 1 A 14 14 LYS CB C 14 35.960 35.693 0.267 1
1 87 . 20 1 1 A 14 14 LYS N N 14 118.693 119.242 -0.549 1
1 88 . 20 1 1 A 15 15 GLN H H 15 8.522 8.451 0.071 1
1 89 . 20 1 1 A 15 15 GLN HA H 15 5.542 5.201 0.341 1
1 96 . 20 1 1 A 15 15 GLN C C 15 174.992 175.778 -0.786 1
1 97 . 20 1 1 A 15 15 GLN CA C 15 54.312 53.952 0.360 1
1 98 . 20 1 1 A 15 15 GLN CB C 15 33.585 31.841 1.744 1
1 100 . 20 1 1 A 15 15 GLN N N 15 124.024 124.514 -0.490 1
1 102 . 20 1 1 A 16 16 GLY H H 16 8.740 8.042 0.698 1
1 103 . 20 1 1 A 16 16 GLY HA2 H 16 4.511 4.027 0.484 1
1 104 . 20 1 1 A 16 16 GLY HA3 H 16 4.064 4.340 -0.276 1
1 105 . 20 1 1 A 16 16 GLY C C 16 171.431 171.422 0.009 1
1 106 . 20 1 1 A 16 16 GLY CA C 16 46.106 45.681 0.425 1
1 107 . 20 1 1 A 16 16 GLY N N 16 109.611 109.490 0.121 1
1 108 . 20 1 1 A 17 17 PHE H H 17 8.886 8.487 0.399 1
1 109 . 20 1 1 A 17 17 PHE HA H 17 5.466 5.078 0.388 1
1 114 . 20 1 1 A 17 17 PHE C C 17 174.795 175.230 -0.435 1
1 115 . 20 1 1 A 17 17 PHE CA C 17 57.788 57.208 0.580 1
1 116 . 20 1 1 A 17 17 PHE CB C 17 41.315 40.836 0.479 1
1 119 . 20 1 1 A 17 17 PHE N N 17 122.684 119.225 3.459 1
1 120 . 20 1 1 A 18 18 LEU H H 18 8.762 9.053 -0.291 1
1 121 . 20 1 1 A 18 18 LEU HA H 18 4.946 4.754 0.192 1
1 131 . 20 1 1 A 18 18 LEU C C 18 175.461 175.009 0.452 1
1 132 . 20 1 1 A 18 18 LEU CA C 18 52.970 53.243 -0.273 1
1 133 . 20 1 1 A 18 18 LEU CB C 18 47.945 45.099 2.846 1
1 137 . 20 1 1 A 18 18 LEU N N 18 119.045 123.804 -4.759 1
1 138 . 20 1 1 A 19 19 TYR H H 19 9.272 8.168 1.104 1
1 139 . 20 1 1 A 19 19 TYR HA H 19 5.682 5.441 0.241 1
1 146 . 20 1 1 A 19 19 TYR C C 19 174.829 174.719 0.110 1
1 147 . 20 1 1 A 19 19 TYR CA C 19 56.482 56.475 0.007 1
1 148 . 20 1 1 A 19 19 TYR CB C 19 41.717 40.741 0.976 1
1 153 . 20 1 1 A 19 19 TYR N N 19 118.024 121.386 -3.362 1
1 154 . 20 1 1 A 20 20 LEU H H 20 9.441 8.844 0.597 1
1 155 . 20 1 1 A 20 20 LEU HA H 20 5.283 5.179 0.104 1
1 165 . 20 1 1 A 20 20 LEU C C 20 175.935 175.901 0.034 1
1 166 . 20 1 1 A 20 20 LEU CA C 20 53.464 53.718 -0.254 1
1 167 . 20 1 1 A 20 20 LEU CB C 20 46.570 45.325 1.245 1
1 171 . 20 1 1 A 20 20 LEU N N 20 122.838 125.400 -2.562 1
1 172 . 20 1 1 A 21 21 GLN H H 21 8.391 8.438 -0.047 1
1 173 . 20 1 1 A 21 21 GLN HA H 21 3.791 3.523 0.268 1
1 180 . 20 1 1 A 21 21 GLN C C 21 175.157 175.924 -0.767 1
1 181 . 20 1 1 A 21 21 GLN CA C 21 56.094 55.815 0.279 1
1 182 . 20 1 1 A 21 21 GLN CB C 21 28.434 28.405 0.029 1
1 184 . 20 1 1 A 21 21 GLN N N 21 129.943 127.257 2.686 1
1 186 . 20 1 1 A 22 22 GLN H H 22 8.829 8.315 0.514 1
1 187 . 20 1 1 A 22 22 GLN HA H 22 4.553 4.629 -0.076 1
1 194 . 20 1 1 A 22 22 GLN C C 22 174.998 176.132 -1.134 1
1 195 . 20 1 1 A 22 22 GLN CA C 22 54.912 54.880 0.032 1
1 196 . 20 1 1 A 22 22 GLN CB C 22 31.930 29.095 2.835 1
1 198 . 20 1 1 A 22 22 GLN N N 22 127.199 125.436 1.763 1
1 200 . 20 1 1 A 23 23 GLN HA H 23 4.142 3.720 0.422 1
1 207 . 20 1 1 A 23 23 GLN CA C 23 56.427 59.247 -2.820 1
1 208 . 20 1 1 A 23 23 GLN CB C 23 29.227 28.266 0.961 1
1 211 . 20 1 1 A 24 24 GLN HA H 24 4.523 3.996 0.527 1
1 218 . 20 1 1 A 24 24 GLN CB C 24 29.759 28.742 1.017 1
1 221 . 20 1 1 A 25 25 THR HA H 25 3.870 4.104 -0.234 1
1 226 . 20 1 1 A 25 25 THR CA C 25 65.096 60.976 4.120 1
1 227 . 20 1 1 A 25 25 THR CB C 25 68.924 70.768 -1.844 1
1 229 . 20 1 1 A 26 26 PHE HA H 26 4.690 4.061 0.629 1
1 236 . 20 1 1 A 26 26 PHE C C 26 175.523 176.870 -1.347 1
1 237 . 20 1 1 A 26 26 PHE CA C 26 57.312 58.932 -1.620 1
1 238 . 20 1 1 A 26 26 PHE CB C 26 39.003 39.144 -0.141 1
1 243 . 20 1 1 A 27 27 GLY H H 27 7.755 8.995 -1.240 1
1 244 . 20 1 1 A 27 27 GLY HA2 H 27 4.172 4.016 0.156 1
1 245 . 20 1 1 A 27 27 GLY HA3 H 27 3.783 4.016 -0.233 1
1 246 . 20 1 1 A 27 27 GLY C C 27 172.557 174.981 -2.424 1
1 247 . 20 1 1 A 27 27 GLY CA C 27 44.924 45.343 -0.419 1
1 248 . 20 1 1 A 27 27 GLY N N 27 109.216 112.090 -2.874 1
1 249 . 20 1 1 A 28 28 LYS H H 28 8.241 8.250 -0.009 1
1 250 . 20 1 1 A 28 28 LYS HA H 28 4.530 3.720 0.810 1
1 259 . 20 1 1 A 28 28 LYS C C 28 176.204 174.734 1.470 1
1 260 . 20 1 1 A 28 28 LYS CA C 28 55.741 57.420 -1.679 1
1 261 . 20 1 1 A 28 28 LYS CB C 28 33.904 29.255 4.649 1
1 265 . 20 1 1 A 28 28 LYS N N 28 118.743 115.974 2.769 1
1 266 . 20 1 1 A 29 29 LYS H H 29 8.356 7.612 0.744 1
1 267 . 20 1 1 A 29 29 LYS HA H 29 4.559 4.804 -0.245 1
1 274 . 20 1 1 A 29 29 LYS C C 29 175.420 174.498 0.922 1
1 275 . 20 1 1 A 29 29 LYS CA C 29 55.406 55.091 0.315 1
1 276 . 20 1 1 A 29 29 LYS CB C 29 35.618 36.076 -0.458 1
1 280 . 20 1 1 A 29 29 LYS N N 29 121.198 118.066 3.132 1
1 281 . 20 1 1 A 30 30 TRP H H 30 8.891 8.711 0.180 1
1 282 . 20 1 1 A 30 30 TRP HA H 30 4.951 4.894 0.057 1
1 291 . 20 1 1 A 30 30 TRP C C 30 175.902 176.442 -0.540 1
1 292 . 20 1 1 A 30 30 TRP CA C 30 56.677 57.527 -0.850 1
1 293 . 20 1 1 A 30 30 TRP CB C 30 30.614 30.747 -0.133 1
1 299 . 20 1 1 A 30 30 TRP N N 30 123.304 122.996 0.308 1
1 301 . 20 1 1 A 31 31 ARG H H 31 8.712 9.205 -0.493 1
1 302 . 20 1 1 A 31 31 ARG HA H 31 4.820 4.889 -0.069 1
1 309 . 20 1 1 A 31 31 ARG C C 31 174.026 175.494 -1.468 1
1 310 . 20 1 1 A 31 31 ARG CA C 31 54.895 54.040 0.855 1
1 311 . 20 1 1 A 31 31 ARG CB C 31 34.045 33.301 0.744 1
1 314 . 20 1 1 A 31 31 ARG N N 31 123.973 121.743 2.230 1
1 315 . 20 1 1 A 32 32 ARG H H 32 8.820 8.340 0.480 1
1 316 . 20 1 1 A 32 32 ARG HA H 32 3.965 4.744 -0.779 1
1 323 . 20 1 1 A 32 32 ARG C C 32 174.785 175.296 -0.511 1
1 324 . 20 1 1 A 32 32 ARG CA C 32 56.924 55.956 0.968 1
1 325 . 20 1 1 A 32 32 ARG CB C 32 31.806 30.367 1.439 1
1 328 . 20 1 1 A 32 32 ARG N N 32 127.041 123.890 3.151 1
1 329 . 20 1 1 A 33 33 PHE H H 33 9.372 8.680 0.692 1
1 330 . 20 1 1 A 33 33 PHE HA H 33 4.863 4.942 -0.079 1
1 338 . 20 1 1 A 33 33 PHE C C 33 176.359 175.464 0.895 1
1 339 . 20 1 1 A 33 33 PHE CA C 33 57.224 56.460 0.764 1
1 340 . 20 1 1 A 33 33 PHE CB C 33 43.385 42.522 0.863 1
1 346 . 20 1 1 A 33 33 PHE N N 33 125.882 120.037 5.845 1
1 347 . 20 1 1 A 34 34 GLY H H 34 9.160 8.458 0.702 1
1 348 . 20 1 1 A 34 34 GLY HA2 H 34 4.182 4.140 0.042 1
1 349 . 20 1 1 A 34 34 GLY HA3 H 34 3.714 4.194 -0.480 1
1 350 . 20 1 1 A 34 34 GLY C C 34 172.920 173.335 -0.415 1
1 351 . 20 1 1 A 34 34 GLY CA C 34 46.247 46.635 -0.388 1
1 352 . 20 1 1 A 34 34 GLY N N 34 108.654 111.215 -2.561 1
1 353 . 20 1 1 A 35 35 ALA H H 35 8.982 8.278 0.704 1
1 354 . 20 1 1 A 35 35 ALA HA H 35 5.660 5.200 0.460 1
1 358 . 20 1 1 A 35 35 ALA C C 35 176.547 176.824 -0.277 1
1 359 . 20 1 1 A 35 35 ALA CA C 35 50.500 50.669 -0.169 1
1 360 . 20 1 1 A 35 35 ALA CB C 35 24.034 20.622 3.412 1
1 361 . 20 1 1 A 35 35 ALA N N 35 130.076 128.959 1.117 1
1 362 . 20 1 1 A 36 36 SER H H 36 8.852 8.623 0.229 1
1 363 . 20 1 1 A 36 36 SER HA H 36 5.203 5.415 -0.212 1
1 366 . 20 1 1 A 36 36 SER C C 36 170.939 172.089 -1.150 1
1 367 . 20 1 1 A 36 36 SER CA C 36 57.806 56.523 1.283 1
1 368 . 20 1 1 A 36 36 SER CB C 36 66.986 65.260 1.726 1
1 369 . 20 1 1 A 36 36 SER N N 36 116.620 117.156 -0.536 1
1 370 . 20 1 1 A 37 37 LEU H H 37 8.862 8.927 -0.065 1
1 371 . 20 1 1 A 37 37 LEU HA H 37 5.163 4.872 0.291 1
1 381 . 20 1 1 A 37 37 LEU C C 37 173.525 174.111 -0.586 1
1 382 . 20 1 1 A 37 37 LEU CA C 37 53.112 53.574 -0.462 1
1 383 . 20 1 1 A 37 37 LEU CB C 37 46.077 43.452 2.625 1
1 387 . 20 1 1 A 37 37 LEU N N 37 127.638 127.578 0.060 1
1 388 . 20 1 1 A 38 38 TYR H H 38 9.280 9.232 0.048 1
1 389 . 20 1 1 A 38 38 TYR HA H 38 4.820 5.437 -0.617 1
1 396 . 20 1 1 A 38 38 TYR C C 38 175.430 175.637 -0.207 1
1 397 . 20 1 1 A 38 38 TYR CA C 38 57.436 55.673 1.763 1
1 398 . 20 1 1 A 38 38 TYR CB C 38 42.128 42.038 0.090 1
1 403 . 20 1 1 A 38 38 TYR N N 38 125.215 126.650 -1.435 1
1 404 . 20 1 1 A 39 39 GLY H H 39 8.532 8.547 -0.015 1
1 405 . 20 1 1 A 39 39 GLY HA2 H 39 4.220 4.290 -0.070 1
1 406 . 20 1 1 A 39 39 GLY HA3 H 39 3.941 4.302 -0.361 1
1 407 . 20 1 1 A 39 39 GLY C C 39 172.950 172.095 0.855 1
1 408 . 20 1 1 A 39 39 GLY CA C 39 44.817 45.990 -1.173 1
1 409 . 20 1 1 A 39 39 GLY N N 39 106.424 109.067 -2.643 1
1 410 . 20 1 1 A 40 40 GLY H H 40 8.477 8.423 0.054 1
1 411 . 20 1 1 A 40 40 GLY HA2 H 40 4.102 4.235 -0.133 1
1 412 . 20 1 1 A 40 40 GLY HA3 H 40 3.927 4.240 -0.313 1
1 413 . 20 1 1 A 40 40 GLY C C 40 174.002 174.558 -0.556 1
1 414 . 20 1 1 A 40 40 GLY CA C 40 44.694 45.410 -0.716 1
1 415 . 20 1 1 A 40 40 GLY N N 40 106.881 108.508 -1.627 1
1 416 . 20 1 1 A 41 41 SER H H 41 8.600 8.860 -0.260 1
1 417 . 20 1 1 A 41 41 SER HA H 41 4.520 4.252 0.268 1
1 420 . 20 1 1 A 41 41 SER C C 41 174.355 174.871 -0.516 1
1 421 . 20 1 1 A 41 41 SER CA C 41 58.565 61.327 -2.762 1
1 422 . 20 1 1 A 41 41 SER CB C 41 64.413 62.802 1.611 1
1 423 . 20 1 1 A 41 41 SER N N 41 115.751 116.964 -1.213 1
1 424 . 20 1 1 A 42 42 ASP H H 42 8.533 8.013 0.520 1
1 425 . 20 1 1 A 42 42 ASP HA H 42 4.560 4.979 -0.419 1
1 428 . 20 1 1 A 42 42 ASP CA C 42 55.230 55.588 -0.358 1
1 429 . 20 1 1 A 42 42 ASP CB C 42 40.648 43.200 -2.552 1
1 430 . 20 1 1 A 42 42 ASP N N 42 119.037 118.881 0.156 1
1 431 . 20 1 1 A 43 43 CYS H H 43 8.152 8.233 -0.081 1
1 432 . 20 1 1 A 43 43 CYS HA H 43 4.541 4.110 0.431 1
1 435 . 20 1 1 A 43 43 CYS C C 43 173.975 174.673 -0.698 1
1 436 . 20 1 1 A 43 43 CYS CA C 43 58.265 62.371 -4.106 1
1 437 . 20 1 1 A 43 43 CYS CB C 43 28.393 27.468 0.925 1
1 438 . 20 1 1 A 43 43 CYS N N 43 116.881 117.551 -0.670 1
1 439 . 20 1 1 A 44 44 ALA H H 44 8.047 7.704 0.343 1
1 440 . 20 1 1 A 44 44 ALA HA H 44 4.395 4.718 -0.323 1
1 444 . 20 1 1 A 44 44 ALA C C 44 176.472 176.363 0.109 1
1 445 . 20 1 1 A 44 44 ALA CA C 44 52.688 51.017 1.671 1
1 446 . 20 1 1 A 44 44 ALA CB C 44 20.579 23.152 -2.573 1
1 447 . 20 1 1 A 44 44 ALA N N 44 125.989 118.390 7.599 1
1 448 . 20 1 1 A 45 45 LEU H H 45 8.052 8.213 -0.161 1
1 449 . 20 1 1 A 45 45 LEU HA H 45 4.452 4.488 -0.036 1
1 459 . 20 1 1 A 45 45 LEU C C 45 176.196 176.365 -0.169 1
1 460 . 20 1 1 A 45 45 LEU CA C 45 53.771 53.966 -0.195 1
1 461 . 20 1 1 A 45 45 LEU CB C 45 43.116 43.266 -0.150 1
1 465 . 20 1 1 A 45 45 LEU N N 45 119.889 117.702 2.187 1
