data_16562_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16562
_Entry.PDB_ID 2KPO
_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 14 . 1 1 1 A 2 2 LEU H H 2 8.509 8.978 -0.469 1
1 15 . 1 1 1 A 2 2 LEU HA H 2 4.463 5.022 -0.559 1
1 25 . 1 1 1 A 2 2 LEU C C 2 173.944 176.118 -2.174 1
1 26 . 1 1 1 A 2 2 LEU CA C 2 54.471 53.743 0.728 1
1 27 . 1 1 1 A 2 2 LEU CB C 2 43.595 43.864 -0.269 1
1 31 . 1 1 1 A 2 2 LEU N N 2 127.160 126.104 1.056 1
1 32 . 1 1 1 A 3 3 LEU H H 3 7.844 8.767 -0.923 1
1 33 . 1 1 1 A 3 3 LEU HA H 3 5.128 5.441 -0.313 1
1 43 . 1 1 1 A 3 3 LEU C C 3 175.423 175.254 0.169 1
1 44 . 1 1 1 A 3 3 LEU CA C 3 53.566 53.211 0.355 1
1 45 . 1 1 1 A 3 3 LEU CB C 3 44.039 44.761 -0.722 1
1 49 . 1 1 1 A 3 3 LEU N N 3 122.555 122.611 -0.056 1
1 50 . 1 1 1 A 4 4 TYR H H 4 8.360 9.173 -0.813 1
1 51 . 1 1 1 A 4 4 TYR HA H 4 5.143 5.480 -0.337 1
1 58 . 1 1 1 A 4 4 TYR C C 4 174.481 174.976 -0.495 1
1 59 . 1 1 1 A 4 4 TYR CA C 4 56.577 56.202 0.375 1
1 60 . 1 1 1 A 4 4 TYR CB C 4 43.840 41.917 1.923 1
1 65 . 1 1 1 A 4 4 TYR N N 4 119.315 123.653 -4.338 1
1 66 . 1 1 1 A 5 5 VAL H H 5 8.918 8.985 -0.067 1
1 67 . 1 1 1 A 5 5 VAL HA H 5 5.106 5.024 0.082 1
1 75 . 1 1 1 A 5 5 VAL C C 5 174.042 174.530 -0.488 1
1 76 . 1 1 1 A 5 5 VAL CA C 5 59.852 61.008 -1.156 1
1 77 . 1 1 1 A 5 5 VAL CB C 5 33.816 34.467 -0.651 1
1 80 . 1 1 1 A 5 5 VAL N N 5 119.952 121.408 -1.456 1
1 81 . 1 1 1 A 6 6 LEU H H 6 9.315 9.507 -0.192 1
1 82 . 1 1 1 A 6 6 LEU HA H 6 5.466 5.270 0.196 1
1 92 . 1 1 1 A 6 6 LEU C C 6 175.049 175.135 -0.086 1
1 93 . 1 1 1 A 6 6 LEU CA C 6 52.090 53.299 -1.209 1
1 94 . 1 1 1 A 6 6 LEU CB C 6 44.103 43.003 1.100 1
1 98 . 1 1 1 A 6 6 LEU N N 6 126.917 126.733 0.184 1
1 99 . 1 1 1 A 7 7 ILE H H 7 8.458 8.922 -0.464 1
1 100 . 1 1 1 A 7 7 ILE HA H 7 5.131 5.060 0.071 1
1 110 . 1 1 1 A 7 7 ILE C C 7 173.213 173.803 -0.590 1
1 111 . 1 1 1 A 7 7 ILE CA C 7 58.463 59.870 -1.407 1
1 112 . 1 1 1 A 7 7 ILE CB C 7 41.020 40.857 0.163 1
1 116 . 1 1 1 A 7 7 ILE N N 7 119.778 126.451 -6.673 1
1 117 . 1 1 1 A 8 8 ILE H H 8 8.797 9.432 -0.635 1
1 118 . 1 1 1 A 8 8 ILE HA H 8 4.611 4.895 -0.284 1
1 128 . 1 1 1 A 8 8 ILE C C 8 174.611 174.640 -0.029 1
1 129 . 1 1 1 A 8 8 ILE CA C 8 60.227 60.495 -0.268 1
1 130 . 1 1 1 A 8 8 ILE CB C 8 37.665 39.403 -1.738 1
1 134 . 1 1 1 A 8 8 ILE N N 8 128.919 129.345 -0.426 1
1 135 . 1 1 1 A 9 9 SER H H 9 7.811 8.799 -0.988 1
1 136 . 1 1 1 A 9 9 SER HA H 9 4.429 5.025 -0.596 1
1 140 . 1 1 1 A 9 9 SER C C 9 172.937 173.679 -0.742 1
1 141 . 1 1 1 A 9 9 SER CA C 9 58.241 56.915 1.326 1
1 142 . 1 1 1 A 9 9 SER CB C 9 64.261 64.417 -0.156 1
1 143 . 1 1 1 A 9 9 SER N N 9 116.365 121.567 -5.202 1
1 144 . 1 1 1 A 10 10 ASN H H 10 8.641 8.862 -0.221 1
1 145 . 1 1 1 A 10 10 ASN HA H 10 4.938 4.760 0.178 1
1 150 . 1 1 1 A 10 10 ASN C C 10 174.497 174.418 0.079 1
1 151 . 1 1 1 A 10 10 ASN CA C 10 52.221 54.037 -1.816 1
1 152 . 1 1 1 A 10 10 ASN CB C 10 39.128 39.793 -0.665 1
1 153 . 1 1 1 A 10 10 ASN N N 10 122.612 122.308 0.304 1
1 155 . 1 1 1 A 11 11 ASP H H 11 8.673 7.624 1.049 1
1 156 . 1 1 1 A 11 11 ASP HA H 11 4.596 4.658 -0.062 1
1 159 . 1 1 1 A 11 11 ASP C C 11 175.342 176.551 -1.209 1
1 160 . 1 1 1 A 11 11 ASP CA C 11 53.233 53.724 -0.491 1
1 161 . 1 1 1 A 11 11 ASP CB C 11 40.965 41.700 -0.735 1
1 162 . 1 1 1 A 11 11 ASP N N 11 122.717 119.754 2.963 1
1 163 . 1 1 1 A 12 12 LYS H H 12 8.562 8.796 -0.234 1
1 164 . 1 1 1 A 12 12 LYS HA H 12 3.854 4.012 -0.158 1
1 173 . 1 1 1 A 12 12 LYS C C 12 178.754 178.540 0.214 1
1 174 . 1 1 1 A 12 12 LYS CA C 12 59.581 59.939 -0.358 1
1 175 . 1 1 1 A 12 12 LYS CB C 12 32.378 32.203 0.175 1
1 179 . 1 1 1 A 12 12 LYS N N 12 125.737 126.371 -0.634 1
1 180 . 1 1 1 A 13 13 LYS H H 13 8.075 7.676 0.399 1
1 181 . 1 1 1 A 13 13 LYS HA H 13 4.154 4.088 0.066 1
1 190 . 1 1 1 A 13 13 LYS C C 13 178.315 179.113 -0.798 1
1 191 . 1 1 1 A 13 13 LYS CA C 13 58.532 59.118 -0.586 1
1 192 . 1 1 1 A 13 13 LYS CB C 13 31.452 32.115 -0.663 1
1 196 . 1 1 1 A 13 13 LYS N N 13 119.604 120.527 -0.923 1
1 197 . 1 1 1 A 14 14 LEU H H 14 7.552 8.304 -0.752 1
1 198 . 1 1 1 A 14 14 LEU HA H 14 3.682 4.052 -0.370 1
1 208 . 1 1 1 A 14 14 LEU C C 14 178.429 178.356 0.073 1
1 209 . 1 1 1 A 14 14 LEU CA C 14 58.999 58.120 0.879 1
1 210 . 1 1 1 A 14 14 LEU CB C 14 41.228 41.547 -0.319 1
1 214 . 1 1 1 A 14 14 LEU N N 14 122.266 121.424 0.842 1
1 215 . 1 1 1 A 15 15 ILE H H 15 8.074 7.850 0.224 1
1 216 . 1 1 1 A 15 15 ILE HA H 15 3.264 3.522 -0.258 1
1 226 . 1 1 1 A 15 15 ILE C C 15 177.000 178.372 -1.372 1
1 227 . 1 1 1 A 15 15 ILE CA C 15 65.939 65.014 0.925 1
1 228 . 1 1 1 A 15 15 ILE CB C 15 37.983 37.551 0.432 1
1 232 . 1 1 1 A 15 15 ILE N N 15 118.214 119.704 -1.490 1
1 233 . 1 1 1 A 16 16 GLU H H 16 8.016 7.875 0.141 1
1 234 . 1 1 1 A 16 16 GLU HA H 16 4.045 4.000 0.045 1
1 239 . 1 1 1 A 16 16 GLU C C 16 179.388 179.543 -0.155 1
1 240 . 1 1 1 A 16 16 GLU CA C 16 59.032 59.835 -0.803 1
1 241 . 1 1 1 A 16 16 GLU CB C 16 29.200 29.232 -0.032 1
1 243 . 1 1 1 A 16 16 GLU N N 16 118.484 119.867 -1.383 1
1 244 . 1 1 1 A 17 17 GLU H H 17 8.063 8.367 -0.304 1
1 245 . 1 1 1 A 17 17 GLU HA H 17 4.053 4.026 0.027 1
1 250 . 1 1 1 A 17 17 GLU C C 17 179.306 179.205 0.101 1
1 251 . 1 1 1 A 17 17 GLU CA C 17 58.636 59.314 -0.678 1
1 252 . 1 1 1 A 17 17 GLU CB C 17 29.011 29.484 -0.473 1
1 254 . 1 1 1 A 17 17 GLU N N 17 118.100 120.606 -2.506 1
1 255 . 1 1 1 A 18 18 ALA H H 18 8.655 8.271 0.384 1
1 256 . 1 1 1 A 18 18 ALA HA H 18 3.775 4.040 -0.265 1
1 260 . 1 1 1 A 18 18 ALA C C 18 178.559 179.738 -1.179 1
1 261 . 1 1 1 A 18 18 ALA CA C 18 54.960 55.449 -0.489 1
1 262 . 1 1 1 A 18 18 ALA CB C 18 17.960 18.396 -0.436 1
1 263 . 1 1 1 A 18 18 ALA N N 18 122.439 122.730 -0.291 1
1 264 . 1 1 1 A 19 19 ARG H H 19 8.900 8.163 0.737 1
1 265 . 1 1 1 A 19 19 ARG HA H 19 3.809 4.049 -0.240 1
1 273 . 1 1 1 A 19 19 ARG C C 19 178.721 178.897 -0.176 1
1 274 . 1 1 1 A 19 19 ARG CA C 19 59.976 59.752 0.224 1
1 275 . 1 1 1 A 19 19 ARG CB C 19 29.572 29.953 -0.381 1
1 278 . 1 1 1 A 19 19 ARG N N 19 118.563 117.876 0.687 1
1 280 . 1 1 1 A 20 20 LYS H H 20 7.792 8.500 -0.708 1
1 281 . 1 1 1 A 20 20 LYS HA H 20 4.052 4.004 0.048 1
1 290 . 1 1 1 A 20 20 LYS C C 20 179.648 179.674 -0.026 1
1 291 . 1 1 1 A 20 20 LYS CA C 20 59.296 59.154 0.142 1
1 292 . 1 1 1 A 20 20 LYS CB C 20 32.216 32.345 -0.129 1
1 296 . 1 1 1 A 20 20 LYS N N 20 118.638 119.313 -0.675 1
1 297 . 1 1 1 A 21 21 MET H H 21 7.684 7.834 -0.150 1
1 298 . 1 1 1 A 21 21 MET HA H 21 4.411 4.185 0.226 1
1 306 . 1 1 1 A 21 21 MET C C 21 177.909 178.158 -0.249 1
1 307 . 1 1 1 A 21 21 MET CA C 21 57.009 58.925 -1.916 1
1 308 . 1 1 1 A 21 21 MET CB C 21 32.028 32.918 -0.890 1
1 311 . 1 1 1 A 21 21 MET N N 21 118.100 118.597 -0.497 1
1 312 . 1 1 1 A 22 22 ALA H H 22 8.815 7.964 0.851 1
1 313 . 1 1 1 A 22 22 ALA HA H 22 3.826 3.971 -0.145 1
1 317 . 1 1 1 A 22 22 ALA C C 22 178.835 179.767 -0.932 1
1 318 . 1 1 1 A 22 22 ALA CA C 22 55.427 55.626 -0.199 1
1 319 . 1 1 1 A 22 22 ALA CB C 22 18.059 18.834 -0.775 1
1 320 . 1 1 1 A 22 22 ALA N N 22 122.150 121.081 1.069 1
1 321 . 1 1 1 A 23 23 GLU H H 23 8.276 8.590 -0.314 1
1 322 . 1 1 1 A 23 23 GLU HA H 23 4.146 3.960 0.186 1
1 327 . 1 1 1 A 23 23 GLU C C 23 180.151 179.322 0.829 1
1 328 . 1 1 1 A 23 23 GLU CA C 23 58.999 59.340 -0.341 1
1 329 . 1 1 1 A 23 23 GLU CB C 23 29.160 29.523 -0.363 1
1 331 . 1 1 1 A 23 23 GLU N N 23 117.001 117.816 -0.815 1
1 332 . 1 1 1 A 24 24 LYS H H 24 7.573 7.936 -0.363 1
1 333 . 1 1 1 A 24 24 LYS HA H 24 4.101 4.009 0.092 1
1 342 . 1 1 1 A 24 24 LYS C C 24 177.145 178.847 -1.702 1
1 343 . 1 1 1 A 24 24 LYS CA C 24 58.261 59.381 -1.120 1
1 344 . 1 1 1 A 24 24 LYS CB C 24 32.079 32.146 -0.067 1
1 348 . 1 1 1 A 24 24 LYS N N 24 119.960 119.571 0.389 1
1 349 . 1 1 1 A 25 25 ALA H H 25 7.710 7.667 0.043 1
1 350 . 1 1 1 A 25 25 ALA HA H 25 4.413 4.416 -0.003 1
1 354 . 1 1 1 A 25 25 ALA C C 25 175.325 176.765 -1.440 1
1 355 . 1 1 1 A 25 25 ALA CA C 25 51.208 52.394 -1.186 1
1 356 . 1 1 1 A 25 25 ALA CB C 25 18.520 19.465 -0.945 1
1 357 . 1 1 1 A 25 25 ALA N N 25 119.257 118.490 0.767 1
1 358 . 1 1 1 A 26 26 ASN H H 26 7.840 8.037 -0.197 1
1 359 . 1 1 1 A 26 26 ASN HA H 26 4.357 4.352 0.005 1
1 364 . 1 1 1 A 26 26 ASN C C 26 173.587 174.283 -0.696 1
1 365 . 1 1 1 A 26 26 ASN CA C 26 54.307 54.559 -0.252 1
1 366 . 1 1 1 A 26 26 ASN CB C 26 36.972 36.864 0.108 1
1 367 . 1 1 1 A 26 26 ASN N N 26 115.266 114.093 1.173 1
1 369 . 1 1 1 A 27 27 LEU H H 27 8.241 8.250 -0.009 1
1 370 . 1 1 1 A 27 27 LEU HA H 27 4.652 4.356 0.296 1
1 380 . 1 1 1 A 27 27 LEU C C 27 175.894 176.346 -0.452 1
1 381 . 1 1 1 A 27 27 LEU CA C 27 52.923 54.132 -1.209 1
1 382 . 1 1 1 A 27 27 LEU CB C 27 44.090 42.893 1.197 1
1 386 . 1 1 1 A 27 27 LEU N N 27 116.828 119.138 -2.310 1
1 387 . 1 1 1 A 28 28 GLU H H 28 7.798 7.924 -0.126 1
1 388 . 1 1 1 A 28 28 GLU HA H 28 4.310 4.483 -0.173 1
1 393 . 1 1 1 A 28 28 GLU C C 28 173.944 175.149 -1.205 1
1 394 . 1 1 1 A 28 28 GLU CA C 28 55.460 55.803 -0.343 1
1 395 . 1 1 1 A 28 28 GLU CB C 28 30.512 29.865 0.647 1
1 397 . 1 1 1 A 28 28 GLU N N 28 121.340 123.036 -1.696 1
1 398 . 1 1 1 A 29 29 LEU H H 29 8.451 8.889 -0.438 1
1 399 . 1 1 1 A 29 29 LEU HA H 29 5.662 5.289 0.373 1
1 409 . 1 1 1 A 29 29 LEU C C 29 176.902 174.786 2.116 1
1 410 . 1 1 1 A 29 29 LEU CA C 29 53.186 54.019 -0.833 1
1 411 . 1 1 1 A 29 29 LEU CB C 29 44.914 44.748 0.166 1
1 415 . 1 1 1 A 29 29 LEU N N 29 126.547 127.984 -1.437 1
1 416 . 1 1 1 A 30 30 ARG H H 30 9.094 9.331 -0.237 1
1 417 . 1 1 1 A 30 30 ARG HA H 30 4.910 4.697 0.213 1
1 425 . 1 1 1 A 30 30 ARG C C 30 175.147 175.525 -0.378 1
1 426 . 1 1 1 A 30 30 ARG CA C 30 53.417 54.358 -0.941 1
1 427 . 1 1 1 A 30 30 ARG CB C 30 32.555 33.145 -0.590 1
1 430 . 1 1 1 A 30 30 ARG N N 30 125.043 126.065 -1.022 1
1 432 . 1 1 1 A 31 31 THR H H 31 8.496 8.513 -0.017 1
1 433 . 1 1 1 A 31 31 THR HA H 31 4.888 4.951 -0.063 1
1 438 . 1 1 1 A 31 31 THR C C 31 173.961 174.066 -0.105 1
1 439 . 1 1 1 A 31 31 THR CA C 31 60.445 61.033 -0.588 1
1 440 . 1 1 1 A 31 31 THR CB C 31 69.492 69.793 -0.301 1
1 442 . 1 1 1 A 31 31 THR N N 31 114.745 115.242 -0.497 1
1 443 . 1 1 1 A 32 32 VAL H H 32 8.480 9.063 -0.583 1
1 444 . 1 1 1 A 32 32 VAL HA H 32 4.411 4.283 0.128 1
1 452 . 1 1 1 A 32 32 VAL C C 32 175.082 175.711 -0.629 1
1 453 . 1 1 1 A 32 32 VAL CA C 32 60.946 63.248 -2.302 1
1 454 . 1 1 1 A 32 32 VAL CB C 32 34.487 32.024 2.463 1
1 457 . 1 1 1 A 32 32 VAL N N 32 122.324 127.060 -4.736 1
1 458 . 1 1 1 A 33 33 LYS H H 33 9.304 9.044 0.260 1
1 459 . 1 1 1 A 33 33 LYS HA H 33 4.534 4.666 -0.132 1
1 468 . 1 1 1 A 33 33 LYS C C 33 176.740 176.495 0.245 1
1 469 . 1 1 1 A 33 33 LYS CA C 33 56.846 56.830 0.016 1
1 470 . 1 1 1 A 33 33 LYS CB C 33 34.355 34.968 -0.613 1
1 474 . 1 1 1 A 33 33 LYS N N 33 123.654 126.494 -2.840 1
1 475 . 1 1 1 A 34 34 THR H H 34 7.245 7.581 -0.336 1
1 476 . 1 1 1 A 34 34 THR HA H 34 4.780 4.563 0.217 1
1 481 . 1 1 1 A 34 34 THR C C 34 174.529 175.345 -0.816 1
1 482 . 1 1 1 A 34 34 THR CA C 34 58.859 59.859 -1.000 1
1 483 . 1 1 1 A 34 34 THR CB C 34 73.023 72.335 0.688 1
1 485 . 1 1 1 A 34 34 THR N N 34 106.300 110.906 -4.606 1
1 486 . 1 1 1 A 35 35 GLU H H 35 9.174 8.739 0.435 1
1 487 . 1 1 1 A 35 35 GLU HA H 35 3.886 3.942 -0.056 1
1 492 . 1 1 1 A 35 35 GLU C C 35 177.714 177.353 0.361 1
1 493 . 1 1 1 A 35 35 GLU CA C 35 59.233 59.617 -0.384 1
1 494 . 1 1 1 A 35 35 GLU CB C 35 29.377 29.359 0.018 1
1 496 . 1 1 1 A 35 35 GLU N N 35 121.919 122.053 -0.134 1
1 497 . 1 1 1 A 36 36 ASP H H 36 8.185 8.274 -0.089 1
1 498 . 1 1 1 A 36 36 ASP HA H 36 4.289 4.240 0.049 1
1 501 . 1 1 1 A 36 36 ASP C C 36 178.348 178.356 -0.008 1
1 502 . 1 1 1 A 36 36 ASP CA C 36 56.962 57.515 -0.553 1
1 503 . 1 1 1 A 36 36 ASP CB C 36 40.214 41.397 -1.183 1
1 504 . 1 1 1 A 36 36 ASP N N 36 118.332 119.646 -1.314 1
1 505 . 1 1 1 A 37 37 GLU H H 37 7.741 7.886 -0.145 1
1 506 . 1 1 1 A 37 37 GLU HA H 37 3.708 3.639 0.069 1
1 511 . 1 1 1 A 37 37 GLU C C 37 177.324 178.490 -1.166 1
1 512 . 1 1 1 A 37 37 GLU CA C 37 58.698 59.052 -0.354 1
1 513 . 1 1 1 A 37 37 GLU CB C 37 30.199 29.198 1.001 1
1 515 . 1 1 1 A 37 37 GLU N N 37 120.704 119.051 1.653 1
1 516 . 1 1 1 A 38 38 LEU H H 38 7.531 8.146 -0.615 1
1 517 . 1 1 1 A 38 38 LEU HA H 38 3.873 4.045 -0.172 1
1 527 . 1 1 1 A 38 38 LEU C C 38 177.357 178.449 -1.092 1
1 528 . 1 1 1 A 38 38 LEU CA C 38 58.305 58.247 0.058 1
1 529 . 1 1 1 A 38 38 LEU CB C 38 40.837 41.696 -0.859 1
1 533 . 1 1 1 A 38 38 LEU N N 38 119.200 121.736 -2.536 1
1 534 . 1 1 1 A 39 39 LYS H H 39 8.083 8.145 -0.062 1
1 535 . 1 1 1 A 39 39 LYS HA H 39 3.608 3.862 -0.254 1
1 544 . 1 1 1 A 39 39 LYS C C 39 177.373 178.792 -1.419 1
1 545 . 1 1 1 A 39 39 LYS CA C 39 60.290 59.556 0.734 1
1 546 . 1 1 1 A 39 39 LYS CB C 39 32.178 32.158 0.020 1
1 550 . 1 1 1 A 39 39 LYS N N 39 116.943 118.785 -1.842 1
1 551 . 1 1 1 A 40 40 LYS H H 40 7.632 8.040 -0.408 1
1 552 . 1 1 1 A 40 40 LYS HA H 40 3.864 4.093 -0.229 1
1 561 . 1 1 1 A 40 40 LYS C C 40 179.566 178.598 0.968 1
1 562 . 1 1 1 A 40 40 LYS CA C 40 58.993 59.012 -0.019 1
1 563 . 1 1 1 A 40 40 LYS CB C 40 31.758 31.862 -0.104 1
1 567 . 1 1 1 A 40 40 LYS N N 40 118.274 119.001 -0.727 1
1 568 . 1 1 1 A 41 41 TYR H H 41 7.823 7.499 0.324 1
1 569 . 1 1 1 A 41 41 TYR HA H 41 3.926 3.859 0.067 1
1 576 . 1 1 1 A 41 41 TYR C C 41 176.625 177.646 -1.021 1
1 577 . 1 1 1 A 41 41 TYR CA C 41 59.757 60.241 -0.484 1
1 578 . 1 1 1 A 41 41 TYR CB C 41 36.901 37.782 -0.881 1
1 583 . 1 1 1 A 41 41 TYR N N 41 117.811 119.189 -1.378 1
1 584 . 1 1 1 A 42 42 LEU H H 42 7.964 8.090 -0.126 1
1 585 . 1 1 1 A 42 42 LEU HA H 42 3.704 3.883 -0.179 1
1 595 . 1 1 1 A 42 42 LEU C C 42 178.396 179.122 -0.726 1
1 596 . 1 1 1 A 42 42 LEU CA C 42 58.237 57.902 0.335 1
1 597 . 1 1 1 A 42 42 LEU CB C 42 40.507 41.393 -0.886 1
1 601 . 1 1 1 A 42 42 LEU N N 42 115.960 119.877 -3.917 1
1 602 . 1 1 1 A 43 43 GLU H H 43 8.193 8.339 -0.146 1
1 603 . 1 1 1 A 43 43 GLU HA H 43 3.882 3.846 0.036 1
1 608 . 1 1 1 A 43 43 GLU C C 43 179.193 178.833 0.360 1
1 609 . 1 1 1 A 43 43 GLU CA C 43 59.122 59.816 -0.694 1
1 610 . 1 1 1 A 43 43 GLU CB C 43 29.244 29.153 0.091 1
1 612 . 1 1 1 A 43 43 GLU N N 43 117.175 117.577 -0.402 1
1 613 . 1 1 1 A 44 44 GLU H H 44 7.601 7.610 -0.009 1
1 614 . 1 1 1 A 44 44 GLU HA H 44 3.936 4.035 -0.099 1
1 619 . 1 1 1 A 44 44 GLU C C 44 179.875 179.045 0.830 1
1 620 . 1 1 1 A 44 44 GLU CA C 44 58.867 59.250 -0.383 1
1 621 . 1 1 1 A 44 44 GLU CB C 44 28.648 29.156 -0.508 1
1 623 . 1 1 1 A 44 44 GLU N N 44 120.472 119.221 1.251 1
1 624 . 1 1 1 A 45 45 PHE H H 45 8.260 8.115 0.145 1
1 625 . 1 1 1 A 45 45 PHE HA H 45 4.520 4.192 0.328 1
1 633 . 1 1 1 A 45 45 PHE C C 45 177.942 178.389 -0.447 1
1 634 . 1 1 1 A 45 45 PHE CA C 45 55.945 61.085 -5.140 1
1 635 . 1 1 1 A 45 45 PHE CB C 45 36.680 37.927 -1.247 1
1 641 . 1 1 1 A 45 45 PHE N N 45 119.272 119.349 -0.077 1
1 642 . 1 1 1 A 46 46 ARG H H 46 8.023 8.116 -0.093 1
1 643 . 1 1 1 A 46 46 ARG HA H 46 4.074 4.167 -0.093 1
1 651 . 1 1 1 A 46 46 ARG C C 46 177.617 178.886 -1.269 1
1 652 . 1 1 1 A 46 46 ARG CA C 46 58.194 59.129 -0.935 1
1 653 . 1 1 1 A 46 46 ARG CB C 46 29.737 30.083 -0.346 1
1 656 . 1 1 1 A 46 46 ARG N N 46 118.136 120.865 -2.729 1
1 658 . 1 1 1 A 47 47 LYS H H 47 7.470 8.007 -0.537 1
1 659 . 1 1 1 A 47 47 LYS HA H 47 4.143 4.093 0.050 1
1 668 . 1 1 1 A 47 47 LYS C C 47 177.324 178.436 -1.112 1
1 669 . 1 1 1 A 47 47 LYS CA C 47 57.726 59.327 -1.601 1
1 670 . 1 1 1 A 47 47 LYS CB C 47 32.409 32.317 0.092 1
1 674 . 1 1 1 A 47 47 LYS N N 47 116.943 119.470 -2.527 1
1 675 . 1 1 1 A 48 48 GLU H H 48 7.615 8.173 -0.558 1
1 676 . 1 1 1 A 48 48 GLU HA H 48 4.428 4.762 -0.334 1
1 681 . 1 1 1 A 48 48 GLU C C 48 176.869 177.011 -0.142 1
1 682 . 1 1 1 A 48 48 GLU CA C 48 55.945 56.176 -0.231 1
1 683 . 1 1 1 A 48 48 GLU CB C 48 29.696 30.367 -0.671 1
1 685 . 1 1 1 A 48 48 GLU N N 48 118.852 117.066 1.786 1
1 686 . 1 1 1 A 49 49 SER H H 49 7.725 8.215 -0.490 1
1 687 . 1 1 1 A 49 49 SER HA H 49 4.244 4.332 -0.088 1
1 690 . 1 1 1 A 49 49 SER C C 49 174.838 176.868 -2.030 1
1 691 . 1 1 1 A 49 49 SER CA C 49 59.366 61.233 -1.867 1
1 692 . 1 1 1 A 49 49 SER CB C 49 63.116 62.993 0.123 1
1 693 . 1 1 1 A 49 49 SER N N 49 114.224 115.169 -0.945 1
1 694 . 1 1 1 A 50 50 GLN H H 50 8.548 8.080 0.468 1
1 695 . 1 1 1 A 50 50 GLN HA H 50 4.398 4.131 0.267 1
1 702 . 1 1 1 A 50 50 GLN C C 50 175.732 176.762 -1.030 1
1 703 . 1 1 1 A 50 50 GLN CA C 50 56.272 59.010 -2.738 1
1 704 . 1 1 1 A 50 50 GLN CB C 50 28.946 28.726 0.220 1
1 706 . 1 1 1 A 50 50 GLN N N 50 120.125 120.877 -0.752 1
1 708 . 1 1 1 A 51 51 ASN H H 51 8.534 7.848 0.686 1
1 709 . 1 1 1 A 51 51 ASN HA H 51 4.980 4.906 0.074 1
1 714 . 1 1 1 A 51 51 ASN C C 51 173.717 173.950 -0.233 1
1 715 . 1 1 1 A 51 51 ASN CA C 51 52.804 52.642 0.162 1
1 716 . 1 1 1 A 51 51 ASN CB C 51 39.583 39.497 0.086 1
1 717 . 1 1 1 A 51 51 ASN N N 51 118.158 114.941 3.217 1
1 719 . 1 1 1 A 52 52 ILE H H 52 7.492 7.486 0.006 1
1 720 . 1 1 1 A 52 52 ILE HA H 52 5.338 5.151 0.187 1
1 730 . 1 1 1 A 52 52 ILE C C 52 175.049 174.290 0.759 1
1 731 . 1 1 1 A 52 52 ILE CA C 52 59.364 59.690 -0.326 1
1 732 . 1 1 1 A 52 52 ILE CB C 52 42.163 41.445 0.718 1
1 736 . 1 1 1 A 52 52 ILE N N 52 117.927 121.344 -3.417 1
1 737 . 1 1 1 A 53 53 LYS H H 53 8.467 9.016 -0.549 1
1 738 . 1 1 1 A 53 53 LYS HA H 53 5.044 5.300 -0.256 1
1 747 . 1 1 1 A 53 53 LYS C C 53 175.082 175.268 -0.186 1
1 748 . 1 1 1 A 53 53 LYS CA C 53 55.429 54.927 0.502 1
1 749 . 1 1 1 A 53 53 LYS CB C 53 36.446 36.062 0.384 1
1 753 . 1 1 1 A 53 53 LYS N N 53 123.249 127.768 -4.519 1
1 754 . 1 1 1 A 54 54 VAL H H 54 8.490 8.852 -0.362 1
1 755 . 1 1 1 A 54 54 VAL HA H 54 5.159 5.106 0.053 1
1 763 . 1 1 1 A 54 54 VAL C C 54 173.473 173.445 0.028 1
1 764 . 1 1 1 A 54 54 VAL CA C 54 60.163 60.868 -0.705 1
1 765 . 1 1 1 A 54 54 VAL CB C 54 35.509 34.443 1.066 1
1 768 . 1 1 1 A 54 54 VAL N N 54 120.762 124.236 -3.474 1
1 769 . 1 1 1 A 55 55 LEU H H 55 8.636 8.798 -0.162 1
1 770 . 1 1 1 A 55 55 LEU HA H 55 4.670 4.911 -0.241 1
1 780 . 1 1 1 A 55 55 LEU C C 55 173.652 174.561 -0.909 1
1 781 . 1 1 1 A 55 55 LEU CA C 55 52.289 52.944 -0.655 1
1 782 . 1 1 1 A 55 55 LEU CB C 55 42.070 44.338 -2.268 1
1 786 . 1 1 1 A 55 55 LEU N N 55 131.898 129.426 2.472 1
1 787 . 1 1 1 A 56 56 ILE H H 56 9.188 9.238 -0.050 1
1 788 . 1 1 1 A 56 56 ILE HA H 56 4.879 5.091 -0.212 1
1 798 . 1 1 1 A 56 56 ILE C C 56 174.172 174.388 -0.216 1
1 799 . 1 1 1 A 56 56 ILE CA C 56 59.976 59.894 0.082 1
1 800 . 1 1 1 A 56 56 ILE CB C 56 38.181 39.722 -1.541 1
1 804 . 1 1 1 A 56 56 ILE N N 56 126.373 127.465 -1.092 1
1 805 . 1 1 1 A 57 57 LEU H H 57 8.929 9.338 -0.409 1
1 806 . 1 1 1 A 57 57 LEU HA H 57 5.394 5.136 0.258 1
1 816 . 1 1 1 A 57 57 LEU C C 57 175.358 175.535 -0.177 1
1 817 . 1 1 1 A 57 57 LEU CA C 57 52.086 53.511 -1.425 1
1 818 . 1 1 1 A 57 57 LEU CB C 57 42.445 43.177 -0.732 1
1 822 . 1 1 1 A 57 57 LEU N N 57 126.547 127.924 -1.377 1
1 823 . 1 1 1 A 58 58 VAL H H 58 8.542 9.222 -0.680 1
1 824 . 1 1 1 A 58 58 VAL HA H 58 5.253 4.736 0.517 1
1 832 . 1 1 1 A 58 58 VAL C C 58 175.244 175.815 -0.571 1
1 833 . 1 1 1 A 58 58 VAL CA C 58 58.241 59.322 -1.081 1
1 834 . 1 1 1 A 58 58 VAL CB C 58 33.165 34.691 -1.526 1
1 837 . 1 1 1 A 58 58 VAL N N 58 114.398 121.683 -7.285 1
1 838 . 1 1 1 A 59 59 SER H H 59 8.797 8.574 0.223 1
1 839 . 1 1 1 A 59 59 SER HA H 59 5.063 4.637 0.426 1
1 842 . 1 1 1 A 59 59 SER C C 59 174.172 173.826 0.346 1
1 843 . 1 1 1 A 59 59 SER CA C 59 59.320 60.555 -1.235 1
1 844 . 1 1 1 A 59 59 SER CB C 59 65.600 64.014 1.586 1
1 845 . 1 1 1 A 59 59 SER N N 59 115.497 116.487 -0.990 1
1 846 . 1 1 1 A 60 60 ASN H H 60 7.730 7.954 -0.224 1
1 847 . 1 1 1 A 60 60 ASN HA H 60 4.811 5.145 -0.334 1
1 852 . 1 1 1 A 60 60 ASN C C 60 174.464 175.007 -0.543 1
1 853 . 1 1 1 A 60 60 ASN CA C 60 52.007 52.281 -0.274 1
1 854 . 1 1 1 A 60 60 ASN CB C 60 40.336 41.630 -1.294 1
1 855 . 1 1 1 A 60 60 ASN N N 60 117.522 116.215 1.307 1
1 857 . 1 1 1 A 61 61 ASP H H 61 8.577 9.094 -0.517 1
1 858 . 1 1 1 A 61 61 ASP HA H 61 4.365 4.240 0.125 1
1 861 . 1 1 1 A 61 61 ASP C C 61 177.357 178.227 -0.870 1
1 862 . 1 1 1 A 61 61 ASP CA C 61 57.351 57.149 0.202 1
1 863 . 1 1 1 A 61 61 ASP CB C 61 40.383 40.449 -0.066 1
1 864 . 1 1 1 A 61 61 ASP N N 61 119.431 121.967 -2.536 1
1 865 . 1 1 1 A 62 62 GLU H H 62 8.405 8.426 -0.021 1
1 866 . 1 1 1 A 62 62 GLU HA H 62 4.121 4.042 0.079 1
1 871 . 1 1 1 A 62 62 GLU C C 62 179.615 178.764 0.851 1
1 872 . 1 1 1 A 62 62 GLU CA C 62 59.593 59.664 -0.071 1
1 873 . 1 1 1 A 62 62 GLU CB C 62 28.478 29.022 -0.544 1
1 875 . 1 1 1 A 62 62 GLU N N 62 122.150 119.466 2.684 1
1 876 . 1 1 1 A 63 63 GLU H H 63 8.384 8.173 0.211 1
1 877 . 1 1 1 A 63 63 GLU HA H 63 3.913 3.984 -0.071 1
1 882 . 1 1 1 A 63 63 GLU C C 63 178.478 179.037 -0.559 1
1 883 . 1 1 1 A 63 63 GLU CA C 63 58.273 59.194 -0.921 1
1 884 . 1 1 1 A 63 63 GLU CB C 63 29.931 29.352 0.579 1
1 886 . 1 1 1 A 63 63 GLU N N 63 119.084 118.566 0.518 1
1 887 . 1 1 1 A 64 64 LEU H H 64 7.717 8.126 -0.409 1
1 888 . 1 1 1 A 64 64 LEU HA H 64 3.750 3.994 -0.244 1
1 898 . 1 1 1 A 64 64 LEU C C 64 177.535 178.093 -0.558 1
1 899 . 1 1 1 A 64 64 LEU CA C 64 58.944 58.549 0.395 1
1 900 . 1 1 1 A 64 64 LEU CB C 64 41.695 41.693 0.002 1
1 904 . 1 1 1 A 64 64 LEU N N 64 120.357 121.946 -1.589 1
1 905 . 1 1 1 A 65 65 ASP H H 65 7.922 8.346 -0.424 1
1 906 . 1 1 1 A 65 65 ASP HA H 65 4.313 4.229 0.084 1
1 909 . 1 1 1 A 65 65 ASP C C 65 179.095 178.601 0.494 1
1 910 . 1 1 1 A 65 65 ASP CA C 65 57.272 57.919 -0.647 1
1 911 . 1 1 1 A 65 65 ASP CB C 65 40.196 41.569 -1.373 1
1 912 . 1 1 1 A 65 65 ASP N N 65 118.100 118.674 -0.574 1
1 913 . 1 1 1 A 66 66 LYS H H 66 7.802 8.078 -0.276 1
1 914 . 1 1 1 A 66 66 LYS HA H 66 4.078 3.893 0.185 1
1 923 . 1 1 1 A 66 66 LYS C C 66 178.624 178.709 -0.085 1
1 924 . 1 1 1 A 66 66 LYS CA C 66 58.429 59.701 -1.272 1
1 925 . 1 1 1 A 66 66 LYS CB C 66 31.727 32.310 -0.583 1
1 929 . 1 1 1 A 66 66 LYS N N 66 119.343 118.010 1.333 1
1 930 . 1 1 1 A 67 67 ALA H H 67 8.480 7.991 0.489 1
1 931 . 1 1 1 A 67 67 ALA HA H 67 3.853 4.139 -0.286 1
1 935 . 1 1 1 A 67 67 ALA C C 67 178.591 179.540 -0.949 1
1 936 . 1 1 1 A 67 67 ALA CA C 67 55.403 55.456 -0.053 1
1 937 . 1 1 1 A 67 67 ALA CB C 67 17.793 18.252 -0.459 1
1 938 . 1 1 1 A 67 67 ALA N N 67 121.562 122.296 -0.734 1
1 939 . 1 1 1 A 68 68 LYS H H 68 8.186 7.771 0.415 1
1 940 . 1 1 1 A 68 68 LYS HA H 68 3.805 4.012 -0.207 1
1 949 . 1 1 1 A 68 68 LYS C C 68 179.095 178.615 0.480 1
1 950 . 1 1 1 A 68 68 LYS CA C 68 59.952 59.284 0.668 1
1 951 . 1 1 1 A 68 68 LYS CB C 68 32.181 31.901 0.280 1
1 955 . 1 1 1 A 68 68 LYS N N 68 116.165 116.939 -0.774 1
1 956 . 1 1 1 A 69 69 GLU H H 69 7.904 8.183 -0.279 1
1 957 . 1 1 1 A 69 69 GLU HA H 69 3.995 4.091 -0.096 1
1 962 . 1 1 1 A 69 69 GLU C C 69 179.079 179.571 -0.492 1
1 963 . 1 1 1 A 69 69 GLU CA C 69 59.022 58.916 0.106 1
1 964 . 1 1 1 A 69 69 GLU CB C 69 29.274 29.637 -0.363 1
1 966 . 1 1 1 A 69 69 GLU N N 69 119.489 119.562 -0.073 1
1 967 . 1 1 1 A 70 70 LEU H H 70 7.962 8.017 -0.055 1
1 968 . 1 1 1 A 70 70 LEU HA H 70 4.020 3.889 0.131 1
1 978 . 1 1 1 A 70 70 LEU C C 70 178.738 178.708 0.030 1
1 979 . 1 1 1 A 70 70 LEU CA C 70 57.486 57.864 -0.378 1
1 980 . 1 1 1 A 70 70 LEU CB C 70 41.695 41.639 0.056 1
1 984 . 1 1 1 A 70 70 LEU N N 70 119.431 119.653 -0.222 1
1 985 . 1 1 1 A 71 71 ALA H H 71 8.260 8.254 0.006 1
1 986 . 1 1 1 A 71 71 ALA HA H 71 3.845 4.147 -0.302 1
1 990 . 1 1 1 A 71 71 ALA C C 71 179.518 180.086 -0.568 1
1 991 . 1 1 1 A 71 71 ALA CA C 71 55.139 55.444 -0.305 1
1 992 . 1 1 1 A 71 71 ALA CB C 71 18.487 18.614 -0.127 1
1 993 . 1 1 1 A 71 71 ALA N N 71 119.604 121.827 -2.223 1
1 994 . 1 1 1 A 72 72 GLN H H 72 7.910 8.314 -0.404 1
1 995 . 1 1 1 A 72 72 GLN HA H 72 4.154 3.893 0.261 1
1 1002 . 1 1 1 A 72 72 GLN C C 72 178.900 178.899 0.001 1
1 1003 . 1 1 1 A 72 72 GLN CA C 72 58.194 59.147 -0.953 1
1 1004 . 1 1 1 A 72 72 GLN CB C 72 28.056 28.157 -0.101 1
1 1006 . 1 1 1 A 72 72 GLN N N 72 115.960 117.536 -1.576 1
1 1008 . 1 1 1 A 73 73 LYS H H 73 7.841 7.715 0.126 1
1 1009 . 1 1 1 A 73 73 LYS HA H 73 4.171 4.093 0.078 1
1 1018 . 1 1 1 A 73 73 LYS C C 73 177.730 178.269 -0.539 1