1 466 . 20 1 1 A 46 46 ALA H H 46 8.381 8.527 -0.146 1
1 467 . 20 1 1 A 46 46 ALA HA H 46 4.449 5.043 -0.594 1
1 471 . 20 1 1 A 46 46 ALA C C 46 179.093 176.695 2.398 1
1 472 . 20 1 1 A 46 46 ALA CA C 46 52.829 51.144 1.685 1
1 473 . 20 1 1 A 46 46 ALA CB C 46 18.687 20.130 -1.443 1
1 474 . 20 1 1 A 46 46 ALA N N 46 125.635 122.628 3.007 1
1 475 . 20 1 1 A 47 47 ARG H H 47 9.012 8.769 0.243 1
1 476 . 20 1 1 A 47 47 ARG HA H 47 5.192 5.081 0.111 1
1 484 . 20 1 1 A 47 47 ARG C C 47 171.524 173.999 -2.475 1
1 485 . 20 1 1 A 47 47 ARG CA C 47 55.265 55.055 0.210 1
1 486 . 20 1 1 A 47 47 ARG CB C 47 30.970 34.024 -3.054 1
1 489 . 20 1 1 A 47 47 ARG N N 47 120.048 121.234 -1.186 1
1 491 . 20 1 1 A 48 48 LEU H H 48 9.029 8.605 0.424 1
1 492 . 20 1 1 A 48 48 LEU HA H 48 5.221 5.004 0.217 1
1 502 . 20 1 1 A 48 48 LEU C C 48 174.348 175.186 -0.838 1
1 503 . 20 1 1 A 48 48 LEU CA C 48 53.253 53.908 -0.655 1
1 504 . 20 1 1 A 48 48 LEU CB C 48 45.419 44.005 1.414 1
1 508 . 20 1 1 A 48 48 LEU N N 48 123.315 123.690 -0.375 1
1 509 . 20 1 1 A 49 49 GLU H H 49 9.473 8.538 0.935 1
1 510 . 20 1 1 A 49 49 GLU HA H 49 5.222 4.923 0.299 1
1 515 . 20 1 1 A 49 49 GLU C C 49 175.507 175.849 -0.342 1
1 516 . 20 1 1 A 49 49 GLU CA C 49 55.159 56.067 -0.908 1
1 517 . 20 1 1 A 49 49 GLU CB C 49 32.341 31.579 0.762 1
1 519 . 20 1 1 A 49 49 GLU N N 49 124.751 127.005 -2.254 1
1 520 . 20 1 1 A 50 50 LEU H H 50 9.088 8.495 0.593 1
1 521 . 20 1 1 A 50 50 LEU HA H 50 5.382 5.186 0.196 1
1 531 . 20 1 1 A 50 50 LEU C C 50 175.474 175.467 0.007 1
1 532 . 20 1 1 A 50 50 LEU CA C 50 52.865 53.659 -0.794 1
1 533 . 20 1 1 A 50 50 LEU CB C 50 43.239 46.190 -2.951 1
1 537 . 20 1 1 A 50 50 LEU N N 50 124.221 122.208 2.013 1
1 538 . 20 1 1 A 51 51 GLN H H 51 9.602 8.811 0.791 1
1 539 . 20 1 1 A 51 51 GLN HA H 51 5.095 4.983 0.112 1
1 546 . 20 1 1 A 51 51 GLN C C 51 175.306 174.742 0.564 1
1 547 . 20 1 1 A 51 51 GLN CA C 51 54.576 54.535 0.041 1
1 548 . 20 1 1 A 51 51 GLN CB C 51 32.177 32.221 -0.044 1
1 550 . 20 1 1 A 51 51 GLN N N 51 123.268 123.098 0.170 1
1 552 . 20 1 1 A 52 52 GLU H H 52 9.172 8.669 0.503 1
1 553 . 20 1 1 A 52 52 GLU HA H 52 4.092 5.391 -1.299 1
1 558 . 20 1 1 A 52 52 GLU C C 52 176.523 176.824 -0.301 1
1 559 . 20 1 1 A 52 52 GLU CA C 52 57.500 55.344 2.156 1
1 560 . 20 1 1 A 52 52 GLU CB C 52 30.696 32.064 -1.368 1
1 562 . 20 1 1 A 52 52 GLU N N 52 128.982 124.444 4.538 1
1 563 . 20 1 1 A 53 53 GLY H H 53 8.644 8.841 -0.197 1
1 564 . 20 1 1 A 53 53 GLY HA2 H 53 4.261 4.082 0.179 1
1 565 . 20 1 1 A 53 53 GLY HA3 H 53 3.993 4.098 -0.105 1
1 566 . 20 1 1 A 53 53 GLY C C 53 172.550 175.275 -2.725 1
1 567 . 20 1 1 A 53 53 GLY CA C 53 45.911 46.167 -0.256 1
1 568 . 20 1 1 A 53 53 GLY N N 53 110.844 111.852 -1.008 1
1 569 . 20 1 1 A 54 54 PRO HA H 54 4.392 4.556 -0.164 1
1 576 . 20 1 1 A 54 54 PRO C C 54 176.828 178.113 -1.285 1
1 577 . 20 1 1 A 54 54 PRO CA C 54 63.665 64.354 -0.689 1
1 578 . 20 1 1 A 54 54 PRO CB C 54 32.012 31.866 0.146 1
1 581 . 20 1 1 A 55 55 GLU H H 55 8.934 8.267 0.667 1
1 582 . 20 1 1 A 55 55 GLU HA H 55 4.193 4.228 -0.035 1
1 587 . 20 1 1 A 55 55 GLU C C 55 176.189 176.365 -0.176 1
1 588 . 20 1 1 A 55 55 GLU CA C 55 57.383 59.068 -1.685 1
1 589 . 20 1 1 A 55 55 GLU CB C 55 28.945 30.950 -2.005 1
1 591 . 20 1 1 A 55 55 GLU N N 55 120.312 117.418 2.894 1
1 592 . 20 1 1 A 56 56 LYS H H 56 7.937 7.592 0.345 1
1 593 . 20 1 1 A 56 56 LYS HA H 56 4.578 4.613 -0.035 1
1 602 . 20 1 1 A 56 56 LYS C C 56 174.295 173.626 0.669 1
1 603 . 20 1 1 A 56 56 LYS CA C 56 54.171 53.687 0.484 1
1 604 . 20 1 1 A 56 56 LYS CB C 56 32.555 35.740 -3.185 1
1 608 . 20 1 1 A 56 56 LYS N N 56 122.008 118.327 3.681 1
1 609 . 20 1 1 A 57 57 PRO HA H 57 4.370 4.798 -0.428 1
1 616 . 20 1 1 A 57 57 PRO CA C 57 63.431 62.844 0.587 1
1 617 . 20 1 1 A 57 57 PRO CB C 57 32.072 31.745 0.327 1
1 620 . 20 1 1 A 58 58 ARG H H 58 8.310 8.653 -0.343 1
1 621 . 20 1 1 A 58 58 ARG HA H 58 4.295 4.818 -0.523 1
1 628 . 20 1 1 A 58 58 ARG CA C 58 56.570 54.130 2.440 1
1 629 . 20 1 1 A 58 58 ARG CB C 58 30.860 33.577 -2.717 1
1 632 . 20 1 1 A 58 58 ARG N N 58 120.045 124.129 -4.084 1
1 633 . 20 1 1 A 60 60 CYS HA H 60 4.482 4.555 -0.073 1
1 636 . 20 1 1 A 60 60 CYS CA C 60 58.621 57.388 1.233 1
1 637 . 20 1 1 A 60 60 CYS CB C 60 28.267 26.745 1.522 1
1 638 . 20 1 1 A 61 61 GLU HA H 61 4.226 4.528 -0.302 1
1 643 . 20 1 1 A 61 61 GLU C C 61 176.299 175.744 0.555 1
1 644 . 20 1 1 A 61 61 GLU CA C 61 57.100 55.038 2.062 1
1 645 . 20 1 1 A 61 61 GLU CB C 61 29.873 29.772 0.101 1
1 647 . 20 1 1 A 62 62 ALA H H 62 8.282 8.860 -0.578 1
1 648 . 20 1 1 A 62 62 ALA HA H 62 4.302 3.798 0.504 1
1 652 . 20 1 1 A 62 62 ALA C C 62 177.277 176.080 1.197 1
1 653 . 20 1 1 A 62 62 ALA CA C 62 52.512 53.186 -0.674 1
1 654 . 20 1 1 A 62 62 ALA CB C 62 19.592 17.322 2.270 1
1 655 . 20 1 1 A 62 62 ALA N N 62 124.386 127.352 -2.966 1
1 656 . 20 1 1 A 63 63 ALA H H 63 8.399 7.946 0.453 1
1 657 . 20 1 1 A 63 63 ALA HA H 63 4.375 4.462 -0.087 1
1 661 . 20 1 1 A 63 63 ALA C C 63 176.843 175.887 0.956 1
1 662 . 20 1 1 A 63 63 ALA CA C 63 52.658 51.115 1.543 1
1 663 . 20 1 1 A 63 63 ALA CB C 63 19.592 18.938 0.654 1
1 664 . 20 1 1 A 63 63 ALA N N 63 123.892 119.928 3.964 1
1 665 . 20 1 1 A 64 64 ARG H H 64 8.152 8.612 -0.460 1
1 666 . 20 1 1 A 64 64 ARG HA H 64 5.008 5.094 -0.086 1
1 673 . 20 1 1 A 64 64 ARG C C 64 175.594 174.374 1.220 1
1 674 . 20 1 1 A 64 64 ARG CA C 64 55.282 54.593 0.689 1
1 675 . 20 1 1 A 64 64 ARG CB C 64 32.506 33.511 -1.005 1
1 678 . 20 1 1 A 64 64 ARG N N 64 119.787 119.388 0.399 1
1 679 . 20 1 1 A 65 65 LYS H H 65 8.945 8.506 0.439 1
1 680 . 20 1 1 A 65 65 LYS HA H 65 4.602 4.936 -0.334 1
1 689 . 20 1 1 A 65 65 LYS C C 65 174.657 174.756 -0.099 1
1 690 . 20 1 1 A 65 65 LYS CA C 65 54.948 54.842 0.106 1
1 691 . 20 1 1 A 65 65 LYS CB C 65 34.068 34.077 -0.009 1
1 695 . 20 1 1 A 65 65 LYS N N 65 124.171 123.336 0.835 1
1 696 . 20 1 1 A 66 66 VAL H H 66 8.672 8.874 -0.202 1
1 697 . 20 1 1 A 66 66 VAL HA H 66 4.532 5.221 -0.689 1
1 705 . 20 1 1 A 66 66 VAL C C 66 175.078 174.103 0.975 1
1 706 . 20 1 1 A 66 66 VAL CA C 66 61.865 59.745 2.120 1
1 707 . 20 1 1 A 66 66 VAL CB C 66 33.835 35.321 -1.486 1
1 710 . 20 1 1 A 66 66 VAL N N 66 124.380 125.962 -1.582 1
1 711 . 20 1 1 A 67 67 ILE H H 67 9.071 9.053 0.018 1
1 712 . 20 1 1 A 67 67 ILE HA H 67 4.142 4.685 -0.543 1
1 722 . 20 1 1 A 67 67 ILE C C 67 175.819 175.772 0.047 1
1 723 . 20 1 1 A 67 67 ILE CA C 67 60.383 60.477 -0.094 1
1 724 . 20 1 1 A 67 67 ILE CB C 67 39.908 39.213 0.695 1
1 728 . 20 1 1 A 67 67 ILE N N 67 129.537 128.615 0.922 1
1 729 . 20 1 1 A 68 68 ARG H H 68 9.203 8.617 0.586 1
1 730 . 20 1 1 A 68 68 ARG HA H 68 4.198 4.248 -0.050 1
1 737 . 20 1 1 A 68 68 ARG C C 68 177.769 177.361 0.408 1
1 738 . 20 1 1 A 68 68 ARG CA C 68 56.835 56.970 -0.135 1
1 739 . 20 1 1 A 68 68 ARG CB C 68 29.832 30.384 -0.552 1
1 742 . 20 1 1 A 68 68 ARG N N 68 128.484 127.929 0.555 1
1 743 . 20 1 1 A 69 69 LEU H H 69 8.212 8.650 -0.438 1
1 744 . 20 1 1 A 69 69 LEU HA H 69 4.221 4.136 0.085 1
1 754 . 20 1 1 A 69 69 LEU C C 69 178.996 178.876 0.120 1
1 755 . 20 1 1 A 69 69 LEU CA C 69 57.136 57.411 -0.275 1
1 756 . 20 1 1 A 69 69 LEU CB C 69 39.455 41.259 -1.804 1
1 760 . 20 1 1 A 69 69 LEU N N 69 123.807 123.796 0.011 1
1 761 . 20 1 1 A 70 70 SER H H 70 8.823 7.938 0.885 1
1 762 . 20 1 1 A 70 70 SER HA H 70 4.331 4.107 0.224 1
1 765 . 20 1 1 A 70 70 SER C C 70 175.076 176.658 -1.582 1
1 766 . 20 1 1 A 70 70 SER CA C 70 60.329 60.919 -0.590 1
1 767 . 20 1 1 A 70 70 SER CB C 70 62.362 63.134 -0.772 1
1 768 . 20 1 1 A 70 70 SER N N 70 115.162 114.669 0.493 1
1 769 . 20 1 1 A 71 71 ASP H H 71 7.602 7.908 -0.306 1
1 770 . 20 1 1 A 71 71 ASP HA H 71 4.820 4.370 0.450 1
1 773 . 20 1 1 A 71 71 ASP C C 71 176.478 176.569 -0.091 1
1 774 . 20 1 1 A 71 71 ASP CA C 71 54.241 56.673 -2.432 1
1 775 . 20 1 1 A 71 71 ASP CB C 71 41.347 40.615 0.732 1
1 776 . 20 1 1 A 71 71 ASP N N 71 119.590 120.637 -1.047 1
1 777 . 20 1 1 A 72 72 CYS H H 72 7.715 7.410 0.305 1
1 778 . 20 1 1 A 72 72 CYS HA H 72 4.372 4.399 -0.027 1
1 781 . 20 1 1 A 72 72 CYS C C 72 173.690 174.664 -0.974 1
1 782 . 20 1 1 A 72 72 CYS CA C 72 60.836 59.132 1.704 1
1 783 . 20 1 1 A 72 72 CYS CB C 72 27.655 27.528 0.127 1
1 784 . 20 1 1 A 72 72 CYS N N 72 118.346 117.417 0.929 1
1 785 . 20 1 1 A 73 73 LEU H H 73 9.472 8.900 0.572 1
1 786 . 20 1 1 A 73 73 LEU HA H 73 4.593 4.105 0.488 1
1 796 . 20 1 1 A 73 73 LEU C C 73 177.562 177.027 0.535 1
1 797 . 20 1 1 A 73 73 LEU CA C 73 55.724 57.620 -1.896 1
1 798 . 20 1 1 A 73 73 LEU CB C 73 43.774 42.199 1.575 1
1 802 . 20 1 1 A 73 73 LEU N N 73 124.752 129.064 -4.312 1
1 803 . 20 1 1 A 74 74 ARG H H 74 7.658 7.341 0.317 1
1 804 . 20 1 1 A 74 74 ARG HA H 74 4.592 5.030 -0.438 1
1 811 . 20 1 1 A 74 74 ARG C C 74 173.605 174.596 -0.991 1
1 812 . 20 1 1 A 74 74 ARG CA C 74 56.465 56.085 0.380 1
1 813 . 20 1 1 A 74 74 ARG CB C 74 34.068 34.063 0.005 1
1 816 . 20 1 1 A 74 74 ARG N N 74 115.565 115.393 0.172 1
1 817 . 20 1 1 A 75 75 VAL H H 75 8.622 8.637 -0.015 1
1 818 . 20 1 1 A 75 75 VAL HA H 75 5.170 5.103 0.067 1
1 826 . 20 1 1 A 75 75 VAL C C 75 173.985 174.518 -0.533 1
1 827 . 20 1 1 A 75 75 VAL CA C 75 60.930 60.024 0.906 1
1 828 . 20 1 1 A 75 75 VAL CB C 75 35.073 35.575 -0.502 1
1 831 . 20 1 1 A 75 75 VAL N N 75 124.278 119.632 4.646 1
1 832 . 20 1 1 A 76 76 ALA H H 76 8.272 9.106 -0.834 1
1 833 . 20 1 1 A 76 76 ALA HA H 76 4.648 5.158 -0.510 1
1 837 . 20 1 1 A 76 76 ALA C C 76 175.630 176.497 -0.867 1
1 838 . 20 1 1 A 76 76 ALA CA C 76 51.294 50.968 0.326 1
1 839 . 20 1 1 A 76 76 ALA CB C 76 22.759 23.622 -0.863 1
1 840 . 20 1 1 A 76 76 ALA N N 76 126.015 124.624 1.391 1
1 841 . 20 1 1 A 77 77 GLU H H 77 9.184 8.622 0.562 1
1 842 . 20 1 1 A 77 77 GLU HA H 77 4.060 4.923 -0.863 1
1 847 . 20 1 1 A 77 77 GLU C C 77 174.949 175.453 -0.504 1
1 848 . 20 1 1 A 77 77 GLU CA C 77 58.424 55.646 2.778 1
1 849 . 20 1 1 A 77 77 GLU CB C 77 30.161 30.552 -0.391 1
1 851 . 20 1 1 A 77 77 GLU N N 77 120.223 119.235 0.988 1
1 852 . 20 1 1 A 78 78 ALA H H 78 7.985 8.452 -0.467 1
1 853 . 20 1 1 A 78 78 ALA HA H 78 4.776 4.849 -0.073 1
1 857 . 20 1 1 A 78 78 ALA C C 78 177.250 177.987 -0.737 1
1 858 . 20 1 1 A 78 78 ALA CA C 78 50.888 51.329 -0.441 1
1 859 . 20 1 1 A 78 78 ALA CB C 78 20.851 19.569 1.282 1
1 860 . 20 1 1 A 78 78 ALA N N 78 125.143 130.163 -5.020 1
1 861 . 20 1 1 A 79 79 GLY H H 79 8.604 8.633 -0.029 1
1 862 . 20 1 1 A 79 79 GLY HA2 H 79 4.327 3.895 0.432 1
1 863 . 20 1 1 A 79 79 GLY HA3 H 79 3.963 3.895 0.068 1
1 864 . 20 1 1 A 79 79 GLY C C 79 175.360 174.789 0.571 1
1 865 . 20 1 1 A 79 79 GLY CA C 79 44.925 46.941 -2.016 1
1 866 . 20 1 1 A 79 79 GLY N N 79 109.420 109.855 -0.435 1
1 867 . 20 1 1 A 80 80 GLY H H 80 8.649 7.642 1.007 1
1 868 . 20 1 1 A 80 80 GLY HA2 H 80 3.962 4.088 -0.126 1
1 869 . 20 1 1 A 80 80 GLY HA3 H 80 3.962 4.100 -0.138 1
1 870 . 20 1 1 A 80 80 GLY C C 80 175.052 172.826 2.226 1
1 871 . 20 1 1 A 80 80 GLY CA C 80 45.955 45.681 0.274 1
1 872 . 20 1 1 A 80 80 GLY N N 80 108.295 106.980 1.315 1
1 873 . 20 1 1 A 81 81 GLU H H 81 8.921 8.572 0.349 1
1 874 . 20 1 1 A 81 81 GLU HA H 81 4.298 4.726 -0.428 1
1 879 . 20 1 1 A 81 81 GLU C C 81 176.532 174.803 1.729 1
1 880 . 20 1 1 A 81 81 GLU CA C 81 57.118 55.645 1.473 1
1 881 . 20 1 1 A 81 81 GLU CB C 81 28.599 30.658 -2.059 1
1 883 . 20 1 1 A 81 81 GLU N N 81 121.170 121.301 -0.131 1
1 884 . 20 1 1 A 82 82 ALA H H 82 8.032 8.060 -0.028 1
1 885 . 20 1 1 A 82 82 ALA HA H 82 4.371 4.702 -0.331 1
1 889 . 20 1 1 A 82 82 ALA C C 82 177.160 177.112 0.048 1
1 890 . 20 1 1 A 82 82 ALA CA C 82 52.653 51.166 1.487 1
1 891 . 20 1 1 A 82 82 ALA CB C 82 19.304 22.056 -2.752 1
1 892 . 20 1 1 A 82 82 ALA N N 82 124.988 125.077 -0.089 1
1 893 . 20 1 1 A 83 83 SER H H 83 8.319 9.150 -0.831 1
1 894 . 20 1 1 A 83 83 SER HA H 83 4.331 4.298 0.033 1
1 897 . 20 1 1 A 83 83 SER C C 83 174.045 174.583 -0.538 1
1 898 . 20 1 1 A 83 83 SER CA C 83 58.053 61.405 -3.352 1
1 899 . 20 1 1 A 83 83 SER CB C 83 63.184 62.907 0.277 1
1 900 . 20 1 1 A 83 83 SER N N 83 114.181 114.855 -0.674 1
1 901 . 20 1 1 A 84 84 SER H H 84 7.823 7.824 -0.001 1
1 902 . 20 1 1 A 84 84 SER HA H 84 3.194 3.922 -0.728 1
1 905 . 20 1 1 A 84 84 SER C C 84 171.072 173.950 -2.878 1
1 906 . 20 1 1 A 84 84 SER CA C 84 57.206 56.945 0.261 1
1 907 . 20 1 1 A 84 84 SER CB C 84 61.622 62.982 -1.360 1
1 908 . 20 1 1 A 84 84 SER N N 84 117.302 114.278 3.024 1
1 909 . 20 1 1 A 85 85 PRO HA H 85 3.922 4.539 -0.617 1
1 916 . 20 1 1 A 85 85 PRO CA C 85 62.691 62.166 0.525 1
1 917 . 20 1 1 A 85 85 PRO CB C 85 31.515 32.423 -0.908 1
1 920 . 20 1 1 A 86 86 ARG HA H 86 3.882 4.187 -0.305 1
1 927 . 20 1 1 A 86 86 ARG C C 86 175.712 176.327 -0.615 1
1 928 . 20 1 1 A 86 86 ARG CA C 86 57.877 55.679 2.198 1
1 929 . 20 1 1 A 86 86 ARG CB C 86 29.791 31.374 -1.583 1
1 932 . 20 1 1 A 87 87 ASP H H 87 8.903 9.036 -0.133 1
1 933 . 20 1 1 A 87 87 ASP HA H 87 4.342 4.190 0.152 1
1 936 . 20 1 1 A 87 87 ASP C C 87 175.723 174.775 0.948 1
1 937 . 20 1 1 A 87 87 ASP CA C 87 56.377 55.005 1.372 1
1 938 . 20 1 1 A 87 87 ASP CB C 87 39.208 39.814 -0.606 1
1 939 . 20 1 1 A 87 87 ASP N N 87 117.520 123.960 -6.440 1
1 940 . 20 1 1 A 88 88 THR H H 88 7.776 7.388 0.388 1
1 941 . 20 1 1 A 88 88 THR HA H 88 5.101 5.094 0.007 1
1 946 . 20 1 1 A 88 88 THR C C 88 173.825 172.736 1.089 1
1 947 . 20 1 1 A 88 88 THR CA C 88 60.154 60.182 -0.028 1
1 948 . 20 1 1 A 88 88 THR CB C 88 72.702 72.599 0.103 1
1 950 . 20 1 1 A 88 88 THR N N 88 108.770 108.396 0.374 1
1 951 . 20 1 1 A 89 89 SER H H 89 9.006 8.986 0.020 1
1 952 . 20 1 1 A 89 89 SER HA H 89 4.718 5.262 -0.544 1
1 955 . 20 1 1 A 89 89 SER C C 89 173.728 172.697 1.031 1
1 956 . 20 1 1 A 89 89 SER CA C 89 57.453 57.786 -0.333 1
1 957 . 20 1 1 A 89 89 SER CB C 89 65.611 65.966 -0.355 1
1 958 . 20 1 1 A 89 89 SER N N 89 114.151 116.901 -2.750 1
1 959 . 20 1 1 A 90 90 ALA H H 90 9.001 8.876 0.125 1
1 960 . 20 1 1 A 90 90 ALA HA H 90 5.660 5.196 0.464 1
1 964 . 20 1 1 A 90 90 ALA C C 90 177.669 177.251 0.418 1
1 965 . 20 1 1 A 90 90 ALA CA C 90 51.670 51.053 0.617 1
1 966 . 20 1 1 A 90 90 ALA CB C 90 22.265 20.982 1.283 1
1 967 . 20 1 1 A 90 90 ALA N N 90 126.177 129.154 -2.977 1
1 968 . 20 1 1 A 91 91 PHE H H 91 9.672 8.479 1.193 1
1 969 . 20 1 1 A 91 91 PHE HA H 91 5.039 5.734 -0.695 1
1 977 . 20 1 1 A 91 91 PHE C C 91 170.731 174.034 -3.303 1
1 978 . 20 1 1 A 91 91 PHE CA C 91 56.271 55.033 1.238 1
1 979 . 20 1 1 A 91 91 PHE CB C 91 41.553 42.519 -0.966 1
1 985 . 20 1 1 A 91 91 PHE N N 91 118.968 116.805 2.163 1
1 986 . 20 1 1 A 92 92 PHE H H 92 9.422 9.480 -0.058 1
1 987 . 20 1 1 A 92 92 PHE HA H 92 5.674 5.075 0.599 1
1 995 . 20 1 1 A 92 92 PHE C C 92 174.570 175.437 -0.867 1
1 996 . 20 1 1 A 92 92 PHE CA C 92 55.917 57.697 -1.780 1
1 997 . 20 1 1 A 92 92 PHE CB C 92 42.787 41.431 1.356 1
1 1003 . 20 1 1 A 92 92 PHE N N 92 117.543 118.604 -1.061 1
1 1004 . 20 1 1 A 93 93 LEU H H 93 9.021 8.844 0.177 1
1 1005 . 20 1 1 A 93 93 LEU HA H 93 5.122 4.888 0.234 1
1 1015 . 20 1 1 A 93 93 LEU C C 93 174.799 174.279 0.520 1
1 1016 . 20 1 1 A 93 93 LEU CA C 93 54.912 54.835 0.077 1
1 1017 . 20 1 1 A 93 93 LEU CB C 93 45.254 45.013 0.241 1
1 1021 . 20 1 1 A 93 93 LEU N N 93 121.719 121.731 -0.012 1
1 1022 . 20 1 1 A 94 94 GLU H H 94 9.294 9.339 -0.045 1
1 1023 . 20 1 1 A 94 94 GLU HA H 94 5.043 5.204 -0.161 1
1 1028 . 20 1 1 A 94 94 GLU C C 94 175.754 175.552 0.202 1
1 1029 . 20 1 1 A 94 94 GLU CA C 94 56.018 54.973 1.045 1
1 1030 . 20 1 1 A 94 94 GLU CB C 94 32.752 32.821 -0.069 1
1 1032 . 20 1 1 A 94 94 GLU N N 94 127.032 128.691 -1.659 1
1 1033 . 20 1 1 A 95 95 THR H H 95 8.822 8.444 0.378 1
1 1034 . 20 1 1 A 95 95 THR HA H 95 5.398 5.074 0.324 1
1 1039 . 20 1 1 A 95 95 THR C C 95 173.860 175.328 -1.468 1
1 1040 . 20 1 1 A 95 95 THR CA C 95 59.588 59.526 0.062 1
1 1041 . 20 1 1 A 95 95 THR CB C 95 72.191 72.344 -0.153 1
1 1043 . 20 1 1 A 95 95 THR N N 95 118.685 117.983 0.702 1
1 1044 . 20 1 1 A 96 96 LYS H H 96 8.823 8.714 0.109 1
1 1045 . 20 1 1 A 96 96 LYS HA H 96 4.022 3.993 0.029 1
1 1054 . 20 1 1 A 96 96 LYS C C 96 177.330 178.443 -1.113 1
1 1055 . 20 1 1 A 96 96 LYS CA C 96 59.588 60.192 -0.604 1
1 1056 . 20 1 1 A 96 96 LYS CB C 96 32.588 32.064 0.524 1
1 1060 . 20 1 1 A 96 96 LYS N N 96 118.801 122.352 -3.551 1
1 1061 . 20 1 1 A 97 97 GLU H H 97 8.092 7.748 0.344 1
1 1062 . 20 1 1 A 97 97 GLU HA H 97 4.282 4.244 0.038 1
1 1067 . 20 1 1 A 97 97 GLU C C 97 176.290 176.704 -0.414 1
1 1068 . 20 1 1 A 97 97 GLU CA C 97 57.365 58.743 -1.378 1
1 1069 . 20 1 1 A 97 97 GLU CB C 97 31.559 30.351 1.208 1
1 1071 . 20 1 1 A 97 97 GLU N N 97 113.992 119.190 -5.198 1
1 1072 . 20 1 1 A 98 98 ARG H H 98 7.482 7.080 0.402 1
1 1073 . 20 1 1 A 98 98 ARG HA H 98 4.397 4.539 -0.142 1
1 1080 . 20 1 1 A 98 98 ARG C C 98 172.792 173.092 -0.300 1
1 1081 . 20 1 1 A 98 98 ARG CA C 98 55.689 54.818 0.871 1
1 1082 . 20 1 1 A 98 98 ARG CB C 98 32.711 31.781 0.930 1
1 1085 . 20 1 1 A 98 98 ARG N N 98 116.022 113.106 2.916 1
1 1086 . 20 1 1 A 99 99 LEU H H 99 8.423 8.201 0.222 1
1 1087 . 20 1 1 A 99 99 LEU HA H 99 4.807 4.678 0.129 1
1 1097 . 20 1 1 A 99 99 LEU C C 99 175.903 174.233 1.670 1
1 1098 . 20 1 1 A 99 99 LEU CA C 99 54.383 54.374 0.009 1
1 1099 . 20 1 1 A 99 99 LEU CB C 99 43.362 44.126 -0.764 1
1 1103 . 20 1 1 A 99 99 LEU N N 99 124.983 122.043 2.940 1
1 1104 . 20 1 1 A 100 100 TYR H H 100 9.144 9.724 -0.580 1
1 1105 . 20 1 1 A 100 100 TYR HA H 100 4.542 5.169 -0.627 1
1 1112 . 20 1 1 A 100 100 TYR C C 100 173.479 174.291 -0.812 1
1 1113 . 20 1 1 A 100 100 TYR CA C 100 57.735 56.311 1.424 1
1 1114 . 20 1 1 A 100 100 TYR CB C 100 39.291 42.425 -3.134 1
1 1119 . 20 1 1 A 100 100 TYR N N 100 126.679 125.817 0.862 1
1 1120 . 20 1 1 A 101 101 LEU H H 101 9.043 8.872 0.171 1
1 1121 . 20 1 1 A 101 101 LEU HA H 101 4.747 4.885 -0.138 1
1 1131 . 20 1 1 A 101 101 LEU C C 101 173.530 175.214 -1.684 1
1 1132 . 20 1 1 A 101 101 LEU CA C 101 54.524 53.674 0.850 1
1 1133 . 20 1 1 A 101 101 LEU CB C 101 42.499 43.736 -1.237 1
1 1137 . 20 1 1 A 101 101 LEU N N 101 127.422 124.912 2.510 1
1 1138 . 20 1 1 A 102 102 LEU H H 102 8.493 8.508 -0.015 1
1 1139 . 20 1 1 A 102 102 LEU HA H 102 5.612 5.417 0.195 1
1 1149 . 20 1 1 A 102 102 LEU C C 102 175.794 176.075 -0.281 1
1 1150 . 20 1 1 A 102 102 LEU CA C 102 53.076 53.360 -0.284 1
1 1151 . 20 1 1 A 102 102 LEU CB C 102 45.994 43.949 2.045 1
1 1155 . 20 1 1 A 102 102 LEU N N 102 126.021 127.750 -1.729 1
1 1156 . 20 1 1 A 103 103 ALA H H 103 9.073 8.918 0.155 1
1 1157 . 20 1 1 A 103 103 ALA HA H 103 5.081 5.295 -0.214 1
1 1161 . 20 1 1 A 103 103 ALA C C 103 175.133 175.920 -0.787 1
1 1162 . 20 1 1 A 103 103 ALA CA C 103 51.688 50.138 1.550 1
1 1163 . 20 1 1 A 103 103 ALA CB C 103 21.689 22.144 -0.455 1
1 1164 . 20 1 1 A 103 103 ALA N N 103 117.679 122.917 -5.238 1
1 1165 . 20 1 1 A 104 104 ALA H H 104 8.582 8.593 -0.011 1
1 1166 . 20 1 1 A 104 104 ALA HA H 104 5.220 4.872 0.348 1
1 1170 . 20 1 1 A 104 104 ALA C C 104 173.471 174.257 -0.786 1
1 1171 . 20 1 1 A 104 104 ALA CA C 104 47.959 49.930 -1.971 1
1 1172 . 20 1 1 A 104 104 ALA CB C 104 21.359 22.553 -1.194 1
1 1173 . 20 1 1 A 104 104 ALA N N 104 123.419 121.904 1.515 1
1 1174 . 20 1 1 A 105 105 PRO HA H 105 4.542 4.742 -0.200 1
1 1181 . 20 1 1 A 105 105 PRO C C 105 178.409 177.931 0.478 1
1 1182 . 20 1 1 A 105 105 PRO CA C 105 64.301 62.868 1.433 1
1 1183 . 20 1 1 A 105 105 PRO CB C 105 32.094 31.615 0.479 1
1 1186 . 20 1 1 A 106 106 ALA H H 106 8.302 8.681 -0.379 1
1 1187 . 20 1 1 A 106 106 ALA HA H 106 4.022 4.034 -0.012 1
1 1191 . 20 1 1 A 106 106 ALA C C 106 179.641 179.647 -0.006 1
1 1192 . 20 1 1 A 106 106 ALA CA C 106 56.341 55.185 1.156 1
1 1193 . 20 1 1 A 106 106 ALA CB C 106 18.523 18.212 0.311 1
1 1194 . 20 1 1 A 106 106 ALA N N 106 127.733 128.241 -0.508 1
1 1195 . 20 1 1 A 107 107 ALA H H 107 9.035 8.246 0.789 1
1 1196 . 20 1 1 A 107 107 ALA HA H 107 4.331 4.009 0.322 1
1 1200 . 20 1 1 A 107 107 ALA C C 107 178.586 179.127 -0.541 1