1 1019 . 1 1 1 A 73 73 LYS CA C 73 57.867 58.670 -0.803 1
1 1020 . 1 1 1 A 73 73 LYS CB C 73 32.277 32.309 -0.032 1
1 1024 . 1 1 1 A 73 73 LYS N N 73 119.027 119.499 -0.472 1
1 1025 . 1 1 1 A 74 74 MET H H 74 7.746 7.560 0.186 1
1 1026 . 1 1 1 A 74 74 MET HA H 74 4.403 4.567 -0.164 1
1 1034 . 1 1 1 A 74 74 MET C C 74 174.416 174.437 -0.021 1
1 1035 . 1 1 1 A 74 74 MET CA C 74 55.194 55.308 -0.114 1
1 1036 . 1 1 1 A 74 74 MET CB C 74 33.366 33.189 0.177 1
1 1039 . 1 1 1 A 74 74 MET N N 74 115.786 115.032 0.754 1
1 1040 . 1 1 1 A 75 75 GLU H H 75 8.076 7.860 0.216 1
1 1041 . 1 1 1 A 75 75 GLU HA H 75 4.001 3.857 0.144 1
1 1046 . 1 1 1 A 75 75 GLU C C 75 175.130 174.868 0.262 1
1 1047 . 1 1 1 A 75 75 GLU CA C 75 56.722 57.655 -0.933 1
1 1048 . 1 1 1 A 75 75 GLU CB C 75 27.118 27.025 0.093 1
1 1050 . 1 1 1 A 75 75 GLU N N 75 116.249 116.008 0.241 1
1 1051 . 1 1 1 A 76 76 ILE H H 76 7.560 7.891 -0.331 1
1 1052 . 1 1 1 A 76 76 ILE HA H 76 4.428 4.504 -0.076 1
1 1062 . 1 1 1 A 76 76 ILE C C 76 174.529 174.911 -0.382 1
1 1063 . 1 1 1 A 76 76 ILE CA C 76 58.475 60.016 -1.541 1
1 1064 . 1 1 1 A 76 76 ILE CB C 76 40.337 39.840 0.497 1
1 1068 . 1 1 1 A 76 76 ILE N N 76 115.960 119.581 -3.621 1
1 1069 . 1 1 1 A 77 77 ASP H H 77 8.889 8.705 0.184 1
1 1070 . 1 1 1 A 77 77 ASP HA H 77 4.569 4.914 -0.345 1
1 1073 . 1 1 1 A 77 77 ASP C C 77 174.123 175.942 -1.819 1
1 1074 . 1 1 1 A 77 77 ASP CA C 77 54.069 54.209 -0.140 1
1 1075 . 1 1 1 A 77 77 ASP CB C 77 40.233 40.931 -0.698 1
1 1076 . 1 1 1 A 77 77 ASP N N 77 126.142 128.447 -2.305 1
1 1077 . 1 1 1 A 78 78 VAL H H 78 7.754 8.938 -1.184 1
1 1078 . 1 1 1 A 78 78 VAL HA H 78 5.192 5.046 0.146 1
1 1086 . 1 1 1 A 78 78 VAL C C 78 174.968 173.978 0.990 1
1 1087 . 1 1 1 A 78 78 VAL CA C 78 58.804 58.992 -0.188 1
1 1088 . 1 1 1 A 78 78 VAL CB C 78 35.293 34.898 0.395 1
1 1091 . 1 1 1 A 78 78 VAL N N 78 122.844 117.387 5.457 1
1 1092 . 1 1 1 A 79 79 ARG H H 79 8.499 9.101 -0.602 1
1 1093 . 1 1 1 A 79 79 ARG HA H 79 4.712 4.657 0.055 1
1 1100 . 1 1 1 A 79 79 ARG C C 79 174.221 175.305 -1.084 1
1 1101 . 1 1 1 A 79 79 ARG CA C 79 54.117 54.946 -0.829 1
1 1102 . 1 1 1 A 79 79 ARG CB C 79 31.196 30.398 0.798 1
1 1105 . 1 1 1 A 79 79 ARG N N 79 125.637 122.606 3.031 1
1 1106 . 1 1 1 A 80 80 THR H H 80 8.416 8.531 -0.115 1
1 1107 . 1 1 1 A 80 80 THR HA H 80 5.332 4.555 0.777 1
1 1112 . 1 1 1 A 80 80 THR C C 80 174.497 174.328 0.169 1
1 1113 . 1 1 1 A 80 80 THR CA C 80 59.694 61.283 -1.589 1
1 1114 . 1 1 1 A 80 80 THR CB C 80 69.772 69.412 0.360 1
1 1116 . 1 1 1 A 80 80 THR N N 80 118.084 117.904 0.180 1
1 1117 . 1 1 1 A 81 81 ARG H H 81 8.758 8.997 -0.239 1
1 1118 . 1 1 1 A 81 81 ARG HA H 81 4.362 4.834 -0.472 1
1 1126 . 1 1 1 A 81 81 ARG C C 81 173.733 173.901 -0.168 1
1 1127 . 1 1 1 A 81 81 ARG CA C 81 53.273 53.832 -0.559 1
1 1128 . 1 1 1 A 81 81 ARG CB C 81 33.915 32.968 0.947 1
1 1131 . 1 1 1 A 81 81 ARG N N 81 122.844 124.315 -1.471 1
1 1133 . 1 1 1 A 82 82 LYS H H 82 8.721 8.708 0.013 1
1 1134 . 1 1 1 A 82 82 LYS HA H 82 4.701 5.303 -0.602 1
1 1143 . 1 1 1 A 82 82 LYS C C 82 175.667 175.672 -0.005 1
1 1144 . 1 1 1 A 82 82 LYS CA C 82 54.960 55.011 -0.051 1
1 1145 . 1 1 1 A 82 82 LYS CB C 82 32.603 34.708 -2.105 1
1 1149 . 1 1 1 A 82 82 LYS N N 82 124.668 123.961 0.707 1
1 1150 . 1 1 1 A 83 83 VAL H H 83 9.112 9.035 0.077 1
1 1151 . 1 1 1 A 83 83 VAL HA H 83 4.796 4.834 -0.038 1
1 1159 . 1 1 1 A 83 83 VAL C C 83 174.594 174.954 -0.360 1
1 1160 . 1 1 1 A 83 83 VAL CA C 83 59.413 59.768 -0.355 1
1 1161 . 1 1 1 A 83 83 VAL CB C 83 35.298 35.608 -0.310 1
1 1164 . 1 1 1 A 83 83 VAL N N 83 122.381 120.568 1.813 1
1 1165 . 1 1 1 A 84 84 THR H H 84 9.200 8.617 0.583 1
1 1166 . 1 1 1 A 84 84 THR HA H 84 4.579 4.566 0.013 1
1 1171 . 1 1 1 A 84 84 THR C C 84 173.993 174.831 -0.838 1
1 1172 . 1 1 1 A 84 84 THR CA C 84 60.960 61.854 -0.894 1
1 1173 . 1 1 1 A 84 84 THR CB C 84 70.100 69.901 0.199 1
1 1175 . 1 1 1 A 84 84 THR N N 84 113.183 115.780 -2.597 1
1 1176 . 1 1 1 A 85 85 SER H H 85 7.688 7.936 -0.248 1
1 1177 . 1 1 1 A 85 85 SER HA H 85 5.136 4.705 0.431 1
1 1180 . 1 1 1 A 85 85 SER CA C 85 55.205 56.091 -0.886 1
1 1181 . 1 1 1 A 85 85 SER CB C 85 64.376 63.987 0.389 1
1 1182 . 1 1 1 A 85 85 SER N N 85 115.555 118.128 -2.573 1
1 1183 . 1 1 1 A 86 86 PRO HA H 86 4.090 4.303 -0.213 1
1 1190 . 1 1 1 A 86 86 PRO C C 86 177.227 178.412 -1.185 1
1 1191 . 1 1 1 A 86 86 PRO CA C 86 65.038 65.713 -0.675 1
1 1192 . 1 1 1 A 86 86 PRO CB C 86 31.711 31.785 -0.074 1
1 1195 . 1 1 1 A 87 87 ASP H H 87 8.131 8.374 -0.243 1
1 1196 . 1 1 1 A 87 87 ASP HA H 87 4.223 4.316 -0.093 1
1 1199 . 1 1 1 A 87 87 ASP C C 87 178.721 179.437 -0.716 1
1 1200 . 1 1 1 A 87 87 ASP CA C 87 57.311 57.117 0.194 1
1 1201 . 1 1 1 A 87 87 ASP CB C 87 40.102 40.229 -0.127 1
1 1202 . 1 1 1 A 87 87 ASP N N 87 115.381 116.740 -1.359 1
1 1203 . 1 1 1 A 88 88 GLU H H 88 7.571 8.141 -0.570 1
1 1204 . 1 1 1 A 88 88 GLU HA H 88 3.659 3.984 -0.325 1
1 1209 . 1 1 1 A 88 88 GLU C C 88 177.097 178.710 -1.613 1
1 1210 . 1 1 1 A 88 88 GLU CA C 88 58.729 58.794 -0.065 1
1 1211 . 1 1 1 A 88 88 GLU CB C 88 30.052 29.802 0.250 1
1 1213 . 1 1 1 A 88 88 GLU N N 88 120.009 120.210 -0.201 1
1 1214 . 1 1 1 A 89 89 ALA H H 89 7.423 7.826 -0.403 1
1 1215 . 1 1 1 A 89 89 ALA HA H 89 3.900 4.376 -0.476 1
1 1219 . 1 1 1 A 89 89 ALA C C 89 178.267 179.938 -1.671 1
1 1220 . 1 1 1 A 89 89 ALA CA C 89 55.607 55.058 0.549 1
1 1221 . 1 1 1 A 89 89 ALA CB C 89 17.348 18.547 -1.199 1
1 1222 . 1 1 1 A 89 89 ALA N N 89 118.873 122.032 -3.159 1
1 1223 . 1 1 1 A 90 90 LYS H H 90 8.046 8.328 -0.282 1
1 1224 . 1 1 1 A 90 90 LYS HA H 90 3.669 4.015 -0.346 1
1 1233 . 1 1 1 A 90 90 LYS C C 90 177.649 179.132 -1.483 1
1 1234 . 1 1 1 A 90 90 LYS CA C 90 60.351 59.834 0.517 1
1 1235 . 1 1 1 A 90 90 LYS CB C 90 32.087 32.207 -0.120 1
1 1239 . 1 1 1 A 90 90 LYS N N 90 114.834 117.508 -2.674 1
1 1240 . 1 1 1 A 91 91 ARG H H 91 7.468 7.667 -0.199 1
1 1241 . 1 1 1 A 91 91 ARG HA H 91 3.887 3.872 0.015 1
1 1249 . 1 1 1 A 91 91 ARG C C 91 178.998 179.150 -0.152 1
1 1250 . 1 1 1 A 91 91 ARG CA C 91 59.164 59.143 0.021 1
1 1251 . 1 1 1 A 91 91 ARG CB C 91 29.274 29.673 -0.399 1
1 1254 . 1 1 1 A 91 91 ARG N N 91 119.029 119.636 -0.607 1
1 1256 . 1 1 1 A 92 92 TRP H H 92 8.136 7.686 0.450 1
1 1257 . 1 1 1 A 92 92 TRP HA H 92 4.818 4.551 0.267 1
1 1266 . 1 1 1 A 92 92 TRP C C 92 179.566 178.907 0.659 1
1 1267 . 1 1 1 A 92 92 TRP CA C 92 58.663 58.878 -0.215 1
1 1268 . 1 1 1 A 92 92 TRP CB C 92 29.790 29.564 0.226 1
1 1274 . 1 1 1 A 92 92 TRP N N 92 118.100 120.139 -2.039 1
1 1276 . 1 1 1 A 93 93 ILE H H 93 8.363 8.529 -0.166 1
1 1277 . 1 1 1 A 93 93 ILE HA H 93 3.544 3.803 -0.259 1
1 1287 . 1 1 1 A 93 93 ILE C C 93 176.820 177.645 -0.825 1
1 1288 . 1 1 1 A 93 93 ILE CA C 93 66.225 65.519 0.706 1
1 1289 . 1 1 1 A 93 93 ILE CB C 93 37.571 37.376 0.195 1
1 1293 . 1 1 1 A 93 93 ILE N N 93 120.588 120.150 0.438 1
1 1294 . 1 1 1 A 94 94 LYS H H 94 8.264 8.139 0.125 1
1 1295 . 1 1 1 A 94 94 LYS HA H 94 3.865 3.929 -0.064 1
1 1304 . 1 1 1 A 94 94 LYS C C 94 179.258 179.008 0.250 1
1 1305 . 1 1 1 A 94 94 LYS CA C 94 59.889 59.815 0.074 1
1 1306 . 1 1 1 A 94 94 LYS CB C 94 32.225 32.523 -0.298 1
1 1310 . 1 1 1 A 94 94 LYS N N 94 121.687 120.682 1.005 1
1 1311 . 1 1 1 A 95 95 GLU H H 95 8.360 8.340 0.020 1
1 1312 . 1 1 1 A 95 95 GLU HA H 95 4.023 4.090 -0.067 1
1 1317 . 1 1 1 A 95 95 GLU C C 95 178.884 179.229 -0.345 1
1 1318 . 1 1 1 A 95 95 GLU CA C 95 59.366 59.052 0.314 1
1 1319 . 1 1 1 A 95 95 GLU CB C 95 29.508 29.500 0.008 1
1 1321 . 1 1 1 A 95 95 GLU N N 95 118.505 117.797 0.708 1
1 1322 . 1 1 1 A 96 96 PHE H H 96 8.212 8.441 -0.229 1
1 1323 . 1 1 1 A 96 96 PHE HA H 96 4.512 4.193 0.319 1
1 1331 . 1 1 1 A 96 96 PHE C C 96 176.820 178.228 -1.408 1
1 1332 . 1 1 1 A 96 96 PHE CA C 96 59.608 61.482 -1.874 1
1 1333 . 1 1 1 A 96 96 PHE CB C 96 40.431 39.183 1.248 1
1 1339 . 1 1 1 A 96 96 PHE N N 96 120.369 122.261 -1.892 1
1 1340 . 1 1 1 A 97 97 SER H H 97 8.216 7.999 0.217 1
1 1341 . 1 1 1 A 97 97 SER HA H 97 3.816 4.072 -0.256 1
1 1344 . 1 1 1 A 97 97 SER C C 97 175.618 177.279 -1.661 1
1 1345 . 1 1 1 A 97 97 SER CA C 97 60.492 61.166 -0.674 1
1 1346 . 1 1 1 A 97 97 SER CB C 97 63.022 62.735 0.287 1
1 1347 . 1 1 1 A 97 97 SER N N 97 111.969 114.259 -2.290 1
1 1348 . 1 1 1 A 98 98 GLU H H 98 7.655 7.939 -0.284 1
1 1349 . 1 1 1 A 98 98 GLU HA H 98 4.187 3.902 0.285 1
1 1354 . 1 1 1 A 98 98 GLU C C 98 177.698 179.032 -1.334 1
1 1355 . 1 1 1 A 98 98 GLU CA C 98 57.069 59.465 -2.396 1
1 1356 . 1 1 1 A 98 98 GLU CB C 98 29.321 29.164 0.157 1
1 1358 . 1 1 1 A 98 98 GLU N N 98 120.588 121.925 -1.337 1
1 1359 . 1 1 1 A 99 99 GLU H H 99 7.794 7.376 0.418 1
1 1360 . 1 1 1 A 99 99 GLU HA H 99 4.123 4.192 -0.069 1
1 1365 . 1 1 1 A 99 99 GLU C C 99 177.665 177.644 0.021 1
1 1366 . 1 1 1 A 99 99 GLU CA C 99 57.304 55.866 1.438 1
1 1367 . 1 1 1 A 99 99 GLU CB C 99 29.368 30.026 -0.658 1
1 1369 . 1 1 1 A 99 99 GLU N N 99 120.067 115.916 4.151 1
1 1370 . 1 1 1 A 100 100 GLY H H 100 8.138 8.403 -0.265 1
1 1371 . 1 1 1 A 100 100 GLY HA2 H 100 3.865 3.715 0.150 1
1 1372 . 1 1 1 A 100 100 GLY HA3 H 100 3.715 3.788 -0.073 1
1 1373 . 1 1 1 A 100 100 GLY C C 100 174.464 175.013 -0.549 1
1 1374 . 1 1 1 A 100 100 GLY CA C 100 45.305 46.480 -1.175 1
1 1375 . 1 1 1 A 100 100 GLY N N 100 107.802 109.132 -1.330 1
1 1376 . 1 1 1 A 101 101 GLY H H 101 8.023 8.423 -0.400 1
1 1377 . 1 1 1 A 101 101 GLY HA2 H 101 3.865 3.757 0.108 1
1 1378 . 1 1 1 A 101 101 GLY HA3 H 101 3.892 3.817 0.075 1
1 1379 . 1 1 1 A 101 101 GLY C C 101 174.204 173.635 0.569 1
1 1380 . 1 1 1 A 101 101 GLY CA C 101 45.036 45.566 -0.530 1
1 1381 . 1 1 1 A 101 101 GLY N N 101 108.032 107.243 0.789 1
1 1382 . 1 1 1 A 102 102 SER H H 102 8.059 7.740 0.319 1
1 1383 . 1 1 1 A 102 102 SER HA H 102 4.380 4.907 -0.527 1
1 1386 . 1 1 1 A 102 102 SER C C 102 174.627 174.147 0.480 1
1 1387 . 1 1 1 A 102 102 SER CA C 102 58.194 57.128 1.066 1
1 1388 . 1 1 1 A 102 102 SER CB C 102 63.538 66.397 -2.859 1
1 1389 . 1 1 1 A 102 102 SER N N 102 115.266 115.849 -0.583 1
1 1390 . 1 1 1 A 103 103 LEU H H 103 8.287 8.838 -0.551 1
1 1391 . 1 1 1 A 103 103 LEU HA H 103 4.301 3.976 0.325 1
1 1401 . 1 1 1 A 103 103 LEU C C 103 177.292 177.981 -0.689 1
1 1402 . 1 1 1 A 103 103 LEU CA C 103 55.007 58.274 -3.267 1
1 1403 . 1 1 1 A 103 103 LEU CB C 103 42.023 41.502 0.521 1
1 1407 . 1 1 1 A 103 103 LEU N N 103 123.596 124.598 -1.002 1
1 1408 . 1 1 1 A 104 104 GLU H H 104 8.216 8.192 0.024 1
1 1409 . 1 1 1 A 104 104 GLU HA H 104 4.126 3.968 0.158 1
1 1414 . 1 1 1 A 104 104 GLU CA C 104 56.518 55.925 0.593 1
1 1415 . 1 1 1 A 104 104 GLU CB C 104 29.837 28.538 1.299 1
1 1417 . 1 1 1 A 104 104 GLU N N 104 120.510 114.594 5.916 1
1 1418 . 1 1 1 A 105 105 HIS HA H 105 4.593 4.529 0.064 1
1 1421 . 1 1 1 A 105 105 HIS C C 105 173.766 174.850 -1.084 1
1 1422 . 1 1 1 A 105 105 HIS CA C 105 55.536 55.478 0.058 1
1 1423 . 1 1 1 A 105 105 HIS CB C 105 30.001 29.717 0.284 1
1 1424 . 1 1 1 A 106 106 HIS H H 106 8.154 8.742 -0.588 1
1 1425 . 1 1 1 A 106 106 HIS HA H 106 4.407 4.550 -0.143 1
1 1428 . 1 1 1 A 106 106 HIS CA C 106 56.920 55.823 1.097 1
1 1429 . 1 1 1 A 106 106 HIS CB C 106 30.001 31.810 -1.809 1
1 14 . 2 1 1 A 2 2 LEU H H 2 8.509 9.417 -0.908 1
1 15 . 2 1 1 A 2 2 LEU HA H 2 4.463 4.777 -0.314 1
1 25 . 2 1 1 A 2 2 LEU C C 2 173.944 176.171 -2.227 1
1 26 . 2 1 1 A 2 2 LEU CA C 2 54.471 54.349 0.122 1
1 27 . 2 1 1 A 2 2 LEU CB C 2 43.595 43.221 0.374 1
1 31 . 2 1 1 A 2 2 LEU N N 2 127.160 127.531 -0.371 1
1 32 . 2 1 1 A 3 3 LEU H H 3 7.844 8.612 -0.768 1
1 33 . 2 1 1 A 3 3 LEU HA H 3 5.128 5.412 -0.284 1
1 43 . 2 1 1 A 3 3 LEU C C 3 175.423 175.053 0.370 1
1 44 . 2 1 1 A 3 3 LEU CA C 3 53.566 52.783 0.783 1
1 45 . 2 1 1 A 3 3 LEU CB C 3 44.039 44.189 -0.150 1
1 49 . 2 1 1 A 3 3 LEU N N 3 122.555 123.310 -0.755 1
1 50 . 2 1 1 A 4 4 TYR H H 4 8.360 9.464 -1.104 1
1 51 . 2 1 1 A 4 4 TYR HA H 4 5.143 5.093 0.050 1
1 58 . 2 1 1 A 4 4 TYR C C 4 174.481 175.106 -0.625 1
1 59 . 2 1 1 A 4 4 TYR CA C 4 56.577 56.486 0.091 1
1 60 . 2 1 1 A 4 4 TYR CB C 4 43.840 42.916 0.924 1
1 65 . 2 1 1 A 4 4 TYR N N 4 119.315 123.107 -3.792 1
1 66 . 2 1 1 A 5 5 VAL H H 5 8.918 8.975 -0.057 1
1 67 . 2 1 1 A 5 5 VAL HA H 5 5.106 4.825 0.281 1
1 75 . 2 1 1 A 5 5 VAL C C 5 174.042 174.490 -0.448 1
1 76 . 2 1 1 A 5 5 VAL CA C 5 59.852 61.067 -1.215 1
1 77 . 2 1 1 A 5 5 VAL CB C 5 33.816 34.496 -0.680 1
1 80 . 2 1 1 A 5 5 VAL N N 5 119.952 121.789 -1.837 1
1 81 . 2 1 1 A 6 6 LEU H H 6 9.315 9.463 -0.148 1
1 82 . 2 1 1 A 6 6 LEU HA H 6 5.466 5.546 -0.080 1
1 92 . 2 1 1 A 6 6 LEU C C 6 175.049 175.086 -0.037 1
1 93 . 2 1 1 A 6 6 LEU CA C 6 52.090 53.402 -1.312 1
1 94 . 2 1 1 A 6 6 LEU CB C 6 44.103 43.387 0.716 1
1 98 . 2 1 1 A 6 6 LEU N N 6 126.917 126.722 0.195 1
1 99 . 2 1 1 A 7 7 ILE H H 7 8.458 8.965 -0.507 1
1 100 . 2 1 1 A 7 7 ILE HA H 7 5.131 5.256 -0.125 1
1 110 . 2 1 1 A 7 7 ILE C C 7 173.213 173.836 -0.623 1
1 111 . 2 1 1 A 7 7 ILE CA C 7 58.463 59.737 -1.274 1
1 112 . 2 1 1 A 7 7 ILE CB C 7 41.020 41.112 -0.092 1
1 116 . 2 1 1 A 7 7 ILE N N 7 119.778 126.501 -6.723 1
1 117 . 2 1 1 A 8 8 ILE H H 8 8.797 9.339 -0.542 1
1 118 . 2 1 1 A 8 8 ILE HA H 8 4.611 4.903 -0.292 1
1 128 . 2 1 1 A 8 8 ILE C C 8 174.611 174.824 -0.213 1
1 129 . 2 1 1 A 8 8 ILE CA C 8 60.227 60.402 -0.175 1
1 130 . 2 1 1 A 8 8 ILE CB C 8 37.665 39.075 -1.410 1
1 134 . 2 1 1 A 8 8 ILE N N 8 128.919 129.687 -0.768 1
1 135 . 2 1 1 A 9 9 SER H H 9 7.811 8.782 -0.971 1
1 136 . 2 1 1 A 9 9 SER HA H 9 4.429 4.938 -0.509 1
1 140 . 2 1 1 A 9 9 SER C C 9 172.937 172.764 0.173 1
1 141 . 2 1 1 A 9 9 SER CA C 9 58.241 56.831 1.410 1
1 142 . 2 1 1 A 9 9 SER CB C 9 64.261 64.356 -0.095 1
1 143 . 2 1 1 A 9 9 SER N N 9 116.365 121.819 -5.454 1
1 144 . 2 1 1 A 10 10 ASN H H 10 8.641 8.663 -0.022 1
1 145 . 2 1 1 A 10 10 ASN HA H 10 4.938 4.975 -0.037 1
1 150 . 2 1 1 A 10 10 ASN C C 10 174.497 175.272 -0.775 1
1 151 . 2 1 1 A 10 10 ASN CA C 10 52.221 53.631 -1.410 1
1 152 . 2 1 1 A 10 10 ASN CB C 10 39.128 39.938 -0.810 1
1 153 . 2 1 1 A 10 10 ASN N N 10 122.612 120.592 2.020 1
1 155 . 2 1 1 A 11 11 ASP H H 11 8.673 7.194 1.479 1
1 156 . 2 1 1 A 11 11 ASP HA H 11 4.596 4.613 -0.017 1
1 159 . 2 1 1 A 11 11 ASP C C 11 175.342 176.037 -0.695 1
1 160 . 2 1 1 A 11 11 ASP CA C 11 53.233 54.229 -0.996 1
1 161 . 2 1 1 A 11 11 ASP CB C 11 40.965 41.129 -0.164 1
1 162 . 2 1 1 A 11 11 ASP N N 11 122.717 119.606 3.111 1
1 163 . 2 1 1 A 12 12 LYS H H 12 8.562 8.655 -0.093 1
1 164 . 2 1 1 A 12 12 LYS HA H 12 3.854 3.977 -0.123 1
1 173 . 2 1 1 A 12 12 LYS C C 12 178.754 178.475 0.279 1
1 174 . 2 1 1 A 12 12 LYS CA C 12 59.581 60.254 -0.673 1
1 175 . 2 1 1 A 12 12 LYS CB C 12 32.378 32.538 -0.160 1
1 179 . 2 1 1 A 12 12 LYS N N 12 125.737 125.018 0.719 1
1 180 . 2 1 1 A 13 13 LYS H H 13 8.075 7.799 0.276 1
1 181 . 2 1 1 A 13 13 LYS HA H 13 4.154 4.065 0.089 1
1 190 . 2 1 1 A 13 13 LYS C C 13 178.315 178.912 -0.597 1
1 191 . 2 1 1 A 13 13 LYS CA C 13 58.532 59.222 -0.690 1
1 192 . 2 1 1 A 13 13 LYS CB C 13 31.452 32.281 -0.829 1
1 196 . 2 1 1 A 13 13 LYS N N 13 119.604 119.755 -0.151 1
1 197 . 2 1 1 A 14 14 LEU H H 14 7.552 8.166 -0.614 1
1 198 . 2 1 1 A 14 14 LEU HA H 14 3.682 4.047 -0.365 1
1 208 . 2 1 1 A 14 14 LEU C C 14 178.429 178.467 -0.038 1
1 209 . 2 1 1 A 14 14 LEU CA C 14 58.999 58.273 0.726 1
1 210 . 2 1 1 A 14 14 LEU CB C 14 41.228 41.368 -0.140 1
1 214 . 2 1 1 A 14 14 LEU N N 14 122.266 121.442 0.824 1
1 215 . 2 1 1 A 15 15 ILE H H 15 8.074 8.003 0.071 1
1 216 . 2 1 1 A 15 15 ILE HA H 15 3.264 3.527 -0.263 1
1 226 . 2 1 1 A 15 15 ILE C C 15 177.000 177.949 -0.949 1
1 227 . 2 1 1 A 15 15 ILE CA C 15 65.939 65.362 0.577 1
1 228 . 2 1 1 A 15 15 ILE CB C 15 37.983 37.519 0.464 1
1 232 . 2 1 1 A 15 15 ILE N N 15 118.214 119.591 -1.377 1
1 233 . 2 1 1 A 16 16 GLU H H 16 8.016 8.296 -0.280 1
1 234 . 2 1 1 A 16 16 GLU HA H 16 4.045 3.991 0.054 1
1 239 . 2 1 1 A 16 16 GLU C C 16 179.388 179.484 -0.096 1
1 240 . 2 1 1 A 16 16 GLU CA C 16 59.032 59.893 -0.861 1
1 241 . 2 1 1 A 16 16 GLU CB C 16 29.200 29.345 -0.145 1
1 243 . 2 1 1 A 16 16 GLU N N 16 118.484 118.881 -0.397 1
1 244 . 2 1 1 A 17 17 GLU H H 17 8.063 8.393 -0.330 1
1 245 . 2 1 1 A 17 17 GLU HA H 17 4.053 4.033 0.020 1
1 250 . 2 1 1 A 17 17 GLU C C 17 179.306 179.140 0.166 1
1 251 . 2 1 1 A 17 17 GLU CA C 17 58.636 59.478 -0.842 1
1 252 . 2 1 1 A 17 17 GLU CB C 17 29.011 29.348 -0.337 1
1 254 . 2 1 1 A 17 17 GLU N N 17 118.100 120.742 -2.642 1
1 255 . 2 1 1 A 18 18 ALA H H 18 8.655 8.031 0.624 1
1 256 . 2 1 1 A 18 18 ALA HA H 18 3.775 4.080 -0.305 1
1 260 . 2 1 1 A 18 18 ALA C C 18 178.559 179.980 -1.421 1
1 261 . 2 1 1 A 18 18 ALA CA C 18 54.960 55.171 -0.211 1
1 262 . 2 1 1 A 18 18 ALA CB C 18 17.960 18.243 -0.283 1
1 263 . 2 1 1 A 18 18 ALA N N 18 122.439 122.764 -0.325 1
1 264 . 2 1 1 A 19 19 ARG H H 19 8.900 7.980 0.920 1
1 265 . 2 1 1 A 19 19 ARG HA H 19 3.809 4.060 -0.251 1
1 273 . 2 1 1 A 19 19 ARG C C 19 178.721 179.009 -0.288 1
1 274 . 2 1 1 A 19 19 ARG CA C 19 59.976 59.722 0.254 1
1 275 . 2 1 1 A 19 19 ARG CB C 19 29.572 29.913 -0.341 1
1 278 . 2 1 1 A 19 19 ARG N N 19 118.563 117.753 0.810 1
1 280 . 2 1 1 A 20 20 LYS H H 20 7.792 8.049 -0.257 1
1 281 . 2 1 1 A 20 20 LYS HA H 20 4.052 4.034 0.018 1
1 290 . 2 1 1 A 20 20 LYS C C 20 179.648 179.782 -0.134 1
1 291 . 2 1 1 A 20 20 LYS CA C 20 59.296 59.288 0.008 1
1 292 . 2 1 1 A 20 20 LYS CB C 20 32.216 32.115 0.101 1
1 296 . 2 1 1 A 20 20 LYS N N 20 118.638 119.442 -0.804 1
1 297 . 2 1 1 A 21 21 MET H H 21 7.684 8.376 -0.692 1
1 298 . 2 1 1 A 21 21 MET HA H 21 4.411 4.200 0.211 1
1 306 . 2 1 1 A 21 21 MET C C 21 177.909 178.182 -0.273 1
1 307 . 2 1 1 A 21 21 MET CA C 21 57.009 59.253 -2.244 1
1 308 . 2 1 1 A 21 21 MET CB C 21 32.028 32.483 -0.455 1
1 311 . 2 1 1 A 21 21 MET N N 21 118.100 118.526 -0.426 1
1 312 . 2 1 1 A 22 22 ALA H H 22 8.815 8.046 0.769 1
1 313 . 2 1 1 A 22 22 ALA HA H 22 3.826 3.920 -0.094 1
1 317 . 2 1 1 A 22 22 ALA C C 22 178.835 179.679 -0.844 1
1 318 . 2 1 1 A 22 22 ALA CA C 22 55.427 55.608 -0.181 1
1 319 . 2 1 1 A 22 22 ALA CB C 22 18.059 18.383 -0.324 1
1 320 . 2 1 1 A 22 22 ALA N N 22 122.150 120.852 1.298 1
1 321 . 2 1 1 A 23 23 GLU H H 23 8.276 8.221 0.055 1
1 322 . 2 1 1 A 23 23 GLU HA H 23 4.146 3.983 0.163 1
1 327 . 2 1 1 A 23 23 GLU C C 23 180.151 179.057 1.094 1
1 328 . 2 1 1 A 23 23 GLU CA C 23 58.999 59.538 -0.539 1
1 329 . 2 1 1 A 23 23 GLU CB C 23 29.160 29.549 -0.389 1
1 331 . 2 1 1 A 23 23 GLU N N 23 117.001 117.803 -0.802 1
1 332 . 2 1 1 A 24 24 LYS H H 24 7.573 7.755 -0.182 1
1 333 . 2 1 1 A 24 24 LYS HA H 24 4.101 4.040 0.061 1
1 342 . 2 1 1 A 24 24 LYS C C 24 177.145 178.734 -1.589 1
1 343 . 2 1 1 A 24 24 LYS CA C 24 58.261 59.225 -0.964 1
1 344 . 2 1 1 A 24 24 LYS CB C 24 32.079 32.117 -0.038 1
1 348 . 2 1 1 A 24 24 LYS N N 24 119.960 119.362 0.598 1
1 349 . 2 1 1 A 25 25 ALA H H 25 7.710 7.804 -0.094 1
1 350 . 2 1 1 A 25 25 ALA HA H 25 4.413 4.365 0.048 1
1 354 . 2 1 1 A 25 25 ALA C C 25 175.325 176.333 -1.008 1
1 355 . 2 1 1 A 25 25 ALA CA C 25 51.208 52.145 -0.937 1
1 356 . 2 1 1 A 25 25 ALA CB C 25 18.520 19.433 -0.913 1
1 357 . 2 1 1 A 25 25 ALA N N 25 119.257 118.501 0.756 1
1 358 . 2 1 1 A 26 26 ASN H H 26 7.840 7.889 -0.049 1
1 359 . 2 1 1 A 26 26 ASN HA H 26 4.357 4.253 0.104 1
1 364 . 2 1 1 A 26 26 ASN C C 26 173.587 173.626 -0.039 1
1 365 . 2 1 1 A 26 26 ASN CA C 26 54.307 54.502 -0.195 1
1 366 . 2 1 1 A 26 26 ASN CB C 26 36.972 36.495 0.477 1
1 367 . 2 1 1 A 26 26 ASN N N 26 115.266 113.909 1.357 1
1 369 . 2 1 1 A 27 27 LEU H H 27 8.241 7.794 0.447 1
1 370 . 2 1 1 A 27 27 LEU HA H 27 4.652 4.723 -0.071 1
1 380 . 2 1 1 A 27 27 LEU C C 27 175.894 175.632 0.262 1
1 381 . 2 1 1 A 27 27 LEU CA C 27 52.923 53.561 -0.638 1
1 382 . 2 1 1 A 27 27 LEU CB C 27 44.090 44.084 0.006 1
1 386 . 2 1 1 A 27 27 LEU N N 27 116.828 118.576 -1.748 1
1 387 . 2 1 1 A 28 28 GLU H H 28 7.798 8.470 -0.672 1
1 388 . 2 1 1 A 28 28 GLU HA H 28 4.310 4.610 -0.300 1
1 393 . 2 1 1 A 28 28 GLU C C 28 173.944 175.087 -1.143 1
1 394 . 2 1 1 A 28 28 GLU CA C 28 55.460 56.141 -0.681 1
1 395 . 2 1 1 A 28 28 GLU CB C 28 30.512 30.286 0.226 1
1 397 . 2 1 1 A 28 28 GLU N N 28 121.340 122.604 -1.264 1
1 398 . 2 1 1 A 29 29 LEU H H 29 8.451 8.990 -0.539 1
1 399 . 2 1 1 A 29 29 LEU HA H 29 5.662 5.342 0.320 1
1 409 . 2 1 1 A 29 29 LEU C C 29 176.902 175.045 1.857 1
1 410 . 2 1 1 A 29 29 LEU CA C 29 53.186 54.093 -0.907 1
1 411 . 2 1 1 A 29 29 LEU CB C 29 44.914 44.179 0.735 1
1 415 . 2 1 1 A 29 29 LEU N N 29 126.547 127.775 -1.228 1
1 416 . 2 1 1 A 30 30 ARG H H 30 9.094 9.458 -0.364 1
1 417 . 2 1 1 A 30 30 ARG HA H 30 4.910 4.859 0.051 1
1 425 . 2 1 1 A 30 30 ARG C C 30 175.147 175.923 -0.776 1
1 426 . 2 1 1 A 30 30 ARG CA C 30 53.417 54.647 -1.230 1
1 427 . 2 1 1 A 30 30 ARG CB C 30 32.555 33.194 -0.639 1
1 430 . 2 1 1 A 30 30 ARG N N 30 125.043 126.562 -1.519 1
1 432 . 2 1 1 A 31 31 THR H H 31 8.496 8.655 -0.159 1
1 433 . 2 1 1 A 31 31 THR HA H 31 4.888 4.929 -0.041 1
1 438 . 2 1 1 A 31 31 THR C C 31 173.961 174.130 -0.169 1
1 439 . 2 1 1 A 31 31 THR CA C 31 60.445 61.106 -0.661 1
1 440 . 2 1 1 A 31 31 THR CB C 31 69.492 69.730 -0.238 1
1 442 . 2 1 1 A 31 31 THR N N 31 114.745 116.189 -1.444 1
1 443 . 2 1 1 A 32 32 VAL H H 32 8.480 9.071 -0.591 1
1 444 . 2 1 1 A 32 32 VAL HA H 32 4.411 3.995 0.416 1
1 452 . 2 1 1 A 32 32 VAL C C 32 175.082 175.598 -0.516 1
1 453 . 2 1 1 A 32 32 VAL CA C 32 60.946 62.429 -1.483 1
1 454 . 2 1 1 A 32 32 VAL CB C 32 34.487 32.030 2.457 1
1 457 . 2 1 1 A 32 32 VAL N N 32 122.324 126.955 -4.631 1
1 458 . 2 1 1 A 33 33 LYS H H 33 9.304 8.843 0.461 1
1 459 . 2 1 1 A 33 33 LYS HA H 33 4.534 4.506 0.028 1
1 468 . 2 1 1 A 33 33 LYS C C 33 176.740 176.612 0.128 1
1 469 . 2 1 1 A 33 33 LYS CA C 33 56.846 57.012 -0.166 1
1 470 . 2 1 1 A 33 33 LYS CB C 33 34.355 33.950 0.405 1
1 474 . 2 1 1 A 33 33 LYS N N 33 123.654 126.569 -2.915 1
1 475 . 2 1 1 A 34 34 THR H H 34 7.245 7.521 -0.276 1
1 476 . 2 1 1 A 34 34 THR HA H 34 4.780 4.542 0.238 1
1 481 . 2 1 1 A 34 34 THR C C 34 174.529 174.654 -0.125 1
1 482 . 2 1 1 A 34 34 THR CA C 34 58.859 59.791 -0.932 1
1 483 . 2 1 1 A 34 34 THR CB C 34 73.023 71.761 1.262 1
1 485 . 2 1 1 A 34 34 THR N N 34 106.300 110.979 -4.679 1
1 486 . 2 1 1 A 35 35 GLU H H 35 9.174 8.762 0.412 1
1 487 . 2 1 1 A 35 35 GLU HA H 35 3.886 3.938 -0.052 1
1 492 . 2 1 1 A 35 35 GLU C C 35 177.714 177.331 0.383 1
1 493 . 2 1 1 A 35 35 GLU CA C 35 59.233 59.503 -0.270 1
1 494 . 2 1 1 A 35 35 GLU CB C 35 29.377 29.399 -0.022 1
1 496 . 2 1 1 A 35 35 GLU N N 35 121.919 121.793 0.126 1
1 497 . 2 1 1 A 36 36 ASP H H 36 8.185 8.217 -0.032 1
1 498 . 2 1 1 A 36 36 ASP HA H 36 4.289 4.267 0.022 1
1 501 . 2 1 1 A 36 36 ASP C C 36 178.348 178.381 -0.033 1
1 502 . 2 1 1 A 36 36 ASP CA C 36 56.962 57.542 -0.580 1
1 503 . 2 1 1 A 36 36 ASP CB C 36 40.214 41.375 -1.161 1
1 504 . 2 1 1 A 36 36 ASP N N 36 118.332 119.859 -1.527 1
1 505 . 2 1 1 A 37 37 GLU H H 37 7.741 7.773 -0.032 1
1 506 . 2 1 1 A 37 37 GLU HA H 37 3.708 3.732 -0.024 1
1 511 . 2 1 1 A 37 37 GLU C C 37 177.324 178.557 -1.233 1
1 512 . 2 1 1 A 37 37 GLU CA C 37 58.698 58.985 -0.287 1
1 513 . 2 1 1 A 37 37 GLU CB C 37 30.199 29.040 1.159 1
1 515 . 2 1 1 A 37 37 GLU N N 37 120.704 119.039 1.665 1
1 516 . 2 1 1 A 38 38 LEU H H 38 7.531 8.004 -0.473 1
1 517 . 2 1 1 A 38 38 LEU HA H 38 3.873 3.867 0.006 1
1 527 . 2 1 1 A 38 38 LEU C C 38 177.357 178.393 -1.036 1
1 528 . 2 1 1 A 38 38 LEU CA C 38 58.305 58.174 0.131 1
1 529 . 2 1 1 A 38 38 LEU CB C 38 40.837 41.605 -0.768 1
1 533 . 2 1 1 A 38 38 LEU N N 38 119.200 121.722 -2.522 1
1 534 . 2 1 1 A 39 39 LYS H H 39 8.083 7.897 0.186 1
1 535 . 2 1 1 A 39 39 LYS HA H 39 3.608 3.865 -0.257 1
1 544 . 2 1 1 A 39 39 LYS C C 39 177.373 178.868 -1.495 1
1 545 . 2 1 1 A 39 39 LYS CA C 39 60.290 59.733 0.557 1
1 546 . 2 1 1 A 39 39 LYS CB C 39 32.178 32.537 -0.359 1
1 550 . 2 1 1 A 39 39 LYS N N 39 116.943 118.822 -1.879 1
1 551 . 2 1 1 A 40 40 LYS H H 40 7.632 8.013 -0.381 1
1 552 . 2 1 1 A 40 40 LYS HA H 40 3.864 4.256 -0.392 1
1 561 . 2 1 1 A 40 40 LYS C C 40 179.566 178.747 0.819 1
1 562 . 2 1 1 A 40 40 LYS CA C 40 58.993 58.888 0.105 1
1 563 . 2 1 1 A 40 40 LYS CB C 40 31.758 32.061 -0.303 1
1 567 . 2 1 1 A 40 40 LYS N N 40 118.274 119.255 -0.981 1
1 568 . 2 1 1 A 41 41 TYR H H 41 7.823 8.041 -0.218 1
1 569 . 2 1 1 A 41 41 TYR HA H 41 3.926 4.010 -0.084 1
1 576 . 2 1 1 A 41 41 TYR C C 41 176.625 177.779 -1.154 1
1 577 . 2 1 1 A 41 41 TYR CA C 41 59.757 61.028 -1.271 1
1 578 . 2 1 1 A 41 41 TYR CB C 41 36.901 37.991 -1.090 1
1 583 . 2 1 1 A 41 41 TYR N N 41 117.811 118.991 -1.180 1
1 584 . 2 1 1 A 42 42 LEU H H 42 7.964 8.048 -0.084 1
1 585 . 2 1 1 A 42 42 LEU HA H 42 3.704 3.996 -0.292 1
1 595 . 2 1 1 A 42 42 LEU C C 42 178.396 179.219 -0.823 1
1 596 . 2 1 1 A 42 42 LEU CA C 42 58.237 57.715 0.522 1
1 597 . 2 1 1 A 42 42 LEU CB C 42 40.507 40.972 -0.465 1
1 601 . 2 1 1 A 42 42 LEU N N 42 115.960 120.262 -4.302 1
1 602 . 2 1 1 A 43 43 GLU H H 43 8.193 8.121 0.072 1
1 603 . 2 1 1 A 43 43 GLU HA H 43 3.882 3.857 0.025 1
1 608 . 2 1 1 A 43 43 GLU C C 43 179.193 178.891 0.302 1
1 609 . 2 1 1 A 43 43 GLU CA C 43 59.122 60.198 -1.076 1
1 610 . 2 1 1 A 43 43 GLU CB C 43 29.244 29.386 -0.142 1
1 612 . 2 1 1 A 43 43 GLU N N 43 117.175 119.656 -2.481 1
1 613 . 2 1 1 A 44 44 GLU H H 44 7.601 7.893 -0.292 1
1 614 . 2 1 1 A 44 44 GLU HA H 44 3.936 3.992 -0.056 1
1 619 . 2 1 1 A 44 44 GLU C C 44 179.875 178.862 1.013 1
1 620 . 2 1 1 A 44 44 GLU CA C 44 58.867 59.165 -0.298 1
1 621 . 2 1 1 A 44 44 GLU CB C 44 28.648 29.126 -0.478 1
1 623 . 2 1 1 A 44 44 GLU N N 44 120.472 119.387 1.085 1
1 624 . 2 1 1 A 45 45 PHE H H 45 8.260 7.501 0.759 1
1 625 . 2 1 1 A 45 45 PHE HA H 45 4.520 4.201 0.319 1
1 633 . 2 1 1 A 45 45 PHE C C 45 177.942 178.412 -0.470 1
1 634 . 2 1 1 A 45 45 PHE CA C 45 55.945 60.883 -4.938 1
1 635 . 2 1 1 A 45 45 PHE CB C 45 36.680 37.975 -1.295 1
1 641 . 2 1 1 A 45 45 PHE N N 45 119.272 119.013 0.259 1
1 642 . 2 1 1 A 46 46 ARG H H 46 8.023 8.228 -0.205 1
1 643 . 2 1 1 A 46 46 ARG HA H 46 4.074 4.098 -0.024 1
1 651 . 2 1 1 A 46 46 ARG C C 46 177.617 178.980 -1.363 1
1 652 . 2 1 1 A 46 46 ARG CA C 46 58.194 59.100 -0.906 1
1 653 . 2 1 1 A 46 46 ARG CB C 46 29.737 30.005 -0.268 1
1 656 . 2 1 1 A 46 46 ARG N N 46 118.136 120.604 -2.468 1
1 658 . 2 1 1 A 47 47 LYS H H 47 7.470 7.396 0.074 1
1 659 . 2 1 1 A 47 47 LYS HA H 47 4.143 4.115 0.028 1
1 668 . 2 1 1 A 47 47 LYS C C 47 177.324 177.543 -0.219 1
1 669 . 2 1 1 A 47 47 LYS CA C 47 57.726 59.259 -1.533 1
1 670 . 2 1 1 A 47 47 LYS CB C 47 32.409 32.601 -0.192 1
1 674 . 2 1 1 A 47 47 LYS N N 47 116.943 119.148 -2.205 1
1 675 . 2 1 1 A 48 48 GLU H H 48 7.615 7.660 -0.045 1
1 676 . 2 1 1 A 48 48 GLU HA H 48 4.428 4.791 -0.363 1
1 681 . 2 1 1 A 48 48 GLU C C 48 176.869 176.789 0.080 1
1 682 . 2 1 1 A 48 48 GLU CA C 48 55.945 55.585 0.360 1
1 683 . 2 1 1 A 48 48 GLU CB C 48 29.696 30.409 -0.713 1
1 685 . 2 1 1 A 48 48 GLU N N 48 118.852 116.162 2.690 1
1 686 . 2 1 1 A 49 49 SER H H 49 7.725 8.218 -0.493 1
1 687 . 2 1 1 A 49 49 SER HA H 49 4.244 4.319 -0.075 1
1 690 . 2 1 1 A 49 49 SER C C 49 174.838 176.886 -2.048 1
1 691 . 2 1 1 A 49 49 SER CA C 49 59.366 61.460 -2.094 1
1 692 . 2 1 1 A 49 49 SER CB C 49 63.116 62.894 0.222 1
1 693 . 2 1 1 A 49 49 SER N N 49 114.224 115.378 -1.154 1
1 694 . 2 1 1 A 50 50 GLN H H 50 8.548 8.163 0.385 1
1 695 . 2 1 1 A 50 50 GLN HA H 50 4.398 4.187 0.211 1
1 702 . 2 1 1 A 50 50 GLN C C 50 175.732 177.066 -1.334 1
1 703 . 2 1 1 A 50 50 GLN CA C 50 56.272 58.269 -1.997 1
1 704 . 2 1 1 A 50 50 GLN CB C 50 28.946 29.021 -0.075 1
1 706 . 2 1 1 A 50 50 GLN N N 50 120.125 120.911 -0.786 1
1 708 . 2 1 1 A 51 51 ASN H H 51 8.534 7.773 0.761 1
1 709 . 2 1 1 A 51 51 ASN HA H 51 4.980 5.092 -0.112 1
1 714 . 2 1 1 A 51 51 ASN C C 51 173.717 174.421 -0.704 1
1 715 . 2 1 1 A 51 51 ASN CA C 51 52.804 52.919 -0.115 1
1 716 . 2 1 1 A 51 51 ASN CB C 51 39.583 39.786 -0.203 1
1 717 . 2 1 1 A 51 51 ASN N N 51 118.158 114.277 3.881 1
1 719 . 2 1 1 A 52 52 ILE H H 52 7.492 7.469 0.023 1
1 720 . 2 1 1 A 52 52 ILE HA H 52 5.338 4.776 0.562 1
1 730 . 2 1 1 A 52 52 ILE C C 52 175.049 174.403 0.646 1
1 731 . 2 1 1 A 52 52 ILE CA C 52 59.364 60.276 -0.912 1
1 732 . 2 1 1 A 52 52 ILE CB C 52 42.163 40.722 1.441 1
1 736 . 2 1 1 A 52 52 ILE N N 52 117.927 121.758 -3.831 1
1 737 . 2 1 1 A 53 53 LYS H H 53 8.467 8.950 -0.483 1
1 738 . 2 1 1 A 53 53 LYS HA H 53 5.044 5.292 -0.248 1
1 747 . 2 1 1 A 53 53 LYS C C 53 175.082 175.475 -0.393 1
1 748 . 2 1 1 A 53 53 LYS CA C 53 55.429 54.910 0.519 1
1 749 . 2 1 1 A 53 53 LYS CB C 53 36.446 35.611 0.835 1
1 753 . 2 1 1 A 53 53 LYS N N 53 123.249 127.448 -4.199 1
1 754 . 2 1 1 A 54 54 VAL H H 54 8.490 9.316 -0.826 1
1 755 . 2 1 1 A 54 54 VAL HA H 54 5.159 4.778 0.381 1
1 763 . 2 1 1 A 54 54 VAL C C 54 173.473 173.882 -0.409 1
1 764 . 2 1 1 A 54 54 VAL CA C 54 60.163 61.170 -1.007 1
1 765 . 2 1 1 A 54 54 VAL CB C 54 35.509 33.088 2.421 1
1 768 . 2 1 1 A 54 54 VAL N N 54 120.762 124.559 -3.797 1
1 769 . 2 1 1 A 55 55 LEU H H 55 8.636 8.822 -0.186 1
1 770 . 2 1 1 A 55 55 LEU HA H 55 4.670 4.837 -0.167 1
1 780 . 2 1 1 A 55 55 LEU C C 55 173.652 174.458 -0.806 1
1 781 . 2 1 1 A 55 55 LEU CA C 55 52.289 53.431 -1.142 1
1 782 . 2 1 1 A 55 55 LEU CB C 55 42.070 43.119 -1.049 1
1 786 . 2 1 1 A 55 55 LEU N N 55 131.898 129.351 2.547 1
1 787 . 2 1 1 A 56 56 ILE H H 56 9.188 8.781 0.407 1
1 788 . 2 1 1 A 56 56 ILE HA H 56 4.879 5.107 -0.228 1
1 798 . 2 1 1 A 56 56 ILE C C 56 174.172 174.376 -0.204 1
1 799 . 2 1 1 A 56 56 ILE CA C 56 59.976 59.727 0.249 1
1 800 . 2 1 1 A 56 56 ILE CB C 56 38.181 38.819 -0.638 1
1 804 . 2 1 1 A 56 56 ILE N N 56 126.373 129.142 -2.769 1
1 805 . 2 1 1 A 57 57 LEU H H 57 8.929 9.424 -0.495 1
1 806 . 2 1 1 A 57 57 LEU HA H 57 5.394 5.299 0.095 1
1 816 . 2 1 1 A 57 57 LEU C C 57 175.358 176.103 -0.745 1
1 817 . 2 1 1 A 57 57 LEU CA C 57 52.086 52.988 -0.902 1
1 818 . 2 1 1 A 57 57 LEU CB C 57 42.445 42.655 -0.210 1
1 822 . 2 1 1 A 57 57 LEU N N 57 126.547 128.510 -1.963 1
1 823 . 2 1 1 A 58 58 VAL H H 58 8.542 9.069 -0.527 1
1 824 . 2 1 1 A 58 58 VAL HA H 58 5.253 4.772 0.481 1
1 832 . 2 1 1 A 58 58 VAL C C 58 175.244 175.496 -0.252 1
1 833 . 2 1 1 A 58 58 VAL CA C 58 58.241 58.863 -0.622 1
1 834 . 2 1 1 A 58 58 VAL CB C 58 33.165 34.569 -1.404 1
1 837 . 2 1 1 A 58 58 VAL N N 58 114.398 120.741 -6.343 1
1 838 . 2 1 1 A 59 59 SER H H 59 8.797 8.941 -0.144 1
1 839 . 2 1 1 A 59 59 SER HA H 59 5.063 4.480 0.583 1
1 842 . 2 1 1 A 59 59 SER C C 59 174.172 173.690 0.482 1
1 843 . 2 1 1 A 59 59 SER CA C 59 59.320 60.033 -0.713 1
1 844 . 2 1 1 A 59 59 SER CB C 59 65.600 64.447 1.153 1
1 845 . 2 1 1 A 59 59 SER N N 59 115.497 116.425 -0.928 1
1 846 . 2 1 1 A 60 60 ASN H H 60 7.730 7.984 -0.254 1
1 847 . 2 1 1 A 60 60 ASN HA H 60 4.811 5.075 -0.264 1
1 852 . 2 1 1 A 60 60 ASN C C 60 174.464 175.145 -0.681 1
1 853 . 2 1 1 A 60 60 ASN CA C 60 52.007 52.276 -0.269 1
1 854 . 2 1 1 A 60 60 ASN CB C 60 40.336 40.506 -0.170 1
1 855 . 2 1 1 A 60 60 ASN N N 60 117.522 116.690 0.832 1
1 857 . 2 1 1 A 61 61 ASP H H 61 8.577 8.959 -0.382 1
1 858 . 2 1 1 A 61 61 ASP HA H 61 4.365 4.289 0.076 1
1 861 . 2 1 1 A 61 61 ASP C C 61 177.357 178.399 -1.042 1
1 862 . 2 1 1 A 61 61 ASP CA C 61 57.351 56.927 0.424 1
1 863 . 2 1 1 A 61 61 ASP CB C 61 40.383 40.326 0.057 1
1 864 . 2 1 1 A 61 61 ASP N N 61 119.431 121.625 -2.194 1
1 865 . 2 1 1 A 62 62 GLU H H 62 8.405 8.333 0.072 1
1 866 . 2 1 1 A 62 62 GLU HA H 62 4.121 4.052 0.069 1
1 871 . 2 1 1 A 62 62 GLU C C 62 179.615 179.384 0.231 1
1 872 . 2 1 1 A 62 62 GLU CA C 62 59.593 59.454 0.139 1
1 873 . 2 1 1 A 62 62 GLU CB C 62 28.478 29.565 -1.087 1
1 875 . 2 1 1 A 62 62 GLU N N 62 122.150 121.512 0.638 1
1 876 . 2 1 1 A 63 63 GLU H H 63 8.384 8.215 0.169 1
1 877 . 2 1 1 A 63 63 GLU HA H 63 3.913 3.993 -0.080 1
1 882 . 2 1 1 A 63 63 GLU C C 63 178.478 179.088 -0.610 1
1 883 . 2 1 1 A 63 63 GLU CA C 63 58.273 59.096 -0.823 1
1 884 . 2 1 1 A 63 63 GLU CB C 63 29.931 29.157 0.774 1
1 886 . 2 1 1 A 63 63 GLU N N 63 119.084 120.724 -1.640 1
1 887 . 2 1 1 A 64 64 LEU H H 64 7.717 8.010 -0.293 1
1 888 . 2 1 1 A 64 64 LEU HA H 64 3.750 3.991 -0.241 1
1 898 . 2 1 1 A 64 64 LEU C C 64 177.535 178.103 -0.568 1
1 899 . 2 1 1 A 64 64 LEU CA C 64 58.944 58.568 0.376 1
1 900 . 2 1 1 A 64 64 LEU CB C 64 41.695 41.624 0.071 1
1 904 . 2 1 1 A 64 64 LEU N N 64 120.357 122.346 -1.989 1
1 905 . 2 1 1 A 65 65 ASP H H 65 7.922 8.176 -0.254 1
1 906 . 2 1 1 A 65 65 ASP HA H 65 4.313 4.203 0.110 1
1 909 . 2 1 1 A 65 65 ASP C C 65 179.095 178.677 0.418 1
1 910 . 2 1 1 A 65 65 ASP CA C 65 57.272 57.758 -0.486 1
1 911 . 2 1 1 A 65 65 ASP CB C 65 40.196 41.807 -1.611 1
1 912 . 2 1 1 A 65 65 ASP N N 65 118.100 118.359 -0.259 1
1 913 . 2 1 1 A 66 66 LYS H H 66 7.802 8.149 -0.347 1
1 914 . 2 1 1 A 66 66 LYS HA H 66 4.078 3.899 0.179 1
1 923 . 2 1 1 A 66 66 LYS C C 66 178.624 178.765 -0.141 1
1 924 . 2 1 1 A 66 66 LYS CA C 66 58.429 59.523 -1.094 1
1 925 . 2 1 1 A 66 66 LYS CB C 66 31.727 32.157 -0.430 1
1 929 . 2 1 1 A 66 66 LYS N N 66 119.343 117.548 1.795 1
1 930 . 2 1 1 A 67 67 ALA H H 67 8.480 8.407 0.073 1
1 931 . 2 1 1 A 67 67 ALA HA H 67 3.853 4.105 -0.252 1
1 935 . 2 1 1 A 67 67 ALA C C 67 178.591 179.580 -0.989 1
1 936 . 2 1 1 A 67 67 ALA CA C 67 55.403 55.278 0.125 1
1 937 . 2 1 1 A 67 67 ALA CB C 67 17.793 18.236 -0.443 1
1 938 . 2 1 1 A 67 67 ALA N N 67 121.562 122.209 -0.647 1
1 939 . 2 1 1 A 68 68 LYS H H 68 8.186 7.576 0.610 1
1 940 . 2 1 1 A 68 68 LYS HA H 68 3.805 4.037 -0.232 1
1 949 . 2 1 1 A 68 68 LYS C C 68 179.095 179.029 0.066 1
1 950 . 2 1 1 A 68 68 LYS CA C 68 59.952 59.242 0.710 1
1 951 . 2 1 1 A 68 68 LYS CB C 68 32.181 31.891 0.290 1
1 955 . 2 1 1 A 68 68 LYS N N 68 116.165 116.959 -0.794 1
1 956 . 2 1 1 A 69 69 GLU H H 69 7.904 8.128 -0.224 1
1 957 . 2 1 1 A 69 69 GLU HA H 69 3.995 4.025 -0.030 1
1 962 . 2 1 1 A 69 69 GLU C C 69 179.079 179.466 -0.387 1
1 963 . 2 1 1 A 69 69 GLU CA C 69 59.022 59.130 -0.108 1
1 964 . 2 1 1 A 69 69 GLU CB C 69 29.274 29.561 -0.287 1
1 966 . 2 1 1 A 69 69 GLU N N 69 119.489 119.357 0.132 1
1 967 . 2 1 1 A 70 70 LEU H H 70 7.962 8.391 -0.429 1
1 968 . 2 1 1 A 70 70 LEU HA H 70 4.020 3.913 0.107 1
1 978 . 2 1 1 A 70 70 LEU C C 70 178.738 178.750 -0.012 1
1 979 . 2 1 1 A 70 70 LEU CA C 70 57.486 57.821 -0.335 1
1 980 . 2 1 1 A 70 70 LEU CB C 70 41.695 41.675 0.020 1
1 984 . 2 1 1 A 70 70 LEU N N 70 119.431 120.741 -1.310 1
1 985 . 2 1 1 A 71 71 ALA H H 71 8.260 8.179 0.081 1
1 986 . 2 1 1 A 71 71 ALA HA H 71 3.845 4.066 -0.221 1
1 990 . 2 1 1 A 71 71 ALA C C 71 179.518 180.247 -0.729 1
1 991 . 2 1 1 A 71 71 ALA CA C 71 55.139 55.281 -0.142 1
1 992 . 2 1 1 A 71 71 ALA CB C 71 18.487 18.878 -0.391 1
1 993 . 2 1 1 A 71 71 ALA N N 71 119.604 121.714 -2.110 1
1 994 . 2 1 1 A 72 72 GLN H H 72 7.910 8.450 -0.540 1
1 995 . 2 1 1 A 72 72 GLN HA H 72 4.154 4.060 0.094 1
1 1002 . 2 1 1 A 72 72 GLN C C 72 178.900 178.645 0.255 1
1 1003 . 2 1 1 A 72 72 GLN CA C 72 58.194 58.796 -0.602 1
1 1004 . 2 1 1 A 72 72 GLN CB C 72 28.056 28.532 -0.476 1
1 1006 . 2 1 1 A 72 72 GLN N N 72 115.960 117.591 -1.631 1
1 1008 . 2 1 1 A 73 73 LYS H H 73 7.841 7.663 0.178 1
1 1009 . 2 1 1 A 73 73 LYS HA H 73 4.171 4.057 0.114 1
1 1018 . 2 1 1 A 73 73 LYS C C 73 177.730 178.306 -0.576 1
1 1019 . 2 1 1 A 73 73 LYS CA C 73 57.867 58.975 -1.108 1
1 1020 . 2 1 1 A 73 73 LYS CB C 73 32.277 32.340 -0.063 1
1 1024 . 2 1 1 A 73 73 LYS N N 73 119.027 119.479 -0.452 1
1 1025 . 2 1 1 A 74 74 MET H H 74 7.746 7.580 0.166 1
1 1026 . 2 1 1 A 74 74 MET HA H 74 4.403 4.549 -0.146 1
1 1034 . 2 1 1 A 74 74 MET C C 74 174.416 174.931 -0.515 1
1 1035 . 2 1 1 A 74 74 MET CA C 74 55.194 55.491 -0.297 1
1 1036 . 2 1 1 A 74 74 MET CB C 74 33.366 33.249 0.117 1
1 1039 . 2 1 1 A 74 74 MET N N 74 115.786 114.715 1.071 1
1 1040 . 2 1 1 A 75 75 GLU H H 75 8.076 7.750 0.326 1
1 1041 . 2 1 1 A 75 75 GLU HA H 75 4.001 3.897 0.104 1
1 1046 . 2 1 1 A 75 75 GLU C C 75 175.130 174.994 0.136 1
1 1047 . 2 1 1 A 75 75 GLU CA C 75 56.722 57.305 -0.583 1
1 1048 . 2 1 1 A 75 75 GLU CB C 75 27.118 27.496 -0.378 1
1 1050 . 2 1 1 A 75 75 GLU N N 75 116.249 116.661 -0.412 1
1 1051 . 2 1 1 A 76 76 ILE H H 76 7.560 7.630 -0.070 1
1 1052 . 2 1 1 A 76 76 ILE HA H 76 4.428 4.589 -0.161 1
1 1062 . 2 1 1 A 76 76 ILE C C 76 174.529 174.662 -0.133 1
1 1063 . 2 1 1 A 76 76 ILE CA C 76 58.475 60.148 -1.673 1
1 1064 . 2 1 1 A 76 76 ILE CB C 76 40.337 41.417 -1.080 1
1 1068 . 2 1 1 A 76 76 ILE N N 76 115.960 119.410 -3.450 1
1 1069 . 2 1 1 A 77 77 ASP H H 77 8.889 8.850 0.039 1
1 1070 . 2 1 1 A 77 77 ASP HA H 77 4.569 4.856 -0.287 1
1 1073 . 2 1 1 A 77 77 ASP C C 77 174.123 175.460 -1.337 1
1 1074 . 2 1 1 A 77 77 ASP CA C 77 54.069 53.350 0.719 1
1 1075 . 2 1 1 A 77 77 ASP CB C 77 40.233 40.538 -0.305 1
1 1076 . 2 1 1 A 77 77 ASP N N 77 126.142 128.188 -2.046 1
1 1077 . 2 1 1 A 78 78 VAL H H 78 7.754 8.487 -0.733 1
1 1078 . 2 1 1 A 78 78 VAL HA H 78 5.192 5.071 0.121 1
1 1086 . 2 1 1 A 78 78 VAL C C 78 174.968 174.107 0.861 1
1 1087 . 2 1 1 A 78 78 VAL CA C 78 58.804 59.380 -0.576 1
1 1088 . 2 1 1 A 78 78 VAL CB C 78 35.293 35.004 0.289 1
1 1091 . 2 1 1 A 78 78 VAL N N 78 122.844 121.919 0.925 1
1 1092 . 2 1 1 A 79 79 ARG H H 79 8.499 8.917 -0.418 1
1 1093 . 2 1 1 A 79 79 ARG HA H 79 4.712 4.827 -0.115 1
1 1100 . 2 1 1 A 79 79 ARG C C 79 174.221 174.875 -0.654 1
1 1101 . 2 1 1 A 79 79 ARG CA C 79 54.117 55.048 -0.931 1
1 1102 . 2 1 1 A 79 79 ARG CB C 79 31.196 32.154 -0.958 1
1 1105 . 2 1 1 A 79 79 ARG N N 79 125.637 121.816 3.821 1
1 1106 . 2 1 1 A 80 80 THR H H 80 8.416 8.741 -0.325 1
1 1107 . 2 1 1 A 80 80 THR HA H 80 5.332 4.875 0.457 1
1 1112 . 2 1 1 A 80 80 THR C C 80 174.497 173.757 0.740 1
1 1113 . 2 1 1 A 80 80 THR CA C 80 59.694 62.143 -2.449 1
1 1114 . 2 1 1 A 80 80 THR CB C 80 69.772 70.190 -0.418 1
1 1116 . 2 1 1 A 80 80 THR N N 80 118.084 119.930 -1.846 1
1 1117 . 2 1 1 A 81 81 ARG H H 81 8.758 9.158 -0.400 1
1 1118 . 2 1 1 A 81 81 ARG HA H 81 4.362 4.738 -0.376 1
1 1126 . 2 1 1 A 81 81 ARG C C 81 173.733 173.850 -0.117 1
1 1127 . 2 1 1 A 81 81 ARG CA C 81 53.273 53.818 -0.545 1
1 1128 . 2 1 1 A 81 81 ARG CB C 81 33.915 33.718 0.197 1
1 1131 . 2 1 1 A 81 81 ARG N N 81 122.844 123.765 -0.921 1
1 1133 . 2 1 1 A 82 82 LYS H H 82 8.721 8.474 0.247 1
1 1134 . 2 1 1 A 82 82 LYS HA H 82 4.701 5.230 -0.529 1
1 1143 . 2 1 1 A 82 82 LYS C C 82 175.667 175.680 -0.013 1
1 1144 . 2 1 1 A 82 82 LYS CA C 82 54.960 54.927 0.033 1
1 1145 . 2 1 1 A 82 82 LYS CB C 82 32.603 34.270 -1.667 1
1 1149 . 2 1 1 A 82 82 LYS N N 82 124.668 123.067 1.601 1
1 1150 . 2 1 1 A 83 83 VAL H H 83 9.112 9.114 -0.002 1
1 1151 . 2 1 1 A 83 83 VAL HA H 83 4.796 4.900 -0.104 1
1 1159 . 2 1 1 A 83 83 VAL C C 83 174.594 174.899 -0.305 1
1 1160 . 2 1 1 A 83 83 VAL CA C 83 59.413 59.802 -0.389 1
1 1161 . 2 1 1 A 83 83 VAL CB C 83 35.298 35.469 -0.171 1
1 1164 . 2 1 1 A 83 83 VAL N N 83 122.381 120.036 2.345 1
1 1165 . 2 1 1 A 84 84 THR H H 84 9.200 8.647 0.553 1
1 1166 . 2 1 1 A 84 84 THR HA H 84 4.579 4.520 0.059 1
1 1171 . 2 1 1 A 84 84 THR C C 84 173.993 175.030 -1.037 1
1 1172 . 2 1 1 A 84 84 THR CA C 84 60.960 62.454 -1.494 1
1 1173 . 2 1 1 A 84 84 THR CB C 84 70.100 70.064 0.036 1
1 1175 . 2 1 1 A 84 84 THR N N 84 113.183 115.195 -2.012 1
1 1176 . 2 1 1 A 85 85 SER H H 85 7.688 8.134 -0.446 1
1 1177 . 2 1 1 A 85 85 SER HA H 85 5.136 4.668 0.468 1
1 1180 . 2 1 1 A 85 85 SER CA C 85 55.205 56.599 -1.394 1
1 1181 . 2 1 1 A 85 85 SER CB C 85 64.376 63.654 0.722 1
1 1182 . 2 1 1 A 85 85 SER N N 85 115.555 116.576 -1.021 1
1 1183 . 2 1 1 A 86 86 PRO HA H 86 4.090 4.340 -0.250 1
1 1190 . 2 1 1 A 86 86 PRO C C 86 177.227 177.914 -0.687 1
1 1191 . 2 1 1 A 86 86 PRO CA C 86 65.038 65.820 -0.782 1
1 1192 . 2 1 1 A 86 86 PRO CB C 86 31.711 31.694 0.017 1
1 1195 . 2 1 1 A 87 87 ASP H H 87 8.131 8.536 -0.405 1
1 1196 . 2 1 1 A 87 87 ASP HA H 87 4.223 4.360 -0.137 1
1 1199 . 2 1 1 A 87 87 ASP C C 87 178.721 179.303 -0.582 1
1 1200 . 2 1 1 A 87 87 ASP CA C 87 57.311 56.790 0.521 1
1 1201 . 2 1 1 A 87 87 ASP CB C 87 40.102 40.059 0.043 1
1 1202 . 2 1 1 A 87 87 ASP N N 87 115.381 116.623 -1.242 1
1 1203 . 2 1 1 A 88 88 GLU H H 88 7.571 7.977 -0.406 1
1 1204 . 2 1 1 A 88 88 GLU HA H 88 3.659 4.070 -0.411 1
1 1209 . 2 1 1 A 88 88 GLU C C 88 177.097 178.679 -1.582 1
1 1210 . 2 1 1 A 88 88 GLU CA C 88 58.729 58.897 -0.168 1
1 1211 . 2 1 1 A 88 88 GLU CB C 88 30.052 29.572 0.480 1
1 1213 . 2 1 1 A 88 88 GLU N N 88 120.009 121.494 -1.485 1
1 1214 . 2 1 1 A 89 89 ALA H H 89 7.423 7.585 -0.162 1
1 1215 . 2 1 1 A 89 89 ALA HA H 89 3.900 4.355 -0.455 1
1 1219 . 2 1 1 A 89 89 ALA C C 89 178.267 180.035 -1.768 1
1 1220 . 2 1 1 A 89 89 ALA CA C 89 55.607 55.137 0.470 1
1 1221 . 2 1 1 A 89 89 ALA CB C 89 17.348 18.510 -1.162 1
1 1222 . 2 1 1 A 89 89 ALA N N 89 118.873 122.151 -3.278 1
1 1223 . 2 1 1 A 90 90 LYS H H 90 8.046 8.158 -0.112 1
1 1224 . 2 1 1 A 90 90 LYS HA H 90 3.669 3.955 -0.286 1
1 1233 . 2 1 1 A 90 90 LYS C C 90 177.649 179.077 -1.428 1
1 1234 . 2 1 1 A 90 90 LYS CA C 90 60.351 59.867 0.484 1
1 1235 . 2 1 1 A 90 90 LYS CB C 90 32.087 32.330 -0.243 1
1 1239 . 2 1 1 A 90 90 LYS N N 90 114.834 117.387 -2.553 1
1 1240 . 2 1 1 A 91 91 ARG H H 91 7.468 7.943 -0.475 1
1 1241 . 2 1 1 A 91 91 ARG HA H 91 3.887 3.904 -0.017 1
1 1249 . 2 1 1 A 91 91 ARG C C 91 178.998 179.099 -0.101 1
1 1250 . 2 1 1 A 91 91 ARG CA C 91 59.164 59.060 0.104 1
1 1251 . 2 1 1 A 91 91 ARG CB C 91 29.274 29.686 -0.412 1
1 1254 . 2 1 1 A 91 91 ARG N N 91 119.029 119.145 -0.116 1
1 1256 . 2 1 1 A 92 92 TRP H H 92 8.136 7.990 0.146 1
1 1257 . 2 1 1 A 92 92 TRP HA H 92 4.818 4.512 0.306 1
1 1266 . 2 1 1 A 92 92 TRP C C 92 179.566 179.095 0.471 1
1 1267 . 2 1 1 A 92 92 TRP CA C 92 58.663 59.395 -0.732 1
1 1268 . 2 1 1 A 92 92 TRP CB C 92 29.790 29.267 0.523 1
1 1274 . 2 1 1 A 92 92 TRP N N 92 118.100 120.360 -2.260 1
1 1276 . 2 1 1 A 93 93 ILE H H 93 8.363 8.418 -0.055 1
1 1277 . 2 1 1 A 93 93 ILE HA H 93 3.544 3.766 -0.222 1
1 1287 . 2 1 1 A 93 93 ILE C C 93 176.820 177.914 -1.094 1
1 1288 . 2 1 1 A 93 93 ILE CA C 93 66.225 65.566 0.659 1
1 1289 . 2 1 1 A 93 93 ILE CB C 93 37.571 37.947 -0.376 1
1 1293 . 2 1 1 A 93 93 ILE N N 93 120.588 120.458 0.130 1
1 1294 . 2 1 1 A 94 94 LYS H H 94 8.264 7.844 0.420 1
1 1295 . 2 1 1 A 94 94 LYS HA H 94 3.865 4.008 -0.143 1
1 1304 . 2 1 1 A 94 94 LYS C C 94 179.258 178.663 0.595 1
1 1305 . 2 1 1 A 94 94 LYS CA C 94 59.889 59.818 0.071 1
1 1306 . 2 1 1 A 94 94 LYS CB C 94 32.225 32.236 -0.011 1
1 1310 . 2 1 1 A 94 94 LYS N N 94 121.687 120.830 0.857 1
1 1311 . 2 1 1 A 95 95 GLU H H 95 8.360 8.704 -0.344 1
1 1312 . 2 1 1 A 95 95 GLU HA H 95 4.023 4.046 -0.023 1
1 1317 . 2 1 1 A 95 95 GLU C C 95 178.884 179.231 -0.347 1
1 1318 . 2 1 1 A 95 95 GLU CA C 95 59.366 59.489 -0.123 1
1 1319 . 2 1 1 A 95 95 GLU CB C 95 29.508 29.497 0.011 1
1 1321 . 2 1 1 A 95 95 GLU N N 95 118.505 117.984 0.521 1
1 1322 . 2 1 1 A 96 96 PHE H H 96 8.212 8.406 -0.194 1
1 1323 . 2 1 1 A 96 96 PHE HA H 96 4.512 4.342 0.170 1
1 1331 . 2 1 1 A 96 96 PHE C C 96 176.820 177.965 -1.145 1
1 1332 . 2 1 1 A 96 96 PHE CA C 96 59.608 61.145 -1.537 1
1 1333 . 2 1 1 A 96 96 PHE CB C 96 40.431 39.247 1.184 1
1 1339 . 2 1 1 A 96 96 PHE N N 96 120.369 122.013 -1.644 1
1 1340 . 2 1 1 A 97 97 SER H H 97 8.216 8.289 -0.073 1
1 1341 . 2 1 1 A 97 97 SER HA H 97 3.816 4.061 -0.245 1
1 1344 . 2 1 1 A 97 97 SER C C 97 175.618 177.254 -1.636 1
1 1345 . 2 1 1 A 97 97 SER CA C 97 60.492 61.606 -1.114 1
1 1346 . 2 1 1 A 97 97 SER CB C 97 63.022 62.473 0.549 1
1 1347 . 2 1 1 A 97 97 SER N N 97 111.969 113.638 -1.669 1
1 1348 . 2 1 1 A 98 98 GLU H H 98 7.655 8.012 -0.357 1
1 1349 . 2 1 1 A 98 98 GLU HA H 98 4.187 4.062 0.125 1
1 1354 . 2 1 1 A 98 98 GLU C C 98 177.698 179.244 -1.546 1
1 1355 . 2 1 1 A 98 98 GLU CA C 98 57.069 59.424 -2.355 1
1 1356 . 2 1 1 A 98 98 GLU CB C 98 29.321 29.196 0.125 1
1 1358 . 2 1 1 A 98 98 GLU N N 98 120.588 122.950 -2.362 1
1 1359 . 2 1 1 A 99 99 GLU H H 99 7.794 8.054 -0.260 1
1 1360 . 2 1 1 A 99 99 GLU HA H 99 4.123 4.014 0.109 1
1 1365 . 2 1 1 A 99 99 GLU C C 99 177.665 177.416 0.249 1
1 1366 . 2 1 1 A 99 99 GLU CA C 99 57.304 58.574 -1.270 1
1 1367 . 2 1 1 A 99 99 GLU CB C 99 29.368 29.834 -0.466 1
1 1369 . 2 1 1 A 99 99 GLU N N 99 120.067 119.271 0.796 1
1 1370 . 2 1 1 A 100 100 GLY H H 100 8.138 8.825 -0.687 1
1 1371 . 2 1 1 A 100 100 GLY HA2 H 100 3.865 3.757 0.108 1
1 1372 . 2 1 1 A 100 100 GLY HA3 H 100 3.715 3.838 -0.123 1
1 1373 . 2 1 1 A 100 100 GLY C C 100 174.464 173.666 0.798 1
1 1374 . 2 1 1 A 100 100 GLY CA C 100 45.305 45.343 -0.038 1
1 1375 . 2 1 1 A 100 100 GLY N N 100 107.802 108.466 -0.664 1
1 1376 . 2 1 1 A 101 101 GLY H H 101 8.023 8.398 -0.375 1
1 1377 . 2 1 1 A 101 101 GLY HA2 H 101 3.865 4.016 -0.151 1
1 1378 . 2 1 1 A 101 101 GLY HA3 H 101 3.892 4.035 -0.143 1
1 1379 . 2 1 1 A 101 101 GLY C C 101 174.204 172.742 1.462 1
1 1380 . 2 1 1 A 101 101 GLY CA C 101 45.036 44.520 0.516 1
1 1381 . 2 1 1 A 101 101 GLY N N 101 108.032 107.275 0.757 1
1 1382 . 2 1 1 A 102 102 SER H H 102 8.059 8.566 -0.507 1
1 1383 . 2 1 1 A 102 102 SER HA H 102 4.380 4.484 -0.104 1
1 1386 . 2 1 1 A 102 102 SER C C 102 174.627 174.937 -0.310 1
1 1387 . 2 1 1 A 102 102 SER CA C 102 58.194 57.988 0.206 1
1 1388 . 2 1 1 A 102 102 SER CB C 102 63.538 61.289 2.249 1
1 1389 . 2 1 1 A 102 102 SER N N 102 115.266 116.663 -1.397 1
1 1390 . 2 1 1 A 103 103 LEU H H 103 8.287 7.790 0.497 1
1 1391 . 2 1 1 A 103 103 LEU HA H 103 4.301 4.082 0.219 1
1 1401 . 2 1 1 A 103 103 LEU C C 103 177.292 176.918 0.374 1
1 1402 . 2 1 1 A 103 103 LEU CA C 103 55.007 55.454 -0.447 1
1 1403 . 2 1 1 A 103 103 LEU CB C 103 42.023 42.151 -0.128 1
1 1407 . 2 1 1 A 103 103 LEU N N 103 123.596 122.490 1.106 1
1 1408 . 2 1 1 A 104 104 GLU H H 104 8.216 7.579 0.637 1
1 1409 . 2 1 1 A 104 104 GLU HA H 104 4.126 4.423 -0.297 1
1 1414 . 2 1 1 A 104 104 GLU CA C 104 56.518 54.980 1.538 1
1 1415 . 2 1 1 A 104 104 GLU CB C 104 29.837 28.134 1.703 1
1 1417 . 2 1 1 A 104 104 GLU N N 104 120.510 119.086 1.424 1
1 1418 . 2 1 1 A 105 105 HIS HA H 105 4.593 4.668 -0.075 1
1 1421 . 2 1 1 A 105 105 HIS C C 105 173.766 175.537 -1.771 1
1 1422 . 2 1 1 A 105 105 HIS CA C 105 55.536 56.038 -0.502 1
1 1423 . 2 1 1 A 105 105 HIS CB C 105 30.001 29.356 0.645 1
1 1424 . 2 1 1 A 106 106 HIS H H 106 8.154 8.526 -0.372 1
1 1425 . 2 1 1 A 106 106 HIS HA H 106 4.407 4.767 -0.360 1
1 1428 . 2 1 1 A 106 106 HIS CA C 106 56.920 57.759 -0.839 1
1 1429 . 2 1 1 A 106 106 HIS CB C 106 30.001 31.633 -1.632 1
1 14 . 3 1 1 A 2 2 LEU H H 2 8.509 9.405 -0.896 1
1 15 . 3 1 1 A 2 2 LEU HA H 2 4.463 5.021 -0.558 1
1 25 . 3 1 1 A 2 2 LEU C C 2 173.944 176.117 -2.173 1
1 26 . 3 1 1 A 2 2 LEU CA C 2 54.471 53.817 0.654 1
1 27 . 3 1 1 A 2 2 LEU CB C 2 43.595 43.878 -0.283 1
1 31 . 3 1 1 A 2 2 LEU N N 2 127.160 127.754 -0.594 1
1 32 . 3 1 1 A 3 3 LEU H H 3 7.844 8.619 -0.775 1
1 33 . 3 1 1 A 3 3 LEU HA H 3 5.128 5.507 -0.379 1
1 43 . 3 1 1 A 3 3 LEU C C 3 175.423 175.097 0.326 1
1 44 . 3 1 1 A 3 3 LEU CA C 3 53.566 52.997 0.569 1
1 45 . 3 1 1 A 3 3 LEU CB C 3 44.039 44.581 -0.542 1
1 49 . 3 1 1 A 3 3 LEU N N 3 122.555 123.142 -0.587 1
1 50 . 3 1 1 A 4 4 TYR H H 4 8.360 9.221 -0.861 1
1 51 . 3 1 1 A 4 4 TYR HA H 4 5.143 5.169 -0.026 1
1 58 . 3 1 1 A 4 4 TYR C C 4 174.481 174.926 -0.445 1
1 59 . 3 1 1 A 4 4 TYR CA C 4 56.577 56.490 0.087 1
1 60 . 3 1 1 A 4 4 TYR CB C 4 43.840 43.148 0.692 1
1 65 . 3 1 1 A 4 4 TYR N N 4 119.315 123.024 -3.709 1
1 66 . 3 1 1 A 5 5 VAL H H 5 8.918 8.693 0.225 1
1 67 . 3 1 1 A 5 5 VAL HA H 5 5.106 4.944 0.162 1
1 75 . 3 1 1 A 5 5 VAL C C 5 174.042 174.904 -0.862 1
1 76 . 3 1 1 A 5 5 VAL CA C 5 59.852 60.589 -0.737 1
1 77 . 3 1 1 A 5 5 VAL CB C 5 33.816 34.583 -0.767 1
1 80 . 3 1 1 A 5 5 VAL N N 5 119.952 121.051 -1.099 1
1 81 . 3 1 1 A 6 6 LEU H H 6 9.315 9.315 0.000 1
1 82 . 3 1 1 A 6 6 LEU HA H 6 5.466 5.435 0.031 1
1 92 . 3 1 1 A 6 6 LEU C C 6 175.049 175.087 -0.038 1
1 93 . 3 1 1 A 6 6 LEU CA C 6 52.090 53.482 -1.392 1
1 94 . 3 1 1 A 6 6 LEU CB C 6 44.103 44.524 -0.421 1
1 98 . 3 1 1 A 6 6 LEU N N 6 126.917 126.241 0.676 1
1 99 . 3 1 1 A 7 7 ILE H H 7 8.458 8.823 -0.365 1
1 100 . 3 1 1 A 7 7 ILE HA H 7 5.131 5.285 -0.154 1
1 110 . 3 1 1 A 7 7 ILE C C 7 173.213 173.802 -0.589 1
1 111 . 3 1 1 A 7 7 ILE CA C 7 58.463 59.113 -0.650 1
1 112 . 3 1 1 A 7 7 ILE CB C 7 41.020 41.621 -0.601 1
1 116 . 3 1 1 A 7 7 ILE N N 7 119.778 126.241 -6.463 1
1 117 . 3 1 1 A 8 8 ILE H H 8 8.797 9.170 -0.373 1
1 118 . 3 1 1 A 8 8 ILE HA H 8 4.611 4.848 -0.237 1