1 1201 . 20 1 1 A 107 107 ALA CA C 107 53.765 55.257 -1.492 1
1 1202 . 20 1 1 A 107 107 ALA CB C 107 18.728 18.529 0.199 1
1 1203 . 20 1 1 A 107 107 ALA N N 107 118.203 120.237 -2.034 1
1 1204 . 20 1 1 A 108 108 GLU H H 108 8.399 8.151 0.248 1
1 1205 . 20 1 1 A 108 108 GLU HA H 108 4.631 4.234 0.397 1
1 1210 . 20 1 1 A 108 108 GLU C C 108 177.127 178.603 -1.476 1
1 1211 . 20 1 1 A 108 108 GLU CA C 108 55.847 57.833 -1.986 1
1 1212 . 20 1 1 A 108 108 GLU CB C 108 32.135 30.130 2.005 1
1 1214 . 20 1 1 A 108 108 GLU N N 108 114.661 117.795 -3.134 1
1 1215 . 20 1 1 A 109 109 ARG H H 109 7.412 8.649 -1.237 1
1 1216 . 20 1 1 A 109 109 ARG HA H 109 3.682 4.150 -0.468 1
1 1223 . 20 1 1 A 109 109 ARG C C 109 176.917 179.196 -2.279 1
1 1224 . 20 1 1 A 109 109 ARG CA C 109 61.600 59.822 1.778 1
1 1225 . 20 1 1 A 109 109 ARG CB C 109 28.845 30.287 -1.442 1
1 1228 . 20 1 1 A 109 109 ARG N N 109 120.954 121.043 -0.089 1
1 1229 . 20 1 1 A 110 110 GLY H H 110 8.833 8.537 0.296 1
1 1230 . 20 1 1 A 110 110 GLY HA2 H 110 3.872 3.831 0.041 1
1 1231 . 20 1 1 A 110 110 GLY HA3 H 110 3.685 3.844 -0.159 1
1 1232 . 20 1 1 A 110 110 GLY C C 110 175.997 175.850 0.147 1
1 1233 . 20 1 1 A 110 110 GLY CA C 110 47.323 47.585 -0.262 1
1 1234 . 20 1 1 A 110 110 GLY N N 110 106.563 107.192 -0.629 1
1 1235 . 20 1 1 A 111 111 ASP H H 111 7.882 8.196 -0.314 1
1 1236 . 20 1 1 A 111 111 ASP HA H 111 4.312 4.373 -0.061 1
1 1239 . 20 1 1 A 111 111 ASP C C 111 179.467 178.670 0.797 1
1 1240 . 20 1 1 A 111 111 ASP CA C 111 56.976 56.978 -0.002 1
1 1241 . 20 1 1 A 111 111 ASP CB C 111 40.648 40.936 -0.288 1
1 1242 . 20 1 1 A 111 111 ASP N N 111 121.402 121.709 -0.307 1
1 1243 . 20 1 1 A 112 112 TRP H H 112 7.804 8.553 -0.749 1
1 1244 . 20 1 1 A 112 112 TRP HA H 112 3.831 4.217 -0.386 1
1 1253 . 20 1 1 A 112 112 TRP C C 112 177.547 178.736 -1.189 1
1 1254 . 20 1 1 A 112 112 TRP CA C 112 62.006 59.959 2.047 1
1 1255 . 20 1 1 A 112 112 TRP CB C 112 29.421 29.381 0.040 1
1 1261 . 20 1 1 A 112 112 TRP N N 112 119.904 120.185 -0.281 1
1 1263 . 20 1 1 A 113 113 VAL H H 113 7.982 7.996 -0.014 1
1 1264 . 20 1 1 A 113 113 VAL HA H 113 3.072 3.670 -0.598 1
1 1272 . 20 1 1 A 113 113 VAL C C 113 178.015 178.158 -0.143 1
1 1273 . 20 1 1 A 113 113 VAL CA C 113 67.407 66.769 0.638 1
1 1274 . 20 1 1 A 113 113 VAL CB C 113 31.724 31.559 0.165 1
1 1277 . 20 1 1 A 113 113 VAL N N 113 117.575 119.203 -1.628 1
1 1278 . 20 1 1 A 114 114 GLN H H 114 8.268 8.070 0.198 1
1 1279 . 20 1 1 A 114 114 GLN HA H 114 3.994 3.938 0.056 1
1 1286 . 20 1 1 A 114 114 GLN C C 114 178.021 178.155 -0.134 1
1 1287 . 20 1 1 A 114 114 GLN CA C 114 59.112 58.593 0.519 1
1 1288 . 20 1 1 A 114 114 GLN CB C 114 28.685 28.442 0.243 1
1 1290 . 20 1 1 A 114 114 GLN N N 114 117.479 120.489 -3.010 1
1 1292 . 20 1 1 A 115 115 ALA H H 115 7.915 8.208 -0.293 1
1 1293 . 20 1 1 A 115 115 ALA HA H 115 3.972 4.018 -0.046 1
1 1297 . 20 1 1 A 115 115 ALA C C 115 180.030 179.556 0.474 1
1 1298 . 20 1 1 A 115 115 ALA CA C 115 55.142 55.105 0.037 1
1 1299 . 20 1 1 A 115 115 ALA CB C 115 18.152 18.884 -0.732 1
1 1300 . 20 1 1 A 115 115 ALA N N 115 120.858 121.993 -1.135 1
1 1301 . 20 1 1 A 116 116 ILE H H 116 8.172 8.317 -0.145 1
1 1302 . 20 1 1 A 116 116 ILE HA H 116 3.482 3.788 -0.306 1
1 1312 . 20 1 1 A 116 116 ILE C C 116 177.739 178.092 -0.353 1
1 1313 . 20 1 1 A 116 116 ILE CA C 116 66.119 65.090 1.029 1
1 1314 . 20 1 1 A 116 116 ILE CB C 116 38.222 37.943 0.279 1
1 1318 . 20 1 1 A 116 116 ILE N N 116 115.977 117.831 -1.854 1
1 1319 . 20 1 1 A 117 117 CYS H H 117 8.449 8.745 -0.296 1
1 1320 . 20 1 1 A 117 117 CYS HA H 117 4.032 4.428 -0.396 1
1 1323 . 20 1 1 A 117 117 CYS C C 117 177.321 177.737 -0.416 1
1 1324 . 20 1 1 A 117 117 CYS CA C 117 64.777 62.505 2.272 1
1 1325 . 20 1 1 A 117 117 CYS CB C 117 26.871 27.073 -0.202 1
1 1326 . 20 1 1 A 117 117 CYS N N 117 117.253 119.668 -2.415 1
1 1327 . 20 1 1 A 118 118 LEU H H 118 8.182 7.846 0.336 1
1 1328 . 20 1 1 A 118 118 LEU HA H 118 4.052 4.022 0.030 1
1 1338 . 20 1 1 A 118 118 LEU C C 118 179.217 179.435 -0.218 1
1 1339 . 20 1 1 A 118 118 LEU CA C 118 57.877 58.208 -0.331 1
1 1340 . 20 1 1 A 118 118 LEU CB C 118 42.088 41.880 0.208 1
1 1344 . 20 1 1 A 118 118 LEU N N 118 119.665 121.489 -1.824 1
1 1345 . 20 1 1 A 119 119 LEU H H 119 7.142 8.362 -1.220 1
1 1346 . 20 1 1 A 119 119 LEU HA H 119 4.192 3.858 0.334 1
1 1356 . 20 1 1 A 119 119 LEU C C 119 178.492 178.816 -0.324 1
1 1357 . 20 1 1 A 119 119 LEU CA C 119 56.259 58.160 -1.901 1
1 1358 . 20 1 1 A 119 119 LEU CB C 119 43.568 42.045 1.523 1
1 1362 . 20 1 1 A 119 119 LEU N N 119 116.244 117.067 -0.823 1
1 1363 . 20 1 1 A 120 120 ALA H H 120 8.513 8.592 -0.079 1
1 1364 . 20 1 1 A 120 120 ALA HA H 120 3.878 4.015 -0.137 1
1 1368 . 20 1 1 A 120 120 ALA C C 120 178.358 178.683 -0.325 1
1 1369 . 20 1 1 A 120 120 ALA CA C 120 53.765 55.254 -1.489 1
1 1370 . 20 1 1 A 120 120 ALA CB C 120 18.687 18.956 -0.269 1
1 1371 . 20 1 1 A 120 120 ALA N N 120 120.009 120.185 -0.176 1
1 1372 . 20 1 1 A 121 121 PHE H H 121 7.822 8.167 -0.345 1
1 1373 . 20 1 1 A 121 121 PHE HA H 121 5.156 4.898 0.258 1
1 1381 . 20 1 1 A 121 121 PHE C C 121 176.273 175.117 1.156 1
1 1382 . 20 1 1 A 121 121 PHE CA C 121 55.741 56.419 -0.678 1
1 1383 . 20 1 1 A 121 121 PHE CB C 121 39.455 37.701 1.754 1
1 1389 . 20 1 1 A 121 121 PHE N N 121 113.981 114.126 -0.145 1
1 1390 . 20 1 1 A 122 122 SER H H 122 7.765 7.845 -0.080 1
1 1391 . 20 1 1 A 122 122 SER HA H 122 4.579 4.628 -0.049 1
1 1394 . 20 1 1 A 122 122 SER C C 122 174.595 174.877 -0.282 1
1 1395 . 20 1 1 A 122 122 SER CA C 122 58.777 57.773 1.004 1
1 1396 . 20 1 1 A 122 122 SER CB C 122 63.719 62.819 0.900 1
1 1397 . 20 1 1 A 122 122 SER N N 122 115.069 113.634 1.435 1
1 1398 . 20 1 1 A 123 123 GLY H H 123 8.223 8.374 -0.151 1
1 1399 . 20 1 1 A 123 123 GLY HA2 H 123 4.174 3.921 0.253 1
1 1400 . 20 1 1 A 123 123 GLY HA3 H 123 4.100 3.928 0.172 1
1 1401 . 20 1 1 A 123 123 GLY C C 123 171.678 173.550 -1.872 1
1 1402 . 20 1 1 A 123 123 GLY CA C 123 44.815 45.370 -0.555 1
1 1403 . 20 1 1 A 123 123 GLY N N 123 110.151 112.756 -2.605 1
1 1404 . 20 1 1 A 124 124 PRO HA H 124 4.482 4.770 -0.288 1
1 1411 . 20 1 1 A 124 124 PRO C C 124 177.314 176.238 1.076 1
1 1412 . 20 1 1 A 124 124 PRO CA C 124 63.206 62.815 0.391 1
1 1413 . 20 1 1 A 124 124 PRO CB C 124 32.176 31.625 0.551 1
1 1416 . 20 1 1 A 125 125 SER H H 125 8.485 8.433 0.052 1
1 1417 . 20 1 1 A 125 125 SER HA H 125 4.472 5.145 -0.673 1
1 1420 . 20 1 1 A 125 125 SER C C 125 174.728 173.438 1.290 1
1 1421 . 20 1 1 A 125 125 SER CA C 125 58.353 56.962 1.391 1
1 1422 . 20 1 1 A 125 125 SER CB C 125 64.048 64.191 -0.143 1
1 1423 . 20 1 1 A 125 125 SER N N 125 116.081 115.519 0.562 1
1 1424 . 20 1 1 A 126 126 SER H H 126 8.332 8.492 -0.160 1
1 1425 . 20 1 1 A 126 126 SER HA H 126 4.464 4.910 -0.446 1
1 1428 . 20 1 1 A 126 126 SER C C 126 173.980 173.961 0.019 1
1 1429 . 20 1 1 A 126 126 SER CA C 126 58.336 57.093 1.243 1
1 1430 . 20 1 1 A 126 126 SER CB C 126 63.925 65.440 -1.515 1
1 1431 . 20 1 1 A 126 126 SER N N 126 118.037 120.981 -2.944 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 112 0.906 1
2 1 1 1 "RMS(OBS, PRED)" CA 119 1.262 1
3 1 1 1 "RMS(OBS, PRED)" CB 107 1.343 1
4 1 1 1 "RMS(OBS, PRED)" H 107 0.502 1
5 1 1 1 "RMS(OBS, PRED)" HA 133 0.362 1
6 1 1 1 "RMS(OBS, PRED)" N 107 2.490 1
7 1 2 1 "RMS(OBS, PRED)" C 112 1.086 1
8 1 2 1 "RMS(OBS, PRED)" CA 119 1.335 1
9 1 2 1 "RMS(OBS, PRED)" CB 107 1.538 1
10 1 2 1 "RMS(OBS, PRED)" H 107 0.496 1
11 1 2 1 "RMS(OBS, PRED)" HA 133 0.376 1
12 1 2 1 "RMS(OBS, PRED)" N 107 2.513 1
13 1 3 1 "RMS(OBS, PRED)" C 112 1.050 1
14 1 3 1 "RMS(OBS, PRED)" CA 119 1.232 1
15 1 3 1 "RMS(OBS, PRED)" CB 107 1.427 1
16 1 3 1 "RMS(OBS, PRED)" H 107 0.503 1
17 1 3 1 "RMS(OBS, PRED)" HA 133 0.342 1
18 1 3 1 "RMS(OBS, PRED)" N 107 2.533 1
19 1 4 1 "RMS(OBS, PRED)" C 112 0.989 1
20 1 4 1 "RMS(OBS, PRED)" CA 119 1.368 1
21 1 4 1 "RMS(OBS, PRED)" CB 107 1.336 1
22 1 4 1 "RMS(OBS, PRED)" H 107 0.481 1
23 1 4 1 "RMS(OBS, PRED)" HA 133 0.392 1
24 1 4 1 "RMS(OBS, PRED)" N 107 2.600 1
25 1 5 1 "RMS(OBS, PRED)" C 112 1.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 119 1.385 1
27 1 5 1 "RMS(OBS, PRED)" CB 107 1.378 1
28 1 5 1 "RMS(OBS, PRED)" H 107 0.446 1
29 1 5 1 "RMS(OBS, PRED)" HA 133 0.365 1
30 1 5 1 "RMS(OBS, PRED)" N 107 2.751 1
31 1 6 1 "RMS(OBS, PRED)" C 112 1.016 1
32 1 6 1 "RMS(OBS, PRED)" CA 119 1.314 1
33 1 6 1 "RMS(OBS, PRED)" CB 107 1.377 1
34 1 6 1 "RMS(OBS, PRED)" H 107 0.504 1
35 1 6 1 "RMS(OBS, PRED)" HA 133 0.381 1
36 1 6 1 "RMS(OBS, PRED)" N 107 2.481 1
37 1 7 1 "RMS(OBS, PRED)" C 112 1.084 1
38 1 7 1 "RMS(OBS, PRED)" CA 119 1.402 1
39 1 7 1 "RMS(OBS, PRED)" CB 107 1.399 1
40 1 7 1 "RMS(OBS, PRED)" H 107 0.467 1
41 1 7 1 "RMS(OBS, PRED)" HA 133 0.390 1
42 1 7 1 "RMS(OBS, PRED)" N 107 3.083 1
43 1 8 1 "RMS(OBS, PRED)" C 112 1.019 1
44 1 8 1 "RMS(OBS, PRED)" CA 119 1.411 1
45 1 8 1 "RMS(OBS, PRED)" CB 107 1.393 1
46 1 8 1 "RMS(OBS, PRED)" H 107 0.507 1
47 1 8 1 "RMS(OBS, PRED)" HA 133 0.382 1
48 1 8 1 "RMS(OBS, PRED)" N 107 2.746 1
49 1 9 1 "RMS(OBS, PRED)" C 112 1.012 1
50 1 9 1 "RMS(OBS, PRED)" CA 119 1.270 1
51 1 9 1 "RMS(OBS, PRED)" CB 107 1.362 1
52 1 9 1 "RMS(OBS, PRED)" H 107 0.465 1
53 1 9 1 "RMS(OBS, PRED)" HA 133 0.358 1
54 1 9 1 "RMS(OBS, PRED)" N 107 2.366 1
55 1 10 1 "RMS(OBS, PRED)" C 112 1.091 1
56 1 10 1 "RMS(OBS, PRED)" CA 119 1.293 1
57 1 10 1 "RMS(OBS, PRED)" CB 107 1.297 1
58 1 10 1 "RMS(OBS, PRED)" H 107 0.494 1
59 1 10 1 "RMS(OBS, PRED)" HA 133 0.369 1
60 1 10 1 "RMS(OBS, PRED)" N 107 2.867 1
61 1 11 1 "RMS(OBS, PRED)" C 112 1.040 1
62 1 11 1 "RMS(OBS, PRED)" CA 119 1.314 1
63 1 11 1 "RMS(OBS, PRED)" CB 107 1.544 1
64 1 11 1 "RMS(OBS, PRED)" H 107 0.504 1
65 1 11 1 "RMS(OBS, PRED)" HA 133 0.353 1
66 1 11 1 "RMS(OBS, PRED)" N 107 2.446 1
67 1 12 1 "RMS(OBS, PRED)" C 112 1.073 1
68 1 12 1 "RMS(OBS, PRED)" CA 119 1.219 1
69 1 12 1 "RMS(OBS, PRED)" CB 107 1.611 1
70 1 12 1 "RMS(OBS, PRED)" H 107 0.514 1