1 128 . 3 1 1 A 8 8 ILE C C 8 174.611 174.417 0.194 1
1 129 . 3 1 1 A 8 8 ILE CA C 8 60.227 60.455 -0.228 1
1 130 . 3 1 1 A 8 8 ILE CB C 8 37.665 39.443 -1.778 1
1 134 . 3 1 1 A 8 8 ILE N N 8 128.919 128.827 0.092 1
1 135 . 3 1 1 A 9 9 SER H H 9 7.811 8.830 -1.019 1
1 136 . 3 1 1 A 9 9 SER HA H 9 4.429 5.426 -0.997 1
1 140 . 3 1 1 A 9 9 SER C C 9 172.937 173.341 -0.404 1
1 141 . 3 1 1 A 9 9 SER CA C 9 58.241 56.700 1.541 1
1 142 . 3 1 1 A 9 9 SER CB C 9 64.261 65.005 -0.744 1
1 143 . 3 1 1 A 9 9 SER N N 9 116.365 121.620 -5.255 1
1 144 . 3 1 1 A 10 10 ASN H H 10 8.641 8.563 0.078 1
1 145 . 3 1 1 A 10 10 ASN HA H 10 4.938 4.808 0.130 1
1 150 . 3 1 1 A 10 10 ASN C C 10 174.497 174.864 -0.367 1
1 151 . 3 1 1 A 10 10 ASN CA C 10 52.221 54.774 -2.553 1
1 152 . 3 1 1 A 10 10 ASN CB C 10 39.128 40.359 -1.231 1
1 153 . 3 1 1 A 10 10 ASN N N 10 122.612 120.733 1.879 1
1 155 . 3 1 1 A 11 11 ASP H H 11 8.673 7.333 1.340 1
1 156 . 3 1 1 A 11 11 ASP HA H 11 4.596 4.745 -0.149 1
1 159 . 3 1 1 A 11 11 ASP C C 11 175.342 176.669 -1.327 1
1 160 . 3 1 1 A 11 11 ASP CA C 11 53.233 53.541 -0.308 1
1 161 . 3 1 1 A 11 11 ASP CB C 11 40.965 41.990 -1.025 1
1 162 . 3 1 1 A 11 11 ASP N N 11 122.717 119.529 3.188 1
1 163 . 3 1 1 A 12 12 LYS H H 12 8.562 8.947 -0.385 1
1 164 . 3 1 1 A 12 12 LYS HA H 12 3.854 3.962 -0.108 1
1 173 . 3 1 1 A 12 12 LYS C C 12 178.754 178.504 0.250 1
1 174 . 3 1 1 A 12 12 LYS CA C 12 59.581 59.895 -0.314 1
1 175 . 3 1 1 A 12 12 LYS CB C 12 32.378 32.293 0.085 1
1 179 . 3 1 1 A 12 12 LYS N N 12 125.737 126.391 -0.654 1
1 180 . 3 1 1 A 13 13 LYS H H 13 8.075 7.734 0.341 1
1 181 . 3 1 1 A 13 13 LYS HA H 13 4.154 4.029 0.125 1
1 190 . 3 1 1 A 13 13 LYS C C 13 178.315 179.012 -0.697 1
1 191 . 3 1 1 A 13 13 LYS CA C 13 58.532 59.130 -0.598 1
1 192 . 3 1 1 A 13 13 LYS CB C 13 31.452 32.119 -0.667 1
1 196 . 3 1 1 A 13 13 LYS N N 13 119.604 120.535 -0.931 1
1 197 . 3 1 1 A 14 14 LEU H H 14 7.552 8.300 -0.748 1
1 198 . 3 1 1 A 14 14 LEU HA H 14 3.682 4.009 -0.327 1
1 208 . 3 1 1 A 14 14 LEU C C 14 178.429 178.285 0.144 1
1 209 . 3 1 1 A 14 14 LEU CA C 14 58.999 58.330 0.669 1
1 210 . 3 1 1 A 14 14 LEU CB C 14 41.228 41.230 -0.002 1
1 214 . 3 1 1 A 14 14 LEU N N 14 122.266 121.430 0.836 1
1 215 . 3 1 1 A 15 15 ILE H H 15 8.074 8.061 0.013 1
1 216 . 3 1 1 A 15 15 ILE HA H 15 3.264 3.622 -0.358 1
1 226 . 3 1 1 A 15 15 ILE C C 15 177.000 178.471 -1.471 1
1 227 . 3 1 1 A 15 15 ILE CA C 15 65.939 65.042 0.897 1
1 228 . 3 1 1 A 15 15 ILE CB C 15 37.983 37.504 0.479 1
1 232 . 3 1 1 A 15 15 ILE N N 15 118.214 119.573 -1.359 1
1 233 . 3 1 1 A 16 16 GLU H H 16 8.016 8.319 -0.303 1
1 234 . 3 1 1 A 16 16 GLU HA H 16 4.045 3.995 0.050 1
1 239 . 3 1 1 A 16 16 GLU C C 16 179.388 179.514 -0.126 1
1 240 . 3 1 1 A 16 16 GLU CA C 16 59.032 59.890 -0.858 1
1 241 . 3 1 1 A 16 16 GLU CB C 16 29.200 29.139 0.061 1
1 243 . 3 1 1 A 16 16 GLU N N 16 118.484 121.257 -2.773 1
1 244 . 3 1 1 A 17 17 GLU H H 17 8.063 8.261 -0.198 1
1 245 . 3 1 1 A 17 17 GLU HA H 17 4.053 4.024 0.029 1
1 250 . 3 1 1 A 17 17 GLU C C 17 179.306 179.185 0.121 1
1 251 . 3 1 1 A 17 17 GLU CA C 17 58.636 59.357 -0.721 1
1 252 . 3 1 1 A 17 17 GLU CB C 17 29.011 29.300 -0.289 1
1 254 . 3 1 1 A 17 17 GLU N N 17 118.100 120.342 -2.242 1
1 255 . 3 1 1 A 18 18 ALA H H 18 8.655 8.271 0.384 1
1 256 . 3 1 1 A 18 18 ALA HA H 18 3.775 4.072 -0.297 1
1 260 . 3 1 1 A 18 18 ALA C C 18 178.559 180.277 -1.718 1
1 261 . 3 1 1 A 18 18 ALA CA C 18 54.960 55.393 -0.433 1
1 262 . 3 1 1 A 18 18 ALA CB C 18 17.960 18.319 -0.359 1
1 263 . 3 1 1 A 18 18 ALA N N 18 122.439 122.734 -0.295 1
1 264 . 3 1 1 A 19 19 ARG H H 19 8.900 8.044 0.856 1
1 265 . 3 1 1 A 19 19 ARG HA H 19 3.809 4.139 -0.330 1
1 273 . 3 1 1 A 19 19 ARG C C 19 178.721 178.959 -0.238 1
1 274 . 3 1 1 A 19 19 ARG CA C 19 59.976 59.849 0.127 1
1 275 . 3 1 1 A 19 19 ARG CB C 19 29.572 29.884 -0.312 1
1 278 . 3 1 1 A 19 19 ARG N N 19 118.563 117.849 0.714 1
1 280 . 3 1 1 A 20 20 LYS H H 20 7.792 8.397 -0.605 1
1 281 . 3 1 1 A 20 20 LYS HA H 20 4.052 4.019 0.033 1
1 290 . 3 1 1 A 20 20 LYS C C 20 179.648 179.846 -0.198 1
1 291 . 3 1 1 A 20 20 LYS CA C 20 59.296 59.463 -0.167 1
1 292 . 3 1 1 A 20 20 LYS CB C 20 32.216 32.371 -0.155 1
1 296 . 3 1 1 A 20 20 LYS N N 20 118.638 119.670 -1.032 1
1 297 . 3 1 1 A 21 21 MET H H 21 7.684 8.433 -0.749 1
1 298 . 3 1 1 A 21 21 MET HA H 21 4.411 4.117 0.294 1
1 306 . 3 1 1 A 21 21 MET C C 21 177.909 177.941 -0.032 1
1 307 . 3 1 1 A 21 21 MET CA C 21 57.009 59.578 -2.569 1
1 308 . 3 1 1 A 21 21 MET CB C 21 32.028 33.112 -1.084 1
1 311 . 3 1 1 A 21 21 MET N N 21 118.100 118.482 -0.382 1
1 312 . 3 1 1 A 22 22 ALA H H 22 8.815 8.205 0.610 1
1 313 . 3 1 1 A 22 22 ALA HA H 22 3.826 3.975 -0.149 1
1 317 . 3 1 1 A 22 22 ALA C C 22 178.835 179.948 -1.113 1
1 318 . 3 1 1 A 22 22 ALA CA C 22 55.427 55.504 -0.077 1
1 319 . 3 1 1 A 22 22 ALA CB C 22 18.059 18.408 -0.349 1
1 320 . 3 1 1 A 22 22 ALA N N 22 122.150 121.265 0.885 1
1 321 . 3 1 1 A 23 23 GLU H H 23 8.276 8.316 -0.040 1
1 322 . 3 1 1 A 23 23 GLU HA H 23 4.146 3.991 0.155 1
1 327 . 3 1 1 A 23 23 GLU C C 23 180.151 179.550 0.601 1
1 328 . 3 1 1 A 23 23 GLU CA C 23 58.999 59.474 -0.475 1
1 329 . 3 1 1 A 23 23 GLU CB C 23 29.160 29.329 -0.169 1
1 331 . 3 1 1 A 23 23 GLU N N 23 117.001 117.967 -0.966 1
1 332 . 3 1 1 A 24 24 LYS H H 24 7.573 8.236 -0.663 1
1 333 . 3 1 1 A 24 24 LYS HA H 24 4.101 4.056 0.045 1
1 342 . 3 1 1 A 24 24 LYS C C 24 177.145 178.436 -1.291 1
1 343 . 3 1 1 A 24 24 LYS CA C 24 58.261 59.034 -0.773 1
1 344 . 3 1 1 A 24 24 LYS CB C 24 32.079 32.209 -0.130 1
1 348 . 3 1 1 A 24 24 LYS N N 24 119.960 119.428 0.532 1
1 349 . 3 1 1 A 25 25 ALA H H 25 7.710 7.758 -0.048 1
1 350 . 3 1 1 A 25 25 ALA HA H 25 4.413 4.365 0.048 1
1 354 . 3 1 1 A 25 25 ALA C C 25 175.325 176.246 -0.921 1
1 355 . 3 1 1 A 25 25 ALA CA C 25 51.208 51.910 -0.702 1
1 356 . 3 1 1 A 25 25 ALA CB C 25 18.520 19.371 -0.851 1
1 357 . 3 1 1 A 25 25 ALA N N 25 119.257 118.815 0.442 1
1 358 . 3 1 1 A 26 26 ASN H H 26 7.840 8.051 -0.211 1
1 359 . 3 1 1 A 26 26 ASN HA H 26 4.357 4.371 -0.014 1
1 364 . 3 1 1 A 26 26 ASN C C 26 173.587 173.779 -0.192 1
1 365 . 3 1 1 A 26 26 ASN CA C 26 54.307 54.567 -0.260 1
1 366 . 3 1 1 A 26 26 ASN CB C 26 36.972 36.965 0.007 1
1 367 . 3 1 1 A 26 26 ASN N N 26 115.266 113.623 1.643 1
1 369 . 3 1 1 A 27 27 LEU H H 27 8.241 7.979 0.262 1
1 370 . 3 1 1 A 27 27 LEU HA H 27 4.652 4.736 -0.084 1
1 380 . 3 1 1 A 27 27 LEU C C 27 175.894 175.851 0.043 1
1 381 . 3 1 1 A 27 27 LEU CA C 27 52.923 53.513 -0.590 1
1 382 . 3 1 1 A 27 27 LEU CB C 27 44.090 43.960 0.130 1
1 386 . 3 1 1 A 27 27 LEU N N 27 116.828 118.974 -2.146 1
1 387 . 3 1 1 A 28 28 GLU H H 28 7.798 8.446 -0.648 1
1 388 . 3 1 1 A 28 28 GLU HA H 28 4.310 4.717 -0.407 1
1 393 . 3 1 1 A 28 28 GLU C C 28 173.944 175.454 -1.510 1
1 394 . 3 1 1 A 28 28 GLU CA C 28 55.460 56.209 -0.749 1
1 395 . 3 1 1 A 28 28 GLU CB C 28 30.512 30.536 -0.024 1
1 397 . 3 1 1 A 28 28 GLU N N 28 121.340 122.835 -1.495 1
1 398 . 3 1 1 A 29 29 LEU H H 29 8.451 8.975 -0.524 1
1 399 . 3 1 1 A 29 29 LEU HA H 29 5.662 5.386 0.276 1
1 409 . 3 1 1 A 29 29 LEU C C 29 176.902 174.918 1.984 1
1 410 . 3 1 1 A 29 29 LEU CA C 29 53.186 54.093 -0.907 1
1 411 . 3 1 1 A 29 29 LEU CB C 29 44.914 44.380 0.534 1
1 415 . 3 1 1 A 29 29 LEU N N 29 126.547 127.885 -1.338 1
1 416 . 3 1 1 A 30 30 ARG H H 30 9.094 9.453 -0.359 1
1 417 . 3 1 1 A 30 30 ARG HA H 30 4.910 5.036 -0.126 1
1 425 . 3 1 1 A 30 30 ARG C C 30 175.147 175.955 -0.808 1
1 426 . 3 1 1 A 30 30 ARG CA C 30 53.417 54.920 -1.503 1
1 427 . 3 1 1 A 30 30 ARG CB C 30 32.555 32.768 -0.213 1
1 430 . 3 1 1 A 30 30 ARG N N 30 125.043 126.558 -1.515 1
1 432 . 3 1 1 A 31 31 THR H H 31 8.496 8.717 -0.221 1
1 433 . 3 1 1 A 31 31 THR HA H 31 4.888 4.895 -0.007 1
1 438 . 3 1 1 A 31 31 THR C C 31 173.961 173.987 -0.026 1
1 439 . 3 1 1 A 31 31 THR CA C 31 60.445 60.938 -0.493 1
1 440 . 3 1 1 A 31 31 THR CB C 31 69.492 69.949 -0.457 1
1 442 . 3 1 1 A 31 31 THR N N 31 114.745 116.281 -1.536 1
1 443 . 3 1 1 A 32 32 VAL H H 32 8.480 8.814 -0.334 1
1 444 . 3 1 1 A 32 32 VAL HA H 32 4.411 4.202 0.209 1
1 452 . 3 1 1 A 32 32 VAL C C 32 175.082 175.231 -0.149 1
1 453 . 3 1 1 A 32 32 VAL CA C 32 60.946 60.663 0.283 1
1 454 . 3 1 1 A 32 32 VAL CB C 32 34.487 33.926 0.561 1
1 457 . 3 1 1 A 32 32 VAL N N 32 122.324 125.674 -3.350 1
1 458 . 3 1 1 A 33 33 LYS H H 33 9.304 8.679 0.625 1
1 459 . 3 1 1 A 33 33 LYS HA H 33 4.534 4.350 0.184 1
1 468 . 3 1 1 A 33 33 LYS C C 33 176.740 176.602 0.138 1
1 469 . 3 1 1 A 33 33 LYS CA C 33 56.846 57.450 -0.604 1
1 470 . 3 1 1 A 33 33 LYS CB C 33 34.355 33.149 1.206 1
1 474 . 3 1 1 A 33 33 LYS N N 33 123.654 125.954 -2.300 1
1 475 . 3 1 1 A 34 34 THR H H 34 7.245 7.611 -0.366 1
1 476 . 3 1 1 A 34 34 THR HA H 34 4.780 4.645 0.135 1
1 481 . 3 1 1 A 34 34 THR C C 34 174.529 175.506 -0.977 1
1 482 . 3 1 1 A 34 34 THR CA C 34 58.859 59.328 -0.469 1
1 483 . 3 1 1 A 34 34 THR CB C 34 73.023 72.004 1.019 1
1 485 . 3 1 1 A 34 34 THR N N 34 106.300 111.556 -5.256 1
1 486 . 3 1 1 A 35 35 GLU H H 35 9.174 8.934 0.240 1
1 487 . 3 1 1 A 35 35 GLU HA H 35 3.886 3.962 -0.076 1
1 492 . 3 1 1 A 35 35 GLU C C 35 177.714 177.433 0.281 1
1 493 . 3 1 1 A 35 35 GLU CA C 35 59.233 59.524 -0.291 1
1 494 . 3 1 1 A 35 35 GLU CB C 35 29.377 29.341 0.036 1
1 496 . 3 1 1 A 35 35 GLU N N 35 121.919 122.015 -0.096 1
1 497 . 3 1 1 A 36 36 ASP H H 36 8.185 8.215 -0.030 1
1 498 . 3 1 1 A 36 36 ASP HA H 36 4.289 4.320 -0.031 1
1 501 . 3 1 1 A 36 36 ASP C C 36 178.348 178.500 -0.152 1
1 502 . 3 1 1 A 36 36 ASP CA C 36 56.962 57.596 -0.634 1
1 503 . 3 1 1 A 36 36 ASP CB C 36 40.214 41.267 -1.053 1
1 504 . 3 1 1 A 36 36 ASP N N 36 118.332 119.682 -1.350 1
1 505 . 3 1 1 A 37 37 GLU H H 37 7.741 7.683 0.058 1
1 506 . 3 1 1 A 37 37 GLU HA H 37 3.708 4.070 -0.362 1
1 511 . 3 1 1 A 37 37 GLU C C 37 177.324 178.904 -1.580 1
1 512 . 3 1 1 A 37 37 GLU CA C 37 58.698 59.202 -0.504 1
1 513 . 3 1 1 A 37 37 GLU CB C 37 30.199 29.458 0.741 1
1 515 . 3 1 1 A 37 37 GLU N N 37 120.704 118.881 1.823 1
1 516 . 3 1 1 A 38 38 LEU H H 38 7.531 8.126 -0.595 1
1 517 . 3 1 1 A 38 38 LEU HA H 38 3.873 3.928 -0.055 1
1 527 . 3 1 1 A 38 38 LEU C C 38 177.357 178.498 -1.141 1
1 528 . 3 1 1 A 38 38 LEU CA C 38 58.305 58.028 0.277 1
1 529 . 3 1 1 A 38 38 LEU CB C 38 40.837 41.581 -0.744 1
1 533 . 3 1 1 A 38 38 LEU N N 38 119.200 121.260 -2.060 1
1 534 . 3 1 1 A 39 39 LYS H H 39 8.083 8.281 -0.198 1
1 535 . 3 1 1 A 39 39 LYS HA H 39 3.608 3.895 -0.287 1
1 544 . 3 1 1 A 39 39 LYS C C 39 177.373 178.781 -1.408 1
1 545 . 3 1 1 A 39 39 LYS CA C 39 60.290 59.727 0.563 1
1 546 . 3 1 1 A 39 39 LYS CB C 39 32.178 32.666 -0.488 1
1 550 . 3 1 1 A 39 39 LYS N N 39 116.943 118.778 -1.835 1
1 551 . 3 1 1 A 40 40 LYS H H 40 7.632 8.000 -0.368 1
1 552 . 3 1 1 A 40 40 LYS HA H 40 3.864 4.021 -0.157 1
1 561 . 3 1 1 A 40 40 LYS C C 40 179.566 178.893 0.673 1
1 562 . 3 1 1 A 40 40 LYS CA C 40 58.993 59.312 -0.319 1
1 563 . 3 1 1 A 40 40 LYS CB C 40 31.758 32.222 -0.464 1
1 567 . 3 1 1 A 40 40 LYS N N 40 118.274 119.290 -1.016 1
1 568 . 3 1 1 A 41 41 TYR H H 41 7.823 8.484 -0.661 1
1 569 . 3 1 1 A 41 41 TYR HA H 41 3.926 4.047 -0.121 1
1 576 . 3 1 1 A 41 41 TYR C C 41 176.625 178.101 -1.476 1
1 577 . 3 1 1 A 41 41 TYR CA C 41 59.757 60.472 -0.715 1
1 578 . 3 1 1 A 41 41 TYR CB C 41 36.901 37.506 -0.605 1
1 583 . 3 1 1 A 41 41 TYR N N 41 117.811 119.322 -1.511 1
1 584 . 3 1 1 A 42 42 LEU H H 42 7.964 8.567 -0.603 1
1 585 . 3 1 1 A 42 42 LEU HA H 42 3.704 4.091 -0.387 1
1 595 . 3 1 1 A 42 42 LEU C C 42 178.396 179.269 -0.873 1
1 596 . 3 1 1 A 42 42 LEU CA C 42 58.237 57.988 0.249 1
1 597 . 3 1 1 A 42 42 LEU CB C 42 40.507 41.397 -0.890 1
1 601 . 3 1 1 A 42 42 LEU N N 42 115.960 120.113 -4.153 1
1 602 . 3 1 1 A 43 43 GLU H H 43 8.193 7.982 0.211 1
1 603 . 3 1 1 A 43 43 GLU HA H 43 3.882 3.991 -0.109 1
1 608 . 3 1 1 A 43 43 GLU C C 43 179.193 179.603 -0.410 1
1 609 . 3 1 1 A 43 43 GLU CA C 43 59.122 59.584 -0.462 1
1 610 . 3 1 1 A 43 43 GLU CB C 43 29.244 29.043 0.201 1
1 612 . 3 1 1 A 43 43 GLU N N 43 117.175 118.127 -0.952 1
1 613 . 3 1 1 A 44 44 GLU H H 44 7.601 7.791 -0.190 1
1 614 . 3 1 1 A 44 44 GLU HA H 44 3.936 3.928 0.008 1
1 619 . 3 1 1 A 44 44 GLU C C 44 179.875 178.594 1.281 1
1 620 . 3 1 1 A 44 44 GLU CA C 44 58.867 59.041 -0.174 1
1 621 . 3 1 1 A 44 44 GLU CB C 44 28.648 28.940 -0.292 1
1 623 . 3 1 1 A 44 44 GLU N N 44 120.472 119.268 1.204 1
1 624 . 3 1 1 A 45 45 PHE H H 45 8.260 7.165 1.095 1
1 625 . 3 1 1 A 45 45 PHE HA H 45 4.520 4.230 0.290 1
1 633 . 3 1 1 A 45 45 PHE C C 45 177.942 178.236 -0.294 1
1 634 . 3 1 1 A 45 45 PHE CA C 45 55.945 60.940 -4.995 1
1 635 . 3 1 1 A 45 45 PHE CB C 45 36.680 38.392 -1.712 1
1 641 . 3 1 1 A 45 45 PHE N N 45 119.272 118.374 0.898 1
1 642 . 3 1 1 A 46 46 ARG H H 46 8.023 8.071 -0.048 1
1 643 . 3 1 1 A 46 46 ARG HA H 46 4.074 4.007 0.067 1
1 651 . 3 1 1 A 46 46 ARG C C 46 177.617 179.010 -1.393 1
1 652 . 3 1 1 A 46 46 ARG CA C 46 58.194 59.655 -1.461 1
1 653 . 3 1 1 A 46 46 ARG CB C 46 29.737 29.942 -0.205 1
1 656 . 3 1 1 A 46 46 ARG N N 46 118.136 120.765 -2.629 1
1 658 . 3 1 1 A 47 47 LYS H H 47 7.470 8.046 -0.576 1
1 659 . 3 1 1 A 47 47 LYS HA H 47 4.143 4.067 0.076 1
1 668 . 3 1 1 A 47 47 LYS C C 47 177.324 178.390 -1.066 1
1 669 . 3 1 1 A 47 47 LYS CA C 47 57.726 59.621 -1.895 1
1 670 . 3 1 1 A 47 47 LYS CB C 47 32.409 32.158 0.251 1
1 674 . 3 1 1 A 47 47 LYS N N 47 116.943 119.725 -2.782 1
1 675 . 3 1 1 A 48 48 GLU H H 48 7.615 8.111 -0.496 1
1 676 . 3 1 1 A 48 48 GLU HA H 48 4.428 4.752 -0.324 1
1 681 . 3 1 1 A 48 48 GLU C C 48 176.869 177.202 -0.333 1
1 682 . 3 1 1 A 48 48 GLU CA C 48 55.945 56.248 -0.303 1
1 683 . 3 1 1 A 48 48 GLU CB C 48 29.696 30.285 -0.589 1
1 685 . 3 1 1 A 48 48 GLU N N 48 118.852 116.680 2.172 1
1 686 . 3 1 1 A 49 49 SER H H 49 7.725 8.237 -0.512 1
1 687 . 3 1 1 A 49 49 SER HA H 49 4.244 4.349 -0.105 1
1 690 . 3 1 1 A 49 49 SER C C 49 174.838 176.965 -2.127 1
1 691 . 3 1 1 A 49 49 SER CA C 49 59.366 61.125 -1.759 1
1 692 . 3 1 1 A 49 49 SER CB C 49 63.116 62.979 0.137 1
1 693 . 3 1 1 A 49 49 SER N N 49 114.224 115.321 -1.097 1
1 694 . 3 1 1 A 50 50 GLN H H 50 8.548 7.995 0.553 1
1 695 . 3 1 1 A 50 50 GLN HA H 50 4.398 4.174 0.224 1
1 702 . 3 1 1 A 50 50 GLN C C 50 175.732 176.340 -0.608 1
1 703 . 3 1 1 A 50 50 GLN CA C 50 56.272 58.186 -1.914 1
1 704 . 3 1 1 A 50 50 GLN CB C 50 28.946 28.945 0.001 1
1 706 . 3 1 1 A 50 50 GLN N N 50 120.125 120.242 -0.117 1
1 708 . 3 1 1 A 51 51 ASN H H 51 8.534 8.193 0.341 1
1 709 . 3 1 1 A 51 51 ASN HA H 51 4.980 4.931 0.049 1
1 714 . 3 1 1 A 51 51 ASN C C 51 173.717 173.700 0.017 1
1 715 . 3 1 1 A 51 51 ASN CA C 51 52.804 52.431 0.373 1
1 716 . 3 1 1 A 51 51 ASN CB C 51 39.583 39.201 0.382 1
1 717 . 3 1 1 A 51 51 ASN N N 51 118.158 115.814 2.344 1
1 719 . 3 1 1 A 52 52 ILE H H 52 7.492 7.615 -0.123 1
1 720 . 3 1 1 A 52 52 ILE HA H 52 5.338 5.409 -0.071 1
1 730 . 3 1 1 A 52 52 ILE C C 52 175.049 173.728 1.321 1
1 731 . 3 1 1 A 52 52 ILE CA C 52 59.364 59.500 -0.136 1
1 732 . 3 1 1 A 52 52 ILE CB C 52 42.163 42.225 -0.062 1
1 736 . 3 1 1 A 52 52 ILE N N 52 117.927 121.156 -3.229 1
1 737 . 3 1 1 A 53 53 LYS H H 53 8.467 8.877 -0.410 1
1 738 . 3 1 1 A 53 53 LYS HA H 53 5.044 5.270 -0.226 1
1 747 . 3 1 1 A 53 53 LYS C C 53 175.082 175.238 -0.156 1
1 748 . 3 1 1 A 53 53 LYS CA C 53 55.429 54.978 0.451 1
1 749 . 3 1 1 A 53 53 LYS CB C 53 36.446 35.704 0.742 1
1 753 . 3 1 1 A 53 53 LYS N N 53 123.249 127.217 -3.968 1
1 754 . 3 1 1 A 54 54 VAL H H 54 8.490 9.211 -0.721 1
1 755 . 3 1 1 A 54 54 VAL HA H 54 5.159 5.157 0.002 1
1 763 . 3 1 1 A 54 54 VAL C C 54 173.473 173.566 -0.093 1
1 764 . 3 1 1 A 54 54 VAL CA C 54 60.163 60.901 -0.738 1
1 765 . 3 1 1 A 54 54 VAL CB C 54 35.509 34.398 1.111 1
1 768 . 3 1 1 A 54 54 VAL N N 54 120.762 125.084 -4.322 1
1 769 . 3 1 1 A 55 55 LEU H H 55 8.636 8.667 -0.031 1
1 770 . 3 1 1 A 55 55 LEU HA H 55 4.670 4.912 -0.242 1
1 780 . 3 1 1 A 55 55 LEU C C 55 173.652 174.438 -0.786 1
1 781 . 3 1 1 A 55 55 LEU CA C 55 52.289 52.980 -0.691 1
1 782 . 3 1 1 A 55 55 LEU CB C 55 42.070 44.636 -2.566 1
1 786 . 3 1 1 A 55 55 LEU N N 55 131.898 129.237 2.661 1
1 787 . 3 1 1 A 56 56 ILE H H 56 9.188 9.301 -0.113 1
1 788 . 3 1 1 A 56 56 ILE HA H 56 4.879 4.853 0.026 1
1 798 . 3 1 1 A 56 56 ILE C C 56 174.172 174.179 -0.007 1
1 799 . 3 1 1 A 56 56 ILE CA C 56 59.976 59.781 0.195 1
1 800 . 3 1 1 A 56 56 ILE CB C 56 38.181 38.904 -0.723 1
1 804 . 3 1 1 A 56 56 ILE N N 56 126.373 128.292 -1.919 1
1 805 . 3 1 1 A 57 57 LEU H H 57 8.929 9.391 -0.462 1
1 806 . 3 1 1 A 57 57 LEU HA H 57 5.394 5.287 0.107 1
1 816 . 3 1 1 A 57 57 LEU C C 57 175.358 175.985 -0.627 1
1 817 . 3 1 1 A 57 57 LEU CA C 57 52.086 53.534 -1.448 1
1 818 . 3 1 1 A 57 57 LEU CB C 57 42.445 43.164 -0.719 1
1 822 . 3 1 1 A 57 57 LEU N N 57 126.547 128.176 -1.629 1
1 823 . 3 1 1 A 58 58 VAL H H 58 8.542 9.066 -0.524 1
1 824 . 3 1 1 A 58 58 VAL HA H 58 5.253 4.833 0.420 1
1 832 . 3 1 1 A 58 58 VAL C C 58 175.244 175.236 0.008 1
1 833 . 3 1 1 A 58 58 VAL CA C 58 58.241 59.135 -0.894 1
1 834 . 3 1 1 A 58 58 VAL CB C 58 33.165 34.658 -1.493 1
1 837 . 3 1 1 A 58 58 VAL N N 58 114.398 122.247 -7.849 1
1 838 . 3 1 1 A 59 59 SER H H 59 8.797 8.786 0.011 1
1 839 . 3 1 1 A 59 59 SER HA H 59 5.063 4.599 0.464 1
1 842 . 3 1 1 A 59 59 SER C C 59 174.172 174.463 -0.291 1
1 843 . 3 1 1 A 59 59 SER CA C 59 59.320 59.562 -0.242 1
1 844 . 3 1 1 A 59 59 SER CB C 59 65.600 64.528 1.072 1
1 845 . 3 1 1 A 59 59 SER N N 59 115.497 116.309 -0.812 1
1 846 . 3 1 1 A 60 60 ASN H H 60 7.730 7.914 -0.184 1
1 847 . 3 1 1 A 60 60 ASN HA H 60 4.811 5.095 -0.284 1
1 852 . 3 1 1 A 60 60 ASN C C 60 174.464 175.284 -0.820 1
1 853 . 3 1 1 A 60 60 ASN CA C 60 52.007 52.227 -0.220 1
1 854 . 3 1 1 A 60 60 ASN CB C 60 40.336 41.130 -0.794 1
1 855 . 3 1 1 A 60 60 ASN N N 60 117.522 117.605 -0.083 1
1 857 . 3 1 1 A 61 61 ASP H H 61 8.577 9.030 -0.453 1
1 858 . 3 1 1 A 61 61 ASP HA H 61 4.365 4.236 0.129 1
1 861 . 3 1 1 A 61 61 ASP C C 61 177.357 178.246 -0.889 1
1 862 . 3 1 1 A 61 61 ASP CA C 61 57.351 57.179 0.172 1
1 863 . 3 1 1 A 61 61 ASP CB C 61 40.383 40.424 -0.041 1
1 864 . 3 1 1 A 61 61 ASP N N 61 119.431 122.249 -2.818 1
1 865 . 3 1 1 A 62 62 GLU H H 62 8.405 8.510 -0.105 1
1 866 . 3 1 1 A 62 62 GLU HA H 62 4.121 3.992 0.129 1
1 871 . 3 1 1 A 62 62 GLU C C 62 179.615 178.975 0.640 1
1 872 . 3 1 1 A 62 62 GLU CA C 62 59.593 59.761 -0.168 1
1 873 . 3 1 1 A 62 62 GLU CB C 62 28.478 29.071 -0.593 1
1 875 . 3 1 1 A 62 62 GLU N N 62 122.150 119.493 2.657 1
1 876 . 3 1 1 A 63 63 GLU H H 63 8.384 8.171 0.213 1
1 877 . 3 1 1 A 63 63 GLU HA H 63 3.913 3.975 -0.062 1
1 882 . 3 1 1 A 63 63 GLU C C 63 178.478 179.075 -0.597 1
1 883 . 3 1 1 A 63 63 GLU CA C 63 58.273 59.098 -0.825 1
1 884 . 3 1 1 A 63 63 GLU CB C 63 29.931 29.061 0.870 1
1 886 . 3 1 1 A 63 63 GLU N N 63 119.084 118.777 0.307 1
1 887 . 3 1 1 A 64 64 LEU H H 64 7.717 8.021 -0.304 1
1 888 . 3 1 1 A 64 64 LEU HA H 64 3.750 4.004 -0.254 1
1 898 . 3 1 1 A 64 64 LEU C C 64 177.535 178.092 -0.557 1
1 899 . 3 1 1 A 64 64 LEU CA C 64 58.944 58.418 0.526 1
1 900 . 3 1 1 A 64 64 LEU CB C 64 41.695 41.531 0.164 1
1 904 . 3 1 1 A 64 64 LEU N N 64 120.357 121.982 -1.625 1
1 905 . 3 1 1 A 65 65 ASP H H 65 7.922 8.270 -0.348 1
1 906 . 3 1 1 A 65 65 ASP HA H 65 4.313 4.291 0.022 1
1 909 . 3 1 1 A 65 65 ASP C C 65 179.095 178.702 0.393 1
1 910 . 3 1 1 A 65 65 ASP CA C 65 57.272 57.225 0.047 1
1 911 . 3 1 1 A 65 65 ASP CB C 65 40.196 40.905 -0.709 1
1 912 . 3 1 1 A 65 65 ASP N N 65 118.100 118.604 -0.504 1
1 913 . 3 1 1 A 66 66 LYS H H 66 7.802 7.892 -0.090 1
1 914 . 3 1 1 A 66 66 LYS HA H 66 4.078 4.020 0.058 1
1 923 . 3 1 1 A 66 66 LYS C C 66 178.624 179.092 -0.468 1
1 924 . 3 1 1 A 66 66 LYS CA C 66 58.429 59.258 -0.829 1
1 925 . 3 1 1 A 66 66 LYS CB C 66 31.727 32.130 -0.403 1
1 929 . 3 1 1 A 66 66 LYS N N 66 119.343 119.139 0.204 1
1 930 . 3 1 1 A 67 67 ALA H H 67 8.480 8.338 0.142 1
1 931 . 3 1 1 A 67 67 ALA HA H 67 3.853 4.127 -0.274 1
1 935 . 3 1 1 A 67 67 ALA C C 67 178.591 179.558 -0.967 1
1 936 . 3 1 1 A 67 67 ALA CA C 67 55.403 55.432 -0.029 1
1 937 . 3 1 1 A 67 67 ALA CB C 67 17.793 18.443 -0.650 1
1 938 . 3 1 1 A 67 67 ALA N N 67 121.562 122.285 -0.723 1
1 939 . 3 1 1 A 68 68 LYS H H 68 8.186 7.770 0.416 1
1 940 . 3 1 1 A 68 68 LYS HA H 68 3.805 4.038 -0.233 1
1 949 . 3 1 1 A 68 68 LYS C C 68 179.095 178.861 0.234 1
1 950 . 3 1 1 A 68 68 LYS CA C 68 59.952 59.255 0.697 1
1 951 . 3 1 1 A 68 68 LYS CB C 68 32.181 32.433 -0.252 1
1 955 . 3 1 1 A 68 68 LYS N N 68 116.165 117.024 -0.859 1
1 956 . 3 1 1 A 69 69 GLU H H 69 7.904 7.817 0.087 1
1 957 . 3 1 1 A 69 69 GLU HA H 69 3.995 4.007 -0.012 1
1 962 . 3 1 1 A 69 69 GLU C C 69 179.079 179.257 -0.178 1
1 963 . 3 1 1 A 69 69 GLU CA C 69 59.022 59.141 -0.119 1
1 964 . 3 1 1 A 69 69 GLU CB C 69 29.274 29.526 -0.252 1
1 966 . 3 1 1 A 69 69 GLU N N 69 119.489 119.672 -0.183 1
1 967 . 3 1 1 A 70 70 LEU H H 70 7.962 8.053 -0.091 1
1 968 . 3 1 1 A 70 70 LEU HA H 70 4.020 4.037 -0.017 1
1 978 . 3 1 1 A 70 70 LEU C C 70 178.738 179.198 -0.460 1
1 979 . 3 1 1 A 70 70 LEU CA C 70 57.486 57.956 -0.470 1
1 980 . 3 1 1 A 70 70 LEU CB C 70 41.695 41.505 0.190 1
1 984 . 3 1 1 A 70 70 LEU N N 70 119.431 120.802 -1.371 1
1 985 . 3 1 1 A 71 71 ALA H H 71 8.260 8.219 0.041 1
1 986 . 3 1 1 A 71 71 ALA HA H 71 3.845 4.057 -0.212 1
1 990 . 3 1 1 A 71 71 ALA C C 71 179.518 179.846 -0.328 1
1 991 . 3 1 1 A 71 71 ALA CA C 71 55.139 55.354 -0.215 1
1 992 . 3 1 1 A 71 71 ALA CB C 71 18.487 18.074 0.413 1
1 993 . 3 1 1 A 71 71 ALA N N 71 119.604 121.446 -1.842 1
1 994 . 3 1 1 A 72 72 GLN H H 72 7.910 8.094 -0.184 1
1 995 . 3 1 1 A 72 72 GLN HA H 72 4.154 4.045 0.109 1
1 1002 . 3 1 1 A 72 72 GLN C C 72 178.900 178.376 0.524 1
1 1003 . 3 1 1 A 72 72 GLN CA C 72 58.194 58.138 0.056 1
1 1004 . 3 1 1 A 72 72 GLN CB C 72 28.056 28.364 -0.308 1
1 1006 . 3 1 1 A 72 72 GLN N N 72 115.960 117.255 -1.295 1
1 1008 . 3 1 1 A 73 73 LYS H H 73 7.841 8.188 -0.347 1
1 1009 . 3 1 1 A 73 73 LYS HA H 73 4.171 4.133 0.038 1
1 1018 . 3 1 1 A 73 73 LYS C C 73 177.730 177.753 -0.023 1
1 1019 . 3 1 1 A 73 73 LYS CA C 73 57.867 58.390 -0.523 1
1 1020 . 3 1 1 A 73 73 LYS CB C 73 32.277 32.569 -0.292 1
1 1024 . 3 1 1 A 73 73 LYS N N 73 119.027 118.892 0.135 1
1 1025 . 3 1 1 A 74 74 MET H H 74 7.746 7.571 0.175 1
1 1026 . 3 1 1 A 74 74 MET HA H 74 4.403 4.624 -0.221 1
1 1034 . 3 1 1 A 74 74 MET C C 74 174.416 174.802 -0.386 1
1 1035 . 3 1 1 A 74 74 MET CA C 74 55.194 54.910 0.284 1
1 1036 . 3 1 1 A 74 74 MET CB C 74 33.366 32.831 0.535 1
1 1039 . 3 1 1 A 74 74 MET N N 74 115.786 115.241 0.545 1
1 1040 . 3 1 1 A 75 75 GLU H H 75 8.076 8.000 0.076 1
1 1041 . 3 1 1 A 75 75 GLU HA H 75 4.001 3.865 0.136 1
1 1046 . 3 1 1 A 75 75 GLU C C 75 175.130 174.967 0.163 1
1 1047 . 3 1 1 A 75 75 GLU CA C 75 56.722 57.444 -0.722 1
1 1048 . 3 1 1 A 75 75 GLU CB C 75 27.118 27.602 -0.484 1
1 1050 . 3 1 1 A 75 75 GLU N N 75 116.249 116.196 0.053 1
1 1051 . 3 1 1 A 76 76 ILE H H 76 7.560 7.619 -0.059 1
1 1052 . 3 1 1 A 76 76 ILE HA H 76 4.428 4.618 -0.190 1
1 1062 . 3 1 1 A 76 76 ILE C C 76 174.529 174.848 -0.319 1
1 1063 . 3 1 1 A 76 76 ILE CA C 76 58.475 60.028 -1.553 1
1 1064 . 3 1 1 A 76 76 ILE CB C 76 40.337 41.516 -1.179 1
1 1068 . 3 1 1 A 76 76 ILE N N 76 115.960 119.285 -3.325 1
1 1069 . 3 1 1 A 77 77 ASP H H 77 8.889 8.686 0.203 1
1 1070 . 3 1 1 A 77 77 ASP HA H 77 4.569 4.844 -0.275 1
1 1073 . 3 1 1 A 77 77 ASP C C 77 174.123 176.247 -2.124 1
1 1074 . 3 1 1 A 77 77 ASP CA C 77 54.069 54.347 -0.278 1
1 1075 . 3 1 1 A 77 77 ASP CB C 77 40.233 41.014 -0.781 1
1 1076 . 3 1 1 A 77 77 ASP N N 77 126.142 127.889 -1.747 1
1 1077 . 3 1 1 A 78 78 VAL H H 78 7.754 8.893 -1.139 1
1 1078 . 3 1 1 A 78 78 VAL HA H 78 5.192 5.486 -0.294 1
1 1086 . 3 1 1 A 78 78 VAL C C 78 174.968 174.475 0.493 1
1 1087 . 3 1 1 A 78 78 VAL CA C 78 58.804 58.589 0.215 1
1 1088 . 3 1 1 A 78 78 VAL CB C 78 35.293 35.908 -0.615 1
1 1091 . 3 1 1 A 78 78 VAL N N 78 122.844 117.064 5.780 1
1 1092 . 3 1 1 A 79 79 ARG H H 79 8.499 8.604 -0.105 1
1 1093 . 3 1 1 A 79 79 ARG HA H 79 4.712 5.029 -0.317 1
1 1100 . 3 1 1 A 79 79 ARG C C 79 174.221 175.263 -1.042 1
1 1101 . 3 1 1 A 79 79 ARG CA C 79 54.117 54.491 -0.374 1
1 1102 . 3 1 1 A 79 79 ARG CB C 79 31.196 32.214 -1.018 1
1 1105 . 3 1 1 A 79 79 ARG N N 79 125.637 121.519 4.118 1
1 1106 . 3 1 1 A 80 80 THR H H 80 8.416 8.551 -0.135 1
1 1107 . 3 1 1 A 80 80 THR HA H 80 5.332 4.899 0.433 1
1 1112 . 3 1 1 A 80 80 THR C C 80 174.497 173.956 0.541 1
1 1113 . 3 1 1 A 80 80 THR CA C 80 59.694 60.643 -0.949 1
1 1114 . 3 1 1 A 80 80 THR CB C 80 69.772 70.141 -0.369 1
1 1116 . 3 1 1 A 80 80 THR N N 80 118.084 117.342 0.742 1
1 1117 . 3 1 1 A 81 81 ARG H H 81 8.758 8.788 -0.030 1
1 1118 . 3 1 1 A 81 81 ARG HA H 81 4.362 4.668 -0.306 1
1 1126 . 3 1 1 A 81 81 ARG C C 81 173.733 173.976 -0.243 1
1 1127 . 3 1 1 A 81 81 ARG CA C 81 53.273 54.023 -0.750 1
1 1128 . 3 1 1 A 81 81 ARG CB C 81 33.915 33.749 0.166 1
1 1131 . 3 1 1 A 81 81 ARG N N 81 122.844 122.321 0.523 1
1 1133 . 3 1 1 A 82 82 LYS H H 82 8.721 8.511 0.210 1
1 1134 . 3 1 1 A 82 82 LYS HA H 82 4.701 5.249 -0.548 1
1 1143 . 3 1 1 A 82 82 LYS C C 82 175.667 175.924 -0.257 1
1 1144 . 3 1 1 A 82 82 LYS CA C 82 54.960 54.986 -0.026 1
1 1145 . 3 1 1 A 82 82 LYS CB C 82 32.603 34.208 -1.605 1
1 1149 . 3 1 1 A 82 82 LYS N N 82 124.668 123.207 1.461 1
1 1150 . 3 1 1 A 83 83 VAL H H 83 9.112 9.185 -0.073 1
1 1151 . 3 1 1 A 83 83 VAL HA H 83 4.796 4.942 -0.146 1
1 1159 . 3 1 1 A 83 83 VAL C C 83 174.594 175.033 -0.439 1
1 1160 . 3 1 1 A 83 83 VAL CA C 83 59.413 60.078 -0.665 1
1 1161 . 3 1 1 A 83 83 VAL CB C 83 35.298 34.695 0.603 1
1 1164 . 3 1 1 A 83 83 VAL N N 83 122.381 120.170 2.211 1
1 1165 . 3 1 1 A 84 84 THR H H 84 9.200 8.674 0.526 1
1 1166 . 3 1 1 A 84 84 THR HA H 84 4.579 4.498 0.081 1
1 1171 . 3 1 1 A 84 84 THR C C 84 173.993 174.390 -0.397 1
1 1172 . 3 1 1 A 84 84 THR CA C 84 60.960 62.304 -1.344 1
1 1173 . 3 1 1 A 84 84 THR CB C 84 70.100 69.883 0.217 1
1 1175 . 3 1 1 A 84 84 THR N N 84 113.183 114.504 -1.321 1
1 1176 . 3 1 1 A 85 85 SER H H 85 7.688 8.125 -0.437 1
1 1177 . 3 1 1 A 85 85 SER HA H 85 5.136 4.669 0.467 1
1 1180 . 3 1 1 A 85 85 SER CA C 85 55.205 56.667 -1.462 1
1 1181 . 3 1 1 A 85 85 SER CB C 85 64.376 63.862 0.514 1
1 1182 . 3 1 1 A 85 85 SER N N 85 115.555 116.022 -0.467 1
1 1183 . 3 1 1 A 86 86 PRO HA H 86 4.090 4.287 -0.197 1
1 1190 . 3 1 1 A 86 86 PRO C C 86 177.227 177.970 -0.743 1
1 1191 . 3 1 1 A 86 86 PRO CA C 86 65.038 65.759 -0.721 1
1 1192 . 3 1 1 A 86 86 PRO CB C 86 31.711 31.740 -0.029 1
1 1195 . 3 1 1 A 87 87 ASP H H 87 8.131 8.465 -0.334 1
1 1196 . 3 1 1 A 87 87 ASP HA H 87 4.223 4.327 -0.104 1
1 1199 . 3 1 1 A 87 87 ASP C C 87 178.721 179.421 -0.700 1
1 1200 . 3 1 1 A 87 87 ASP CA C 87 57.311 56.822 0.489 1
1 1201 . 3 1 1 A 87 87 ASP CB C 87 40.102 40.223 -0.121 1
1 1202 . 3 1 1 A 87 87 ASP N N 87 115.381 116.400 -1.019 1
1 1203 . 3 1 1 A 88 88 GLU H H 88 7.571 7.900 -0.329 1
1 1204 . 3 1 1 A 88 88 GLU HA H 88 3.659 4.047 -0.388 1
1 1209 . 3 1 1 A 88 88 GLU C C 88 177.097 178.655 -1.558 1
1 1210 . 3 1 1 A 88 88 GLU CA C 88 58.729 58.889 -0.160 1
1 1211 . 3 1 1 A 88 88 GLU CB C 88 30.052 29.560 0.492 1
1 1213 . 3 1 1 A 88 88 GLU N N 88 120.009 121.043 -1.034 1
1 1214 . 3 1 1 A 89 89 ALA H H 89 7.423 7.515 -0.092 1
1 1215 . 3 1 1 A 89 89 ALA HA H 89 3.900 4.362 -0.462 1
1 1219 . 3 1 1 A 89 89 ALA C C 89 178.267 180.087 -1.820 1
1 1220 . 3 1 1 A 89 89 ALA CA C 89 55.607 55.180 0.427 1
1 1221 . 3 1 1 A 89 89 ALA CB C 89 17.348 18.354 -1.006 1
1 1222 . 3 1 1 A 89 89 ALA N N 89 118.873 122.166 -3.293 1
1 1223 . 3 1 1 A 90 90 LYS H H 90 8.046 8.397 -0.351 1
1 1224 . 3 1 1 A 90 90 LYS HA H 90 3.669 4.042 -0.373 1
1 1233 . 3 1 1 A 90 90 LYS C C 90 177.649 179.076 -1.427 1
1 1234 . 3 1 1 A 90 90 LYS CA C 90 60.351 59.815 0.536 1
1 1235 . 3 1 1 A 90 90 LYS CB C 90 32.087 32.329 -0.242 1
1 1239 . 3 1 1 A 90 90 LYS N N 90 114.834 117.314 -2.480 1
1 1240 . 3 1 1 A 91 91 ARG H H 91 7.468 7.824 -0.356 1
1 1241 . 3 1 1 A 91 91 ARG HA H 91 3.887 3.863 0.024 1
1 1249 . 3 1 1 A 91 91 ARG C C 91 178.998 179.044 -0.046 1
1 1250 . 3 1 1 A 91 91 ARG CA C 91 59.164 59.219 -0.055 1
1 1251 . 3 1 1 A 91 91 ARG CB C 91 29.274 29.714 -0.440 1
1 1254 . 3 1 1 A 91 91 ARG N N 91 119.029 119.647 -0.618 1
1 1256 . 3 1 1 A 92 92 TRP H H 92 8.136 7.809 0.327 1
1 1257 . 3 1 1 A 92 92 TRP HA H 92 4.818 4.491 0.327 1
1 1266 . 3 1 1 A 92 92 TRP C C 92 179.566 179.061 0.505 1
1 1267 . 3 1 1 A 92 92 TRP CA C 92 58.663 59.423 -0.760 1
1 1268 . 3 1 1 A 92 92 TRP CB C 92 29.790 29.258 0.532 1
1 1274 . 3 1 1 A 92 92 TRP N N 92 118.100 120.157 -2.057 1
1 1276 . 3 1 1 A 93 93 ILE H H 93 8.363 8.392 -0.029 1
1 1277 . 3 1 1 A 93 93 ILE HA H 93 3.544 3.709 -0.165 1
1 1287 . 3 1 1 A 93 93 ILE C C 93 176.820 178.059 -1.239 1
1 1288 . 3 1 1 A 93 93 ILE CA C 93 66.225 65.423 0.802 1
1 1289 . 3 1 1 A 93 93 ILE CB C 93 37.571 37.806 -0.235 1
1 1293 . 3 1 1 A 93 93 ILE N N 93 120.588 120.397 0.191 1
1 1294 . 3 1 1 A 94 94 LYS H H 94 8.264 7.805 0.459 1
1 1295 . 3 1 1 A 94 94 LYS HA H 94 3.865 3.989 -0.124 1
1 1304 . 3 1 1 A 94 94 LYS C C 94 179.258 179.096 0.162 1
1 1305 . 3 1 1 A 94 94 LYS CA C 94 59.889 59.797 0.092 1
1 1306 . 3 1 1 A 94 94 LYS CB C 94 32.225 32.382 -0.157 1
1 1310 . 3 1 1 A 94 94 LYS N N 94 121.687 120.885 0.802 1
1 1311 . 3 1 1 A 95 95 GLU H H 95 8.360 8.379 -0.019 1
1 1312 . 3 1 1 A 95 95 GLU HA H 95 4.023 4.075 -0.052 1
1 1317 . 3 1 1 A 95 95 GLU C C 95 178.884 178.898 -0.014 1
1 1318 . 3 1 1 A 95 95 GLU CA C 95 59.366 58.952 0.414 1
1 1319 . 3 1 1 A 95 95 GLU CB C 95 29.508 28.891 0.617 1
1 1321 . 3 1 1 A 95 95 GLU N N 95 118.505 117.465 1.040 1
1 1322 . 3 1 1 A 96 96 PHE H H 96 8.212 8.158 0.054 1
1 1323 . 3 1 1 A 96 96 PHE HA H 96 4.512 4.241 0.271 1
1 1331 . 3 1 1 A 96 96 PHE C C 96 176.820 178.229 -1.409 1
1 1332 . 3 1 1 A 96 96 PHE CA C 96 59.608 61.376 -1.768 1
1 1333 . 3 1 1 A 96 96 PHE CB C 96 40.431 39.132 1.299 1
1 1339 . 3 1 1 A 96 96 PHE N N 96 120.369 122.142 -1.773 1
1 1340 . 3 1 1 A 97 97 SER H H 97 8.216 7.885 0.331 1
1 1341 . 3 1 1 A 97 97 SER HA H 97 3.816 4.003 -0.187 1
1 1344 . 3 1 1 A 97 97 SER C C 97 175.618 177.210 -1.592 1
1 1345 . 3 1 1 A 97 97 SER CA C 97 60.492 61.288 -0.796 1
1 1346 . 3 1 1 A 97 97 SER CB C 97 63.022 62.699 0.323 1
1 1347 . 3 1 1 A 97 97 SER N N 97 111.969 114.298 -2.329 1
1 1348 . 3 1 1 A 98 98 GLU H H 98 7.655 7.530 0.125 1
1 1349 . 3 1 1 A 98 98 GLU HA H 98 4.187 3.894 0.293 1
1 1354 . 3 1 1 A 98 98 GLU C C 98 177.698 179.192 -1.494 1
1 1355 . 3 1 1 A 98 98 GLU CA C 98 57.069 59.303 -2.234 1
1 1356 . 3 1 1 A 98 98 GLU CB C 98 29.321 29.011 0.310 1
1 1358 . 3 1 1 A 98 98 GLU N N 98 120.588 121.992 -1.404 1
1 1359 . 3 1 1 A 99 99 GLU H H 99 7.794 7.666 0.128 1
1 1360 . 3 1 1 A 99 99 GLU HA H 99 4.123 3.802 0.321 1
1 1365 . 3 1 1 A 99 99 GLU C C 99 177.665 177.156 0.509 1
1 1366 . 3 1 1 A 99 99 GLU CA C 99 57.304 56.235 1.069 1
1 1367 . 3 1 1 A 99 99 GLU CB C 99 29.368 29.804 -0.436 1
1 1369 . 3 1 1 A 99 99 GLU N N 99 120.067 117.288 2.779 1
1 1370 . 3 1 1 A 100 100 GLY H H 100 8.138 8.080 0.058 1
1 1371 . 3 1 1 A 100 100 GLY HA2 H 100 3.865 3.739 0.126 1
1 1372 . 3 1 1 A 100 100 GLY HA3 H 100 3.715 3.838 -0.123 1
1 1373 . 3 1 1 A 100 100 GLY C C 100 174.464 175.227 -0.763 1
1 1374 . 3 1 1 A 100 100 GLY CA C 100 45.305 46.620 -1.315 1
1 1375 . 3 1 1 A 100 100 GLY N N 100 107.802 108.691 -0.889 1
1 1376 . 3 1 1 A 101 101 GLY H H 101 8.023 8.467 -0.444 1
1 1377 . 3 1 1 A 101 101 GLY HA2 H 101 3.865 3.770 0.095 1
1 1378 . 3 1 1 A 101 101 GLY HA3 H 101 3.892 3.808 0.084 1
1 1379 . 3 1 1 A 101 101 GLY C C 101 174.204 173.592 0.612 1
1 1380 . 3 1 1 A 101 101 GLY CA C 101 45.036 45.946 -0.910 1
1 1381 . 3 1 1 A 101 101 GLY N N 101 108.032 107.256 0.776 1
1 1382 . 3 1 1 A 102 102 SER H H 102 8.059 7.570 0.489 1
1 1383 . 3 1 1 A 102 102 SER HA H 102 4.380 4.866 -0.486 1
1 1386 . 3 1 1 A 102 102 SER C C 102 174.627 173.641 0.986 1
1 1387 . 3 1 1 A 102 102 SER CA C 102 58.194 57.335 0.859 1
1 1388 . 3 1 1 A 102 102 SER CB C 102 63.538 66.424 -2.886 1
1 1389 . 3 1 1 A 102 102 SER N N 102 115.266 114.523 0.743 1
1 1390 . 3 1 1 A 103 103 LEU H H 103 8.287 8.821 -0.534 1
1 1391 . 3 1 1 A 103 103 LEU HA H 103 4.301 3.837 0.464 1
1 1401 . 3 1 1 A 103 103 LEU C C 103 177.292 178.129 -0.837 1
1 1402 . 3 1 1 A 103 103 LEU CA C 103 55.007 57.853 -2.846 1
1 1403 . 3 1 1 A 103 103 LEU CB C 103 42.023 41.870 0.153 1
1 1407 . 3 1 1 A 103 103 LEU N N 103 123.596 126.664 -3.068 1
1 1408 . 3 1 1 A 104 104 GLU H H 104 8.216 8.154 0.062 1
1 1409 . 3 1 1 A 104 104 GLU HA H 104 4.126 4.596 -0.470 1
1 1414 . 3 1 1 A 104 104 GLU CA C 104 56.518 57.181 -0.663 1
1 1415 . 3 1 1 A 104 104 GLU CB C 104 29.837 30.902 -1.065 1
1 1417 . 3 1 1 A 104 104 GLU N N 104 120.510 116.583 3.927 1
1 1418 . 3 1 1 A 105 105 HIS HA H 105 4.593 4.663 -0.070 1
1 1421 . 3 1 1 A 105 105 HIS C C 105 173.766 175.271 -1.505 1
1 1422 . 3 1 1 A 105 105 HIS CA C 105 55.536 57.183 -1.647 1
1 1423 . 3 1 1 A 105 105 HIS CB C 105 30.001 29.481 0.520 1
1 1424 . 3 1 1 A 106 106 HIS H H 106 8.154 7.928 0.226 1
1 1425 . 3 1 1 A 106 106 HIS HA H 106 4.407 4.374 0.033 1
1 1428 . 3 1 1 A 106 106 HIS CA C 106 56.920 55.531 1.389 1
1 1429 . 3 1 1 A 106 106 HIS CB C 106 30.001 29.526 0.475 1
1 14 . 4 1 1 A 2 2 LEU H H 2 8.509 8.742 -0.233 1
1 15 . 4 1 1 A 2 2 LEU HA H 2 4.463 5.194 -0.731 1
1 25 . 4 1 1 A 2 2 LEU C C 2 173.944 176.469 -2.525 1
1 26 . 4 1 1 A 2 2 LEU CA C 2 54.471 53.514 0.957 1
1 27 . 4 1 1 A 2 2 LEU CB C 2 43.595 44.331 -0.736 1
1 31 . 4 1 1 A 2 2 LEU N N 2 127.160 125.740 1.420 1
1 32 . 4 1 1 A 3 3 LEU H H 3 7.844 8.807 -0.963 1
1 33 . 4 1 1 A 3 3 LEU HA H 3 5.128 5.569 -0.441 1
1 43 . 4 1 1 A 3 3 LEU C C 3 175.423 175.320 0.103 1
1 44 . 4 1 1 A 3 3 LEU CA C 3 53.566 53.446 0.120 1
1 45 . 4 1 1 A 3 3 LEU CB C 3 44.039 45.085 -1.046 1
1 49 . 4 1 1 A 3 3 LEU N N 3 122.555 122.546 0.009 1
1 50 . 4 1 1 A 4 4 TYR H H 4 8.360 9.488 -1.128 1
1 51 . 4 1 1 A 4 4 TYR HA H 4 5.143 5.163 -0.020 1
1 58 . 4 1 1 A 4 4 TYR C C 4 174.481 174.971 -0.490 1
1 59 . 4 1 1 A 4 4 TYR CA C 4 56.577 55.728 0.849 1
1 60 . 4 1 1 A 4 4 TYR CB C 4 43.840 42.215 1.625 1
1 65 . 4 1 1 A 4 4 TYR N N 4 119.315 123.458 -4.143 1
1 66 . 4 1 1 A 5 5 VAL H H 5 8.918 8.788 0.130 1
1 67 . 4 1 1 A 5 5 VAL HA H 5 5.106 5.065 0.041 1
1 75 . 4 1 1 A 5 5 VAL C C 5 174.042 174.692 -0.650 1
1 76 . 4 1 1 A 5 5 VAL CA C 5 59.852 60.806 -0.954 1
1 77 . 4 1 1 A 5 5 VAL CB C 5 33.816 35.548 -1.732 1
1 80 . 4 1 1 A 5 5 VAL N N 5 119.952 120.254 -0.302 1
1 81 . 4 1 1 A 6 6 LEU H H 6 9.315 9.494 -0.179 1
1 82 . 4 1 1 A 6 6 LEU HA H 6 5.466 5.153 0.313 1
1 92 . 4 1 1 A 6 6 LEU C C 6 175.049 174.781 0.268 1
1 93 . 4 1 1 A 6 6 LEU CA C 6 52.090 53.226 -1.136 1
1 94 . 4 1 1 A 6 6 LEU CB C 6 44.103 43.178 0.925 1
1 98 . 4 1 1 A 6 6 LEU N N 6 126.917 126.555 0.362 1
1 99 . 4 1 1 A 7 7 ILE H H 7 8.458 9.151 -0.693 1
1 100 . 4 1 1 A 7 7 ILE HA H 7 5.131 4.939 0.192 1
1 110 . 4 1 1 A 7 7 ILE C C 7 173.213 173.579 -0.366 1
1 111 . 4 1 1 A 7 7 ILE CA C 7 58.463 59.947 -1.484 1
1 112 . 4 1 1 A 7 7 ILE CB C 7 41.020 40.487 0.533 1
1 116 . 4 1 1 A 7 7 ILE N N 7 119.778 126.236 -6.458 1
1 117 . 4 1 1 A 8 8 ILE H H 8 8.797 9.461 -0.664 1
1 118 . 4 1 1 A 8 8 ILE HA H 8 4.611 5.015 -0.404 1
1 128 . 4 1 1 A 8 8 ILE C C 8 174.611 174.776 -0.165 1
1 129 . 4 1 1 A 8 8 ILE CA C 8 60.227 60.342 -0.115 1
1 130 . 4 1 1 A 8 8 ILE CB C 8 37.665 38.959 -1.294 1
1 134 . 4 1 1 A 8 8 ILE N N 8 128.919 131.014 -2.095 1
1 135 . 4 1 1 A 9 9 SER H H 9 7.811 8.757 -0.946 1
1 136 . 4 1 1 A 9 9 SER HA H 9 4.429 4.935 -0.506 1
1 140 . 4 1 1 A 9 9 SER C C 9 172.937 172.681 0.256 1
1 141 . 4 1 1 A 9 9 SER CA C 9 58.241 56.919 1.322 1
1 142 . 4 1 1 A 9 9 SER CB C 9 64.261 64.205 0.056 1
1 143 . 4 1 1 A 9 9 SER N N 9 116.365 121.907 -5.542 1
1 144 . 4 1 1 A 10 10 ASN H H 10 8.641 8.682 -0.041 1
1 145 . 4 1 1 A 10 10 ASN HA H 10 4.938 5.037 -0.099 1
1 150 . 4 1 1 A 10 10 ASN C C 10 174.497 174.581 -0.084 1
1 151 . 4 1 1 A 10 10 ASN CA C 10 52.221 52.968 -0.747 1
1 152 . 4 1 1 A 10 10 ASN CB C 10 39.128 39.706 -0.578 1
1 153 . 4 1 1 A 10 10 ASN N N 10 122.612 120.606 2.006 1
1 155 . 4 1 1 A 11 11 ASP H H 11 8.673 7.678 0.995 1
1 156 . 4 1 1 A 11 11 ASP HA H 11 4.596 4.712 -0.116 1
1 159 . 4 1 1 A 11 11 ASP C C 11 175.342 176.697 -1.355 1
1 160 . 4 1 1 A 11 11 ASP CA C 11 53.233 53.725 -0.492 1
1 161 . 4 1 1 A 11 11 ASP CB C 11 40.965 42.242 -1.277 1
1 162 . 4 1 1 A 11 11 ASP N N 11 122.717 122.556 0.161 1
1 163 . 4 1 1 A 12 12 LYS H H 12 8.562 8.802 -0.240 1
1 164 . 4 1 1 A 12 12 LYS HA H 12 3.854 3.948 -0.094 1
1 173 . 4 1 1 A 12 12 LYS C C 12 178.754 178.316 0.438 1
1 174 . 4 1 1 A 12 12 LYS CA C 12 59.581 60.233 -0.652 1
1 175 . 4 1 1 A 12 12 LYS CB C 12 32.378 32.467 -0.089 1
1 179 . 4 1 1 A 12 12 LYS N N 12 125.737 126.357 -0.620 1
1 180 . 4 1 1 A 13 13 LYS H H 13 8.075 7.621 0.454 1
1 181 . 4 1 1 A 13 13 LYS HA H 13 4.154 4.033 0.121 1
1 190 . 4 1 1 A 13 13 LYS C C 13 178.315 178.892 -0.577 1
1 191 . 4 1 1 A 13 13 LYS CA C 13 58.532 59.221 -0.689 1
1 192 . 4 1 1 A 13 13 LYS CB C 13 31.452 32.165 -0.713 1
1 196 . 4 1 1 A 13 13 LYS N N 13 119.604 120.193 -0.589 1
1 197 . 4 1 1 A 14 14 LEU H H 14 7.552 8.055 -0.503 1
1 198 . 4 1 1 A 14 14 LEU HA H 14 3.682 4.054 -0.372 1
1 208 . 4 1 1 A 14 14 LEU C C 14 178.429 178.204 0.225 1
1 209 . 4 1 1 A 14 14 LEU CA C 14 58.999 58.311 0.688 1
1 210 . 4 1 1 A 14 14 LEU CB C 14 41.228 41.453 -0.225 1
1 214 . 4 1 1 A 14 14 LEU N N 14 122.266 121.156 1.110 1
1 215 . 4 1 1 A 15 15 ILE H H 15 8.074 8.040 0.034 1
1 216 . 4 1 1 A 15 15 ILE HA H 15 3.264 3.442 -0.178 1
1 226 . 4 1 1 A 15 15 ILE C C 15 177.000 177.806 -0.806 1
1 227 . 4 1 1 A 15 15 ILE CA C 15 65.939 65.825 0.114 1
1 228 . 4 1 1 A 15 15 ILE CB C 15 37.983 38.071 -0.088 1
1 232 . 4 1 1 A 15 15 ILE N N 15 118.214 119.957 -1.743 1
1 233 . 4 1 1 A 16 16 GLU H H 16 8.016 8.408 -0.392 1
1 234 . 4 1 1 A 16 16 GLU HA H 16 4.045 3.914 0.131 1
1 239 . 4 1 1 A 16 16 GLU C C 16 179.388 179.669 -0.281 1
1 240 . 4 1 1 A 16 16 GLU CA C 16 59.032 59.914 -0.882 1
1 241 . 4 1 1 A 16 16 GLU CB C 16 29.200 29.193 0.007 1
1 243 . 4 1 1 A 16 16 GLU N N 16 118.484 118.732 -0.248 1
1 244 . 4 1 1 A 17 17 GLU H H 17 8.063 8.395 -0.332 1
1 245 . 4 1 1 A 17 17 GLU HA H 17 4.053 4.030 0.023 1
1 250 . 4 1 1 A 17 17 GLU C C 17 179.306 179.262 0.044 1
1 251 . 4 1 1 A 17 17 GLU CA C 17 58.636 59.325 -0.689 1
1 252 . 4 1 1 A 17 17 GLU CB C 17 29.011 29.319 -0.308 1
1 254 . 4 1 1 A 17 17 GLU N N 17 118.100 120.552 -2.452 1
1 255 . 4 1 1 A 18 18 ALA H H 18 8.655 8.219 0.436 1
1 256 . 4 1 1 A 18 18 ALA HA H 18 3.775 4.021 -0.246 1
1 260 . 4 1 1 A 18 18 ALA C C 18 178.559 179.735 -1.176 1
1 261 . 4 1 1 A 18 18 ALA CA C 18 54.960 55.431 -0.471 1
1 262 . 4 1 1 A 18 18 ALA CB C 18 17.960 18.348 -0.388 1
1 263 . 4 1 1 A 18 18 ALA N N 18 122.439 122.708 -0.269 1
1 264 . 4 1 1 A 19 19 ARG H H 19 8.900 8.066 0.834 1
1 265 . 4 1 1 A 19 19 ARG HA H 19 3.809 4.070 -0.261 1
1 273 . 4 1 1 A 19 19 ARG C C 19 178.721 178.929 -0.208 1
1 274 . 4 1 1 A 19 19 ARG CA C 19 59.976 59.803 0.173 1
1 275 . 4 1 1 A 19 19 ARG CB C 19 29.572 29.941 -0.369 1
1 278 . 4 1 1 A 19 19 ARG N N 19 118.563 117.656 0.907 1
1 280 . 4 1 1 A 20 20 LYS H H 20 7.792 7.891 -0.099 1
1 281 . 4 1 1 A 20 20 LYS HA H 20 4.052 4.012 0.040 1
1 290 . 4 1 1 A 20 20 LYS C C 20 179.648 179.852 -0.204 1
1 291 . 4 1 1 A 20 20 LYS CA C 20 59.296 59.441 -0.145 1
1 292 . 4 1 1 A 20 20 LYS CB C 20 32.216 32.276 -0.060 1
1 296 . 4 1 1 A 20 20 LYS N N 20 118.638 119.500 -0.862 1
1 297 . 4 1 1 A 21 21 MET H H 21 7.684 8.073 -0.389 1
1 298 . 4 1 1 A 21 21 MET HA H 21 4.411 4.173 0.238 1
1 306 . 4 1 1 A 21 21 MET C C 21 177.909 178.101 -0.192 1
1 307 . 4 1 1 A 21 21 MET CA C 21 57.009 59.269 -2.260 1
1 308 . 4 1 1 A 21 21 MET CB C 21 32.028 32.550 -0.522 1
1 311 . 4 1 1 A 21 21 MET N N 21 118.100 118.377 -0.277 1
1 312 . 4 1 1 A 22 22 ALA H H 22 8.815 7.997 0.818 1
1 313 . 4 1 1 A 22 22 ALA HA H 22 3.826 3.932 -0.106 1
1 317 . 4 1 1 A 22 22 ALA C C 22 178.835 179.476 -0.641 1
1 318 . 4 1 1 A 22 22 ALA CA C 22 55.427 55.509 -0.082 1
1 319 . 4 1 1 A 22 22 ALA CB C 22 18.059 18.398 -0.339 1
1 320 . 4 1 1 A 22 22 ALA N N 22 122.150 120.922 1.228 1
1 321 . 4 1 1 A 23 23 GLU H H 23 8.276 8.397 -0.121 1
1 322 . 4 1 1 A 23 23 GLU HA H 23 4.146 3.945 0.201 1
1 327 . 4 1 1 A 23 23 GLU C C 23 180.151 179.340 0.811 1
1 328 . 4 1 1 A 23 23 GLU CA C 23 58.999 59.516 -0.517 1
1 329 . 4 1 1 A 23 23 GLU CB C 23 29.160 29.571 -0.411 1
1 331 . 4 1 1 A 23 23 GLU N N 23 117.001 117.885 -0.884 1
1 332 . 4 1 1 A 24 24 LYS H H 24 7.573 7.906 -0.333 1
1 333 . 4 1 1 A 24 24 LYS HA H 24 4.101 4.036 0.065 1
1 342 . 4 1 1 A 24 24 LYS C C 24 177.145 178.380 -1.235 1
1 343 . 4 1 1 A 24 24 LYS CA C 24 58.261 59.129 -0.868 1
1 344 . 4 1 1 A 24 24 LYS CB C 24 32.079 32.072 0.007 1
1 348 . 4 1 1 A 24 24 LYS N N 24 119.960 119.603 0.357 1
1 349 . 4 1 1 A 25 25 ALA H H 25 7.710 7.565 0.145 1
1 350 . 4 1 1 A 25 25 ALA HA H 25 4.413 4.393 0.020 1
1 354 . 4 1 1 A 25 25 ALA C C 25 175.325 176.484 -1.159 1
1 355 . 4 1 1 A 25 25 ALA CA C 25 51.208 51.741 -0.533 1
1 356 . 4 1 1 A 25 25 ALA CB C 25 18.520 19.209 -0.689 1
1 357 . 4 1 1 A 25 25 ALA N N 25 119.257 118.577 0.680 1
1 358 . 4 1 1 A 26 26 ASN H H 26 7.840 7.857 -0.017 1
1 359 . 4 1 1 A 26 26 ASN HA H 26 4.357 4.297 0.060 1
1 364 . 4 1 1 A 26 26 ASN C C 26 173.587 174.482 -0.895 1
1 365 . 4 1 1 A 26 26 ASN CA C 26 54.307 54.520 -0.213 1
1 366 . 4 1 1 A 26 26 ASN CB C 26 36.972 37.350 -0.378 1
1 367 . 4 1 1 A 26 26 ASN N N 26 115.266 113.565 1.701 1
1 369 . 4 1 1 A 27 27 LEU H H 27 8.241 8.137 0.104 1
1 370 . 4 1 1 A 27 27 LEU HA H 27 4.652 4.180 0.472 1
1 380 . 4 1 1 A 27 27 LEU C C 27 175.894 176.048 -0.154 1
1 381 . 4 1 1 A 27 27 LEU CA C 27 52.923 54.696 -1.773 1
1 382 . 4 1 1 A 27 27 LEU CB C 27 44.090 42.167 1.923 1
1 386 . 4 1 1 A 27 27 LEU N N 27 116.828 119.192 -2.364 1
1 387 . 4 1 1 A 28 28 GLU H H 28 7.798 7.816 -0.018 1
1 388 . 4 1 1 A 28 28 GLU HA H 28 4.310 4.505 -0.195 1
1 393 . 4 1 1 A 28 28 GLU C C 28 173.944 175.050 -1.106 1
1 394 . 4 1 1 A 28 28 GLU CA C 28 55.460 55.998 -0.538 1
1 395 . 4 1 1 A 28 28 GLU CB C 28 30.512 29.838 0.674 1
1 397 . 4 1 1 A 28 28 GLU N N 28 121.340 124.292 -2.952 1
1 398 . 4 1 1 A 29 29 LEU H H 29 8.451 8.909 -0.458 1
1 399 . 4 1 1 A 29 29 LEU HA H 29 5.662 5.244 0.418 1
1 409 . 4 1 1 A 29 29 LEU C C 29 176.902 174.976 1.926 1
1 410 . 4 1 1 A 29 29 LEU CA C 29 53.186 54.110 -0.924 1
1 411 . 4 1 1 A 29 29 LEU CB C 29 44.914 44.627 0.287 1
1 415 . 4 1 1 A 29 29 LEU N N 29 126.547 127.727 -1.180 1
1 416 . 4 1 1 A 30 30 ARG H H 30 9.094 9.415 -0.321 1
1 417 . 4 1 1 A 30 30 ARG HA H 30 4.910 5.085 -0.175 1
1 425 . 4 1 1 A 30 30 ARG C C 30 175.147 175.011 0.136 1
1 426 . 4 1 1 A 30 30 ARG CA C 30 53.417 54.009 -0.592 1
1 427 . 4 1 1 A 30 30 ARG CB C 30 32.555 33.661 -1.106 1
1 430 . 4 1 1 A 30 30 ARG N N 30 125.043 125.730 -0.687 1
1 432 . 4 1 1 A 31 31 THR H H 31 8.496 8.549 -0.053 1
1 433 . 4 1 1 A 31 31 THR HA H 31 4.888 5.055 -0.167 1
1 438 . 4 1 1 A 31 31 THR C C 31 173.961 173.663 0.298 1
1 439 . 4 1 1 A 31 31 THR CA C 31 60.445 60.229 0.216 1
1 440 . 4 1 1 A 31 31 THR CB C 31 69.492 70.200 -0.708 1
1 442 . 4 1 1 A 31 31 THR N N 31 114.745 113.107 1.638 1
1 443 . 4 1 1 A 32 32 VAL H H 32 8.480 8.885 -0.405 1
1 444 . 4 1 1 A 32 32 VAL HA H 32 4.411 4.877 -0.466 1
1 452 . 4 1 1 A 32 32 VAL C C 32 175.082 175.389 -0.307 1
1 453 . 4 1 1 A 32 32 VAL CA C 32 60.946 60.339 0.607 1
1 454 . 4 1 1 A 32 32 VAL CB C 32 34.487 34.844 -0.357 1
1 457 . 4 1 1 A 32 32 VAL N N 32 122.324 123.833 -1.509 1
1 458 . 4 1 1 A 33 33 LYS H H 33 9.304 8.759 0.545 1
1 459 . 4 1 1 A 33 33 LYS HA H 33 4.534 4.536 -0.002 1
1 468 . 4 1 1 A 33 33 LYS C C 33 176.740 176.378 0.362 1
1 469 . 4 1 1 A 33 33 LYS CA C 33 56.846 57.221 -0.375 1
1 470 . 4 1 1 A 33 33 LYS CB C 33 34.355 34.260 0.095 1
1 474 . 4 1 1 A 33 33 LYS N N 33 123.654 125.228 -1.574 1
1 475 . 4 1 1 A 34 34 THR H H 34 7.245 7.712 -0.467 1
1 476 . 4 1 1 A 34 34 THR HA H 34 4.780 4.715 0.065 1
1 481 . 4 1 1 A 34 34 THR C C 34 174.529 175.666 -1.137 1
1 482 . 4 1 1 A 34 34 THR CA C 34 58.859 59.907 -1.048 1
1 483 . 4 1 1 A 34 34 THR CB C 34 73.023 72.092 0.931 1
1 485 . 4 1 1 A 34 34 THR N N 34 106.300 111.894 -5.594 1
1 486 . 4 1 1 A 35 35 GLU H H 35 9.174 9.133 0.041 1
1 487 . 4 1 1 A 35 35 GLU HA H 35 3.886 3.915 -0.029 1
1 492 . 4 1 1 A 35 35 GLU C C 35 177.714 177.616 0.098 1
1 493 . 4 1 1 A 35 35 GLU CA C 35 59.233 59.654 -0.421 1
1 494 . 4 1 1 A 35 35 GLU CB C 35 29.377 29.463 -0.086 1
1 496 . 4 1 1 A 35 35 GLU N N 35 121.919 122.241 -0.322 1
1 497 . 4 1 1 A 36 36 ASP H H 36 8.185 8.323 -0.138 1
1 498 . 4 1 1 A 36 36 ASP HA H 36 4.289 4.303 -0.014 1
1 501 . 4 1 1 A 36 36 ASP C C 36 178.348 178.423 -0.075 1
1 502 . 4 1 1 A 36 36 ASP CA C 36 56.962 57.575 -0.613 1
1 503 . 4 1 1 A 36 36 ASP CB C 36 40.214 41.389 -1.175 1
1 504 . 4 1 1 A 36 36 ASP N N 36 118.332 120.286 -1.954 1
1 505 . 4 1 1 A 37 37 GLU H H 37 7.741 7.499 0.242 1
1 506 . 4 1 1 A 37 37 GLU HA H 37 3.708 3.997 -0.289 1
1 511 . 4 1 1 A 37 37 GLU C C 37 177.324 178.974 -1.650 1
1 512 . 4 1 1 A 37 37 GLU CA C 37 58.698 59.265 -0.567 1
1 513 . 4 1 1 A 37 37 GLU CB C 37 30.199 29.534 0.665 1
1 515 . 4 1 1 A 37 37 GLU N N 37 120.704 118.906 1.798 1
1 516 . 4 1 1 A 38 38 LEU H H 38 7.531 8.000 -0.469 1
1 517 . 4 1 1 A 38 38 LEU HA H 38 3.873 4.098 -0.225 1
1 527 . 4 1 1 A 38 38 LEU C C 38 177.357 178.510 -1.153 1
1 528 . 4 1 1 A 38 38 LEU CA C 38 58.305 58.282 0.023 1
1 529 . 4 1 1 A 38 38 LEU CB C 38 40.837 41.555 -0.718 1
1 533 . 4 1 1 A 38 38 LEU N N 38 119.200 121.756 -2.556 1
1 534 . 4 1 1 A 39 39 LYS H H 39 8.083 7.768 0.315 1
1 535 . 4 1 1 A 39 39 LYS HA H 39 3.608 3.923 -0.315 1
1 544 . 4 1 1 A 39 39 LYS C C 39 177.373 178.946 -1.573 1
1 545 . 4 1 1 A 39 39 LYS CA C 39 60.290 59.422 0.868 1
1 546 . 4 1 1 A 39 39 LYS CB C 39 32.178 32.420 -0.242 1
1 550 . 4 1 1 A 39 39 LYS N N 39 116.943 118.707 -1.764 1
1 551 . 4 1 1 A 40 40 LYS H H 40 7.632 8.040 -0.408 1
1 552 . 4 1 1 A 40 40 LYS HA H 40 3.864 3.898 -0.034 1
1 561 . 4 1 1 A 40 40 LYS C C 40 179.566 178.545 1.021 1
1 562 . 4 1 1 A 40 40 LYS CA C 40 58.993 58.834 0.159 1
1 563 . 4 1 1 A 40 40 LYS CB C 40 31.758 31.911 -0.153 1
1 567 . 4 1 1 A 40 40 LYS N N 40 118.274 119.200 -0.926 1
1 568 . 4 1 1 A 41 41 TYR H H 41 7.823 7.744 0.079 1
1 569 . 4 1 1 A 41 41 TYR HA H 41 3.926 4.103 -0.177 1
1 576 . 4 1 1 A 41 41 TYR C C 41 176.625 177.756 -1.131 1
1 577 . 4 1 1 A 41 41 TYR CA C 41 59.757 60.950 -1.193 1
1 578 . 4 1 1 A 41 41 TYR CB C 41 36.901 38.247 -1.346 1
1 583 . 4 1 1 A 41 41 TYR N N 41 117.811 118.705 -0.894 1
1 584 . 4 1 1 A 42 42 LEU H H 42 7.964 8.007 -0.043 1
1 585 . 4 1 1 A 42 42 LEU HA H 42 3.704 3.461 0.243 1
1 595 . 4 1 1 A 42 42 LEU C C 42 178.396 179.068 -0.672 1
1 596 . 4 1 1 A 42 42 LEU CA C 42 58.237 57.479 0.758 1
1 597 . 4 1 1 A 42 42 LEU CB C 42 40.507 40.775 -0.268 1
1 601 . 4 1 1 A 42 42 LEU N N 42 115.960 119.905 -3.945 1
1 602 . 4 1 1 A 43 43 GLU H H 43 8.193 8.170 0.023 1
1 603 . 4 1 1 A 43 43 GLU HA H 43 3.882 3.889 -0.007 1
1 608 . 4 1 1 A 43 43 GLU C C 43 179.193 179.300 -0.107 1
1 609 . 4 1 1 A 43 43 GLU CA C 43 59.122 59.782 -0.660 1
1 610 . 4 1 1 A 43 43 GLU CB C 43 29.244 29.135 0.109 1
1 612 . 4 1 1 A 43 43 GLU N N 43 117.175 119.832 -2.657 1
1 613 . 4 1 1 A 44 44 GLU H H 44 7.601 7.617 -0.016 1
1 614 . 4 1 1 A 44 44 GLU HA H 44 3.936 4.101 -0.165 1
1 619 . 4 1 1 A 44 44 GLU C C 44 179.875 179.079 0.796 1
1 620 . 4 1 1 A 44 44 GLU CA C 44 58.867 59.341 -0.474 1
1 621 . 4 1 1 A 44 44 GLU CB C 44 28.648 29.454 -0.806 1
1 623 . 4 1 1 A 44 44 GLU N N 44 120.472 119.469 1.003 1
1 624 . 4 1 1 A 45 45 PHE H H 45 8.260 7.777 0.483 1
1 625 . 4 1 1 A 45 45 PHE HA H 45 4.520 4.045 0.475 1
1 633 . 4 1 1 A 45 45 PHE C C 45 177.942 178.314 -0.372 1
1 634 . 4 1 1 A 45 45 PHE CA C 45 55.945 60.744 -4.799 1
1 635 . 4 1 1 A 45 45 PHE CB C 45 36.680 37.880 -1.200 1
1 641 . 4 1 1 A 45 45 PHE N N 45 119.272 119.228 0.044 1
1 642 . 4 1 1 A 46 46 ARG H H 46 8.023 8.154 -0.131 1
1 643 . 4 1 1 A 46 46 ARG HA H 46 4.074 4.034 0.040 1
1 651 . 4 1 1 A 46 46 ARG C C 46 177.617 179.049 -1.432 1
1 652 . 4 1 1 A 46 46 ARG CA C 46 58.194 59.274 -1.080 1
1 653 . 4 1 1 A 46 46 ARG CB C 46 29.737 30.068 -0.331 1
1 656 . 4 1 1 A 46 46 ARG N N 46 118.136 120.168 -2.032 1
1 658 . 4 1 1 A 47 47 LYS H H 47 7.470 7.628 -0.158 1
1 659 . 4 1 1 A 47 47 LYS HA H 47 4.143 4.070 0.073 1