71 1 12 1 "RMS(OBS, PRED)" HA 133 0.383 1
72 1 12 1 "RMS(OBS, PRED)" N 107 2.618 1
73 1 13 1 "RMS(OBS, PRED)" C 112 1.068 1
74 1 13 1 "RMS(OBS, PRED)" CA 119 1.192 1
75 1 13 1 "RMS(OBS, PRED)" CB 107 1.262 1
76 1 13 1 "RMS(OBS, PRED)" H 107 0.496 1
77 1 13 1 "RMS(OBS, PRED)" HA 133 0.363 1
78 1 13 1 "RMS(OBS, PRED)" N 107 2.595 1
79 1 14 1 "RMS(OBS, PRED)" C 112 1.043 1
80 1 14 1 "RMS(OBS, PRED)" CA 119 1.476 1
81 1 14 1 "RMS(OBS, PRED)" CB 107 1.404 1
82 1 14 1 "RMS(OBS, PRED)" H 107 0.532 1
83 1 14 1 "RMS(OBS, PRED)" HA 133 0.374 1
84 1 14 1 "RMS(OBS, PRED)" N 107 2.872 1
85 1 15 1 "RMS(OBS, PRED)" C 112 0.994 1
86 1 15 1 "RMS(OBS, PRED)" CA 119 1.323 1
87 1 15 1 "RMS(OBS, PRED)" CB 107 1.370 1
88 1 15 1 "RMS(OBS, PRED)" H 107 0.500 1
89 1 15 1 "RMS(OBS, PRED)" HA 133 0.374 1
90 1 15 1 "RMS(OBS, PRED)" N 107 2.668 1
91 1 16 1 "RMS(OBS, PRED)" C 112 1.042 1
92 1 16 1 "RMS(OBS, PRED)" CA 119 1.374 1
93 1 16 1 "RMS(OBS, PRED)" CB 107 1.351 1
94 1 16 1 "RMS(OBS, PRED)" H 107 0.511 1
95 1 16 1 "RMS(OBS, PRED)" HA 133 0.339 1
96 1 16 1 "RMS(OBS, PRED)" N 107 2.528 1
97 1 17 1 "RMS(OBS, PRED)" C 112 1.050 1
98 1 17 1 "RMS(OBS, PRED)" CA 119 1.306 1
99 1 17 1 "RMS(OBS, PRED)" CB 107 1.429 1
100 1 17 1 "RMS(OBS, PRED)" H 107 0.492 1
101 1 17 1 "RMS(OBS, PRED)" HA 133 0.352 1
102 1 17 1 "RMS(OBS, PRED)" N 107 2.551 1
103 1 18 1 "RMS(OBS, PRED)" C 112 1.029 1
104 1 18 1 "RMS(OBS, PRED)" CA 119 1.330 1
105 1 18 1 "RMS(OBS, PRED)" CB 107 1.360 1
106 1 18 1 "RMS(OBS, PRED)" H 107 0.513 1
107 1 18 1 "RMS(OBS, PRED)" HA 133 0.358 1
108 1 18 1 "RMS(OBS, PRED)" N 107 2.535 1
109 1 19 1 "RMS(OBS, PRED)" C 112 1.027 1
110 1 19 1 "RMS(OBS, PRED)" CA 119 1.435 1
111 1 19 1 "RMS(OBS, PRED)" CB 107 1.458 1
112 1 19 1 "RMS(OBS, PRED)" H 107 0.496 1
113 1 19 1 "RMS(OBS, PRED)" HA 133 0.363 1
114 1 19 1 "RMS(OBS, PRED)" N 107 2.650 1
115 1 20 1 "RMS(OBS, PRED)" C 112 1.059 1
116 1 20 1 "RMS(OBS, PRED)" CA 119 1.400 1
117 1 20 1 "RMS(OBS, PRED)" CB 107 1.436 1
118 1 20 1 "RMS(OBS, PRED)" H 107 0.490 1
119 1 20 1 "RMS(OBS, PRED)" HA 133 0.358 1
120 1 20 1 "RMS(OBS, PRED)" N 107 2.576 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 4.458 4.702 -0.244 2
1 3 . 1 1 A 6 6 SER C C 6 175.108 174.179 0.929 2
1 4 . 1 1 A 6 6 SER CA C 6 58.689 58.197 0.492 2
1 5 . 1 1 A 6 6 SER CB C 6 63.678 64.066 -0.388 2
1 6 . 1 1 A 7 7 GLY H H 7 8.449 8.317 0.132 2
1 7 . 1 1 A 7 7 GLY HA2 H 7 3.965 4.092 -0.127 2
1 8 . 1 1 A 7 7 GLY HA3 H 7 3.965 4.094 -0.129 2
1 9 . 1 1 A 7 7 GLY C C 7 174.380 173.623 0.757 2
1 10 . 1 1 A 7 7 GLY CA C 7 45.435 45.548 -0.113 2
1 11 . 1 1 A 7 7 GLY N N 7 110.792 110.552 0.240 2
1 12 . 1 1 A 8 8 MET H H 8 8.259 8.450 -0.191 2
1 13 . 1 1 A 8 8 MET HA H 8 4.487 4.567 -0.080 2
1 21 . 1 1 A 8 8 MET C C 8 176.961 176.062 0.899 2
1 22 . 1 1 A 8 8 MET CA C 8 55.565 55.711 -0.146 2
1 23 . 1 1 A 8 8 MET CB C 8 32.835 33.116 -0.281 2
1 26 . 1 1 A 8 8 MET N N 8 119.639 121.595 -1.956 2
1 27 . 1 1 A 9 9 GLY H H 9 8.472 8.328 0.144 2
1 28 . 1 1 A 9 9 GLY HA2 H 9 3.946 4.069 -0.123 2
1 29 . 1 1 A 9 9 GLY HA3 H 9 3.946 4.076 -0.130 2
1 30 . 1 1 A 9 9 GLY C C 9 174.005 173.333 0.672 2
1 31 . 1 1 A 9 9 GLY CA C 9 45.488 45.371 0.117 2
1 32 . 1 1 A 9 9 GLY N N 9 110.107 109.787 0.320 2
1 33 . 1 1 A 10 10 ASP H H 10 8.292 8.545 -0.253 2
1 34 . 1 1 A 10 10 ASP HA H 10 4.636 4.910 -0.274 2
1 37 . 1 1 A 10 10 ASP C C 10 176.768 175.957 0.811 2
1 38 . 1 1 A 10 10 ASP CA C 10 54.206 54.297 -0.091 2
1 39 . 1 1 A 10 10 ASP CB C 10 41.306 41.842 -0.536 2
1 40 . 1 1 A 10 10 ASP N N 10 120.370 121.524 -1.154 2
1 41 . 1 1 A 11 11 GLY H H 11 8.452 8.262 0.190 2
1 42 . 1 1 A 11 11 GLY HA2 H 11 3.980 4.133 -0.153 2
1 43 . 1 1 A 11 11 GLY HA3 H 11 4.022 4.165 -0.143 2
1 44 . 1 1 A 11 11 GLY C C 11 174.102 173.656 0.446 2
1 45 . 1 1 A 11 11 GLY CA C 11 45.170 45.769 -0.599 2
1 46 . 1 1 A 11 11 GLY N N 11 108.391 109.219 -0.828 2
1 47 . 1 1 A 12 12 ALA H H 12 8.293 8.163 0.130 2
1 48 . 1 1 A 12 12 ALA HA H 12 3.777 4.284 -0.507 2
1 52 . 1 1 A 12 12 ALA C C 12 178.193 178.223 -0.030 2
1 53 . 1 1 A 12 12 ALA CA C 12 52.759 52.112 0.647 2
1 54 . 1 1 A 12 12 ALA CB C 12 17.855 19.103 -1.248 2
1 55 . 1 1 A 12 12 ALA N N 12 124.185 124.918 -0.733 2
1 56 . 1 1 A 13 13 VAL H H 13 8.822 8.400 0.422 2
1 57 . 1 1 A 13 13 VAL HA H 13 3.912 3.723 0.189 2
1 65 . 1 1 A 13 13 VAL C C 13 176.073 175.792 0.281 2
1 66 . 1 1 A 13 13 VAL CA C 13 63.100 66.150 -3.050 2
1 67 . 1 1 A 13 13 VAL CB C 13 32.711 31.886 0.825 2
1 70 . 1 1 A 13 13 VAL N N 13 120.877 124.350 -3.473 2
1 71 . 1 1 A 14 14 LYS H H 14 7.093 7.347 -0.254 2
1 72 . 1 1 A 14 14 LYS HA H 14 4.169 4.672 -0.503 2
1 81 . 1 1 A 14 14 LYS C C 14 173.291 174.190 -0.899 2
1 82 . 1 1 A 14 14 LYS CA C 14 56.465 55.165 1.300 2
1 83 . 1 1 A 14 14 LYS CB C 14 35.960 35.565 0.395 2
1 87 . 1 1 A 14 14 LYS N N 14 118.693 119.173 -0.480 2
1 88 . 1 1 A 15 15 GLN H H 15 8.522 8.496 0.026 2
1 89 . 1 1 A 15 15 GLN HA H 15 5.542 5.187 0.355 2
1 96 . 1 1 A 15 15 GLN C C 15 174.992 175.624 -0.632 2
1 97 . 1 1 A 15 15 GLN CA C 15 54.312 54.046 0.266 2
1 98 . 1 1 A 15 15 GLN CB C 15 33.585 31.891 1.694 2
1 100 . 1 1 A 15 15 GLN N N 15 124.024 124.553 -0.529 2
1 102 . 1 1 A 16 16 GLY H H 16 8.740 8.046 0.694 2
1 103 . 1 1 A 16 16 GLY HA2 H 16 4.511 3.951 0.560 2
1 104 . 1 1 A 16 16 GLY HA3 H 16 4.064 4.373 -0.309 2
1 105 . 1 1 A 16 16 GLY C C 16 171.431 171.339 0.092 2
1 106 . 1 1 A 16 16 GLY CA C 16 46.106 45.829 0.277 2
1 107 . 1 1 A 16 16 GLY N N 16 109.611 108.955 0.656 2
1 108 . 1 1 A 17 17 PHE H H 17 8.886 8.419 0.467 2
1 109 . 1 1 A 17 17 PHE HA H 17 5.466 5.127 0.339 2
1 114 . 1 1 A 17 17 PHE C C 17 174.795 174.869 -0.073 2
1 115 . 1 1 A 17 17 PHE CA C 17 57.788 56.658 1.130 2
1 116 . 1 1 A 17 17 PHE CB C 17 41.315 41.294 0.021 2
1 119 . 1 1 A 17 17 PHE N N 17 122.684 119.441 3.243 2
1 120 . 1 1 A 18 18 LEU H H 18 8.762 8.759 0.003 2
1 121 . 1 1 A 18 18 LEU HA H 18 4.946 4.724 0.222 2
1 131 . 1 1 A 18 18 LEU C C 18 175.461 175.156 0.305 2
1 132 . 1 1 A 18 18 LEU CA C 18 52.970 53.168 -0.198 2
1 133 . 1 1 A 18 18 LEU CB C 18 47.945 44.758 3.187 2
1 137 . 1 1 A 18 18 LEU N N 18 119.045 123.737 -4.692 2
1 138 . 1 1 A 19 19 TYR H H 19 9.272 8.251 1.021 2
1 139 . 1 1 A 19 19 TYR HA H 19 5.682 5.526 0.156 2
1 146 . 1 1 A 19 19 TYR C C 19 174.829 174.586 0.243 2
1 147 . 1 1 A 19 19 TYR CA C 19 56.482 56.582 -0.100 2
1 148 . 1 1 A 19 19 TYR CB C 19 41.717 40.976 0.741 2
1 153 . 1 1 A 19 19 TYR N N 19 118.024 121.476 -3.452 2
1 154 . 1 1 A 20 20 LEU H H 20 9.441 9.010 0.431 2
1 155 . 1 1 A 20 20 LEU HA H 20 5.283 5.293 -0.010 2
1 165 . 1 1 A 20 20 LEU C C 20 175.935 175.502 0.433 2
1 166 . 1 1 A 20 20 LEU CA C 20 53.464 53.830 -0.366 2
1 167 . 1 1 A 20 20 LEU CB C 20 46.570 45.749 0.821 2
1 171 . 1 1 A 20 20 LEU N N 20 122.838 125.364 -2.526 2
1 172 . 1 1 A 21 21 GLN H H 21 8.391 8.609 -0.218 2
1 173 . 1 1 A 21 21 GLN HA H 21 3.791 4.188 -0.397 2
1 180 . 1 1 A 21 21 GLN C C 21 175.157 174.756 0.401 2
1 181 . 1 1 A 21 21 GLN CA C 21 56.094 55.484 0.610 2
1 182 . 1 1 A 21 21 GLN CB C 21 28.434 28.872 -0.438 2
1 184 . 1 1 A 21 21 GLN N N 21 129.943 127.696 2.247 2
1 186 . 1 1 A 22 22 GLN H H 22 8.829 8.449 0.380 2
1 187 . 1 1 A 22 22 GLN HA H 22 4.553 4.811 -0.258 2
1 194 . 1 1 A 22 22 GLN C C 22 174.998 175.099 -0.101 2
1 195 . 1 1 A 22 22 GLN CA C 22 54.912 54.387 0.525 2
1 196 . 1 1 A 22 22 GLN CB C 22 31.930 30.969 0.961 2
1 198 . 1 1 A 22 22 GLN N N 22 127.199 125.380 1.819 2
1 200 . 1 1 A 23 23 GLN HA H 23 4.142 4.445 -0.303 2
1 207 . 1 1 A 23 23 GLN CA C 23 56.427 55.813 0.614 2
1 208 . 1 1 A 23 23 GLN CB C 23 29.227 29.344 -0.117 2
1 211 . 1 1 A 24 24 GLN HA H 24 4.523 4.248 0.275 2
1 218 . 1 1 A 24 24 GLN CB C 24 29.759 29.722 0.037 2
1 221 . 1 1 A 25 25 THR HA H 25 3.870 4.318 -0.448 2
1 226 . 1 1 A 25 25 THR CA C 25 65.096 62.627 2.469 2
1 227 . 1 1 A 25 25 THR CB C 25 68.924 70.044 -1.120 2
1 229 . 1 1 A 26 26 PHE HA H 26 4.690 4.405 0.285 2
1 236 . 1 1 A 26 26 PHE C C 26 175.523 175.787 -0.264 2
1 237 . 1 1 A 26 26 PHE CA C 26 57.312 58.418 -1.106 2
1 238 . 1 1 A 26 26 PHE CB C 26 39.003 39.509 -0.506 2
1 243 . 1 1 A 27 27 GLY H H 27 7.755 8.517 -0.762 2
1 244 . 1 1 A 27 27 GLY HA2 H 27 4.172 3.902 0.270 2
1 245 . 1 1 A 27 27 GLY HA3 H 27 3.783 3.986 -0.203 2
1 246 . 1 1 A 27 27 GLY C C 27 172.557 173.581 -1.024 2
1 247 . 1 1 A 27 27 GLY CA C 27 44.924 45.409 -0.485 2
1 248 . 1 1 A 27 27 GLY N N 27 109.216 109.341 -0.125 2
1 249 . 1 1 A 28 28 LYS H H 28 8.241 8.167 0.074 2
1 250 . 1 1 A 28 28 LYS HA H 28 4.530 4.486 0.044 2
1 259 . 1 1 A 28 28 LYS C C 28 176.204 175.118 1.086 2
1 260 . 1 1 A 28 28 LYS CA C 28 55.741 55.927 -0.186 2
1 261 . 1 1 A 28 28 LYS CB C 28 33.904 32.566 1.338 2
1 265 . 1 1 A 28 28 LYS N N 28 118.743 119.353 -0.610 2
1 266 . 1 1 A 29 29 LYS H H 29 8.356 8.234 0.122 2
1 267 . 1 1 A 29 29 LYS HA H 29 4.559 4.757 -0.198 2
1 274 . 1 1 A 29 29 LYS C C 29 175.420 175.279 0.141 2
1 275 . 1 1 A 29 29 LYS CA C 29 55.406 54.596 0.810 2
1 276 . 1 1 A 29 29 LYS CB C 29 35.618 36.027 -0.409 2
1 280 . 1 1 A 29 29 LYS N N 29 121.198 121.785 -0.587 2
1 281 . 1 1 A 30 30 TRP H H 30 8.891 8.638 0.253 2
1 282 . 1 1 A 30 30 TRP HA H 30 4.951 4.881 0.070 2
1 291 . 1 1 A 30 30 TRP C C 30 175.902 176.236 -0.334 2
1 292 . 1 1 A 30 30 TRP CA C 30 56.677 57.554 -0.877 2
1 293 . 1 1 A 30 30 TRP CB C 30 30.614 30.501 0.113 2
1 299 . 1 1 A 30 30 TRP N N 30 123.304 122.742 0.562 2
1 301 . 1 1 A 31 31 ARG H H 31 8.712 8.999 -0.287 2
1 302 . 1 1 A 31 31 ARG HA H 31 4.820 4.860 -0.040 2
1 309 . 1 1 A 31 31 ARG C C 31 174.026 174.674 -0.648 2
1 310 . 1 1 A 31 31 ARG CA C 31 54.895 54.063 0.832 2
1 311 . 1 1 A 31 31 ARG CB C 31 34.045 33.399 0.646 2
1 314 . 1 1 A 31 31 ARG N N 31 123.973 122.555 1.418 2
1 315 . 1 1 A 32 32 ARG H H 32 8.820 8.441 0.379 2
1 316 . 1 1 A 32 32 ARG HA H 32 3.965 4.861 -0.896 2
1 323 . 1 1 A 32 32 ARG C C 32 174.785 174.835 -0.050 2
1 324 . 1 1 A 32 32 ARG CA C 32 56.924 55.546 1.378 2
1 325 . 1 1 A 32 32 ARG CB C 32 31.806 31.645 0.161 2