1 668 . 4 1 1 A 47 47 LYS C C 47 177.324 178.091 -0.767 1
1 669 . 4 1 1 A 47 47 LYS CA C 47 57.726 59.766 -2.040 1
1 670 . 4 1 1 A 47 47 LYS CB C 47 32.409 32.361 0.048 1
1 674 . 4 1 1 A 47 47 LYS N N 47 116.943 119.976 -3.033 1
1 675 . 4 1 1 A 48 48 GLU H H 48 7.615 7.462 0.153 1
1 676 . 4 1 1 A 48 48 GLU HA H 48 4.428 4.786 -0.358 1
1 681 . 4 1 1 A 48 48 GLU C C 48 176.869 176.907 -0.038 1
1 682 . 4 1 1 A 48 48 GLU CA C 48 55.945 55.893 0.052 1
1 683 . 4 1 1 A 48 48 GLU CB C 48 29.696 30.216 -0.520 1
1 685 . 4 1 1 A 48 48 GLU N N 48 118.852 116.239 2.613 1
1 686 . 4 1 1 A 49 49 SER H H 49 7.725 7.834 -0.109 1
1 687 . 4 1 1 A 49 49 SER HA H 49 4.244 4.293 -0.049 1
1 690 . 4 1 1 A 49 49 SER C C 49 174.838 176.958 -2.120 1
1 691 . 4 1 1 A 49 49 SER CA C 49 59.366 61.463 -2.097 1
1 692 . 4 1 1 A 49 49 SER CB C 49 63.116 62.753 0.363 1
1 693 . 4 1 1 A 49 49 SER N N 49 114.224 115.490 -1.266 1
1 694 . 4 1 1 A 50 50 GLN H H 50 8.548 8.105 0.443 1
1 695 . 4 1 1 A 50 50 GLN HA H 50 4.398 4.135 0.263 1
1 702 . 4 1 1 A 50 50 GLN C C 50 175.732 176.964 -1.232 1
1 703 . 4 1 1 A 50 50 GLN CA C 50 56.272 58.815 -2.543 1
1 704 . 4 1 1 A 50 50 GLN CB C 50 28.946 28.782 0.164 1
1 706 . 4 1 1 A 50 50 GLN N N 50 120.125 120.830 -0.705 1
1 708 . 4 1 1 A 51 51 ASN H H 51 8.534 7.849 0.685 1
1 709 . 4 1 1 A 51 51 ASN HA H 51 4.980 5.007 -0.027 1
1 714 . 4 1 1 A 51 51 ASN C C 51 173.717 174.461 -0.744 1
1 715 . 4 1 1 A 51 51 ASN CA C 51 52.804 52.939 -0.135 1
1 716 . 4 1 1 A 51 51 ASN CB C 51 39.583 40.062 -0.479 1
1 717 . 4 1 1 A 51 51 ASN N N 51 118.158 114.163 3.995 1
1 719 . 4 1 1 A 52 52 ILE H H 52 7.492 7.109 0.383 1
1 720 . 4 1 1 A 52 52 ILE HA H 52 5.338 4.808 0.530 1
1 730 . 4 1 1 A 52 52 ILE C C 52 175.049 174.665 0.384 1
1 731 . 4 1 1 A 52 52 ILE CA C 52 59.364 60.566 -1.202 1
1 732 . 4 1 1 A 52 52 ILE CB C 52 42.163 40.465 1.698 1
1 736 . 4 1 1 A 52 52 ILE N N 52 117.927 121.816 -3.889 1
1 737 . 4 1 1 A 53 53 LYS H H 53 8.467 9.021 -0.554 1
1 738 . 4 1 1 A 53 53 LYS HA H 53 5.044 5.287 -0.243 1
1 747 . 4 1 1 A 53 53 LYS C C 53 175.082 175.276 -0.194 1
1 748 . 4 1 1 A 53 53 LYS CA C 53 55.429 54.863 0.566 1
1 749 . 4 1 1 A 53 53 LYS CB C 53 36.446 36.690 -0.244 1
1 753 . 4 1 1 A 53 53 LYS N N 53 123.249 127.595 -4.346 1
1 754 . 4 1 1 A 54 54 VAL H H 54 8.490 8.768 -0.278 1
1 755 . 4 1 1 A 54 54 VAL HA H 54 5.159 5.096 0.063 1
1 763 . 4 1 1 A 54 54 VAL C C 54 173.473 173.757 -0.284 1
1 764 . 4 1 1 A 54 54 VAL CA C 54 60.163 60.951 -0.788 1
1 765 . 4 1 1 A 54 54 VAL CB C 54 35.509 34.487 1.022 1
1 768 . 4 1 1 A 54 54 VAL N N 54 120.762 123.991 -3.229 1
1 769 . 4 1 1 A 55 55 LEU H H 55 8.636 8.853 -0.217 1
1 770 . 4 1 1 A 55 55 LEU HA H 55 4.670 4.888 -0.218 1
1 780 . 4 1 1 A 55 55 LEU C C 55 173.652 174.522 -0.870 1
1 781 . 4 1 1 A 55 55 LEU CA C 55 52.289 52.981 -0.692 1
1 782 . 4 1 1 A 55 55 LEU CB C 55 42.070 44.580 -2.510 1
1 786 . 4 1 1 A 55 55 LEU N N 55 131.898 129.061 2.837 1
1 787 . 4 1 1 A 56 56 ILE H H 56 9.188 9.192 -0.004 1
1 788 . 4 1 1 A 56 56 ILE HA H 56 4.879 5.021 -0.142 1
1 798 . 4 1 1 A 56 56 ILE C C 56 174.172 174.208 -0.036 1
1 799 . 4 1 1 A 56 56 ILE CA C 56 59.976 59.922 0.054 1
1 800 . 4 1 1 A 56 56 ILE CB C 56 38.181 39.586 -1.405 1
1 804 . 4 1 1 A 56 56 ILE N N 56 126.373 128.234 -1.861 1
1 805 . 4 1 1 A 57 57 LEU H H 57 8.929 9.342 -0.413 1
1 806 . 4 1 1 A 57 57 LEU HA H 57 5.394 5.131 0.263 1
1 816 . 4 1 1 A 57 57 LEU C C 57 175.358 175.893 -0.535 1
1 817 . 4 1 1 A 57 57 LEU CA C 57 52.086 53.499 -1.413 1
1 818 . 4 1 1 A 57 57 LEU CB C 57 42.445 43.103 -0.658 1
1 822 . 4 1 1 A 57 57 LEU N N 57 126.547 127.865 -1.318 1
1 823 . 4 1 1 A 58 58 VAL H H 58 8.542 9.020 -0.478 1
1 824 . 4 1 1 A 58 58 VAL HA H 58 5.253 4.779 0.474 1
1 832 . 4 1 1 A 58 58 VAL C C 58 175.244 175.980 -0.736 1
1 833 . 4 1 1 A 58 58 VAL CA C 58 58.241 59.057 -0.816 1
1 834 . 4 1 1 A 58 58 VAL CB C 58 33.165 34.762 -1.597 1
1 837 . 4 1 1 A 58 58 VAL N N 58 114.398 122.815 -8.417 1
1 838 . 4 1 1 A 59 59 SER H H 59 8.797 8.901 -0.104 1
1 839 . 4 1 1 A 59 59 SER HA H 59 5.063 4.544 0.519 1
1 842 . 4 1 1 A 59 59 SER C C 59 174.172 173.604 0.568 1
1 843 . 4 1 1 A 59 59 SER CA C 59 59.320 60.765 -1.445 1
1 844 . 4 1 1 A 59 59 SER CB C 59 65.600 63.986 1.614 1
1 845 . 4 1 1 A 59 59 SER N N 59 115.497 116.189 -0.692 1
1 846 . 4 1 1 A 60 60 ASN H H 60 7.730 7.853 -0.123 1
1 847 . 4 1 1 A 60 60 ASN HA H 60 4.811 5.151 -0.340 1
1 852 . 4 1 1 A 60 60 ASN C C 60 174.464 174.690 -0.226 1
1 853 . 4 1 1 A 60 60 ASN CA C 60 52.007 51.821 0.186 1
1 854 . 4 1 1 A 60 60 ASN CB C 60 40.336 42.091 -1.755 1
1 855 . 4 1 1 A 60 60 ASN N N 60 117.522 115.982 1.540 1
1 857 . 4 1 1 A 61 61 ASP H H 61 8.577 8.940 -0.363 1
1 858 . 4 1 1 A 61 61 ASP HA H 61 4.365 4.323 0.042 1
1 861 . 4 1 1 A 61 61 ASP C C 61 177.357 178.014 -0.657 1
1 862 . 4 1 1 A 61 61 ASP CA C 61 57.351 56.662 0.689 1
1 863 . 4 1 1 A 61 61 ASP CB C 61 40.383 40.501 -0.118 1
1 864 . 4 1 1 A 61 61 ASP N N 61 119.431 121.620 -2.189 1
1 865 . 4 1 1 A 62 62 GLU H H 62 8.405 8.402 0.003 1
1 866 . 4 1 1 A 62 62 GLU HA H 62 4.121 4.024 0.097 1
1 871 . 4 1 1 A 62 62 GLU C C 62 179.615 178.997 0.618 1
1 872 . 4 1 1 A 62 62 GLU CA C 62 59.593 59.414 0.179 1
1 873 . 4 1 1 A 62 62 GLU CB C 62 28.478 29.269 -0.791 1
1 875 . 4 1 1 A 62 62 GLU N N 62 122.150 120.166 1.984 1
1 876 . 4 1 1 A 63 63 GLU H H 63 8.384 8.230 0.154 1
1 877 . 4 1 1 A 63 63 GLU HA H 63 3.913 4.083 -0.170 1
1 882 . 4 1 1 A 63 63 GLU C C 63 178.478 178.963 -0.485 1
1 883 . 4 1 1 A 63 63 GLU CA C 63 58.273 59.001 -0.728 1
1 884 . 4 1 1 A 63 63 GLU CB C 63 29.931 28.444 1.487 1
1 886 . 4 1 1 A 63 63 GLU N N 63 119.084 117.886 1.198 1
1 887 . 4 1 1 A 64 64 LEU H H 64 7.717 7.853 -0.136 1
1 888 . 4 1 1 A 64 64 LEU HA H 64 3.750 3.988 -0.238 1
1 898 . 4 1 1 A 64 64 LEU C C 64 177.535 178.117 -0.582 1
1 899 . 4 1 1 A 64 64 LEU CA C 64 58.944 58.571 0.373 1
1 900 . 4 1 1 A 64 64 LEU CB C 64 41.695 41.640 0.055 1
1 904 . 4 1 1 A 64 64 LEU N N 64 120.357 122.608 -2.251 1
1 905 . 4 1 1 A 65 65 ASP H H 65 7.922 8.095 -0.173 1
1 906 . 4 1 1 A 65 65 ASP HA H 65 4.313 4.245 0.068 1
1 909 . 4 1 1 A 65 65 ASP C C 65 179.095 178.611 0.484 1
1 910 . 4 1 1 A 65 65 ASP CA C 65 57.272 57.969 -0.697 1
1 911 . 4 1 1 A 65 65 ASP CB C 65 40.196 40.928 -0.732 1
1 912 . 4 1 1 A 65 65 ASP N N 65 118.100 118.591 -0.491 1
1 913 . 4 1 1 A 66 66 LYS H H 66 7.802 7.540 0.262 1
1 914 . 4 1 1 A 66 66 LYS HA H 66 4.078 4.026 0.052 1
1 923 . 4 1 1 A 66 66 LYS C C 66 178.624 179.184 -0.560 1
1 924 . 4 1 1 A 66 66 LYS CA C 66 58.429 59.302 -0.873 1
1 925 . 4 1 1 A 66 66 LYS CB C 66 31.727 32.122 -0.395 1
1 929 . 4 1 1 A 66 66 LYS N N 66 119.343 118.953 0.390 1
1 930 . 4 1 1 A 67 67 ALA H H 67 8.480 8.489 -0.009 1
1 931 . 4 1 1 A 67 67 ALA HA H 67 3.853 4.052 -0.199 1
1 935 . 4 1 1 A 67 67 ALA C C 67 178.591 179.556 -0.965 1
1 936 . 4 1 1 A 67 67 ALA CA C 67 55.403 54.994 0.409 1
1 937 . 4 1 1 A 67 67 ALA CB C 67 17.793 18.549 -0.756 1
1 938 . 4 1 1 A 67 67 ALA N N 67 121.562 122.675 -1.113 1
1 939 . 4 1 1 A 68 68 LYS H H 68 8.186 7.587 0.599 1
1 940 . 4 1 1 A 68 68 LYS HA H 68 3.805 4.035 -0.230 1
1 949 . 4 1 1 A 68 68 LYS C C 68 179.095 178.752 0.343 1
1 950 . 4 1 1 A 68 68 LYS CA C 68 59.952 59.214 0.738 1
1 951 . 4 1 1 A 68 68 LYS CB C 68 32.181 31.894 0.287 1
1 955 . 4 1 1 A 68 68 LYS N N 68 116.165 116.423 -0.258 1
1 956 . 4 1 1 A 69 69 GLU H H 69 7.904 7.947 -0.043 1
1 957 . 4 1 1 A 69 69 GLU HA H 69 3.995 4.003 -0.008 1
1 962 . 4 1 1 A 69 69 GLU C C 69 179.079 179.292 -0.213 1
1 963 . 4 1 1 A 69 69 GLU CA C 69 59.022 59.074 -0.052 1
1 964 . 4 1 1 A 69 69 GLU CB C 69 29.274 29.493 -0.219 1
1 966 . 4 1 1 A 69 69 GLU N N 69 119.489 119.568 -0.079 1
1 967 . 4 1 1 A 70 70 LEU H H 70 7.962 7.960 0.002 1
1 968 . 4 1 1 A 70 70 LEU HA H 70 4.020 3.997 0.023 1
1 978 . 4 1 1 A 70 70 LEU C C 70 178.738 179.217 -0.479 1
1 979 . 4 1 1 A 70 70 LEU CA C 70 57.486 57.942 -0.456 1
1 980 . 4 1 1 A 70 70 LEU CB C 70 41.695 41.339 0.356 1
1 984 . 4 1 1 A 70 70 LEU N N 70 119.431 120.783 -1.352 1
1 985 . 4 1 1 A 71 71 ALA H H 71 8.260 8.107 0.153 1
1 986 . 4 1 1 A 71 71 ALA HA H 71 3.845 4.069 -0.224 1
1 990 . 4 1 1 A 71 71 ALA C C 71 179.518 180.060 -0.542 1
1 991 . 4 1 1 A 71 71 ALA CA C 71 55.139 55.715 -0.576 1
1 992 . 4 1 1 A 71 71 ALA CB C 71 18.487 18.300 0.187 1
1 993 . 4 1 1 A 71 71 ALA N N 71 119.604 121.974 -2.370 1
1 994 . 4 1 1 A 72 72 GLN H H 72 7.910 8.398 -0.488 1
1 995 . 4 1 1 A 72 72 GLN HA H 72 4.154 3.938 0.216 1
1 1002 . 4 1 1 A 72 72 GLN C C 72 178.900 178.654 0.246 1
1 1003 . 4 1 1 A 72 72 GLN CA C 72 58.194 58.973 -0.779 1
1 1004 . 4 1 1 A 72 72 GLN CB C 72 28.056 28.294 -0.238 1
1 1006 . 4 1 1 A 72 72 GLN N N 72 115.960 117.249 -1.289 1
1 1008 . 4 1 1 A 73 73 LYS H H 73 7.841 8.046 -0.205 1
1 1009 . 4 1 1 A 73 73 LYS HA H 73 4.171 4.055 0.116 1
1 1018 . 4 1 1 A 73 73 LYS C C 73 177.730 178.485 -0.755 1
1 1019 . 4 1 1 A 73 73 LYS CA C 73 57.867 58.948 -1.081 1
1 1020 . 4 1 1 A 73 73 LYS CB C 73 32.277 32.123 0.154 1
1 1024 . 4 1 1 A 73 73 LYS N N 73 119.027 119.289 -0.262 1
1 1025 . 4 1 1 A 74 74 MET H H 74 7.746 8.049 -0.303 1
1 1026 . 4 1 1 A 74 74 MET HA H 74 4.403 4.563 -0.160 1
1 1034 . 4 1 1 A 74 74 MET C C 74 174.416 174.924 -0.508 1
1 1035 . 4 1 1 A 74 74 MET CA C 74 55.194 55.629 -0.435 1
1 1036 . 4 1 1 A 74 74 MET CB C 74 33.366 33.122 0.244 1
1 1039 . 4 1 1 A 74 74 MET N N 74 115.786 114.873 0.913 1
1 1040 . 4 1 1 A 75 75 GLU H H 75 8.076 7.837 0.239 1
1 1041 . 4 1 1 A 75 75 GLU HA H 75 4.001 3.948 0.053 1
1 1046 . 4 1 1 A 75 75 GLU C C 75 175.130 175.330 -0.200 1
1 1047 . 4 1 1 A 75 75 GLU CA C 75 56.722 57.592 -0.870 1
1 1048 . 4 1 1 A 75 75 GLU CB C 75 27.118 27.218 -0.100 1
1 1050 . 4 1 1 A 75 75 GLU N N 75 116.249 115.695 0.554 1
1 1051 . 4 1 1 A 76 76 ILE H H 76 7.560 7.987 -0.427 1
1 1052 . 4 1 1 A 76 76 ILE HA H 76 4.428 4.333 0.095 1
1 1062 . 4 1 1 A 76 76 ILE C C 76 174.529 174.873 -0.344 1
1 1063 . 4 1 1 A 76 76 ILE CA C 76 58.475 60.480 -2.005 1
1 1064 . 4 1 1 A 76 76 ILE CB C 76 40.337 38.846 1.491 1
1 1068 . 4 1 1 A 76 76 ILE N N 76 115.960 120.066 -4.106 1
1 1069 . 4 1 1 A 77 77 ASP H H 77 8.889 8.545 0.344 1
1 1070 . 4 1 1 A 77 77 ASP HA H 77 4.569 4.965 -0.396 1
1 1073 . 4 1 1 A 77 77 ASP C C 77 174.123 175.904 -1.781 1
1 1074 . 4 1 1 A 77 77 ASP CA C 77 54.069 54.224 -0.155 1
1 1075 . 4 1 1 A 77 77 ASP CB C 77 40.233 41.333 -1.100 1
1 1076 . 4 1 1 A 77 77 ASP N N 77 126.142 127.641 -1.499 1
1 1077 . 4 1 1 A 78 78 VAL H H 78 7.754 8.939 -1.185 1
1 1078 . 4 1 1 A 78 78 VAL HA H 78 5.192 5.065 0.127 1
1 1086 . 4 1 1 A 78 78 VAL C C 78 174.968 174.040 0.928 1
1 1087 . 4 1 1 A 78 78 VAL CA C 78 58.804 59.082 -0.278 1
1 1088 . 4 1 1 A 78 78 VAL CB C 78 35.293 35.142 0.151 1
1 1091 . 4 1 1 A 78 78 VAL N N 78 122.844 117.672 5.172 1
1 1092 . 4 1 1 A 79 79 ARG H H 79 8.499 9.184 -0.685 1
1 1093 . 4 1 1 A 79 79 ARG HA H 79 4.712 4.639 0.073 1
1 1100 . 4 1 1 A 79 79 ARG C C 79 174.221 174.932 -0.711 1
1 1101 . 4 1 1 A 79 79 ARG CA C 79 54.117 55.113 -0.996 1
1 1102 . 4 1 1 A 79 79 ARG CB C 79 31.196 30.327 0.869 1
1 1105 . 4 1 1 A 79 79 ARG N N 79 125.637 123.505 2.132 1
1 1106 . 4 1 1 A 80 80 THR H H 80 8.416 8.884 -0.468 1
1 1107 . 4 1 1 A 80 80 THR HA H 80 5.332 5.065 0.267 1
1 1112 . 4 1 1 A 80 80 THR C C 80 174.497 174.127 0.370 1
1 1113 . 4 1 1 A 80 80 THR CA C 80 59.694 62.114 -2.420 1
1 1114 . 4 1 1 A 80 80 THR CB C 80 69.772 69.030 0.742 1
1 1116 . 4 1 1 A 80 80 THR N N 80 118.084 121.948 -3.864 1
1 1117 . 4 1 1 A 81 81 ARG H H 81 8.758 9.151 -0.393 1
1 1118 . 4 1 1 A 81 81 ARG HA H 81 4.362 4.843 -0.481 1
1 1126 . 4 1 1 A 81 81 ARG C C 81 173.733 173.873 -0.140 1
1 1127 . 4 1 1 A 81 81 ARG CA C 81 53.273 53.773 -0.500 1
1 1128 . 4 1 1 A 81 81 ARG CB C 81 33.915 33.015 0.900 1
1 1131 . 4 1 1 A 81 81 ARG N N 81 122.844 125.401 -2.557 1
1 1133 . 4 1 1 A 82 82 LYS H H 82 8.721 8.509 0.212 1
1 1134 . 4 1 1 A 82 82 LYS HA H 82 4.701 5.104 -0.403 1
1 1143 . 4 1 1 A 82 82 LYS C C 82 175.667 175.492 0.175 1
1 1144 . 4 1 1 A 82 82 LYS CA C 82 54.960 54.950 0.010 1
1 1145 . 4 1 1 A 82 82 LYS CB C 82 32.603 34.272 -1.669 1
1 1149 . 4 1 1 A 82 82 LYS N N 82 124.668 123.619 1.049 1
1 1150 . 4 1 1 A 83 83 VAL H H 83 9.112 9.339 -0.227 1
1 1151 . 4 1 1 A 83 83 VAL HA H 83 4.796 4.883 -0.087 1
1 1159 . 4 1 1 A 83 83 VAL C C 83 174.594 175.199 -0.605 1
1 1160 . 4 1 1 A 83 83 VAL CA C 83 59.413 59.898 -0.485 1
1 1161 . 4 1 1 A 83 83 VAL CB C 83 35.298 34.646 0.652 1
1 1164 . 4 1 1 A 83 83 VAL N N 83 122.381 122.338 0.043 1
1 1165 . 4 1 1 A 84 84 THR H H 84 9.200 8.628 0.572 1
1 1166 . 4 1 1 A 84 84 THR HA H 84 4.579 4.589 -0.010 1
1 1171 . 4 1 1 A 84 84 THR C C 84 173.993 175.068 -1.075 1
1 1172 . 4 1 1 A 84 84 THR CA C 84 60.960 62.218 -1.258 1
1 1173 . 4 1 1 A 84 84 THR CB C 84 70.100 70.015 0.085 1
1 1175 . 4 1 1 A 84 84 THR N N 84 113.183 115.743 -2.560 1
1 1176 . 4 1 1 A 85 85 SER H H 85 7.688 7.789 -0.101 1
1 1177 . 4 1 1 A 85 85 SER HA H 85 5.136 4.585 0.551 1
1 1180 . 4 1 1 A 85 85 SER CA C 85 55.205 56.846 -1.641 1
1 1181 . 4 1 1 A 85 85 SER CB C 85 64.376 63.380 0.996 1
1 1182 . 4 1 1 A 85 85 SER N N 85 115.555 117.975 -2.420 1
1 1183 . 4 1 1 A 86 86 PRO HA H 86 4.090 4.246 -0.156 1
1 1190 . 4 1 1 A 86 86 PRO C C 86 177.227 178.273 -1.046 1
1 1191 . 4 1 1 A 86 86 PRO CA C 86 65.038 65.711 -0.673 1
1 1192 . 4 1 1 A 86 86 PRO CB C 86 31.711 31.810 -0.099 1
1 1195 . 4 1 1 A 87 87 ASP H H 87 8.131 8.550 -0.419 1
1 1196 . 4 1 1 A 87 87 ASP HA H 87 4.223 4.349 -0.126 1
1 1199 . 4 1 1 A 87 87 ASP C C 87 178.721 179.180 -0.459 1
1 1200 . 4 1 1 A 87 87 ASP CA C 87 57.311 56.635 0.676 1
1 1201 . 4 1 1 A 87 87 ASP CB C 87 40.102 40.096 0.006 1
1 1202 . 4 1 1 A 87 87 ASP N N 87 115.381 116.699 -1.318 1
1 1203 . 4 1 1 A 88 88 GLU H H 88 7.571 7.894 -0.323 1
1 1204 . 4 1 1 A 88 88 GLU HA H 88 3.659 4.005 -0.346 1
1 1209 . 4 1 1 A 88 88 GLU C C 88 177.097 179.161 -2.064 1
1 1210 . 4 1 1 A 88 88 GLU CA C 88 58.729 58.874 -0.145 1
1 1211 . 4 1 1 A 88 88 GLU CB C 88 30.052 29.704 0.348 1
1 1213 . 4 1 1 A 88 88 GLU N N 88 120.009 121.130 -1.121 1
1 1214 . 4 1 1 A 89 89 ALA H H 89 7.423 7.906 -0.483 1
1 1215 . 4 1 1 A 89 89 ALA HA H 89 3.900 4.214 -0.314 1
1 1219 . 4 1 1 A 89 89 ALA C C 89 178.267 180.062 -1.795 1
1 1220 . 4 1 1 A 89 89 ALA CA C 89 55.607 55.293 0.314 1
1 1221 . 4 1 1 A 89 89 ALA CB C 89 17.348 18.326 -0.978 1
1 1222 . 4 1 1 A 89 89 ALA N N 89 118.873 122.794 -3.921 1
1 1223 . 4 1 1 A 90 90 LYS H H 90 8.046 8.136 -0.090 1
1 1224 . 4 1 1 A 90 90 LYS HA H 90 3.669 3.960 -0.291 1
1 1233 . 4 1 1 A 90 90 LYS C C 90 177.649 178.906 -1.257 1
1 1234 . 4 1 1 A 90 90 LYS CA C 90 60.351 59.611 0.740 1
1 1235 . 4 1 1 A 90 90 LYS CB C 90 32.087 32.365 -0.278 1
1 1239 . 4 1 1 A 90 90 LYS N N 90 114.834 117.385 -2.551 1
1 1240 . 4 1 1 A 91 91 ARG H H 91 7.468 8.005 -0.537 1
1 1241 . 4 1 1 A 91 91 ARG HA H 91 3.887 3.891 -0.004 1
1 1249 . 4 1 1 A 91 91 ARG C C 91 178.998 178.904 0.094 1
1 1250 . 4 1 1 A 91 91 ARG CA C 91 59.164 59.157 0.007 1
1 1251 . 4 1 1 A 91 91 ARG CB C 91 29.274 29.895 -0.621 1
1 1254 . 4 1 1 A 91 91 ARG N N 91 119.029 119.481 -0.452 1
1 1256 . 4 1 1 A 92 92 TRP H H 92 8.136 8.234 -0.098 1
1 1257 . 4 1 1 A 92 92 TRP HA H 92 4.818 4.581 0.237 1
1 1266 . 4 1 1 A 92 92 TRP C C 92 179.566 179.227 0.339 1
1 1267 . 4 1 1 A 92 92 TRP CA C 92 58.663 60.063 -1.400 1
1 1268 . 4 1 1 A 92 92 TRP CB C 92 29.790 29.526 0.264 1
1 1274 . 4 1 1 A 92 92 TRP N N 92 118.100 119.890 -1.790 1
1 1276 . 4 1 1 A 93 93 ILE H H 93 8.363 8.114 0.249 1
1 1277 . 4 1 1 A 93 93 ILE HA H 93 3.544 3.795 -0.251 1
1 1287 . 4 1 1 A 93 93 ILE C C 93 176.820 178.027 -1.207 1
1 1288 . 4 1 1 A 93 93 ILE CA C 93 66.225 65.583 0.642 1
1 1289 . 4 1 1 A 93 93 ILE CB C 93 37.571 37.843 -0.272 1
1 1293 . 4 1 1 A 93 93 ILE N N 93 120.588 120.426 0.162 1
1 1294 . 4 1 1 A 94 94 LYS H H 94 8.264 8.028 0.236 1
1 1295 . 4 1 1 A 94 94 LYS HA H 94 3.865 4.007 -0.142 1
1 1304 . 4 1 1 A 94 94 LYS C C 94 179.258 178.769 0.489 1
1 1305 . 4 1 1 A 94 94 LYS CA C 94 59.889 59.864 0.025 1
1 1306 . 4 1 1 A 94 94 LYS CB C 94 32.225 32.286 -0.061 1
1 1310 . 4 1 1 A 94 94 LYS N N 94 121.687 120.651 1.036 1
1 1311 . 4 1 1 A 95 95 GLU H H 95 8.360 8.489 -0.129 1
1 1312 . 4 1 1 A 95 95 GLU HA H 95 4.023 4.019 0.004 1
1 1317 . 4 1 1 A 95 95 GLU C C 95 178.884 179.064 -0.180 1
1 1318 . 4 1 1 A 95 95 GLU CA C 95 59.366 59.488 -0.122 1
1 1319 . 4 1 1 A 95 95 GLU CB C 95 29.508 29.471 0.037 1
1 1321 . 4 1 1 A 95 95 GLU N N 95 118.505 117.925 0.580 1
1 1322 . 4 1 1 A 96 96 PHE H H 96 8.212 8.520 -0.308 1
1 1323 . 4 1 1 A 96 96 PHE HA H 96 4.512 4.343 0.169 1
1 1331 . 4 1 1 A 96 96 PHE C C 96 176.820 178.085 -1.265 1
1 1332 . 4 1 1 A 96 96 PHE CA C 96 59.608 61.342 -1.734 1
1 1333 . 4 1 1 A 96 96 PHE CB C 96 40.431 39.274 1.157 1
1 1339 . 4 1 1 A 96 96 PHE N N 96 120.369 122.079 -1.710 1
1 1340 . 4 1 1 A 97 97 SER H H 97 8.216 8.238 -0.022 1
1 1341 . 4 1 1 A 97 97 SER HA H 97 3.816 4.088 -0.272 1
1 1344 . 4 1 1 A 97 97 SER C C 97 175.618 177.179 -1.561 1
1 1345 . 4 1 1 A 97 97 SER CA C 97 60.492 61.471 -0.979 1
1 1346 . 4 1 1 A 97 97 SER CB C 97 63.022 62.482 0.540 1
1 1347 . 4 1 1 A 97 97 SER N N 97 111.969 113.782 -1.813 1
1 1348 . 4 1 1 A 98 98 GLU H H 98 7.655 8.145 -0.490 1
1 1349 . 4 1 1 A 98 98 GLU HA H 98 4.187 4.002 0.185 1
1 1354 . 4 1 1 A 98 98 GLU C C 98 177.698 179.250 -1.552 1
1 1355 . 4 1 1 A 98 98 GLU CA C 98 57.069 59.391 -2.322 1
1 1356 . 4 1 1 A 98 98 GLU CB C 98 29.321 29.291 0.030 1
1 1358 . 4 1 1 A 98 98 GLU N N 98 120.588 123.018 -2.430 1
1 1359 . 4 1 1 A 99 99 GLU H H 99 7.794 7.979 -0.185 1
1 1360 . 4 1 1 A 99 99 GLU HA H 99 4.123 4.338 -0.215 1
1 1365 . 4 1 1 A 99 99 GLU C C 99 177.665 176.967 0.698 1
1 1366 . 4 1 1 A 99 99 GLU CA C 99 57.304 56.252 1.052 1
1 1367 . 4 1 1 A 99 99 GLU CB C 99 29.368 29.777 -0.409 1
1 1369 . 4 1 1 A 99 99 GLU N N 99 120.067 117.159 2.908 1
1 1370 . 4 1 1 A 100 100 GLY H H 100 8.138 8.620 -0.482 1
1 1371 . 4 1 1 A 100 100 GLY HA2 H 100 3.865 3.851 0.014 1
1 1372 . 4 1 1 A 100 100 GLY HA3 H 100 3.715 3.881 -0.166 1
1 1373 . 4 1 1 A 100 100 GLY C C 100 174.464 174.909 -0.445 1
1 1374 . 4 1 1 A 100 100 GLY CA C 100 45.305 45.561 -0.256 1
1 1375 . 4 1 1 A 100 100 GLY N N 100 107.802 108.606 -0.804 1
1 1376 . 4 1 1 A 101 101 GLY H H 101 8.023 8.520 -0.497 1
1 1377 . 4 1 1 A 101 101 GLY HA2 H 101 3.865 3.826 0.039 1
1 1378 . 4 1 1 A 101 101 GLY HA3 H 101 3.892 3.830 0.062 1
1 1379 . 4 1 1 A 101 101 GLY C C 101 174.204 174.843 -0.639 1
1 1380 . 4 1 1 A 101 101 GLY CA C 101 45.036 44.961 0.075 1
1 1381 . 4 1 1 A 101 101 GLY N N 101 108.032 107.873 0.159 1
1 1382 . 4 1 1 A 102 102 SER H H 102 8.059 7.920 0.139 1
1 1383 . 4 1 1 A 102 102 SER HA H 102 4.380 4.557 -0.177 1
1 1386 . 4 1 1 A 102 102 SER C C 102 174.627 174.363 0.264 1
1 1387 . 4 1 1 A 102 102 SER CA C 102 58.194 57.690 0.504 1
1 1388 . 4 1 1 A 102 102 SER CB C 102 63.538 61.328 2.210 1
1 1389 . 4 1 1 A 102 102 SER N N 102 115.266 117.524 -2.258 1
1 1390 . 4 1 1 A 103 103 LEU H H 103 8.287 8.297 -0.010 1
1 1391 . 4 1 1 A 103 103 LEU HA H 103 4.301 4.680 -0.379 1
1 1401 . 4 1 1 A 103 103 LEU C C 103 177.292 176.180 1.112 1
1 1402 . 4 1 1 A 103 103 LEU CA C 103 55.007 54.337 0.670 1
1 1403 . 4 1 1 A 103 103 LEU CB C 103 42.023 42.692 -0.669 1
1 1407 . 4 1 1 A 103 103 LEU N N 103 123.596 126.411 -2.815 1
1 1408 . 4 1 1 A 104 104 GLU H H 104 8.216 7.483 0.733 1
1 1409 . 4 1 1 A 104 104 GLU HA H 104 4.126 4.231 -0.105 1
1 1414 . 4 1 1 A 104 104 GLU CA C 104 56.518 56.742 -0.224 1
1 1415 . 4 1 1 A 104 104 GLU CB C 104 29.837 29.775 0.062 1
1 1417 . 4 1 1 A 104 104 GLU N N 104 120.510 119.931 0.579 1
1 1418 . 4 1 1 A 105 105 HIS HA H 105 4.593 4.622 -0.029 1
1 1421 . 4 1 1 A 105 105 HIS C C 105 173.766 174.266 -0.500 1
1 1422 . 4 1 1 A 105 105 HIS CA C 105 55.536 55.024 0.512 1
1 1423 . 4 1 1 A 105 105 HIS CB C 105 30.001 29.756 0.245 1
1 1424 . 4 1 1 A 106 106 HIS H H 106 8.154 8.610 -0.456 1
1 1425 . 4 1 1 A 106 106 HIS HA H 106 4.407 4.600 -0.193 1
1 1428 . 4 1 1 A 106 106 HIS CA C 106 56.920 55.616 1.304 1
1 1429 . 4 1 1 A 106 106 HIS CB C 106 30.001 31.508 -1.507 1
1 14 . 5 1 1 A 2 2 LEU H H 2 8.509 9.299 -0.790 1
1 15 . 5 1 1 A 2 2 LEU HA H 2 4.463 4.879 -0.416 1
1 25 . 5 1 1 A 2 2 LEU C C 2 173.944 175.974 -2.030 1
1 26 . 5 1 1 A 2 2 LEU CA C 2 54.471 53.514 0.957 1
1 27 . 5 1 1 A 2 2 LEU CB C 2 43.595 43.928 -0.333 1
1 31 . 5 1 1 A 2 2 LEU N N 2 127.160 127.772 -0.612 1
1 32 . 5 1 1 A 3 3 LEU H H 3 7.844 8.571 -0.727 1
1 33 . 5 1 1 A 3 3 LEU HA H 3 5.128 5.315 -0.187 1
1 43 . 5 1 1 A 3 3 LEU C C 3 175.423 175.291 0.132 1
1 44 . 5 1 1 A 3 3 LEU CA C 3 53.566 53.879 -0.313 1
1 45 . 5 1 1 A 3 3 LEU CB C 3 44.039 44.967 -0.928 1
1 49 . 5 1 1 A 3 3 LEU N N 3 122.555 122.121 0.434 1
1 50 . 5 1 1 A 4 4 TYR H H 4 8.360 9.067 -0.707 1
1 51 . 5 1 1 A 4 4 TYR HA H 4 5.143 5.128 0.015 1
1 58 . 5 1 1 A 4 4 TYR C C 4 174.481 174.993 -0.512 1
1 59 . 5 1 1 A 4 4 TYR CA C 4 56.577 56.549 0.028 1
1 60 . 5 1 1 A 4 4 TYR CB C 4 43.840 42.961 0.879 1
1 65 . 5 1 1 A 4 4 TYR N N 4 119.315 122.277 -2.962 1
1 66 . 5 1 1 A 5 5 VAL H H 5 8.918 8.732 0.186 1
1 67 . 5 1 1 A 5 5 VAL HA H 5 5.106 4.730 0.376 1
1 75 . 5 1 1 A 5 5 VAL C C 5 174.042 174.870 -0.828 1
1 76 . 5 1 1 A 5 5 VAL CA C 5 59.852 60.417 -0.565 1
1 77 . 5 1 1 A 5 5 VAL CB C 5 33.816 34.830 -1.014 1
1 80 . 5 1 1 A 5 5 VAL N N 5 119.952 121.074 -1.122 1
1 81 . 5 1 1 A 6 6 LEU H H 6 9.315 9.207 0.108 1
1 82 . 5 1 1 A 6 6 LEU HA H 6 5.466 5.169 0.297 1
1 92 . 5 1 1 A 6 6 LEU C C 6 175.049 175.003 0.046 1
1 93 . 5 1 1 A 6 6 LEU CA C 6 52.090 53.340 -1.250 1
1 94 . 5 1 1 A 6 6 LEU CB C 6 44.103 45.132 -1.029 1
1 98 . 5 1 1 A 6 6 LEU N N 6 126.917 126.172 0.745 1
1 99 . 5 1 1 A 7 7 ILE H H 7 8.458 8.875 -0.417 1
1 100 . 5 1 1 A 7 7 ILE HA H 7 5.131 5.174 -0.043 1
1 110 . 5 1 1 A 7 7 ILE C C 7 173.213 173.658 -0.445 1
1 111 . 5 1 1 A 7 7 ILE CA C 7 58.463 59.217 -0.754 1
1 112 . 5 1 1 A 7 7 ILE CB C 7 41.020 42.359 -1.339 1
1 116 . 5 1 1 A 7 7 ILE N N 7 119.778 124.536 -4.758 1
1 117 . 5 1 1 A 8 8 ILE H H 8 8.797 9.057 -0.260 1
1 118 . 5 1 1 A 8 8 ILE HA H 8 4.611 5.198 -0.587 1
1 128 . 5 1 1 A 8 8 ILE C C 8 174.611 174.426 0.185 1
1 129 . 5 1 1 A 8 8 ILE CA C 8 60.227 60.557 -0.330 1
1 130 . 5 1 1 A 8 8 ILE CB C 8 37.665 39.419 -1.754 1
1 134 . 5 1 1 A 8 8 ILE N N 8 128.919 128.685 0.234 1
1 135 . 5 1 1 A 9 9 SER H H 9 7.811 8.770 -0.959 1
1 136 . 5 1 1 A 9 9 SER HA H 9 4.429 5.010 -0.581 1
1 140 . 5 1 1 A 9 9 SER C C 9 172.937 172.940 -0.003 1
1 141 . 5 1 1 A 9 9 SER CA C 9 58.241 56.933 1.308 1
1 142 . 5 1 1 A 9 9 SER CB C 9 64.261 64.370 -0.109 1
1 143 . 5 1 1 A 9 9 SER N N 9 116.365 121.649 -5.284 1
1 144 . 5 1 1 A 10 10 ASN H H 10 8.641 8.586 0.055 1
1 145 . 5 1 1 A 10 10 ASN HA H 10 4.938 4.911 0.027 1
1 150 . 5 1 1 A 10 10 ASN C C 10 174.497 174.987 -0.490 1
1 151 . 5 1 1 A 10 10 ASN CA C 10 52.221 53.838 -1.617 1
1 152 . 5 1 1 A 10 10 ASN CB C 10 39.128 39.716 -0.588 1
1 153 . 5 1 1 A 10 10 ASN N N 10 122.612 121.079 1.533 1
1 155 . 5 1 1 A 11 11 ASP H H 11 8.673 7.448 1.225 1
1 156 . 5 1 1 A 11 11 ASP HA H 11 4.596 4.834 -0.238 1
1 159 . 5 1 1 A 11 11 ASP C C 11 175.342 176.216 -0.874 1
1 160 . 5 1 1 A 11 11 ASP CA C 11 53.233 53.449 -0.216 1
1 161 . 5 1 1 A 11 11 ASP CB C 11 40.965 40.495 0.470 1
1 162 . 5 1 1 A 11 11 ASP N N 11 122.717 119.939 2.778 1
1 163 . 5 1 1 A 12 12 LYS H H 12 8.562 8.700 -0.138 1
1 164 . 5 1 1 A 12 12 LYS HA H 12 3.854 4.086 -0.232 1
1 173 . 5 1 1 A 12 12 LYS C C 12 178.754 178.469 0.285 1
1 174 . 5 1 1 A 12 12 LYS CA C 12 59.581 59.636 -0.055 1
1 175 . 5 1 1 A 12 12 LYS CB C 12 32.378 32.128 0.250 1
1 179 . 5 1 1 A 12 12 LYS N N 12 125.737 126.105 -0.368 1
1 180 . 5 1 1 A 13 13 LYS H H 13 8.075 7.883 0.192 1
1 181 . 5 1 1 A 13 13 LYS HA H 13 4.154 4.085 0.069 1
1 190 . 5 1 1 A 13 13 LYS C C 13 178.315 179.024 -0.709 1
1 191 . 5 1 1 A 13 13 LYS CA C 13 58.532 59.096 -0.564 1
1 192 . 5 1 1 A 13 13 LYS CB C 13 31.452 32.613 -1.161 1
1 196 . 5 1 1 A 13 13 LYS N N 13 119.604 120.042 -0.438 1
1 197 . 5 1 1 A 14 14 LEU H H 14 7.552 7.522 0.030 1
1 198 . 5 1 1 A 14 14 LEU HA H 14 3.682 4.110 -0.428 1
1 208 . 5 1 1 A 14 14 LEU C C 14 178.429 179.138 -0.709 1
1 209 . 5 1 1 A 14 14 LEU CA C 14 58.999 57.820 1.179 1
1 210 . 5 1 1 A 14 14 LEU CB C 14 41.228 41.818 -0.590 1