1 328 . 1 1 A 32 32 ARG N N 32 127.041 123.857 3.184 2
1 329 . 1 1 A 33 33 PHE H H 33 9.372 8.704 0.667 2
1 330 . 1 1 A 33 33 PHE HA H 33 4.863 5.028 -0.165 2
1 338 . 1 1 A 33 33 PHE C C 33 176.359 175.353 1.006 2
1 339 . 1 1 A 33 33 PHE CA C 33 57.224 56.539 0.684 2
1 340 . 1 1 A 33 33 PHE CB C 33 43.385 42.339 1.046 2
1 346 . 1 1 A 33 33 PHE N N 33 125.882 122.472 3.410 2
1 347 . 1 1 A 34 34 GLY H H 34 9.160 8.798 0.362 2
1 348 . 1 1 A 34 34 GLY HA2 H 34 4.182 4.108 0.074 2
1 349 . 1 1 A 34 34 GLY HA3 H 34 3.714 4.194 -0.480 2
1 350 . 1 1 A 34 34 GLY C C 34 172.920 173.110 -0.190 2
1 351 . 1 1 A 34 34 GLY CA C 34 46.247 46.075 0.172 2
1 352 . 1 1 A 34 34 GLY N N 34 108.654 111.188 -2.534 2
1 353 . 1 1 A 35 35 ALA H H 35 8.982 8.428 0.553 2
1 354 . 1 1 A 35 35 ALA HA H 35 5.660 5.480 0.180 2
1 358 . 1 1 A 35 35 ALA C C 35 176.547 176.065 0.482 2
1 359 . 1 1 A 35 35 ALA CA C 35 50.500 50.463 0.037 2
1 360 . 1 1 A 35 35 ALA CB C 35 24.034 21.291 2.743 2
1 361 . 1 1 A 35 35 ALA N N 35 130.076 128.028 2.048 2
1 362 . 1 1 A 36 36 SER H H 36 8.852 8.573 0.279 2
1 363 . 1 1 A 36 36 SER HA H 36 5.203 5.033 0.170 2
1 366 . 1 1 A 36 36 SER C C 36 170.939 172.391 -1.452 2
1 367 . 1 1 A 36 36 SER CA C 36 57.806 57.255 0.551 2
1 368 . 1 1 A 36 36 SER CB C 36 66.986 65.219 1.767 2
1 369 . 1 1 A 36 36 SER N N 36 116.620 117.867 -1.247 2
1 370 . 1 1 A 37 37 LEU H H 37 8.862 8.749 0.113 2
1 371 . 1 1 A 37 37 LEU HA H 37 5.163 4.886 0.278 2
1 381 . 1 1 A 37 37 LEU C C 37 173.525 174.120 -0.595 2
1 382 . 1 1 A 37 37 LEU CA C 37 53.112 53.472 -0.360 2
1 383 . 1 1 A 37 37 LEU CB C 37 46.077 43.607 2.470 2
1 387 . 1 1 A 37 37 LEU N N 37 127.638 128.846 -1.208 2
1 388 . 1 1 A 38 38 TYR H H 38 9.280 8.687 0.593 2
1 389 . 1 1 A 38 38 TYR HA H 38 4.820 5.311 -0.491 2
1 396 . 1 1 A 38 38 TYR C C 38 175.430 175.361 0.069 2
1 397 . 1 1 A 38 38 TYR CA C 38 57.436 56.157 1.279 2
1 398 . 1 1 A 38 38 TYR CB C 38 42.128 41.442 0.686 2
1 403 . 1 1 A 38 38 TYR N N 38 125.215 126.789 -1.574 2
1 404 . 1 1 A 39 39 GLY H H 39 8.532 8.517 0.015 2
1 405 . 1 1 A 39 39 GLY HA2 H 39 4.220 4.204 0.016 2
1 406 . 1 1 A 39 39 GLY HA3 H 39 3.941 4.208 -0.267 2
1 407 . 1 1 A 39 39 GLY C C 39 172.950 173.435 -0.485 2
1 408 . 1 1 A 39 39 GLY CA C 39 44.817 44.764 0.053 2
1 409 . 1 1 A 39 39 GLY N N 39 106.424 109.961 -3.537 2
1 410 . 1 1 A 40 40 GLY H H 40 8.477 8.517 -0.040 2
1 411 . 1 1 A 40 40 GLY HA2 H 40 4.102 4.046 0.056 2
1 412 . 1 1 A 40 40 GLY HA3 H 40 3.927 4.049 -0.122 2
1 413 . 1 1 A 40 40 GLY C C 40 174.002 174.083 -0.081 2
1 414 . 1 1 A 40 40 GLY CA C 40 44.694 45.961 -1.267 2
1 415 . 1 1 A 40 40 GLY N N 40 106.881 108.652 -1.771 2
1 416 . 1 1 A 41 41 SER H H 41 8.600 8.257 0.343 2
1 417 . 1 1 A 41 41 SER HA H 41 4.520 4.512 0.008 2
1 420 . 1 1 A 41 41 SER C C 41 174.355 174.140 0.215 2
1 421 . 1 1 A 41 41 SER CA C 41 58.565 59.076 -0.511 2
1 422 . 1 1 A 41 41 SER CB C 41 64.413 64.222 0.191 2
1 423 . 1 1 A 41 41 SER N N 41 115.751 116.087 -0.336 2
1 424 . 1 1 A 42 42 ASP H H 42 8.533 8.486 0.047 2
1 425 . 1 1 A 42 42 ASP HA H 42 4.560 4.578 -0.018 2
1 428 . 1 1 A 42 42 ASP CA C 42 55.230 54.914 0.316 2
1 429 . 1 1 A 42 42 ASP CB C 42 40.648 40.750 -0.102 2
1 430 . 1 1 A 42 42 ASP N N 42 119.037 121.415 -2.378 2
1 431 . 1 1 A 43 43 CYS H H 43 8.152 8.334 -0.182 2
1 432 . 1 1 A 43 43 CYS HA H 43 4.541 4.401 0.140 2
1 435 . 1 1 A 43 43 CYS C C 43 173.975 174.250 -0.275 2
1 436 . 1 1 A 43 43 CYS CA C 43 58.265 59.683 -1.418 2
1 437 . 1 1 A 43 43 CYS CB C 43 28.393 27.939 0.454 2
1 438 . 1 1 A 43 43 CYS N N 43 116.881 118.888 -2.007 2
1 439 . 1 1 A 44 44 ALA H H 44 8.047 7.969 0.078 2
1 440 . 1 1 A 44 44 ALA HA H 44 4.395 4.618 -0.223 2
1 444 . 1 1 A 44 44 ALA C C 44 176.472 176.597 -0.125 2
1 445 . 1 1 A 44 44 ALA CA C 44 52.688 51.621 1.067 2
1 446 . 1 1 A 44 44 ALA CB C 44 20.579 20.925 -0.346 2
1 447 . 1 1 A 44 44 ALA N N 44 125.989 123.173 2.816 2
1 448 . 1 1 A 45 45 LEU H H 45 8.052 8.241 -0.189 2
1 449 . 1 1 A 45 45 LEU HA H 45 4.452 4.651 -0.199 2
1 459 . 1 1 A 45 45 LEU C C 45 176.196 176.040 0.156 2
1 460 . 1 1 A 45 45 LEU CA C 45 53.771 54.265 -0.494 2
1 461 . 1 1 A 45 45 LEU CB C 45 43.116 43.018 0.098 2
1 465 . 1 1 A 45 45 LEU N N 45 119.889 120.452 -0.563 2
1 466 . 1 1 A 46 46 ALA H H 46 8.381 8.393 -0.012 2
1 467 . 1 1 A 46 46 ALA HA H 46 4.449 5.232 -0.783 2
1 471 . 1 1 A 46 46 ALA C C 46 179.093 176.503 2.590 2
1 472 . 1 1 A 46 46 ALA CA C 46 52.829 51.422 1.407 2
1 473 . 1 1 A 46 46 ALA CB C 46 18.687 20.914 -2.227 2
1 474 . 1 1 A 46 46 ALA N N 46 125.635 125.484 0.151 2
1 475 . 1 1 A 47 47 ARG H H 47 9.012 8.773 0.239 2
1 476 . 1 1 A 47 47 ARG HA H 47 5.192 5.117 0.074 2
1 484 . 1 1 A 47 47 ARG C C 47 171.524 173.944 -2.420 2
1 485 . 1 1 A 47 47 ARG CA C 47 55.265 54.827 0.438 2
1 486 . 1 1 A 47 47 ARG CB C 47 30.970 33.921 -2.951 2
1 489 . 1 1 A 47 47 ARG N N 47 120.048 119.669 0.379 2
1 491 . 1 1 A 48 48 LEU H H 48 9.029 8.630 0.399 2
1 492 . 1 1 A 48 48 LEU HA H 48 5.221 5.030 0.191 2
1 502 . 1 1 A 48 48 LEU C C 48 174.348 175.207 -0.859 2
1 503 . 1 1 A 48 48 LEU CA C 48 53.253 53.944 -0.691 2
1 504 . 1 1 A 48 48 LEU CB C 48 45.419 43.992 1.427 2
1 508 . 1 1 A 48 48 LEU N N 48 123.315 123.781 -0.466 2
1 509 . 1 1 A 49 49 GLU H H 49 9.473 8.624 0.849 2
1 510 . 1 1 A 49 49 GLU HA H 49 5.222 4.952 0.270 2
1 515 . 1 1 A 49 49 GLU C C 49 175.507 175.610 -0.103 2
1 516 . 1 1 A 49 49 GLU CA C 49 55.159 55.532 -0.373 2
1 517 . 1 1 A 49 49 GLU CB C 49 32.341 31.793 0.548 2
1 519 . 1 1 A 49 49 GLU N N 49 124.751 126.886 -2.135 2
1 520 . 1 1 A 50 50 LEU H H 50 9.088 8.607 0.481 2
1 521 . 1 1 A 50 50 LEU HA H 50 5.382 5.269 0.113 2
1 531 . 1 1 A 50 50 LEU C C 50 175.474 175.562 -0.088 2
1 532 . 1 1 A 50 50 LEU CA C 50 52.865 53.601 -0.736 2
1 533 . 1 1 A 50 50 LEU CB C 50 43.239 45.838 -2.599 2
1 537 . 1 1 A 50 50 LEU N N 50 124.221 122.861 1.360 2
1 538 . 1 1 A 51 51 GLN H H 51 9.602 8.740 0.862 2
1 539 . 1 1 A 51 51 GLN HA H 51 5.095 5.030 0.065 2
1 546 . 1 1 A 51 51 GLN C C 51 175.306 174.831 0.475 2
1 547 . 1 1 A 51 51 GLN CA C 51 54.576 54.307 0.269 2
1 548 . 1 1 A 51 51 GLN CB C 51 32.177 31.839 0.338 2
1 550 . 1 1 A 51 51 GLN N N 51 123.268 121.601 1.667 2
1 552 . 1 1 A 52 52 GLU H H 52 9.172 8.954 0.218 2
1 553 . 1 1 A 52 52 GLU HA H 52 4.092 4.708 -0.616 2
1 558 . 1 1 A 52 52 GLU C C 52 176.523 176.450 0.073 2
1 559 . 1 1 A 52 52 GLU CA C 52 57.500 56.550 0.950 2
1 560 . 1 1 A 52 52 GLU CB C 52 30.696 31.127 -0.431 2
1 562 . 1 1 A 52 52 GLU N N 52 128.982 123.944 5.038 2
1 563 . 1 1 A 53 53 GLY H H 53 8.644 8.431 0.213 2
1 564 . 1 1 A 53 53 GLY HA2 H 53 4.261 4.157 0.104 2
1 565 . 1 1 A 53 53 GLY HA3 H 53 3.993 4.175 -0.182 2
1 566 . 1 1 A 53 53 GLY C C 53 172.550 174.019 -1.469 2
1 567 . 1 1 A 53 53 GLY CA C 53 45.911 46.297 -0.386 2
1 568 . 1 1 A 53 53 GLY N N 53 110.844 110.757 0.087 2
1 569 . 1 1 A 54 54 PRO HA H 54 4.392 4.567 -0.175 2
1 576 . 1 1 A 54 54 PRO C C 54 176.828 176.750 0.078 2
1 577 . 1 1 A 54 54 PRO CA C 54 63.665 63.641 0.024 2
1 578 . 1 1 A 54 54 PRO CB C 54 32.012 32.271 -0.259 2
1 581 . 1 1 A 55 55 GLU H H 55 8.934 8.430 0.504 2
1 582 . 1 1 A 55 55 GLU HA H 55 4.193 4.434 -0.241 2
1 587 . 1 1 A 55 55 GLU C C 55 176.189 175.936 0.253 2
1 588 . 1 1 A 55 55 GLU CA C 55 57.383 56.917 0.466 2
1 589 . 1 1 A 55 55 GLU CB C 55 28.945 30.556 -1.611 2
1 591 . 1 1 A 55 55 GLU N N 55 120.312 118.897 1.416 2
1 592 . 1 1 A 56 56 LYS H H 56 7.937 8.091 -0.154 2
1 593 . 1 1 A 56 56 LYS HA H 56 4.578 4.644 -0.066 2
1 602 . 1 1 A 56 56 LYS C C 56 174.295 175.310 -1.015 2
1 603 . 1 1 A 56 56 LYS CA C 56 54.171 53.937 0.234 2
1 604 . 1 1 A 56 56 LYS CB C 56 32.555 33.838 -1.283 2
1 608 . 1 1 A 56 56 LYS N N 56 122.008 120.179 1.829 2
1 609 . 1 1 A 57 57 PRO HA H 57 4.370 4.534 -0.164 2
1 616 . 1 1 A 57 57 PRO CA C 57 63.431 63.683 -0.252 2
1 617 . 1 1 A 57 57 PRO CB C 57 32.072 31.669 0.403 2
1 620 . 1 1 A 58 58 ARG H H 58 8.310 8.372 -0.062 2
1 621 . 1 1 A 58 58 ARG HA H 58 4.295 4.393 -0.098 2
1 628 . 1 1 A 58 58 ARG CA C 58 56.570 56.474 0.096 2
1 629 . 1 1 A 58 58 ARG CB C 58 30.860 31.207 -0.347 2
1 632 . 1 1 A 58 58 ARG N N 58 120.045 119.482 0.563 2
1 633 . 1 1 A 60 60 CYS HA H 60 4.482 4.697 -0.215 2
1 636 . 1 1 A 60 60 CYS CA C 60 58.621 58.952 -0.331 2
1 637 . 1 1 A 60 60 CYS CB C 60 28.267 29.166 -0.899 2
1 638 . 1 1 A 61 61 GLU HA H 61 4.226 4.447 -0.222 2
1 643 . 1 1 A 61 61 GLU C C 61 176.299 175.710 0.589 2
1 644 . 1 1 A 61 61 GLU CA C 61 57.100 56.159 0.941 2
1 645 . 1 1 A 61 61 GLU CB C 61 29.873 30.214 -0.341 2
1 647 . 1 1 A 62 62 ALA H H 62 8.282 8.161 0.121 2
1 648 . 1 1 A 62 62 ALA HA H 62 4.302 4.552 -0.250 2
1 652 . 1 1 A 62 62 ALA C C 62 177.277 176.469 0.808 2
1 653 . 1 1 A 62 62 ALA CA C 62 52.512 51.936 0.576 2
1 654 . 1 1 A 62 62 ALA CB C 62 19.592 20.407 -0.815 2
1 655 . 1 1 A 62 62 ALA N N 62 124.386 124.353 0.033 2
1 656 . 1 1 A 63 63 ALA H H 63 8.399 8.300 0.099 2
1 657 . 1 1 A 63 63 ALA HA H 63 4.375 4.591 -0.216 2
1 661 . 1 1 A 63 63 ALA C C 63 176.843 176.369 0.474 2
1 662 . 1 1 A 63 63 ALA CA C 63 52.658 51.588 1.070 2
1 663 . 1 1 A 63 63 ALA CB C 63 19.592 20.131 -0.539 2
1 664 . 1 1 A 63 63 ALA N N 63 123.892 123.093 0.799 2
1 665 . 1 1 A 64 64 ARG H H 64 8.152 8.574 -0.422 2
1 666 . 1 1 A 64 64 ARG HA H 64 5.008 4.893 0.115 2
1 673 . 1 1 A 64 64 ARG C C 64 175.594 174.726 0.868 2
1 674 . 1 1 A 64 64 ARG CA C 64 55.282 54.938 0.344 2
1 675 . 1 1 A 64 64 ARG CB C 64 32.506 32.765 -0.259 2
1 678 . 1 1 A 64 64 ARG N N 64 119.787 121.238 -1.451 2
1 679 . 1 1 A 65 65 LYS H H 65 8.945 8.670 0.275 2
1 680 . 1 1 A 65 65 LYS HA H 65 4.602 4.960 -0.358 2
1 689 . 1 1 A 65 65 LYS C C 65 174.657 174.619 0.038 2
1 690 . 1 1 A 65 65 LYS CA C 65 54.948 54.901 0.047 2
1 691 . 1 1 A 65 65 LYS CB C 65 34.068 34.429 -0.361 2
1 695 . 1 1 A 65 65 LYS N N 65 124.171 124.034 0.137 2
1 696 . 1 1 A 66 66 VAL H H 66 8.672 8.925 -0.253 2
1 697 . 1 1 A 66 66 VAL HA H 66 4.532 5.153 -0.621 2
1 705 . 1 1 A 66 66 VAL C C 66 175.078 173.877 1.201 2