1 214 . 5 1 1 A 14 14 LEU N N 14 122.266 120.978 1.288 1
1 215 . 5 1 1 A 15 15 ILE H H 15 8.074 7.714 0.360 1
1 216 . 5 1 1 A 15 15 ILE HA H 15 3.264 3.535 -0.271 1
1 226 . 5 1 1 A 15 15 ILE C C 15 177.000 177.413 -0.413 1
1 227 . 5 1 1 A 15 15 ILE CA C 15 65.939 65.645 0.294 1
1 228 . 5 1 1 A 15 15 ILE CB C 15 37.983 37.409 0.574 1
1 232 . 5 1 1 A 15 15 ILE N N 15 118.214 119.328 -1.114 1
1 233 . 5 1 1 A 16 16 GLU H H 16 8.016 8.893 -0.877 1
1 234 . 5 1 1 A 16 16 GLU HA H 16 4.045 3.895 0.150 1
1 239 . 5 1 1 A 16 16 GLU C C 16 179.388 179.735 -0.347 1
1 240 . 5 1 1 A 16 16 GLU CA C 16 59.032 59.945 -0.913 1
1 241 . 5 1 1 A 16 16 GLU CB C 16 29.200 29.222 -0.022 1
1 243 . 5 1 1 A 16 16 GLU N N 16 118.484 118.742 -0.258 1
1 244 . 5 1 1 A 17 17 GLU H H 17 8.063 8.060 0.003 1
1 245 . 5 1 1 A 17 17 GLU HA H 17 4.053 4.028 0.025 1
1 250 . 5 1 1 A 17 17 GLU C C 17 179.306 179.242 0.064 1
1 251 . 5 1 1 A 17 17 GLU CA C 17 58.636 59.385 -0.749 1
1 252 . 5 1 1 A 17 17 GLU CB C 17 29.011 29.232 -0.221 1
1 254 . 5 1 1 A 17 17 GLU N N 17 118.100 120.411 -2.311 1
1 255 . 5 1 1 A 18 18 ALA H H 18 8.655 7.783 0.872 1
1 256 . 5 1 1 A 18 18 ALA HA H 18 3.775 4.010 -0.235 1
1 260 . 5 1 1 A 18 18 ALA C C 18 178.559 179.465 -0.906 1
1 261 . 5 1 1 A 18 18 ALA CA C 18 54.960 55.506 -0.546 1
1 262 . 5 1 1 A 18 18 ALA CB C 18 17.960 18.186 -0.226 1
1 263 . 5 1 1 A 18 18 ALA N N 18 122.439 122.727 -0.288 1
1 264 . 5 1 1 A 19 19 ARG H H 19 8.900 8.162 0.738 1
1 265 . 5 1 1 A 19 19 ARG HA H 19 3.809 4.167 -0.358 1
1 273 . 5 1 1 A 19 19 ARG C C 19 178.721 179.124 -0.403 1
1 274 . 5 1 1 A 19 19 ARG CA C 19 59.976 59.954 0.022 1
1 275 . 5 1 1 A 19 19 ARG CB C 19 29.572 29.783 -0.211 1
1 278 . 5 1 1 A 19 19 ARG N N 19 118.563 117.603 0.960 1
1 280 . 5 1 1 A 20 20 LYS H H 20 7.792 8.096 -0.304 1
1 281 . 5 1 1 A 20 20 LYS HA H 20 4.052 4.038 0.014 1
1 290 . 5 1 1 A 20 20 LYS C C 20 179.648 179.484 0.164 1
1 291 . 5 1 1 A 20 20 LYS CA C 20 59.296 58.818 0.478 1
1 292 . 5 1 1 A 20 20 LYS CB C 20 32.216 32.132 0.084 1
1 296 . 5 1 1 A 20 20 LYS N N 20 118.638 119.293 -0.655 1
1 297 . 5 1 1 A 21 21 MET H H 21 7.684 7.810 -0.126 1
1 298 . 5 1 1 A 21 21 MET HA H 21 4.411 4.201 0.210 1
1 306 . 5 1 1 A 21 21 MET C C 21 177.909 178.300 -0.391 1
1 307 . 5 1 1 A 21 21 MET CA C 21 57.009 58.861 -1.852 1
1 308 . 5 1 1 A 21 21 MET CB C 21 32.028 33.121 -1.093 1
1 311 . 5 1 1 A 21 21 MET N N 21 118.100 119.180 -1.080 1
1 312 . 5 1 1 A 22 22 ALA H H 22 8.815 8.386 0.429 1
1 313 . 5 1 1 A 22 22 ALA HA H 22 3.826 3.999 -0.173 1
1 317 . 5 1 1 A 22 22 ALA C C 22 178.835 180.142 -1.307 1
1 318 . 5 1 1 A 22 22 ALA CA C 22 55.427 55.461 -0.034 1
1 319 . 5 1 1 A 22 22 ALA CB C 22 18.059 18.333 -0.274 1
1 320 . 5 1 1 A 22 22 ALA N N 22 122.150 121.442 0.708 1
1 321 . 5 1 1 A 23 23 GLU H H 23 8.276 8.666 -0.390 1
1 322 . 5 1 1 A 23 23 GLU HA H 23 4.146 3.989 0.157 1
1 327 . 5 1 1 A 23 23 GLU C C 23 180.151 179.430 0.721 1
1 328 . 5 1 1 A 23 23 GLU CA C 23 58.999 59.551 -0.552 1
1 329 . 5 1 1 A 23 23 GLU CB C 23 29.160 29.236 -0.076 1
1 331 . 5 1 1 A 23 23 GLU N N 23 117.001 118.165 -1.164 1
1 332 . 5 1 1 A 24 24 LYS H H 24 7.573 8.212 -0.639 1
1 333 . 5 1 1 A 24 24 LYS HA H 24 4.101 4.099 0.002 1
1 342 . 5 1 1 A 24 24 LYS C C 24 177.145 178.080 -0.935 1
1 343 . 5 1 1 A 24 24 LYS CA C 24 58.261 58.949 -0.688 1
1 344 . 5 1 1 A 24 24 LYS CB C 24 32.079 31.796 0.283 1
1 348 . 5 1 1 A 24 24 LYS N N 24 119.960 118.399 1.561 1
1 349 . 5 1 1 A 25 25 ALA H H 25 7.710 7.627 0.083 1
1 350 . 5 1 1 A 25 25 ALA HA H 25 4.413 4.419 -0.006 1
1 354 . 5 1 1 A 25 25 ALA C C 25 175.325 176.279 -0.954 1
1 355 . 5 1 1 A 25 25 ALA CA C 25 51.208 51.773 -0.565 1
1 356 . 5 1 1 A 25 25 ALA CB C 25 18.520 19.296 -0.776 1
1 357 . 5 1 1 A 25 25 ALA N N 25 119.257 119.135 0.122 1
1 358 . 5 1 1 A 26 26 ASN H H 26 7.840 7.849 -0.009 1
1 359 . 5 1 1 A 26 26 ASN HA H 26 4.357 4.347 0.010 1
1 364 . 5 1 1 A 26 26 ASN C C 26 173.587 173.981 -0.394 1
1 365 . 5 1 1 A 26 26 ASN CA C 26 54.307 54.535 -0.228 1
1 366 . 5 1 1 A 26 26 ASN CB C 26 36.972 37.023 -0.051 1
1 367 . 5 1 1 A 26 26 ASN N N 26 115.266 113.614 1.652 1
1 369 . 5 1 1 A 27 27 LEU H H 27 8.241 7.979 0.262 1
1 370 . 5 1 1 A 27 27 LEU HA H 27 4.652 4.590 0.062 1
1 380 . 5 1 1 A 27 27 LEU C C 27 175.894 175.852 0.042 1
1 381 . 5 1 1 A 27 27 LEU CA C 27 52.923 53.207 -0.284 1
1 382 . 5 1 1 A 27 27 LEU CB C 27 44.090 43.644 0.446 1
1 386 . 5 1 1 A 27 27 LEU N N 27 116.828 119.645 -2.817 1
1 387 . 5 1 1 A 28 28 GLU H H 28 7.798 8.516 -0.718 1
1 388 . 5 1 1 A 28 28 GLU HA H 28 4.310 4.621 -0.311 1
1 393 . 5 1 1 A 28 28 GLU C C 28 173.944 175.453 -1.509 1
1 394 . 5 1 1 A 28 28 GLU CA C 28 55.460 56.477 -1.017 1
1 395 . 5 1 1 A 28 28 GLU CB C 28 30.512 30.158 0.354 1
1 397 . 5 1 1 A 28 28 GLU N N 28 121.340 125.009 -3.669 1
1 398 . 5 1 1 A 29 29 LEU H H 29 8.451 8.859 -0.408 1
1 399 . 5 1 1 A 29 29 LEU HA H 29 5.662 5.031 0.631 1
1 409 . 5 1 1 A 29 29 LEU C C 29 176.902 174.707 2.195 1
1 410 . 5 1 1 A 29 29 LEU CA C 29 53.186 54.401 -1.215 1
1 411 . 5 1 1 A 29 29 LEU CB C 29 44.914 43.645 1.269 1
1 415 . 5 1 1 A 29 29 LEU N N 29 126.547 127.820 -1.273 1
1 416 . 5 1 1 A 30 30 ARG H H 30 9.094 9.180 -0.086 1
1 417 . 5 1 1 A 30 30 ARG HA H 30 4.910 4.760 0.150 1
1 425 . 5 1 1 A 30 30 ARG C C 30 175.147 175.714 -0.567 1
1 426 . 5 1 1 A 30 30 ARG CA C 30 53.417 54.528 -1.111 1
1 427 . 5 1 1 A 30 30 ARG CB C 30 32.555 32.304 0.251 1
1 430 . 5 1 1 A 30 30 ARG N N 30 125.043 126.530 -1.487 1
1 432 . 5 1 1 A 31 31 THR H H 31 8.496 8.525 -0.029 1
1 433 . 5 1 1 A 31 31 THR HA H 31 4.888 5.031 -0.143 1
1 438 . 5 1 1 A 31 31 THR C C 31 173.961 174.150 -0.189 1
1 439 . 5 1 1 A 31 31 THR CA C 31 60.445 60.802 -0.357 1
1 440 . 5 1 1 A 31 31 THR CB C 31 69.492 70.042 -0.550 1
1 442 . 5 1 1 A 31 31 THR N N 31 114.745 114.791 -0.046 1
1 443 . 5 1 1 A 32 32 VAL H H 32 8.480 9.151 -0.671 1
1 444 . 5 1 1 A 32 32 VAL HA H 32 4.411 4.922 -0.511 1
1 452 . 5 1 1 A 32 32 VAL C C 32 175.082 175.365 -0.283 1
1 453 . 5 1 1 A 32 32 VAL CA C 32 60.946 60.506 0.440 1
1 454 . 5 1 1 A 32 32 VAL CB C 32 34.487 34.923 -0.436 1
1 457 . 5 1 1 A 32 32 VAL N N 32 122.324 126.065 -3.741 1
1 458 . 5 1 1 A 33 33 LYS H H 33 9.304 8.985 0.319 1
1 459 . 5 1 1 A 33 33 LYS HA H 33 4.534 4.680 -0.146 1
1 468 . 5 1 1 A 33 33 LYS C C 33 176.740 176.264 0.476 1
1 469 . 5 1 1 A 33 33 LYS CA C 33 56.846 56.828 0.018 1
1 470 . 5 1 1 A 33 33 LYS CB C 33 34.355 35.246 -0.891 1
1 474 . 5 1 1 A 33 33 LYS N N 33 123.654 123.103 0.551 1
1 475 . 5 1 1 A 34 34 THR H H 34 7.245 7.463 -0.218 1
1 476 . 5 1 1 A 34 34 THR HA H 34 4.780 4.643 0.137 1
1 481 . 5 1 1 A 34 34 THR C C 34 174.529 175.363 -0.834 1
1 482 . 5 1 1 A 34 34 THR CA C 34 58.859 59.708 -0.849 1
1 483 . 5 1 1 A 34 34 THR CB C 34 73.023 72.227 0.796 1
1 485 . 5 1 1 A 34 34 THR N N 34 106.300 110.620 -4.320 1
1 486 . 5 1 1 A 35 35 GLU H H 35 9.174 8.875 0.299 1
1 487 . 5 1 1 A 35 35 GLU HA H 35 3.886 3.951 -0.065 1
1 492 . 5 1 1 A 35 35 GLU C C 35 177.714 177.607 0.107 1
1 493 . 5 1 1 A 35 35 GLU CA C 35 59.233 59.771 -0.538 1
1 494 . 5 1 1 A 35 35 GLU CB C 35 29.377 29.552 -0.175 1
1 496 . 5 1 1 A 35 35 GLU N N 35 121.919 121.981 -0.062 1
1 497 . 5 1 1 A 36 36 ASP H H 36 8.185 8.462 -0.277 1
1 498 . 5 1 1 A 36 36 ASP HA H 36 4.289 4.336 -0.047 1
1 501 . 5 1 1 A 36 36 ASP C C 36 178.348 178.612 -0.264 1
1 502 . 5 1 1 A 36 36 ASP CA C 36 56.962 57.879 -0.917 1
1 503 . 5 1 1 A 36 36 ASP CB C 36 40.214 42.464 -2.250 1
1 504 . 5 1 1 A 36 36 ASP N N 36 118.332 120.082 -1.750 1
1 505 . 5 1 1 A 37 37 GLU H H 37 7.741 7.962 -0.221 1
1 506 . 5 1 1 A 37 37 GLU HA H 37 3.708 4.039 -0.331 1
1 511 . 5 1 1 A 37 37 GLU C C 37 177.324 178.889 -1.565 1
1 512 . 5 1 1 A 37 37 GLU CA C 37 58.698 59.366 -0.668 1
1 513 . 5 1 1 A 37 37 GLU CB C 37 30.199 29.494 0.705 1
1 515 . 5 1 1 A 37 37 GLU N N 37 120.704 118.976 1.728 1
1 516 . 5 1 1 A 38 38 LEU H H 38 7.531 8.152 -0.621 1
1 517 . 5 1 1 A 38 38 LEU HA H 38 3.873 4.149 -0.276 1
1 527 . 5 1 1 A 38 38 LEU C C 38 177.357 178.644 -1.287 1
1 528 . 5 1 1 A 38 38 LEU CA C 38 58.305 58.104 0.201 1
1 529 . 5 1 1 A 38 38 LEU CB C 38 40.837 41.536 -0.699 1
1 533 . 5 1 1 A 38 38 LEU N N 38 119.200 121.991 -2.791 1
1 534 . 5 1 1 A 39 39 LYS H H 39 8.083 8.411 -0.328 1
1 535 . 5 1 1 A 39 39 LYS HA H 39 3.608 3.883 -0.275 1
1 544 . 5 1 1 A 39 39 LYS C C 39 177.373 178.810 -1.437 1
1 545 . 5 1 1 A 39 39 LYS CA C 39 60.290 59.761 0.529 1
1 546 . 5 1 1 A 39 39 LYS CB C 39 32.178 32.149 0.029 1
1 550 . 5 1 1 A 39 39 LYS N N 39 116.943 118.809 -1.866 1
1 551 . 5 1 1 A 40 40 LYS H H 40 7.632 8.075 -0.443 1
1 552 . 5 1 1 A 40 40 LYS HA H 40 3.864 3.981 -0.117 1
1 561 . 5 1 1 A 40 40 LYS C C 40 179.566 178.245 1.321 1
1 562 . 5 1 1 A 40 40 LYS CA C 40 58.993 59.015 -0.022 1
1 563 . 5 1 1 A 40 40 LYS CB C 40 31.758 32.037 -0.279 1
1 567 . 5 1 1 A 40 40 LYS N N 40 118.274 119.184 -0.910 1
1 568 . 5 1 1 A 41 41 TYR H H 41 7.823 7.521 0.302 1
1 569 . 5 1 1 A 41 41 TYR HA H 41 3.926 3.917 0.009 1
1 576 . 5 1 1 A 41 41 TYR C C 41 176.625 177.486 -0.861 1
1 577 . 5 1 1 A 41 41 TYR CA C 41 59.757 60.753 -0.996 1
1 578 . 5 1 1 A 41 41 TYR CB C 41 36.901 37.891 -0.990 1
1 583 . 5 1 1 A 41 41 TYR N N 41 117.811 118.774 -0.963 1
1 584 . 5 1 1 A 42 42 LEU H H 42 7.964 8.006 -0.042 1
1 585 . 5 1 1 A 42 42 LEU HA H 42 3.704 3.752 -0.048 1
1 595 . 5 1 1 A 42 42 LEU C C 42 178.396 179.041 -0.645 1
1 596 . 5 1 1 A 42 42 LEU CA C 42 58.237 57.795 0.442 1
1 597 . 5 1 1 A 42 42 LEU CB C 42 40.507 41.289 -0.782 1
1 601 . 5 1 1 A 42 42 LEU N N 42 115.960 119.859 -3.899 1
1 602 . 5 1 1 A 43 43 GLU H H 43 8.193 8.214 -0.021 1
1 603 . 5 1 1 A 43 43 GLU HA H 43 3.882 3.785 0.097 1
1 608 . 5 1 1 A 43 43 GLU C C 43 179.193 179.016 0.177 1
1 609 . 5 1 1 A 43 43 GLU CA C 43 59.122 60.017 -0.895 1
1 610 . 5 1 1 A 43 43 GLU CB C 43 29.244 29.208 0.036 1
1 612 . 5 1 1 A 43 43 GLU N N 43 117.175 118.127 -0.952 1
1 613 . 5 1 1 A 44 44 GLU H H 44 7.601 7.452 0.149 1
1 614 . 5 1 1 A 44 44 GLU HA H 44 3.936 4.008 -0.072 1
1 619 . 5 1 1 A 44 44 GLU C C 44 179.875 179.007 0.868 1
1 620 . 5 1 1 A 44 44 GLU CA C 44 58.867 59.150 -0.283 1
1 621 . 5 1 1 A 44 44 GLU CB C 44 28.648 29.198 -0.550 1
1 623 . 5 1 1 A 44 44 GLU N N 44 120.472 119.268 1.204 1
1 624 . 5 1 1 A 45 45 PHE H H 45 8.260 7.923 0.337 1
1 625 . 5 1 1 A 45 45 PHE HA H 45 4.520 4.148 0.372 1
1 633 . 5 1 1 A 45 45 PHE C C 45 177.942 178.485 -0.543 1
1 634 . 5 1 1 A 45 45 PHE CA C 45 55.945 61.199 -5.254 1
1 635 . 5 1 1 A 45 45 PHE CB C 45 36.680 37.908 -1.228 1
1 641 . 5 1 1 A 45 45 PHE N N 45 119.272 119.263 0.009 1
1 642 . 5 1 1 A 46 46 ARG H H 46 8.023 8.292 -0.269 1
1 643 . 5 1 1 A 46 46 ARG HA H 46 4.074 4.038 0.036 1
1 651 . 5 1 1 A 46 46 ARG C C 46 177.617 178.964 -1.347 1
1 652 . 5 1 1 A 46 46 ARG CA C 46 58.194 59.419 -1.225 1
1 653 . 5 1 1 A 46 46 ARG CB C 46 29.737 29.944 -0.207 1
1 656 . 5 1 1 A 46 46 ARG N N 46 118.136 120.863 -2.727 1
1 658 . 5 1 1 A 47 47 LYS H H 47 7.470 7.993 -0.523 1
1 659 . 5 1 1 A 47 47 LYS HA H 47 4.143 4.160 -0.017 1
1 668 . 5 1 1 A 47 47 LYS C C 47 177.324 178.373 -1.049 1
1 669 . 5 1 1 A 47 47 LYS CA C 47 57.726 59.225 -1.499 1
1 670 . 5 1 1 A 47 47 LYS CB C 47 32.409 32.595 -0.186 1
1 674 . 5 1 1 A 47 47 LYS N N 47 116.943 118.138 -1.195 1
1 675 . 5 1 1 A 48 48 GLU H H 48 7.615 7.707 -0.092 1
1 676 . 5 1 1 A 48 48 GLU HA H 48 4.428 4.540 -0.112 1
1 681 . 5 1 1 A 48 48 GLU C C 48 176.869 177.424 -0.555 1
1 682 . 5 1 1 A 48 48 GLU CA C 48 55.945 56.634 -0.689 1
1 683 . 5 1 1 A 48 48 GLU CB C 48 29.696 30.235 -0.539 1
1 685 . 5 1 1 A 48 48 GLU N N 48 118.852 117.804 1.048 1
1 686 . 5 1 1 A 49 49 SER H H 49 7.725 8.297 -0.572 1
1 687 . 5 1 1 A 49 49 SER HA H 49 4.244 4.339 -0.095 1
1 690 . 5 1 1 A 49 49 SER C C 49 174.838 177.011 -2.173 1
1 691 . 5 1 1 A 49 49 SER CA C 49 59.366 61.352 -1.986 1
1 692 . 5 1 1 A 49 49 SER CB C 49 63.116 62.814 0.302 1
1 693 . 5 1 1 A 49 49 SER N N 49 114.224 115.600 -1.376 1
1 694 . 5 1 1 A 50 50 GLN H H 50 8.548 7.836 0.712 1
1 695 . 5 1 1 A 50 50 GLN HA H 50 4.398 4.142 0.256 1
1 702 . 5 1 1 A 50 50 GLN C C 50 175.732 176.357 -0.625 1
1 703 . 5 1 1 A 50 50 GLN CA C 50 56.272 58.920 -2.648 1
1 704 . 5 1 1 A 50 50 GLN CB C 50 28.946 28.775 0.171 1
1 706 . 5 1 1 A 50 50 GLN N N 50 120.125 119.635 0.490 1
1 708 . 5 1 1 A 51 51 ASN H H 51 8.534 7.701 0.833 1
1 709 . 5 1 1 A 51 51 ASN HA H 51 4.980 5.135 -0.155 1
1 714 . 5 1 1 A 51 51 ASN C C 51 173.717 173.498 0.219 1
1 715 . 5 1 1 A 51 51 ASN CA C 51 52.804 52.467 0.337 1
1 716 . 5 1 1 A 51 51 ASN CB C 51 39.583 39.984 -0.401 1
1 717 . 5 1 1 A 51 51 ASN N N 51 118.158 117.127 1.031 1
1 719 . 5 1 1 A 52 52 ILE H H 52 7.492 8.623 -1.131 1
1 720 . 5 1 1 A 52 52 ILE HA H 52 5.338 5.359 -0.021 1
1 730 . 5 1 1 A 52 52 ILE C C 52 175.049 173.324 1.725 1
1 731 . 5 1 1 A 52 52 ILE CA C 52 59.364 59.604 -0.240 1
1 732 . 5 1 1 A 52 52 ILE CB C 52 42.163 41.438 0.725 1
1 736 . 5 1 1 A 52 52 ILE N N 52 117.927 123.166 -5.239 1
1 737 . 5 1 1 A 53 53 LYS H H 53 8.467 8.732 -0.265 1
1 738 . 5 1 1 A 53 53 LYS HA H 53 5.044 5.177 -0.133 1
1 747 . 5 1 1 A 53 53 LYS C C 53 175.082 175.272 -0.190 1
1 748 . 5 1 1 A 53 53 LYS CA C 53 55.429 54.846 0.583 1
1 749 . 5 1 1 A 53 53 LYS CB C 53 36.446 35.597 0.849 1
1 753 . 5 1 1 A 53 53 LYS N N 53 123.249 128.017 -4.768 1
1 754 . 5 1 1 A 54 54 VAL H H 54 8.490 9.197 -0.707 1
1 755 . 5 1 1 A 54 54 VAL HA H 54 5.159 4.941 0.218 1
1 763 . 5 1 1 A 54 54 VAL C C 54 173.473 173.593 -0.120 1
1 764 . 5 1 1 A 54 54 VAL CA C 54 60.163 60.824 -0.661 1
1 765 . 5 1 1 A 54 54 VAL CB C 54 35.509 34.401 1.108 1
1 768 . 5 1 1 A 54 54 VAL N N 54 120.762 123.965 -3.203 1
1 769 . 5 1 1 A 55 55 LEU H H 55 8.636 8.574 0.062 1
1 770 . 5 1 1 A 55 55 LEU HA H 55 4.670 4.915 -0.245 1
1 780 . 5 1 1 A 55 55 LEU C C 55 173.652 174.321 -0.669 1
1 781 . 5 1 1 A 55 55 LEU CA C 55 52.289 52.862 -0.573 1
1 782 . 5 1 1 A 55 55 LEU CB C 55 42.070 44.290 -2.220 1
1 786 . 5 1 1 A 55 55 LEU N N 55 131.898 129.485 2.413 1
1 787 . 5 1 1 A 56 56 ILE H H 56 9.188 8.990 0.198 1
1 788 . 5 1 1 A 56 56 ILE HA H 56 4.879 4.827 0.052 1
1 798 . 5 1 1 A 56 56 ILE C C 56 174.172 174.531 -0.359 1
1 799 . 5 1 1 A 56 56 ILE CA C 56 59.976 59.516 0.460 1
1 800 . 5 1 1 A 56 56 ILE CB C 56 38.181 40.797 -2.616 1
1 804 . 5 1 1 A 56 56 ILE N N 56 126.373 126.290 0.083 1
1 805 . 5 1 1 A 57 57 LEU H H 57 8.929 9.320 -0.391 1
1 806 . 5 1 1 A 57 57 LEU HA H 57 5.394 5.354 0.040 1
1 816 . 5 1 1 A 57 57 LEU C C 57 175.358 175.786 -0.428 1
1 817 . 5 1 1 A 57 57 LEU CA C 57 52.086 53.448 -1.362 1
1 818 . 5 1 1 A 57 57 LEU CB C 57 42.445 43.373 -0.928 1
1 822 . 5 1 1 A 57 57 LEU N N 57 126.547 127.850 -1.303 1
1 823 . 5 1 1 A 58 58 VAL H H 58 8.542 9.107 -0.565 1
1 824 . 5 1 1 A 58 58 VAL HA H 58 5.253 4.757 0.496 1
1 832 . 5 1 1 A 58 58 VAL C C 58 175.244 175.944 -0.700 1
1 833 . 5 1 1 A 58 58 VAL CA C 58 58.241 59.227 -0.986 1
1 834 . 5 1 1 A 58 58 VAL CB C 58 33.165 34.909 -1.744 1
1 837 . 5 1 1 A 58 58 VAL N N 58 114.398 122.029 -7.631 1
1 838 . 5 1 1 A 59 59 SER H H 59 8.797 8.822 -0.025 1
1 839 . 5 1 1 A 59 59 SER HA H 59 5.063 4.435 0.628 1
1 842 . 5 1 1 A 59 59 SER C C 59 174.172 174.100 0.072 1
1 843 . 5 1 1 A 59 59 SER CA C 59 59.320 60.424 -1.104 1
1 844 . 5 1 1 A 59 59 SER CB C 59 65.600 63.319 2.281 1
1 845 . 5 1 1 A 59 59 SER N N 59 115.497 116.208 -0.711 1
1 846 . 5 1 1 A 60 60 ASN H H 60 7.730 8.077 -0.347 1
1 847 . 5 1 1 A 60 60 ASN HA H 60 4.811 5.132 -0.321 1
1 852 . 5 1 1 A 60 60 ASN C C 60 174.464 175.860 -1.396 1
1 853 . 5 1 1 A 60 60 ASN CA C 60 52.007 52.158 -0.151 1
1 854 . 5 1 1 A 60 60 ASN CB C 60 40.336 40.986 -0.650 1
1 855 . 5 1 1 A 60 60 ASN N N 60 117.522 118.040 -0.518 1
1 857 . 5 1 1 A 61 61 ASP H H 61 8.577 8.921 -0.344 1
1 858 . 5 1 1 A 61 61 ASP HA H 61 4.365 4.306 0.059 1
1 861 . 5 1 1 A 61 61 ASP C C 61 177.357 178.365 -1.008 1
1 862 . 5 1 1 A 61 61 ASP CA C 61 57.351 57.074 0.277 1
1 863 . 5 1 1 A 61 61 ASP CB C 61 40.383 39.752 0.631 1
1 864 . 5 1 1 A 61 61 ASP N N 61 119.431 122.122 -2.691 1
1 865 . 5 1 1 A 62 62 GLU H H 62 8.405 8.462 -0.057 1
1 866 . 5 1 1 A 62 62 GLU HA H 62 4.121 3.981 0.140 1
1 871 . 5 1 1 A 62 62 GLU C C 62 179.615 179.183 0.432 1
1 872 . 5 1 1 A 62 62 GLU CA C 62 59.593 59.782 -0.189 1
1 873 . 5 1 1 A 62 62 GLU CB C 62 28.478 29.063 -0.585 1
1 875 . 5 1 1 A 62 62 GLU N N 62 122.150 119.248 2.902 1
1 876 . 5 1 1 A 63 63 GLU H H 63 8.384 8.265 0.119 1
1 877 . 5 1 1 A 63 63 GLU HA H 63 3.913 3.976 -0.063 1
1 882 . 5 1 1 A 63 63 GLU C C 63 178.478 179.042 -0.564 1
1 883 . 5 1 1 A 63 63 GLU CA C 63 58.273 59.155 -0.882 1
1 884 . 5 1 1 A 63 63 GLU CB C 63 29.931 28.929 1.002 1
1 886 . 5 1 1 A 63 63 GLU N N 63 119.084 118.874 0.210 1
1 887 . 5 1 1 A 64 64 LEU H H 64 7.717 8.034 -0.317 1
1 888 . 5 1 1 A 64 64 LEU HA H 64 3.750 4.015 -0.265 1
1 898 . 5 1 1 A 64 64 LEU C C 64 177.535 177.971 -0.436 1
1 899 . 5 1 1 A 64 64 LEU CA C 64 58.944 58.307 0.637 1
1 900 . 5 1 1 A 64 64 LEU CB C 64 41.695 41.625 0.070 1
1 904 . 5 1 1 A 64 64 LEU N N 64 120.357 121.610 -1.253 1
1 905 . 5 1 1 A 65 65 ASP H H 65 7.922 8.378 -0.456 1
1 906 . 5 1 1 A 65 65 ASP HA H 65 4.313 4.293 0.020 1
1 909 . 5 1 1 A 65 65 ASP C C 65 179.095 178.695 0.400 1
1 910 . 5 1 1 A 65 65 ASP CA C 65 57.272 57.279 -0.007 1
1 911 . 5 1 1 A 65 65 ASP CB C 65 40.196 40.919 -0.723 1
1 912 . 5 1 1 A 65 65 ASP N N 65 118.100 118.647 -0.547 1
1 913 . 5 1 1 A 66 66 LYS H H 66 7.802 7.831 -0.029 1
1 914 . 5 1 1 A 66 66 LYS HA H 66 4.078 3.994 0.084 1
1 923 . 5 1 1 A 66 66 LYS C C 66 178.624 179.158 -0.534 1
1 924 . 5 1 1 A 66 66 LYS CA C 66 58.429 59.283 -0.854 1
1 925 . 5 1 1 A 66 66 LYS CB C 66 31.727 32.139 -0.412 1
1 929 . 5 1 1 A 66 66 LYS N N 66 119.343 119.091 0.252 1
1 930 . 5 1 1 A 67 67 ALA H H 67 8.480 8.153 0.327 1
1 931 . 5 1 1 A 67 67 ALA HA H 67 3.853 4.089 -0.236 1
1 935 . 5 1 1 A 67 67 ALA C C 67 178.591 179.639 -1.048 1
1 936 . 5 1 1 A 67 67 ALA CA C 67 55.403 55.039 0.364 1
1 937 . 5 1 1 A 67 67 ALA CB C 67 17.793 18.480 -0.687 1
1 938 . 5 1 1 A 67 67 ALA N N 67 121.562 122.662 -1.100 1
1 939 . 5 1 1 A 68 68 LYS H H 68 8.186 7.708 0.478 1
1 940 . 5 1 1 A 68 68 LYS HA H 68 3.805 4.041 -0.236 1
1 949 . 5 1 1 A 68 68 LYS C C 68 179.095 178.748 0.347 1
1 950 . 5 1 1 A 68 68 LYS CA C 68 59.952 59.063 0.889 1
1 951 . 5 1 1 A 68 68 LYS CB C 68 32.181 31.851 0.330 1
1 955 . 5 1 1 A 68 68 LYS N N 68 116.165 116.455 -0.290 1
1 956 . 5 1 1 A 69 69 GLU H H 69 7.904 7.889 0.015 1
1 957 . 5 1 1 A 69 69 GLU HA H 69 3.995 4.010 -0.015 1
1 962 . 5 1 1 A 69 69 GLU C C 69 179.079 179.317 -0.238 1
1 963 . 5 1 1 A 69 69 GLU CA C 69 59.022 59.046 -0.024 1
1 964 . 5 1 1 A 69 69 GLU CB C 69 29.274 29.385 -0.111 1
1 966 . 5 1 1 A 69 69 GLU N N 69 119.489 119.464 0.025 1
1 967 . 5 1 1 A 70 70 LEU H H 70 7.962 7.826 0.136 1
1 968 . 5 1 1 A 70 70 LEU HA H 70 4.020 3.908 0.112 1
1 978 . 5 1 1 A 70 70 LEU C C 70 178.738 178.816 -0.078 1
1 979 . 5 1 1 A 70 70 LEU CA C 70 57.486 57.908 -0.422 1
1 980 . 5 1 1 A 70 70 LEU CB C 70 41.695 41.531 0.164 1
1 984 . 5 1 1 A 70 70 LEU N N 70 119.431 120.549 -1.118 1
1 985 . 5 1 1 A 71 71 ALA H H 71 8.260 8.424 -0.164 1
1 986 . 5 1 1 A 71 71 ALA HA H 71 3.845 4.038 -0.193 1
1 990 . 5 1 1 A 71 71 ALA C C 71 179.518 179.878 -0.360 1
1 991 . 5 1 1 A 71 71 ALA CA C 71 55.139 55.487 -0.348 1
1 992 . 5 1 1 A 71 71 ALA CB C 71 18.487 18.607 -0.120 1
1 993 . 5 1 1 A 71 71 ALA N N 71 119.604 121.052 -1.448 1
1 994 . 5 1 1 A 72 72 GLN H H 72 7.910 8.266 -0.356 1
1 995 . 5 1 1 A 72 72 GLN HA H 72 4.154 3.905 0.249 1
1 1002 . 5 1 1 A 72 72 GLN C C 72 178.900 178.684 0.216 1
1 1003 . 5 1 1 A 72 72 GLN CA C 72 58.194 59.103 -0.909 1
1 1004 . 5 1 1 A 72 72 GLN CB C 72 28.056 28.338 -0.282 1
1 1006 . 5 1 1 A 72 72 GLN N N 72 115.960 117.492 -1.532 1
1 1008 . 5 1 1 A 73 73 LYS H H 73 7.841 7.899 -0.058 1
1 1009 . 5 1 1 A 73 73 LYS HA H 73 4.171 4.058 0.113 1
1 1018 . 5 1 1 A 73 73 LYS C C 73 177.730 178.530 -0.800 1
1 1019 . 5 1 1 A 73 73 LYS CA C 73 57.867 58.999 -1.132 1
1 1020 . 5 1 1 A 73 73 LYS CB C 73 32.277 32.120 0.157 1
1 1024 . 5 1 1 A 73 73 LYS N N 73 119.027 119.171 -0.144 1
1 1025 . 5 1 1 A 74 74 MET H H 74 7.746 7.964 -0.218 1
1 1026 . 5 1 1 A 74 74 MET HA H 74 4.403 4.527 -0.124 1
1 1034 . 5 1 1 A 74 74 MET C C 74 174.416 175.311 -0.895 1
1 1035 . 5 1 1 A 74 74 MET CA C 74 55.194 55.006 0.188 1
1 1036 . 5 1 1 A 74 74 MET CB C 74 33.366 33.007 0.359 1
1 1039 . 5 1 1 A 74 74 MET N N 74 115.786 114.702 1.084 1
1 1040 . 5 1 1 A 75 75 GLU H H 75 8.076 7.780 0.296 1
1 1041 . 5 1 1 A 75 75 GLU HA H 75 4.001 3.918 0.083 1
1 1046 . 5 1 1 A 75 75 GLU C C 75 175.130 174.999 0.131 1
1 1047 . 5 1 1 A 75 75 GLU CA C 75 56.722 57.448 -0.726 1
1 1048 . 5 1 1 A 75 75 GLU CB C 75 27.118 27.661 -0.543 1
1 1050 . 5 1 1 A 75 75 GLU N N 75 116.249 116.792 -0.543 1
1 1051 . 5 1 1 A 76 76 ILE H H 76 7.560 7.411 0.149 1
1 1052 . 5 1 1 A 76 76 ILE HA H 76 4.428 4.638 -0.210 1
1 1062 . 5 1 1 A 76 76 ILE C C 76 174.529 174.794 -0.265 1
1 1063 . 5 1 1 A 76 76 ILE CA C 76 58.475 59.723 -1.248 1
1 1064 . 5 1 1 A 76 76 ILE CB C 76 40.337 41.719 -1.382 1
1 1068 . 5 1 1 A 76 76 ILE N N 76 115.960 119.088 -3.128 1
1 1069 . 5 1 1 A 77 77 ASP H H 77 8.889 8.721 0.168 1
1 1070 . 5 1 1 A 77 77 ASP HA H 77 4.569 4.799 -0.230 1
1 1073 . 5 1 1 A 77 77 ASP C C 77 174.123 176.118 -1.995 1
1 1074 . 5 1 1 A 77 77 ASP CA C 77 54.069 53.907 0.162 1
1 1075 . 5 1 1 A 77 77 ASP CB C 77 40.233 40.891 -0.658 1
1 1076 . 5 1 1 A 77 77 ASP N N 77 126.142 127.620 -1.478 1
1 1077 . 5 1 1 A 78 78 VAL H H 78 7.754 8.935 -1.181 1
1 1078 . 5 1 1 A 78 78 VAL HA H 78 5.192 5.532 -0.340 1
1 1086 . 5 1 1 A 78 78 VAL C C 78 174.968 174.402 0.566 1
1 1087 . 5 1 1 A 78 78 VAL CA C 78 58.804 58.595 0.209 1
1 1088 . 5 1 1 A 78 78 VAL CB C 78 35.293 35.695 -0.402 1
1 1091 . 5 1 1 A 78 78 VAL N N 78 122.844 120.704 2.140 1
1 1092 . 5 1 1 A 79 79 ARG H H 79 8.499 8.476 0.023 1
1 1093 . 5 1 1 A 79 79 ARG HA H 79 4.712 4.934 -0.222 1
1 1100 . 5 1 1 A 79 79 ARG C C 79 174.221 175.244 -1.023 1
1 1101 . 5 1 1 A 79 79 ARG CA C 79 54.117 54.719 -0.602 1
1 1102 . 5 1 1 A 79 79 ARG CB C 79 31.196 31.848 -0.652 1
1 1105 . 5 1 1 A 79 79 ARG N N 79 125.637 121.548 4.089 1
1 1106 . 5 1 1 A 80 80 THR H H 80 8.416 8.511 -0.095 1
1 1107 . 5 1 1 A 80 80 THR HA H 80 5.332 4.609 0.723 1
1 1112 . 5 1 1 A 80 80 THR C C 80 174.497 173.986 0.511 1
1 1113 . 5 1 1 A 80 80 THR CA C 80 59.694 61.086 -1.392 1
1 1114 . 5 1 1 A 80 80 THR CB C 80 69.772 69.692 0.080 1
1 1116 . 5 1 1 A 80 80 THR N N 80 118.084 117.481 0.603 1
1 1117 . 5 1 1 A 81 81 ARG H H 81 8.758 8.967 -0.209 1
1 1118 . 5 1 1 A 81 81 ARG HA H 81 4.362 4.771 -0.409 1
1 1126 . 5 1 1 A 81 81 ARG C C 81 173.733 173.878 -0.145 1
1 1127 . 5 1 1 A 81 81 ARG CA C 81 53.273 53.984 -0.711 1
1 1128 . 5 1 1 A 81 81 ARG CB C 81 33.915 33.425 0.490 1
1 1131 . 5 1 1 A 81 81 ARG N N 81 122.844 124.973 -2.129 1
1 1133 . 5 1 1 A 82 82 LYS H H 82 8.721 8.698 0.023 1
1 1134 . 5 1 1 A 82 82 LYS HA H 82 4.701 5.163 -0.462 1
1 1143 . 5 1 1 A 82 82 LYS C C 82 175.667 175.864 -0.197 1
1 1144 . 5 1 1 A 82 82 LYS CA C 82 54.960 54.988 -0.028 1
1 1145 . 5 1 1 A 82 82 LYS CB C 82 32.603 34.445 -1.842 1
1 1149 . 5 1 1 A 82 82 LYS N N 82 124.668 123.790 0.878 1
1 1150 . 5 1 1 A 83 83 VAL H H 83 9.112 9.276 -0.164 1
1 1151 . 5 1 1 A 83 83 VAL HA H 83 4.796 4.928 -0.132 1
1 1159 . 5 1 1 A 83 83 VAL C C 83 174.594 175.517 -0.923 1
1 1160 . 5 1 1 A 83 83 VAL CA C 83 59.413 60.076 -0.663 1
1 1161 . 5 1 1 A 83 83 VAL CB C 83 35.298 34.619 0.679 1
1 1164 . 5 1 1 A 83 83 VAL N N 83 122.381 121.436 0.945 1
1 1165 . 5 1 1 A 84 84 THR H H 84 9.200 8.759 0.441 1
1 1166 . 5 1 1 A 84 84 THR HA H 84 4.579 4.518 0.061 1
1 1171 . 5 1 1 A 84 84 THR C C 84 173.993 175.067 -1.074 1
1 1172 . 5 1 1 A 84 84 THR CA C 84 60.960 62.426 -1.466 1
1 1173 . 5 1 1 A 84 84 THR CB C 84 70.100 69.701 0.399 1
1 1175 . 5 1 1 A 84 84 THR N N 84 113.183 116.447 -3.264 1
1 1176 . 5 1 1 A 85 85 SER H H 85 7.688 8.270 -0.582 1
1 1177 . 5 1 1 A 85 85 SER HA H 85 5.136 4.801 0.335 1
1 1180 . 5 1 1 A 85 85 SER CA C 85 55.205 55.741 -0.536 1
1 1181 . 5 1 1 A 85 85 SER CB C 85 64.376 64.117 0.259 1
1 1182 . 5 1 1 A 85 85 SER N N 85 115.555 116.747 -1.192 1
1 1183 . 5 1 1 A 86 86 PRO HA H 86 4.090 4.241 -0.151 1