1 706 . 1 1 A 66 66 VAL CA C 66 61.865 59.851 2.014 2
1 707 . 1 1 A 66 66 VAL CB C 66 33.835 34.791 -0.956 2
1 710 . 1 1 A 66 66 VAL N N 66 124.380 124.607 -0.227 2
1 711 . 1 1 A 67 67 ILE H H 67 9.071 9.157 -0.086 2
1 712 . 1 1 A 67 67 ILE HA H 67 4.142 4.634 -0.492 2
1 722 . 1 1 A 67 67 ILE C C 67 175.819 175.638 0.181 2
1 723 . 1 1 A 67 67 ILE CA C 67 60.383 60.426 -0.043 2
1 724 . 1 1 A 67 67 ILE CB C 67 39.908 38.753 1.155 2
1 728 . 1 1 A 67 67 ILE N N 67 129.537 129.151 0.386 2
1 729 . 1 1 A 68 68 ARG H H 68 9.203 8.668 0.535 2
1 730 . 1 1 A 68 68 ARG HA H 68 4.198 4.280 -0.082 2
1 737 . 1 1 A 68 68 ARG C C 68 177.769 177.148 0.621 2
1 738 . 1 1 A 68 68 ARG CA C 68 56.835 56.830 0.005 2
1 739 . 1 1 A 68 68 ARG CB C 68 29.832 30.587 -0.755 2
1 742 . 1 1 A 68 68 ARG N N 68 128.484 128.153 0.331 2
1 743 . 1 1 A 69 69 LEU H H 69 8.212 8.599 -0.387 2
1 744 . 1 1 A 69 69 LEU HA H 69 4.221 4.093 0.128 2
1 754 . 1 1 A 69 69 LEU C C 69 178.996 178.638 0.358 2
1 755 . 1 1 A 69 69 LEU CA C 69 57.136 57.272 -0.136 2
1 756 . 1 1 A 69 69 LEU CB C 69 39.455 41.469 -2.014 2
1 760 . 1 1 A 69 69 LEU N N 69 123.807 123.965 -0.158 2
1 761 . 1 1 A 70 70 SER H H 70 8.823 8.036 0.787 2
1 762 . 1 1 A 70 70 SER HA H 70 4.331 4.141 0.190 2
1 765 . 1 1 A 70 70 SER C C 70 175.076 176.033 -0.957 2
1 766 . 1 1 A 70 70 SER CA C 70 60.329 61.106 -0.777 2
1 767 . 1 1 A 70 70 SER CB C 70 62.362 63.009 -0.647 2
1 768 . 1 1 A 70 70 SER N N 70 115.162 114.230 0.932 2
1 769 . 1 1 A 71 71 ASP H H 71 7.602 7.979 -0.377 2
1 770 . 1 1 A 71 71 ASP HA H 71 4.820 4.471 0.349 2
1 773 . 1 1 A 71 71 ASP C C 71 176.478 176.826 -0.348 2
1 774 . 1 1 A 71 71 ASP CA C 71 54.241 56.222 -1.981 2
1 775 . 1 1 A 71 71 ASP CB C 71 41.347 40.963 0.384 2
1 776 . 1 1 A 71 71 ASP N N 71 119.590 120.031 -0.441 2
1 777 . 1 1 A 72 72 CYS H H 72 7.715 7.483 0.232 2
1 778 . 1 1 A 72 72 CYS HA H 72 4.372 4.599 -0.227 2
1 781 . 1 1 A 72 72 CYS C C 72 173.690 174.528 -0.838 2
1 782 . 1 1 A 72 72 CYS CA C 72 60.836 59.000 1.836 2
1 783 . 1 1 A 72 72 CYS CB C 72 27.655 27.336 0.319 2
1 784 . 1 1 A 72 72 CYS N N 72 118.346 117.858 0.488 2
1 785 . 1 1 A 73 73 LEU H H 73 9.472 8.942 0.530 2
1 786 . 1 1 A 73 73 LEU HA H 73 4.593 4.105 0.488 2
1 796 . 1 1 A 73 73 LEU C C 73 177.562 176.818 0.744 2
1 797 . 1 1 A 73 73 LEU CA C 73 55.724 57.176 -1.452 2
1 798 . 1 1 A 73 73 LEU CB C 73 43.774 42.265 1.509 2
1 802 . 1 1 A 73 73 LEU N N 73 124.752 128.744 -3.992 2
1 803 . 1 1 A 74 74 ARG H H 74 7.658 7.451 0.207 2
1 804 . 1 1 A 74 74 ARG HA H 74 4.592 5.094 -0.502 2
1 811 . 1 1 A 74 74 ARG C C 74 173.605 174.490 -0.885 2
1 812 . 1 1 A 74 74 ARG CA C 74 56.465 55.876 0.589 2
1 813 . 1 1 A 74 74 ARG CB C 74 34.068 33.945 0.123 2
1 816 . 1 1 A 74 74 ARG N N 74 115.565 115.970 -0.405 2
1 817 . 1 1 A 75 75 VAL H H 75 8.622 8.816 -0.194 2
1 818 . 1 1 A 75 75 VAL HA H 75 5.170 5.255 -0.085 2
1 826 . 1 1 A 75 75 VAL C C 75 173.985 174.407 -0.422 2
1 827 . 1 1 A 75 75 VAL CA C 75 60.930 59.615 1.315 2
1 828 . 1 1 A 75 75 VAL CB C 75 35.073 36.263 -1.190 2
1 831 . 1 1 A 75 75 VAL N N 75 124.278 119.179 5.099 2
1 832 . 1 1 A 76 76 ALA H H 76 8.272 8.833 -0.561 2
1 833 . 1 1 A 76 76 ALA HA H 76 4.648 4.997 -0.349 2
1 837 . 1 1 A 76 76 ALA C C 76 175.630 175.870 -0.240 2
1 838 . 1 1 A 76 76 ALA CA C 76 51.294 51.272 0.022 2
1 839 . 1 1 A 76 76 ALA CB C 76 22.759 23.790 -1.031 2
1 840 . 1 1 A 76 76 ALA N N 76 126.015 123.928 2.087 2
1 841 . 1 1 A 77 77 GLU H H 77 9.184 8.698 0.486 2
1 842 . 1 1 A 77 77 GLU HA H 77 4.060 5.146 -1.086 2
1 847 . 1 1 A 77 77 GLU C C 77 174.949 175.943 -0.994 2
1 848 . 1 1 A 77 77 GLU CA C 77 58.424 55.344 3.080 2
1 849 . 1 1 A 77 77 GLU CB C 77 30.161 31.645 -1.484 2
1 851 . 1 1 A 77 77 GLU N N 77 120.223 118.669 1.554 2
1 852 . 1 1 A 78 78 ALA H H 78 7.985 8.960 -0.975 2
1 853 . 1 1 A 78 78 ALA HA H 78 4.776 5.034 -0.258 2
1 857 . 1 1 A 78 78 ALA C C 78 177.250 177.279 -0.029 2
1 858 . 1 1 A 78 78 ALA CA C 78 50.888 51.316 -0.428 2
1 859 . 1 1 A 78 78 ALA CB C 78 20.851 21.115 -0.264 2
1 860 . 1 1 A 78 78 ALA N N 78 125.143 127.306 -2.163 2
1 861 . 1 1 A 79 79 GLY H H 79 8.604 8.563 0.041 2
1 862 . 1 1 A 79 79 GLY HA2 H 79 4.327 4.141 0.186 2
1 863 . 1 1 A 79 79 GLY HA3 H 79 3.963 4.151 -0.188 2
1 864 . 1 1 A 79 79 GLY C C 79 175.360 174.476 0.884 2
1 865 . 1 1 A 79 79 GLY CA C 79 44.925 45.487 -0.562 2
1 866 . 1 1 A 79 79 GLY N N 79 109.420 107.303 2.117 2
1 867 . 1 1 A 80 80 GLY H H 80 8.649 8.510 0.139 2
1 868 . 1 1 A 80 80 GLY HA2 H 80 3.962 3.943 0.019 2
1 869 . 1 1 A 80 80 GLY HA3 H 80 3.962 3.951 0.011 2
1 870 . 1 1 A 80 80 GLY C C 80 175.052 174.739 0.313 2
1 871 . 1 1 A 80 80 GLY CA C 80 45.955 46.456 -0.501 2
1 872 . 1 1 A 80 80 GLY N N 80 108.295 110.068 -1.773 2
1 873 . 1 1 A 81 81 GLU H H 81 8.921 8.380 0.541 2
1 874 . 1 1 A 81 81 GLU HA H 81 4.298 4.359 -0.061 2
1 879 . 1 1 A 81 81 GLU C C 81 176.532 176.351 0.181 2
1 880 . 1 1 A 81 81 GLU CA C 81 57.118 57.420 -0.302 2
1 881 . 1 1 A 81 81 GLU CB C 81 28.599 30.172 -1.573 2
1 883 . 1 1 A 81 81 GLU N N 81 121.170 121.288 -0.118 2
1 884 . 1 1 A 82 82 ALA H H 82 8.032 7.637 0.395 2
1 885 . 1 1 A 82 82 ALA HA H 82 4.371 4.449 -0.078 2
1 889 . 1 1 A 82 82 ALA C C 82 177.160 177.661 -0.501 2
1 890 . 1 1 A 82 82 ALA CA C 82 52.653 51.892 0.761 2
1 891 . 1 1 A 82 82 ALA CB C 82 19.304 21.066 -1.762 2
1 892 . 1 1 A 82 82 ALA N N 82 124.988 122.772 2.216 2
1 893 . 1 1 A 83 83 SER H H 83 8.319 8.920 -0.601 2
1 894 . 1 1 A 83 83 SER HA H 83 4.331 4.281 0.050 2
1 897 . 1 1 A 83 83 SER C C 83 174.045 175.028 -0.983 2
1 898 . 1 1 A 83 83 SER CA C 83 58.053 61.804 -3.751 2
1 899 . 1 1 A 83 83 SER CB C 83 63.184 62.940 0.244 2
1 900 . 1 1 A 83 83 SER N N 83 114.181 115.984 -1.803 2
1 901 . 1 1 A 84 84 SER H H 84 7.823 7.780 0.043 2
1 902 . 1 1 A 84 84 SER HA H 84 3.194 4.239 -1.045 2
1 905 . 1 1 A 84 84 SER C C 84 171.072 173.961 -2.889 2
1 906 . 1 1 A 84 84 SER CA C 84 57.206 57.016 0.190 2
1 907 . 1 1 A 84 84 SER CB C 84 61.622 63.252 -1.630 2
1 908 . 1 1 A 84 84 SER N N 84 117.302 114.863 2.439 2
1 909 . 1 1 A 85 85 PRO HA H 85 3.922 4.540 -0.619 2
1 916 . 1 1 A 85 85 PRO CA C 85 62.691 62.281 0.411 2
1 917 . 1 1 A 85 85 PRO CB C 85 31.515 32.757 -1.242 2
1 920 . 1 1 A 86 86 ARG HA H 86 3.882 4.190 -0.308 2
1 927 . 1 1 A 86 86 ARG C C 86 175.712 176.678 -0.966 2
1 928 . 1 1 A 86 86 ARG CA C 86 57.877 56.935 0.942 2
1 929 . 1 1 A 86 86 ARG CB C 86 29.791 30.732 -0.941 2
1 932 . 1 1 A 87 87 ASP H H 87 8.903 8.553 0.350 2
1 933 . 1 1 A 87 87 ASP HA H 87 4.342 4.382 -0.040 2
1 936 . 1 1 A 87 87 ASP C C 87 175.723 175.222 0.501 2
1 937 . 1 1 A 87 87 ASP CA C 87 56.377 55.064 1.313 2
1 938 . 1 1 A 87 87 ASP CB C 87 39.208 40.373 -1.165 2
1 939 . 1 1 A 87 87 ASP N N 87 117.520 120.961 -3.441 2
1 940 . 1 1 A 88 88 THR H H 88 7.776 7.493 0.283 2
1 941 . 1 1 A 88 88 THR HA H 88 5.101 5.089 0.012 2
1 946 . 1 1 A 88 88 THR C C 88 173.825 172.910 0.915 2
1 947 . 1 1 A 88 88 THR CA C 88 60.154 59.877 0.277 2
1 948 . 1 1 A 88 88 THR CB C 88 72.702 72.697 0.005 2
1 950 . 1 1 A 88 88 THR N N 88 108.770 109.446 -0.676 2
1 951 . 1 1 A 89 89 SER H H 89 9.006 9.220 -0.213 2
1 952 . 1 1 A 89 89 SER HA H 89 4.718 5.190 -0.472 2
1 955 . 1 1 A 89 89 SER C C 89 173.728 173.103 0.625 2
1 956 . 1 1 A 89 89 SER CA C 89 57.453 57.734 -0.281 2
1 957 . 1 1 A 89 89 SER CB C 89 65.611 65.567 0.044 2
1 958 . 1 1 A 89 89 SER N N 89 114.151 117.113 -2.962 2
1 959 . 1 1 A 90 90 ALA H H 90 9.001 8.793 0.208 2
1 960 . 1 1 A 90 90 ALA HA H 90 5.660 4.758 0.902 2
1 964 . 1 1 A 90 90 ALA C C 90 177.669 177.287 0.382 2
1 965 . 1 1 A 90 90 ALA CA C 90 51.670 51.788 -0.118 2
1 966 . 1 1 A 90 90 ALA CB C 90 22.265 20.245 2.020 2
1 967 . 1 1 A 90 90 ALA N N 90 126.177 128.908 -2.731 2
1 968 . 1 1 A 91 91 PHE H H 91 9.672 8.337 1.335 2
1 969 . 1 1 A 91 91 PHE HA H 91 5.039 5.574 -0.535 2
1 977 . 1 1 A 91 91 PHE C C 91 170.731 173.357 -2.626 2
1 978 . 1 1 A 91 91 PHE CA C 91 56.271 55.223 1.048 2
1 979 . 1 1 A 91 91 PHE CB C 91 41.553 42.148 -0.596 2
1 985 . 1 1 A 91 91 PHE N N 91 118.968 116.351 2.617 2
1 986 . 1 1 A 92 92 PHE H H 92 9.422 9.448 -0.026 2
1 987 . 1 1 A 92 92 PHE HA H 92 5.674 5.150 0.524 2
1 995 . 1 1 A 92 92 PHE C C 92 174.570 175.274 -0.704 2
1 996 . 1 1 A 92 92 PHE CA C 92 55.917 57.361 -1.444 2
1 997 . 1 1 A 92 92 PHE CB C 92 42.787 41.536 1.251 2
1 1003 . 1 1 A 92 92 PHE N N 92 117.543 118.169 -0.626 2
1 1004 . 1 1 A 93 93 LEU H H 93 9.021 8.755 0.266 2
1 1005 . 1 1 A 93 93 LEU HA H 93 5.122 5.006 0.116 2
1 1015 . 1 1 A 93 93 LEU C C 93 174.799 174.245 0.554 2
1 1016 . 1 1 A 93 93 LEU CA C 93 54.912 54.672 0.240 2
1 1017 . 1 1 A 93 93 LEU CB C 93 45.254 45.080 0.174 2
1 1021 . 1 1 A 93 93 LEU N N 93 121.719 122.244 -0.525 2
1 1022 . 1 1 A 94 94 GLU H H 94 9.294 9.332 -0.038 2
1 1023 . 1 1 A 94 94 GLU HA H 94 5.043 5.220 -0.177 2
1 1028 . 1 1 A 94 94 GLU C C 94 175.754 175.473 0.281 2
1 1029 . 1 1 A 94 94 GLU CA C 94 56.018 54.961 1.057 2
1 1030 . 1 1 A 94 94 GLU CB C 94 32.752 32.744 0.008 2
1 1032 . 1 1 A 94 94 GLU N N 94 127.032 128.621 -1.589 2
1 1033 . 1 1 A 95 95 THR H H 95 8.822 8.545 0.277 2
1 1034 . 1 1 A 95 95 THR HA H 95 5.398 5.125 0.273 2
1 1039 . 1 1 A 95 95 THR C C 95 173.860 175.465 -1.605 2
1 1040 . 1 1 A 95 95 THR CA C 95 59.588 59.544 0.044 2
1 1041 . 1 1 A 95 95 THR CB C 95 72.191 72.280 -0.089 2
1 1043 . 1 1 A 95 95 THR N N 95 118.685 117.898 0.787 2
1 1044 . 1 1 A 96 96 LYS H H 96 8.823 9.011 -0.188 2
1 1045 . 1 1 A 96 96 LYS HA H 96 4.022 3.969 0.053 2
1 1054 . 1 1 A 96 96 LYS C C 96 177.330 178.737 -1.407 2
1 1055 . 1 1 A 96 96 LYS CA C 96 59.588 59.953 -0.365 2
1 1056 . 1 1 A 96 96 LYS CB C 96 32.588 32.067 0.521 2
1 1060 . 1 1 A 96 96 LYS N N 96 118.801 122.035 -3.234 2
1 1061 . 1 1 A 97 97 GLU H H 97 8.092 7.787 0.305 2
1 1062 . 1 1 A 97 97 GLU HA H 97 4.282 4.228 0.054 2
1 1067 . 1 1 A 97 97 GLU C C 97 176.290 176.403 -0.113 2
1 1068 . 1 1 A 97 97 GLU CA C 97 57.365 58.768 -1.403 2
1 1069 . 1 1 A 97 97 GLU CB C 97 31.559 30.613 0.946 2
1 1071 . 1 1 A 97 97 GLU N N 97 113.992 118.804 -4.812 2
1 1072 . 1 1 A 98 98 ARG H H 98 7.482 7.178 0.304 2
1 1073 . 1 1 A 98 98 ARG HA H 98 4.397 4.570 -0.173 2
1 1080 . 1 1 A 98 98 ARG C C 98 172.792 173.129 -0.337 2
1 1081 . 1 1 A 98 98 ARG CA C 98 55.689 54.627 1.062 2
1 1082 . 1 1 A 98 98 ARG CB C 98 32.711 31.796 0.915 2
1 1085 . 1 1 A 98 98 ARG N N 98 116.022 114.127 1.895 2
1 1086 . 1 1 A 99 99 LEU H H 99 8.423 8.236 0.187 2
1 1087 . 1 1 A 99 99 LEU HA H 99 4.807 4.754 0.053 2
1 1097 . 1 1 A 99 99 LEU C C 99 175.903 174.082 1.821 2
1 1098 . 1 1 A 99 99 LEU CA C 99 54.383 53.766 0.617 2
1 1099 . 1 1 A 99 99 LEU CB C 99 43.362 43.968 -0.606 2
1 1103 . 1 1 A 99 99 LEU N N 99 124.983 121.771 3.212 2
1 1104 . 1 1 A 100 100 TYR H H 100 9.144 9.499 -0.355 2
1 1105 . 1 1 A 100 100 TYR HA H 100 4.542 5.183 -0.641 2
1 1112 . 1 1 A 100 100 TYR C C 100 173.479 174.456 -0.977 2
1 1113 . 1 1 A 100 100 TYR CA C 100 57.735 56.384 1.351 2
1 1114 . 1 1 A 100 100 TYR CB C 100 39.291 41.172 -1.881 2
1 1119 . 1 1 A 100 100 TYR N N 100 126.679 126.752 -0.073 2
1 1120 . 1 1 A 101 101 LEU H H 101 9.043 8.869 0.174 2
1 1121 . 1 1 A 101 101 LEU HA H 101 4.747 4.887 -0.140 2
1 1131 . 1 1 A 101 101 LEU C C 101 173.530 175.070 -1.540 2
1 1132 . 1 1 A 101 101 LEU CA C 101 54.524 53.715 0.809 2
1 1133 . 1 1 A 101 101 LEU CB C 101 42.499 43.922 -1.423 2
1 1137 . 1 1 A 101 101 LEU N N 101 127.422 125.541 1.881 2
1 1138 . 1 1 A 102 102 LEU H H 102 8.493 8.519 -0.026 2
1 1139 . 1 1 A 102 102 LEU HA H 102 5.612 5.470 0.142 2
1 1149 . 1 1 A 102 102 LEU C C 102 175.794 176.000 -0.206 2
1 1150 . 1 1 A 102 102 LEU CA C 102 53.076 53.252 -0.176 2
1 1151 . 1 1 A 102 102 LEU CB C 102 45.994 44.412 1.582 2
1 1155 . 1 1 A 102 102 LEU N N 102 126.021 128.631 -2.610 2
1 1156 . 1 1 A 103 103 ALA H H 103 9.073 8.915 0.158 2
1 1157 . 1 1 A 103 103 ALA HA H 103 5.081 5.340 -0.259 2
1 1161 . 1 1 A 103 103 ALA C C 103 175.133 175.891 -0.758 2
1 1162 . 1 1 A 103 103 ALA CA C 103 51.688 49.867 1.821 2
1 1163 . 1 1 A 103 103 ALA CB C 103 21.689 22.430 -0.740 2
1 1164 . 1 1 A 103 103 ALA N N 103 117.679 122.941 -5.262 2
1 1165 . 1 1 A 104 104 ALA H H 104 8.582 8.535 0.047 2
1 1166 . 1 1 A 104 104 ALA HA H 104 5.220 4.839 0.381 2
1 1170 . 1 1 A 104 104 ALA C C 104 173.471 174.188 -0.717 2
1 1171 . 1 1 A 104 104 ALA CA C 104 47.959 49.865 -1.906 2
1 1172 . 1 1 A 104 104 ALA CB C 104 21.359 22.391 -1.032 2
1 1173 . 1 1 A 104 104 ALA N N 104 123.419 121.425 1.994 2
1 1174 . 1 1 A 105 105 PRO HA H 105 4.542 4.773 -0.231 2
1 1181 . 1 1 A 105 105 PRO C C 105 178.409 177.924 0.485 2
1 1182 . 1 1 A 105 105 PRO CA C 105 64.301 62.838 1.463 2
1 1183 . 1 1 A 105 105 PRO CB C 105 32.094 31.648 0.446 2
1 1186 . 1 1 A 106 106 ALA H H 106 8.302 8.678 -0.376 2
1 1187 . 1 1 A 106 106 ALA HA H 106 4.022 4.029 -0.007 2
1 1191 . 1 1 A 106 106 ALA C C 106 179.641 179.662 -0.021 2
1 1192 . 1 1 A 106 106 ALA CA C 106 56.341 55.185 1.156 2
1 1193 . 1 1 A 106 106 ALA CB C 106 18.523 18.233 0.290 2
1 1194 . 1 1 A 106 106 ALA N N 106 127.733 128.051 -0.318 2
1 1195 . 1 1 A 107 107 ALA H H 107 9.035 8.159 0.876 2
1 1196 . 1 1 A 107 107 ALA HA H 107 4.331 4.032 0.299 2
1 1200 . 1 1 A 107 107 ALA C C 107 178.586 179.639 -1.053 2
1 1201 . 1 1 A 107 107 ALA CA C 107 53.765 55.268 -1.503 2
1 1202 . 1 1 A 107 107 ALA CB C 107 18.728 18.297 0.431 2
1 1203 . 1 1 A 107 107 ALA N N 107 118.203 119.981 -1.778 2
1 1204 . 1 1 A 108 108 GLU H H 108 8.399 8.109 0.290 2
1 1205 . 1 1 A 108 108 GLU HA H 108 4.631 4.163 0.468 2
1 1210 . 1 1 A 108 108 GLU C C 108 177.127 178.778 -1.651 2
1 1211 . 1 1 A 108 108 GLU CA C 108 55.847 58.612 -2.765 2
1 1212 . 1 1 A 108 108 GLU CB C 108 32.135 30.018 2.117 2
1 1214 . 1 1 A 108 108 GLU N N 108 114.661 117.960 -3.299 2
1 1215 . 1 1 A 109 109 ARG H H 109 7.412 8.642 -1.230 2
1 1216 . 1 1 A 109 109 ARG HA H 109 3.682 4.130 -0.449 2
1 1223 . 1 1 A 109 109 ARG C C 109 176.917 179.191 -2.274 2
1 1224 . 1 1 A 109 109 ARG CA C 109 61.600 59.810 1.790 2
1 1225 . 1 1 A 109 109 ARG CB C 109 28.845 30.333 -1.488 2
1 1228 . 1 1 A 109 109 ARG N N 109 120.954 121.005 -0.051 2
1 1229 . 1 1 A 110 110 GLY H H 110 8.833 8.306 0.527 2
1 1230 . 1 1 A 110 110 GLY HA2 H 110 3.872 3.798 0.074 2
1 1231 . 1 1 A 110 110 GLY HA3 H 110 3.685 3.812 -0.127 2
1 1232 . 1 1 A 110 110 GLY C C 110 175.997 175.686 0.311 2
1 1233 . 1 1 A 110 110 GLY CA C 110 47.323 47.528 -0.205 2
1 1234 . 1 1 A 110 110 GLY N N 110 106.563 107.234 -0.671 2
1 1235 . 1 1 A 111 111 ASP H H 111 7.882 8.168 -0.286 2
1 1236 . 1 1 A 111 111 ASP HA H 111 4.312 4.344 -0.032 2
1 1239 . 1 1 A 111 111 ASP C C 111 179.467 178.570 0.897 2
1 1240 . 1 1 A 111 111 ASP CA C 111 56.976 56.690 0.286 2
1 1241 . 1 1 A 111 111 ASP CB C 111 40.648 40.802 -0.154 2
1 1242 . 1 1 A 111 111 ASP N N 111 121.402 121.380 0.022 2
1 1243 . 1 1 A 112 112 TRP H H 112 7.804 8.396 -0.592 2
1 1244 . 1 1 A 112 112 TRP HA H 112 3.831 4.201 -0.370 2
1 1253 . 1 1 A 112 112 TRP C C 112 177.547 178.689 -1.142 2
1 1254 . 1 1 A 112 112 TRP CA C 112 62.006 59.970 2.036 2
1 1255 . 1 1 A 112 112 TRP CB C 112 29.421 29.337 0.084 2
1 1261 . 1 1 A 112 112 TRP N N 112 119.904 120.199 -0.295 2
1 1263 . 1 1 A 113 113 VAL H H 113 7.982 8.010 -0.028 2
1 1264 . 1 1 A 113 113 VAL HA H 113 3.072 3.632 -0.560 2
1 1272 . 1 1 A 113 113 VAL C C 113 178.015 178.402 -0.387 2
1 1273 . 1 1 A 113 113 VAL CA C 113 67.407 66.727 0.680 2
1 1274 . 1 1 A 113 113 VAL CB C 113 31.724 31.529 0.195 2
1 1277 . 1 1 A 113 113 VAL N N 113 117.575 119.193 -1.618 2
1 1278 . 1 1 A 114 114 GLN H H 114 8.268 8.089 0.179 2
1 1279 . 1 1 A 114 114 GLN HA H 114 3.994 3.999 -0.005 2
1 1286 . 1 1 A 114 114 GLN C C 114 178.021 177.941 0.080 2
1 1287 . 1 1 A 114 114 GLN CA C 114 59.112 58.812 0.300 2
1 1288 . 1 1 A 114 114 GLN CB C 114 28.685 28.765 -0.080 2
1 1290 . 1 1 A 114 114 GLN N N 114 117.479 120.085 -2.606 2
1 1292 . 1 1 A 115 115 ALA H H 115 7.915 8.314 -0.399 2
1 1293 . 1 1 A 115 115 ALA HA H 115 3.972 4.071 -0.099 2
1 1297 . 1 1 A 115 115 ALA C C 115 180.030 179.944 0.086 2
1 1298 . 1 1 A 115 115 ALA CA C 115 55.142 55.127 0.015 2
1 1299 . 1 1 A 115 115 ALA CB C 115 18.152 18.505 -0.353 2
1 1300 . 1 1 A 115 115 ALA N N 115 120.858 120.742 0.116 2
1 1301 . 1 1 A 116 116 ILE H H 116 8.172 8.417 -0.245 2
1 1302 . 1 1 A 116 116 ILE HA H 116 3.482 3.782 -0.300 2
1 1312 . 1 1 A 116 116 ILE C C 116 177.739 178.126 -0.387 2
1 1313 . 1 1 A 116 116 ILE CA C 116 66.119 65.098 1.021 2
1 1314 . 1 1 A 116 116 ILE CB C 116 38.222 37.803 0.419 2
1 1318 . 1 1 A 116 116 ILE N N 116 115.977 117.648 -1.671 2
1 1319 . 1 1 A 117 117 CYS H H 117 8.449 8.359 0.090 2
1 1320 . 1 1 A 117 117 CYS HA H 117 4.032 4.504 -0.472 2
1 1323 . 1 1 A 117 117 CYS C C 117 177.321 177.185 0.136 2
1 1324 . 1 1 A 117 117 CYS CA C 117 64.777 62.321 2.456 2
1 1325 . 1 1 A 117 117 CYS CB C 117 26.871 27.262 -0.392 2
1 1326 . 1 1 A 117 117 CYS N N 117 117.253 120.752 -3.499 2
1 1327 . 1 1 A 118 118 LEU H H 118 8.182 8.083 0.099 2
1 1328 . 1 1 A 118 118 LEU HA H 118 4.052 4.087 -0.035 2
1 1338 . 1 1 A 118 118 LEU C C 118 179.217 179.155 0.062 2
1 1339 . 1 1 A 118 118 LEU CA C 118 57.877 57.673 0.204 2
1 1340 . 1 1 A 118 118 LEU CB C 118 42.088 41.788 0.300 2
1 1344 . 1 1 A 118 118 LEU N N 118 119.665 121.274 -1.609 2
1 1345 . 1 1 A 119 119 LEU H H 119 7.142 7.955 -0.812 2
1 1346 . 1 1 A 119 119 LEU HA H 119 4.192 4.183 0.009 2
1 1356 . 1 1 A 119 119 LEU C C 119 178.492 178.589 -0.097 2
1 1357 . 1 1 A 119 119 LEU CA C 119 56.259 57.744 -1.485 2
1 1358 . 1 1 A 119 119 LEU CB C 119 43.568 42.107 1.461 2
1 1362 . 1 1 A 119 119 LEU N N 119 116.244 118.868 -2.624 2
1 1363 . 1 1 A 120 120 ALA H H 120 8.513 8.374 0.139 2
1 1364 . 1 1 A 120 120 ALA HA H 120 3.878 4.049 -0.171 2
1 1368 . 1 1 A 120 120 ALA C C 120 178.358 178.482 -0.124 2
1 1369 . 1 1 A 120 120 ALA CA C 120 53.765 55.002 -1.237 2
1 1370 . 1 1 A 120 120 ALA CB C 120 18.687 18.716 -0.029 2
1 1371 . 1 1 A 120 120 ALA N N 120 120.009 120.422 -0.413 2
1 1372 . 1 1 A 121 121 PHE H H 121 7.822 8.161 -0.339 2
1 1373 . 1 1 A 121 121 PHE HA H 121 5.156 4.908 0.248 2
1 1381 . 1 1 A 121 121 PHE C C 121 176.273 175.530 0.743 2
1 1382 . 1 1 A 121 121 PHE CA C 121 55.741 56.819 -1.078 2
1 1383 . 1 1 A 121 121 PHE CB C 121 39.455 38.254 1.201 2
1 1389 . 1 1 A 121 121 PHE N N 121 113.981 114.837 -0.856 2
1 1390 . 1 1 A 122 122 SER H H 122 7.765 8.083 -0.318 2
1 1391 . 1 1 A 122 122 SER HA H 122 4.579 4.615 -0.036 2
1 1394 . 1 1 A 122 122 SER C C 122 174.595 174.452 0.143 2
1 1395 . 1 1 A 122 122 SER CA C 122 58.777 59.421 -0.644 2
1 1396 . 1 1 A 122 122 SER CB C 122 63.719 63.396 0.323 2
1 1397 . 1 1 A 122 122 SER N N 122 115.069 115.643 -0.574 2
1 1398 . 1 1 A 123 123 GLY H H 123 8.223 8.196 0.027 2
1 1399 . 1 1 A 123 123 GLY HA2 H 123 4.174 4.145 0.029 2
1 1400 . 1 1 A 123 123 GLY HA3 H 123 4.100 4.152 -0.052 2
1 1401 . 1 1 A 123 123 GLY C C 123 171.678 173.263 -1.585 2
1 1402 . 1 1 A 123 123 GLY CA C 123 44.815 45.195 -0.380 2
1 1403 . 1 1 A 123 123 GLY N N 123 110.151 110.904 -0.753 2
1 1404 . 1 1 A 124 124 PRO HA H 124 4.482 4.609 -0.127 2
1 1411 . 1 1 A 124 124 PRO C C 124 177.314 176.433 0.881 2
1 1412 . 1 1 A 124 124 PRO CA C 124 63.206 63.298 -0.092 2
1 1413 . 1 1 A 124 124 PRO CB C 124 32.176 32.112 0.064 2
1 1416 . 1 1 A 125 125 SER H H 125 8.485 8.294 0.191 2
1 1417 . 1 1 A 125 125 SER HA H 125 4.472 4.656 -0.184 2
1 1420 . 1 1 A 125 125 SER C C 125 174.728 174.067 0.661 2
1 1421 . 1 1 A 125 125 SER CA C 125 58.353 58.726 -0.373 2
1 1422 . 1 1 A 125 125 SER CB C 125 64.048 64.070 -0.022 2
1 1423 . 1 1 A 125 125 SER N N 125 116.081 116.327 -0.246 2
1 1424 . 1 1 A 126 126 SER H H 126 8.332 8.498 -0.166 2
1 1425 . 1 1 A 126 126 SER HA H 126 4.464 4.747 -0.283 2
1 1428 . 1 1 A 126 126 SER C C 126 173.980 174.370 -0.390 2
1 1429 . 1 1 A 126 126 SER CA C 126 58.336 57.979 0.357 2
1 1430 . 1 1 A 126 126 SER CB C 126 63.925 64.571 -0.646 2
1 1431 . 1 1 A 126 126 SER N N 126 118.037 118.697 -0.660 2
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