1 1190 . 5 1 1 A 86 86 PRO C C 86 177.227 178.242 -1.015 1
1 1191 . 5 1 1 A 86 86 PRO CA C 86 65.038 65.681 -0.643 1
1 1192 . 5 1 1 A 86 86 PRO CB C 86 31.711 31.889 -0.178 1
1 1195 . 5 1 1 A 87 87 ASP H H 87 8.131 8.350 -0.219 1
1 1196 . 5 1 1 A 87 87 ASP HA H 87 4.223 4.313 -0.090 1
1 1199 . 5 1 1 A 87 87 ASP C C 87 178.721 179.493 -0.772 1
1 1200 . 5 1 1 A 87 87 ASP CA C 87 57.311 57.176 0.135 1
1 1201 . 5 1 1 A 87 87 ASP CB C 87 40.102 40.228 -0.126 1
1 1202 . 5 1 1 A 87 87 ASP N N 87 115.381 117.005 -1.624 1
1 1203 . 5 1 1 A 88 88 GLU H H 88 7.571 8.015 -0.444 1
1 1204 . 5 1 1 A 88 88 GLU HA H 88 3.659 3.990 -0.331 1
1 1209 . 5 1 1 A 88 88 GLU C C 88 177.097 178.672 -1.575 1
1 1210 . 5 1 1 A 88 88 GLU CA C 88 58.729 58.833 -0.104 1
1 1211 . 5 1 1 A 88 88 GLU CB C 88 30.052 29.592 0.460 1
1 1213 . 5 1 1 A 88 88 GLU N N 88 120.009 120.188 -0.179 1
1 1214 . 5 1 1 A 89 89 ALA H H 89 7.423 8.143 -0.720 1
1 1215 . 5 1 1 A 89 89 ALA HA H 89 3.900 4.326 -0.426 1
1 1219 . 5 1 1 A 89 89 ALA C C 89 178.267 179.789 -1.522 1
1 1220 . 5 1 1 A 89 89 ALA CA C 89 55.607 55.026 0.581 1
1 1221 . 5 1 1 A 89 89 ALA CB C 89 17.348 18.410 -1.062 1
1 1222 . 5 1 1 A 89 89 ALA N N 89 118.873 122.036 -3.163 1
1 1223 . 5 1 1 A 90 90 LYS H H 90 8.046 8.174 -0.128 1
1 1224 . 5 1 1 A 90 90 LYS HA H 90 3.669 4.019 -0.350 1
1 1233 . 5 1 1 A 90 90 LYS C C 90 177.649 179.062 -1.413 1
1 1234 . 5 1 1 A 90 90 LYS CA C 90 60.351 59.704 0.647 1
1 1235 . 5 1 1 A 90 90 LYS CB C 90 32.087 32.239 -0.152 1
1 1239 . 5 1 1 A 90 90 LYS N N 90 114.834 117.313 -2.479 1
1 1240 . 5 1 1 A 91 91 ARG H H 91 7.468 8.052 -0.584 1
1 1241 . 5 1 1 A 91 91 ARG HA H 91 3.887 3.915 -0.028 1
1 1249 . 5 1 1 A 91 91 ARG C C 91 178.998 179.148 -0.150 1
1 1250 . 5 1 1 A 91 91 ARG CA C 91 59.164 59.061 0.103 1
1 1251 . 5 1 1 A 91 91 ARG CB C 91 29.274 29.715 -0.441 1
1 1254 . 5 1 1 A 91 91 ARG N N 91 119.029 119.980 -0.951 1
1 1256 . 5 1 1 A 92 92 TRP H H 92 8.136 8.168 -0.032 1
1 1257 . 5 1 1 A 92 92 TRP HA H 92 4.818 4.546 0.272 1
1 1266 . 5 1 1 A 92 92 TRP C C 92 179.566 179.039 0.527 1
1 1267 . 5 1 1 A 92 92 TRP CA C 92 58.663 59.076 -0.413 1
1 1268 . 5 1 1 A 92 92 TRP CB C 92 29.790 29.593 0.197 1
1 1274 . 5 1 1 A 92 92 TRP N N 92 118.100 120.453 -2.353 1
1 1276 . 5 1 1 A 93 93 ILE H H 93 8.363 8.580 -0.217 1
1 1277 . 5 1 1 A 93 93 ILE HA H 93 3.544 3.780 -0.236 1
1 1287 . 5 1 1 A 93 93 ILE C C 93 176.820 177.791 -0.971 1
1 1288 . 5 1 1 A 93 93 ILE CA C 93 66.225 65.555 0.670 1
1 1289 . 5 1 1 A 93 93 ILE CB C 93 37.571 37.806 -0.235 1
1 1293 . 5 1 1 A 93 93 ILE N N 93 120.588 120.384 0.204 1
1 1294 . 5 1 1 A 94 94 LYS H H 94 8.264 7.922 0.342 1
1 1295 . 5 1 1 A 94 94 LYS HA H 94 3.865 3.977 -0.112 1
1 1304 . 5 1 1 A 94 94 LYS C C 94 179.258 179.037 0.221 1
1 1305 . 5 1 1 A 94 94 LYS CA C 94 59.889 59.832 0.057 1
1 1306 . 5 1 1 A 94 94 LYS CB C 94 32.225 32.533 -0.308 1
1 1310 . 5 1 1 A 94 94 LYS N N 94 121.687 120.548 1.139 1
1 1311 . 5 1 1 A 95 95 GLU H H 95 8.360 7.940 0.420 1
1 1312 . 5 1 1 A 95 95 GLU HA H 95 4.023 4.083 -0.060 1
1 1317 . 5 1 1 A 95 95 GLU C C 95 178.884 179.044 -0.160 1
1 1318 . 5 1 1 A 95 95 GLU CA C 95 59.366 59.518 -0.152 1
1 1319 . 5 1 1 A 95 95 GLU CB C 95 29.508 29.609 -0.101 1
1 1321 . 5 1 1 A 95 95 GLU N N 95 118.505 117.759 0.746 1
1 1322 . 5 1 1 A 96 96 PHE H H 96 8.212 8.386 -0.174 1
1 1323 . 5 1 1 A 96 96 PHE HA H 96 4.512 4.195 0.317 1
1 1331 . 5 1 1 A 96 96 PHE C C 96 176.820 178.254 -1.434 1
1 1332 . 5 1 1 A 96 96 PHE CA C 96 59.608 61.602 -1.994 1
1 1333 . 5 1 1 A 96 96 PHE CB C 96 40.431 39.264 1.167 1
1 1339 . 5 1 1 A 96 96 PHE N N 96 120.369 122.087 -1.718 1
1 1340 . 5 1 1 A 97 97 SER H H 97 8.216 8.210 0.006 1
1 1341 . 5 1 1 A 97 97 SER HA H 97 3.816 4.100 -0.284 1
1 1344 . 5 1 1 A 97 97 SER C C 97 175.618 177.146 -1.528 1
1 1345 . 5 1 1 A 97 97 SER CA C 97 60.492 61.391 -0.899 1
1 1346 . 5 1 1 A 97 97 SER CB C 97 63.022 62.996 0.026 1
1 1347 . 5 1 1 A 97 97 SER N N 97 111.969 114.105 -2.136 1
1 1348 . 5 1 1 A 98 98 GLU H H 98 7.655 7.531 0.124 1
1 1349 . 5 1 1 A 98 98 GLU HA H 98 4.187 4.092 0.095 1
1 1354 . 5 1 1 A 98 98 GLU C C 98 177.698 179.262 -1.564 1
1 1355 . 5 1 1 A 98 98 GLU CA C 98 57.069 59.263 -2.194 1
1 1356 . 5 1 1 A 98 98 GLU CB C 98 29.321 28.816 0.505 1
1 1358 . 5 1 1 A 98 98 GLU N N 98 120.588 122.031 -1.443 1
1 1359 . 5 1 1 A 99 99 GLU H H 99 7.794 7.783 0.011 1
1 1360 . 5 1 1 A 99 99 GLU HA H 99 4.123 4.019 0.104 1
1 1365 . 5 1 1 A 99 99 GLU C C 99 177.665 177.598 0.067 1
1 1366 . 5 1 1 A 99 99 GLU CA C 99 57.304 58.591 -1.287 1
1 1367 . 5 1 1 A 99 99 GLU CB C 99 29.368 29.756 -0.388 1
1 1369 . 5 1 1 A 99 99 GLU N N 99 120.067 119.938 0.129 1
1 1370 . 5 1 1 A 100 100 GLY H H 100 8.138 8.155 -0.017 1
1 1371 . 5 1 1 A 100 100 GLY HA2 H 100 3.865 3.824 0.041 1
1 1372 . 5 1 1 A 100 100 GLY HA3 H 100 3.715 3.875 -0.160 1
1 1373 . 5 1 1 A 100 100 GLY C C 100 174.464 173.818 0.646 1
1 1374 . 5 1 1 A 100 100 GLY CA C 100 45.305 46.464 -1.159 1
1 1375 . 5 1 1 A 100 100 GLY N N 100 107.802 108.659 -0.857 1
1 1376 . 5 1 1 A 101 101 GLY H H 101 8.023 7.836 0.187 1
1 1377 . 5 1 1 A 101 101 GLY HA2 H 101 3.865 4.032 -0.167 1
1 1378 . 5 1 1 A 101 101 GLY HA3 H 101 3.892 4.052 -0.160 1
1 1379 . 5 1 1 A 101 101 GLY C C 101 174.204 171.642 2.562 1
1 1380 . 5 1 1 A 101 101 GLY CA C 101 45.036 45.013 0.023 1
1 1381 . 5 1 1 A 101 101 GLY N N 101 108.032 107.240 0.792 1
1 1382 . 5 1 1 A 102 102 SER H H 102 8.059 8.908 -0.849 1
1 1383 . 5 1 1 A 102 102 SER HA H 102 4.380 5.017 -0.637 1
1 1386 . 5 1 1 A 102 102 SER C C 102 174.627 173.586 1.041 1
1 1387 . 5 1 1 A 102 102 SER CA C 102 58.194 57.731 0.463 1
1 1388 . 5 1 1 A 102 102 SER CB C 102 63.538 64.494 -0.956 1
1 1389 . 5 1 1 A 102 102 SER N N 102 115.266 120.126 -4.860 1
1 1390 . 5 1 1 A 103 103 LEU H H 103 8.287 8.372 -0.085 1
1 1391 . 5 1 1 A 103 103 LEU HA H 103 4.301 4.203 0.098 1
1 1401 . 5 1 1 A 103 103 LEU C C 103 177.292 177.050 0.242 1
1 1402 . 5 1 1 A 103 103 LEU CA C 103 55.007 56.433 -1.426 1
1 1403 . 5 1 1 A 103 103 LEU CB C 103 42.023 42.271 -0.248 1
1 1407 . 5 1 1 A 103 103 LEU N N 103 123.596 127.823 -4.227 1
1 1408 . 5 1 1 A 104 104 GLU H H 104 8.216 7.734 0.482 1
1 1409 . 5 1 1 A 104 104 GLU HA H 104 4.126 4.418 -0.292 1
1 1414 . 5 1 1 A 104 104 GLU CA C 104 56.518 56.162 0.356 1
1 1415 . 5 1 1 A 104 104 GLU CB C 104 29.837 30.225 -0.388 1
1 1417 . 5 1 1 A 104 104 GLU N N 104 120.510 118.525 1.985 1
1 1418 . 5 1 1 A 105 105 HIS HA H 105 4.593 4.717 -0.124 1
1 1421 . 5 1 1 A 105 105 HIS C C 105 173.766 175.545 -1.779 1
1 1422 . 5 1 1 A 105 105 HIS CA C 105 55.536 54.478 1.058 1
1 1423 . 5 1 1 A 105 105 HIS CB C 105 30.001 27.335 2.666 1
1 1424 . 5 1 1 A 106 106 HIS H H 106 8.154 8.109 0.045 1
1 1425 . 5 1 1 A 106 106 HIS HA H 106 4.407 4.282 0.125 1
1 1428 . 5 1 1 A 106 106 HIS CA C 106 56.920 55.893 1.027 1
1 1429 . 5 1 1 A 106 106 HIS CB C 106 30.001 29.093 0.908 1
1 14 . 6 1 1 A 2 2 LEU H H 2 8.509 9.043 -0.534 1
1 15 . 6 1 1 A 2 2 LEU HA H 2 4.463 5.263 -0.800 1
1 25 . 6 1 1 A 2 2 LEU C C 2 173.944 176.387 -2.443 1
1 26 . 6 1 1 A 2 2 LEU CA C 2 54.471 53.656 0.815 1
1 27 . 6 1 1 A 2 2 LEU CB C 2 43.595 44.324 -0.729 1
1 31 . 6 1 1 A 2 2 LEU N N 2 127.160 125.752 1.408 1
1 32 . 6 1 1 A 3 3 LEU H H 3 7.844 8.992 -1.148 1
1 33 . 6 1 1 A 3 3 LEU HA H 3 5.128 5.510 -0.382 1
1 43 . 6 1 1 A 3 3 LEU C C 3 175.423 175.534 -0.111 1
1 44 . 6 1 1 A 3 3 LEU CA C 3 53.566 53.228 0.338 1
1 45 . 6 1 1 A 3 3 LEU CB C 3 44.039 44.779 -0.740 1
1 49 . 6 1 1 A 3 3 LEU N N 3 122.555 122.949 -0.394 1
1 50 . 6 1 1 A 4 4 TYR H H 4 8.360 9.579 -1.219 1
1 51 . 6 1 1 A 4 4 TYR HA H 4 5.143 5.310 -0.167 1
1 58 . 6 1 1 A 4 4 TYR C C 4 174.481 174.865 -0.384 1
1 59 . 6 1 1 A 4 4 TYR CA C 4 56.577 55.903 0.674 1
1 60 . 6 1 1 A 4 4 TYR CB C 4 43.840 41.726 2.114 1
1 65 . 6 1 1 A 4 4 TYR N N 4 119.315 123.801 -4.486 1
1 66 . 6 1 1 A 5 5 VAL H H 5 8.918 8.899 0.019 1
1 67 . 6 1 1 A 5 5 VAL HA H 5 5.106 4.868 0.238 1
1 75 . 6 1 1 A 5 5 VAL C C 5 174.042 174.737 -0.695 1
1 76 . 6 1 1 A 5 5 VAL CA C 5 59.852 60.844 -0.992 1
1 77 . 6 1 1 A 5 5 VAL CB C 5 33.816 34.934 -1.118 1
1 80 . 6 1 1 A 5 5 VAL N N 5 119.952 120.251 -0.299 1
1 81 . 6 1 1 A 6 6 LEU H H 6 9.315 9.527 -0.212 1
1 82 . 6 1 1 A 6 6 LEU HA H 6 5.466 5.232 0.234 1
1 92 . 6 1 1 A 6 6 LEU C C 6 175.049 175.036 0.013 1
1 93 . 6 1 1 A 6 6 LEU CA C 6 52.090 53.169 -1.079 1
1 94 . 6 1 1 A 6 6 LEU CB C 6 44.103 43.148 0.955 1
1 98 . 6 1 1 A 6 6 LEU N N 6 126.917 126.759 0.158 1
1 99 . 6 1 1 A 7 7 ILE H H 7 8.458 8.889 -0.431 1
1 100 . 6 1 1 A 7 7 ILE HA H 7 5.131 4.961 0.170 1
1 110 . 6 1 1 A 7 7 ILE C C 7 173.213 173.811 -0.598 1
1 111 . 6 1 1 A 7 7 ILE CA C 7 58.463 59.974 -1.511 1
1 112 . 6 1 1 A 7 7 ILE CB C 7 41.020 40.662 0.358 1
1 116 . 6 1 1 A 7 7 ILE N N 7 119.778 125.994 -6.216 1
1 117 . 6 1 1 A 8 8 ILE H H 8 8.797 9.414 -0.617 1
1 118 . 6 1 1 A 8 8 ILE HA H 8 4.611 4.879 -0.268 1
1 128 . 6 1 1 A 8 8 ILE C C 8 174.611 174.969 -0.358 1
1 129 . 6 1 1 A 8 8 ILE CA C 8 60.227 60.472 -0.245 1
1 130 . 6 1 1 A 8 8 ILE CB C 8 37.665 37.417 0.248 1
1 134 . 6 1 1 A 8 8 ILE N N 8 128.919 132.669 -3.750 1
1 135 . 6 1 1 A 9 9 SER H H 9 7.811 8.770 -0.959 1
1 136 . 6 1 1 A 9 9 SER HA H 9 4.429 5.033 -0.604 1
1 140 . 6 1 1 A 9 9 SER C C 9 172.937 172.841 0.096 1
1 141 . 6 1 1 A 9 9 SER CA C 9 58.241 56.910 1.331 1
1 142 . 6 1 1 A 9 9 SER CB C 9 64.261 64.557 -0.296 1
1 143 . 6 1 1 A 9 9 SER N N 9 116.365 121.800 -5.435 1
1 144 . 6 1 1 A 10 10 ASN H H 10 8.641 8.639 0.002 1
1 145 . 6 1 1 A 10 10 ASN HA H 10 4.938 5.074 -0.136 1
1 150 . 6 1 1 A 10 10 ASN C C 10 174.497 173.906 0.591 1
1 151 . 6 1 1 A 10 10 ASN CA C 10 52.221 53.380 -1.159 1
1 152 . 6 1 1 A 10 10 ASN CB C 10 39.128 39.023 0.105 1
1 153 . 6 1 1 A 10 10 ASN N N 10 122.612 120.608 2.004 1
1 155 . 6 1 1 A 11 11 ASP H H 11 8.673 7.710 0.963 1
1 156 . 6 1 1 A 11 11 ASP HA H 11 4.596 4.850 -0.254 1
1 159 . 6 1 1 A 11 11 ASP C C 11 175.342 176.330 -0.988 1
1 160 . 6 1 1 A 11 11 ASP CA C 11 53.233 52.949 0.284 1
1 161 . 6 1 1 A 11 11 ASP CB C 11 40.965 42.551 -1.586 1
1 162 . 6 1 1 A 11 11 ASP N N 11 122.717 121.394 1.323 1
1 163 . 6 1 1 A 12 12 LYS H H 12 8.562 9.046 -0.484 1
1 164 . 6 1 1 A 12 12 LYS HA H 12 3.854 4.105 -0.251 1
1 173 . 6 1 1 A 12 12 LYS C C 12 178.754 178.746 0.008 1
1 174 . 6 1 1 A 12 12 LYS CA C 12 59.581 58.852 0.729 1
1 175 . 6 1 1 A 12 12 LYS CB C 12 32.378 32.371 0.007 1
1 179 . 6 1 1 A 12 12 LYS N N 12 125.737 126.102 -0.365 1
1 180 . 6 1 1 A 13 13 LYS H H 13 8.075 7.724 0.351 1
1 181 . 6 1 1 A 13 13 LYS HA H 13 4.154 4.047 0.107 1
1 190 . 6 1 1 A 13 13 LYS C C 13 178.315 179.058 -0.743 1
1 191 . 6 1 1 A 13 13 LYS CA C 13 58.532 59.195 -0.663 1
1 192 . 6 1 1 A 13 13 LYS CB C 13 31.452 32.124 -0.672 1
1 196 . 6 1 1 A 13 13 LYS N N 13 119.604 120.150 -0.546 1
1 197 . 6 1 1 A 14 14 LEU H H 14 7.552 8.083 -0.531 1
1 198 . 6 1 1 A 14 14 LEU HA H 14 3.682 4.067 -0.385 1
1 208 . 6 1 1 A 14 14 LEU C C 14 178.429 178.122 0.307 1
1 209 . 6 1 1 A 14 14 LEU CA C 14 58.999 58.134 0.865 1
1 210 . 6 1 1 A 14 14 LEU CB C 14 41.228 41.321 -0.093 1
1 214 . 6 1 1 A 14 14 LEU N N 14 122.266 121.459 0.807 1
1 215 . 6 1 1 A 15 15 ILE H H 15 8.074 7.899 0.175 1
1 216 . 6 1 1 A 15 15 ILE HA H 15 3.264 3.450 -0.186 1
1 226 . 6 1 1 A 15 15 ILE C C 15 177.000 177.975 -0.975 1
1 227 . 6 1 1 A 15 15 ILE CA C 15 65.939 65.704 0.235 1
1 228 . 6 1 1 A 15 15 ILE CB C 15 37.983 37.833 0.150 1
1 232 . 6 1 1 A 15 15 ILE N N 15 118.214 119.598 -1.384 1
1 233 . 6 1 1 A 16 16 GLU H H 16 8.016 8.450 -0.434 1
1 234 . 6 1 1 A 16 16 GLU HA H 16 4.045 3.893 0.152 1
1 239 . 6 1 1 A 16 16 GLU C C 16 179.388 179.607 -0.219 1
1 240 . 6 1 1 A 16 16 GLU CA C 16 59.032 59.949 -0.917 1
1 241 . 6 1 1 A 16 16 GLU CB C 16 29.200 29.233 -0.033 1
1 243 . 6 1 1 A 16 16 GLU N N 16 118.484 118.811 -0.327 1
1 244 . 6 1 1 A 17 17 GLU H H 17 8.063 8.377 -0.314 1
1 245 . 6 1 1 A 17 17 GLU HA H 17 4.053 4.048 0.005 1
1 250 . 6 1 1 A 17 17 GLU C C 17 179.306 179.189 0.117 1
1 251 . 6 1 1 A 17 17 GLU CA C 17 58.636 59.214 -0.578 1
1 252 . 6 1 1 A 17 17 GLU CB C 17 29.011 29.494 -0.483 1
1 254 . 6 1 1 A 17 17 GLU N N 17 118.100 120.506 -2.406 1
1 255 . 6 1 1 A 18 18 ALA H H 18 8.655 8.297 0.358 1
1 256 . 6 1 1 A 18 18 ALA HA H 18 3.775 4.017 -0.242 1
1 260 . 6 1 1 A 18 18 ALA C C 18 178.559 179.466 -0.907 1
1 261 . 6 1 1 A 18 18 ALA CA C 18 54.960 55.405 -0.445 1
1 262 . 6 1 1 A 18 18 ALA CB C 18 17.960 18.175 -0.215 1
1 263 . 6 1 1 A 18 18 ALA N N 18 122.439 122.692 -0.253 1
1 264 . 6 1 1 A 19 19 ARG H H 19 8.900 8.121 0.779 1
1 265 . 6 1 1 A 19 19 ARG HA H 19 3.809 3.999 -0.190 1
1 273 . 6 1 1 A 19 19 ARG C C 19 178.721 178.930 -0.209 1
1 274 . 6 1 1 A 19 19 ARG CA C 19 59.976 59.721 0.255 1
1 275 . 6 1 1 A 19 19 ARG CB C 19 29.572 30.055 -0.483 1
1 278 . 6 1 1 A 19 19 ARG N N 19 118.563 117.729 0.834 1
1 280 . 6 1 1 A 20 20 LYS H H 20 7.792 8.124 -0.332 1
1 281 . 6 1 1 A 20 20 LYS HA H 20 4.052 4.065 -0.013 1
1 290 . 6 1 1 A 20 20 LYS C C 20 179.648 179.570 0.078 1
1 291 . 6 1 1 A 20 20 LYS CA C 20 59.296 59.373 -0.077 1
1 292 . 6 1 1 A 20 20 LYS CB C 20 32.216 32.218 -0.002 1
1 296 . 6 1 1 A 20 20 LYS N N 20 118.638 119.276 -0.638 1
1 297 . 6 1 1 A 21 21 MET H H 21 7.684 7.797 -0.113 1
1 298 . 6 1 1 A 21 21 MET HA H 21 4.411 4.170 0.241 1
1 306 . 6 1 1 A 21 21 MET C C 21 177.909 178.124 -0.215 1
1 307 . 6 1 1 A 21 21 MET CA C 21 57.009 58.970 -1.961 1
1 308 . 6 1 1 A 21 21 MET CB C 21 32.028 32.765 -0.737 1
1 311 . 6 1 1 A 21 21 MET N N 21 118.100 118.398 -0.298 1
1 312 . 6 1 1 A 22 22 ALA H H 22 8.815 8.060 0.755 1
1 313 . 6 1 1 A 22 22 ALA HA H 22 3.826 3.945 -0.119 1
1 317 . 6 1 1 A 22 22 ALA C C 22 178.835 179.858 -1.023 1
1 318 . 6 1 1 A 22 22 ALA CA C 22 55.427 55.536 -0.109 1
1 319 . 6 1 1 A 22 22 ALA CB C 22 18.059 18.369 -0.310 1
1 320 . 6 1 1 A 22 22 ALA N N 22 122.150 120.951 1.199 1
1 321 . 6 1 1 A 23 23 GLU H H 23 8.276 8.245 0.031 1
1 322 . 6 1 1 A 23 23 GLU HA H 23 4.146 4.037 0.109 1
1 327 . 6 1 1 A 23 23 GLU C C 23 180.151 179.261 0.890 1
1 328 . 6 1 1 A 23 23 GLU CA C 23 58.999 59.383 -0.384 1
1 329 . 6 1 1 A 23 23 GLU CB C 23 29.160 29.359 -0.199 1
1 331 . 6 1 1 A 23 23 GLU N N 23 117.001 118.086 -1.085 1
1 332 . 6 1 1 A 24 24 LYS H H 24 7.573 7.790 -0.217 1
1 333 . 6 1 1 A 24 24 LYS HA H 24 4.101 4.016 0.085 1
1 342 . 6 1 1 A 24 24 LYS C C 24 177.145 178.833 -1.688 1
1 343 . 6 1 1 A 24 24 LYS CA C 24 58.261 59.230 -0.969 1
1 344 . 6 1 1 A 24 24 LYS CB C 24 32.079 32.088 -0.009 1
1 348 . 6 1 1 A 24 24 LYS N N 24 119.960 119.470 0.490 1
1 349 . 6 1 1 A 25 25 ALA H H 25 7.710 7.738 -0.028 1
1 350 . 6 1 1 A 25 25 ALA HA H 25 4.413 4.326 0.087 1
1 354 . 6 1 1 A 25 25 ALA C C 25 175.325 176.416 -1.091 1
1 355 . 6 1 1 A 25 25 ALA CA C 25 51.208 52.446 -1.238 1
1 356 . 6 1 1 A 25 25 ALA CB C 25 18.520 19.460 -0.940 1
1 357 . 6 1 1 A 25 25 ALA N N 25 119.257 118.431 0.826 1
1 358 . 6 1 1 A 26 26 ASN H H 26 7.840 7.916 -0.076 1
1 359 . 6 1 1 A 26 26 ASN HA H 26 4.357 4.263 0.094 1
1 364 . 6 1 1 A 26 26 ASN C C 26 173.587 174.176 -0.589 1
1 365 . 6 1 1 A 26 26 ASN CA C 26 54.307 54.516 -0.209 1
1 366 . 6 1 1 A 26 26 ASN CB C 26 36.972 36.609 0.363 1
1 367 . 6 1 1 A 26 26 ASN N N 26 115.266 114.462 0.804 1
1 369 . 6 1 1 A 27 27 LEU H H 27 8.241 7.856 0.385 1
1 370 . 6 1 1 A 27 27 LEU HA H 27 4.652 4.408 0.244 1
1 380 . 6 1 1 A 27 27 LEU C C 27 175.894 176.120 -0.226 1
1 381 . 6 1 1 A 27 27 LEU CA C 27 52.923 53.811 -0.888 1
1 382 . 6 1 1 A 27 27 LEU CB C 27 44.090 42.503 1.587 1
1 386 . 6 1 1 A 27 27 LEU N N 27 116.828 119.347 -2.519 1
1 387 . 6 1 1 A 28 28 GLU H H 28 7.798 8.241 -0.443 1
1 388 . 6 1 1 A 28 28 GLU HA H 28 4.310 4.320 -0.010 1
1 393 . 6 1 1 A 28 28 GLU C C 28 173.944 175.322 -1.378 1
1 394 . 6 1 1 A 28 28 GLU CA C 28 55.460 56.353 -0.893 1
1 395 . 6 1 1 A 28 28 GLU CB C 28 30.512 29.327 1.185 1
1 397 . 6 1 1 A 28 28 GLU N N 28 121.340 123.467 -2.127 1
1 398 . 6 1 1 A 29 29 LEU H H 29 8.451 8.811 -0.360 1
1 399 . 6 1 1 A 29 29 LEU HA H 29 5.662 5.095 0.567 1
1 409 . 6 1 1 A 29 29 LEU C C 29 176.902 174.876 2.026 1
1 410 . 6 1 1 A 29 29 LEU CA C 29 53.186 54.123 -0.937 1
1 411 . 6 1 1 A 29 29 LEU CB C 29 44.914 43.702 1.212 1
1 415 . 6 1 1 A 29 29 LEU N N 29 126.547 127.587 -1.040 1
1 416 . 6 1 1 A 30 30 ARG H H 30 9.094 9.219 -0.125 1
1 417 . 6 1 1 A 30 30 ARG HA H 30 4.910 4.627 0.283 1
1 425 . 6 1 1 A 30 30 ARG C C 30 175.147 176.053 -0.906 1
1 426 . 6 1 1 A 30 30 ARG CA C 30 53.417 54.441 -1.024 1
1 427 . 6 1 1 A 30 30 ARG CB C 30 32.555 32.380 0.175 1
1 430 . 6 1 1 A 30 30 ARG N N 30 125.043 126.445 -1.402 1
1 432 . 6 1 1 A 31 31 THR H H 31 8.496 8.523 -0.027 1
1 433 . 6 1 1 A 31 31 THR HA H 31 4.888 4.853 0.035 1
1 438 . 6 1 1 A 31 31 THR C C 31 173.961 174.204 -0.243 1
1 439 . 6 1 1 A 31 31 THR CA C 31 60.445 60.994 -0.549 1
1 440 . 6 1 1 A 31 31 THR CB C 31 69.492 70.093 -0.601 1
1 442 . 6 1 1 A 31 31 THR N N 31 114.745 115.541 -0.796 1
1 443 . 6 1 1 A 32 32 VAL H H 32 8.480 9.024 -0.544 1
1 444 . 6 1 1 A 32 32 VAL HA H 32 4.411 4.604 -0.193 1
1 452 . 6 1 1 A 32 32 VAL C C 32 175.082 175.384 -0.302 1
1 453 . 6 1 1 A 32 32 VAL CA C 32 60.946 61.206 -0.260 1
1 454 . 6 1 1 A 32 32 VAL CB C 32 34.487 34.023 0.464 1
1 457 . 6 1 1 A 32 32 VAL N N 32 122.324 124.934 -2.610 1
1 458 . 6 1 1 A 33 33 LYS H H 33 9.304 8.827 0.477 1
1 459 . 6 1 1 A 33 33 LYS HA H 33 4.534 4.409 0.125 1
1 468 . 6 1 1 A 33 33 LYS C C 33 176.740 176.502 0.238 1
1 469 . 6 1 1 A 33 33 LYS CA C 33 56.846 57.370 -0.524 1
1 470 . 6 1 1 A 33 33 LYS CB C 33 34.355 33.511 0.844 1
1 474 . 6 1 1 A 33 33 LYS N N 33 123.654 126.624 -2.970 1
1 475 . 6 1 1 A 34 34 THR H H 34 7.245 7.689 -0.444 1
1 476 . 6 1 1 A 34 34 THR HA H 34 4.780 4.704 0.076 1
1 481 . 6 1 1 A 34 34 THR C C 34 174.529 175.267 -0.738 1
1 482 . 6 1 1 A 34 34 THR CA C 34 58.859 59.200 -0.341 1
1 483 . 6 1 1 A 34 34 THR CB C 34 73.023 71.702 1.321 1
1 485 . 6 1 1 A 34 34 THR N N 34 106.300 111.567 -5.267 1
1 486 . 6 1 1 A 35 35 GLU H H 35 9.174 9.103 0.071 1
1 487 . 6 1 1 A 35 35 GLU HA H 35 3.886 3.958 -0.072 1
1 492 . 6 1 1 A 35 35 GLU C C 35 177.714 177.554 0.160 1
1 493 . 6 1 1 A 35 35 GLU CA C 35 59.233 59.551 -0.318 1
1 494 . 6 1 1 A 35 35 GLU CB C 35 29.377 29.449 -0.072 1
1 496 . 6 1 1 A 35 35 GLU N N 35 121.919 122.028 -0.109 1
1 497 . 6 1 1 A 36 36 ASP H H 36 8.185 8.316 -0.131 1
1 498 . 6 1 1 A 36 36 ASP HA H 36 4.289 4.311 -0.022 1
1 501 . 6 1 1 A 36 36 ASP C C 36 178.348 178.367 -0.019 1
1 502 . 6 1 1 A 36 36 ASP CA C 36 56.962 57.763 -0.801 1
1 503 . 6 1 1 A 36 36 ASP CB C 36 40.214 41.872 -1.658 1
1 504 . 6 1 1 A 36 36 ASP N N 36 118.332 119.633 -1.301 1
1 505 . 6 1 1 A 37 37 GLU H H 37 7.741 7.732 0.009 1
1 506 . 6 1 1 A 37 37 GLU HA H 37 3.708 3.865 -0.157 1
1 511 . 6 1 1 A 37 37 GLU C C 37 177.324 178.840 -1.516 1
1 512 . 6 1 1 A 37 37 GLU CA C 37 58.698 59.054 -0.356 1
1 513 . 6 1 1 A 37 37 GLU CB C 37 30.199 29.593 0.606 1
1 515 . 6 1 1 A 37 37 GLU N N 37 120.704 118.920 1.784 1
1 516 . 6 1 1 A 38 38 LEU H H 38 7.531 8.016 -0.485 1
1 517 . 6 1 1 A 38 38 LEU HA H 38 3.873 4.153 -0.280 1
1 527 . 6 1 1 A 38 38 LEU C C 38 177.357 178.589 -1.232 1
1 528 . 6 1 1 A 38 38 LEU CA C 38 58.305 58.429 -0.124 1
1 529 . 6 1 1 A 38 38 LEU CB C 38 40.837 41.641 -0.804 1
1 533 . 6 1 1 A 38 38 LEU N N 38 119.200 121.756 -2.556 1
1 534 . 6 1 1 A 39 39 LYS H H 39 8.083 7.952 0.131 1
1 535 . 6 1 1 A 39 39 LYS HA H 39 3.608 3.871 -0.263 1
1 544 . 6 1 1 A 39 39 LYS C C 39 177.373 178.802 -1.429 1
1 545 . 6 1 1 A 39 39 LYS CA C 39 60.290 59.720 0.570 1
1 546 . 6 1 1 A 39 39 LYS CB C 39 32.178 32.166 0.012 1
1 550 . 6 1 1 A 39 39 LYS N N 39 116.943 118.807 -1.864 1
1 551 . 6 1 1 A 40 40 LYS H H 40 7.632 8.102 -0.470 1
1 552 . 6 1 1 A 40 40 LYS HA H 40 3.864 3.862 0.002 1
1 561 . 6 1 1 A 40 40 LYS C C 40 179.566 178.219 1.347 1
1 562 . 6 1 1 A 40 40 LYS CA C 40 58.993 58.873 0.120 1
1 563 . 6 1 1 A 40 40 LYS CB C 40 31.758 31.876 -0.118 1
1 567 . 6 1 1 A 40 40 LYS N N 40 118.274 118.932 -0.658 1
1 568 . 6 1 1 A 41 41 TYR H H 41 7.823 7.732 0.091 1
1 569 . 6 1 1 A 41 41 TYR HA H 41 3.926 4.041 -0.115 1
1 576 . 6 1 1 A 41 41 TYR C C 41 176.625 177.522 -0.897 1
1 577 . 6 1 1 A 41 41 TYR CA C 41 59.757 61.047 -1.290 1
1 578 . 6 1 1 A 41 41 TYR CB C 41 36.901 37.735 -0.834 1
1 583 . 6 1 1 A 41 41 TYR N N 41 117.811 118.903 -1.092 1
1 584 . 6 1 1 A 42 42 LEU H H 42 7.964 8.152 -0.188 1
1 585 . 6 1 1 A 42 42 LEU HA H 42 3.704 3.723 -0.019 1
1 595 . 6 1 1 A 42 42 LEU C C 42 178.396 179.247 -0.851 1
1 596 . 6 1 1 A 42 42 LEU CA C 42 58.237 57.714 0.523 1
1 597 . 6 1 1 A 42 42 LEU CB C 42 40.507 41.184 -0.677 1
1 601 . 6 1 1 A 42 42 LEU N N 42 115.960 120.185 -4.225 1
1 602 . 6 1 1 A 43 43 GLU H H 43 8.193 7.864 0.329 1
1 603 . 6 1 1 A 43 43 GLU HA H 43 3.882 3.899 -0.017 1
1 608 . 6 1 1 A 43 43 GLU C C 43 179.193 179.378 -0.185 1
1 609 . 6 1 1 A 43 43 GLU CA C 43 59.122 59.685 -0.563 1
1 610 . 6 1 1 A 43 43 GLU CB C 43 29.244 29.233 0.011 1
1 612 . 6 1 1 A 43 43 GLU N N 43 117.175 119.354 -2.179 1
1 613 . 6 1 1 A 44 44 GLU H H 44 7.601 7.393 0.208 1
1 614 . 6 1 1 A 44 44 GLU HA H 44 3.936 4.090 -0.154 1
1 619 . 6 1 1 A 44 44 GLU C C 44 179.875 179.187 0.688 1
1 620 . 6 1 1 A 44 44 GLU CA C 44 58.867 59.228 -0.361 1
1 621 . 6 1 1 A 44 44 GLU CB C 44 28.648 29.291 -0.643 1
1 623 . 6 1 1 A 44 44 GLU N N 44 120.472 119.359 1.113 1
1 624 . 6 1 1 A 45 45 PHE H H 45 8.260 8.042 0.218 1
1 625 . 6 1 1 A 45 45 PHE HA H 45 4.520 3.973 0.547 1
1 633 . 6 1 1 A 45 45 PHE C C 45 177.942 178.645 -0.703 1
1 634 . 6 1 1 A 45 45 PHE CA C 45 55.945 61.111 -5.166 1
1 635 . 6 1 1 A 45 45 PHE CB C 45 36.680 38.420 -1.740 1
1 641 . 6 1 1 A 45 45 PHE N N 45 119.272 119.255 0.017 1
1 642 . 6 1 1 A 46 46 ARG H H 46 8.023 8.200 -0.177 1
1 643 . 6 1 1 A 46 46 ARG HA H 46 4.074 3.950 0.124 1
1 651 . 6 1 1 A 46 46 ARG C C 46 177.617 178.878 -1.261 1
1 652 . 6 1 1 A 46 46 ARG CA C 46 58.194 59.157 -0.963 1
1 653 . 6 1 1 A 46 46 ARG CB C 46 29.737 29.951 -0.214 1
1 656 . 6 1 1 A 46 46 ARG N N 46 118.136 119.077 -0.941 1
1 658 . 6 1 1 A 47 47 LYS H H 47 7.470 7.820 -0.350 1
1 659 . 6 1 1 A 47 47 LYS HA H 47 4.143 4.093 0.050 1
1 668 . 6 1 1 A 47 47 LYS C C 47 177.324 177.905 -0.581 1
1 669 . 6 1 1 A 47 47 LYS CA C 47 57.726 59.633 -1.907 1
1 670 . 6 1 1 A 47 47 LYS CB C 47 32.409 32.531 -0.122 1
1 674 . 6 1 1 A 47 47 LYS N N 47 116.943 119.823 -2.880 1
1 675 . 6 1 1 A 48 48 GLU H H 48 7.615 7.785 -0.170 1
1 676 . 6 1 1 A 48 48 GLU HA H 48 4.428 4.671 -0.243 1
1 681 . 6 1 1 A 48 48 GLU C C 48 176.869 176.699 0.170 1
1 682 . 6 1 1 A 48 48 GLU CA C 48 55.945 55.487 0.458 1
1 683 . 6 1 1 A 48 48 GLU CB C 48 29.696 30.203 -0.507 1
1 685 . 6 1 1 A 48 48 GLU N N 48 118.852 115.927 2.925 1
1 686 . 6 1 1 A 49 49 SER H H 49 7.725 7.898 -0.173 1
1 687 . 6 1 1 A 49 49 SER HA H 49 4.244 4.054 0.190 1
1 690 . 6 1 1 A 49 49 SER C C 49 174.838 177.095 -2.257 1
1 691 . 6 1 1 A 49 49 SER CA C 49 59.366 61.139 -1.773 1
1 692 . 6 1 1 A 49 49 SER CB C 49 63.116 63.158 -0.042 1
1 693 . 6 1 1 A 49 49 SER N N 49 114.224 117.210 -2.986 1
1 694 . 6 1 1 A 50 50 GLN H H 50 8.548 8.015 0.533 1
1 695 . 6 1 1 A 50 50 GLN HA H 50 4.398 4.078 0.320 1
1 702 . 6 1 1 A 50 50 GLN C C 50 175.732 176.697 -0.965 1
1 703 . 6 1 1 A 50 50 GLN CA C 50 56.272 59.214 -2.942 1
1 704 . 6 1 1 A 50 50 GLN CB C 50 28.946 28.512 0.434 1
1 706 . 6 1 1 A 50 50 GLN N N 50 120.125 120.399 -0.274 1
1 708 . 6 1 1 A 51 51 ASN H H 51 8.534 8.433 0.101 1
1 709 . 6 1 1 A 51 51 ASN HA H 51 4.980 4.915 0.065 1
1 714 . 6 1 1 A 51 51 ASN C C 51 173.717 174.144 -0.427 1
1 715 . 6 1 1 A 51 51 ASN CA C 51 52.804 52.641 0.163 1
1 716 . 6 1 1 A 51 51 ASN CB C 51 39.583 39.676 -0.093 1
1 717 . 6 1 1 A 51 51 ASN N N 51 118.158 113.873 4.285 1
1 719 . 6 1 1 A 52 52 ILE H H 52 7.492 7.150 0.342 1
1 720 . 6 1 1 A 52 52 ILE HA H 52 5.338 4.885 0.453 1
1 730 . 6 1 1 A 52 52 ILE C C 52 175.049 174.390 0.659 1
1 731 . 6 1 1 A 52 52 ILE CA C 52 59.364 59.986 -0.622 1
1 732 . 6 1 1 A 52 52 ILE CB C 52 42.163 40.972 1.191 1
1 736 . 6 1 1 A 52 52 ILE N N 52 117.927 121.477 -3.550 1
1 737 . 6 1 1 A 53 53 LYS H H 53 8.467 9.239 -0.772 1
1 738 . 6 1 1 A 53 53 LYS HA H 53 5.044 5.029 0.015 1
1 747 . 6 1 1 A 53 53 LYS C C 53 175.082 175.197 -0.115 1
1 748 . 6 1 1 A 53 53 LYS CA C 53 55.429 54.746 0.683 1
1 749 . 6 1 1 A 53 53 LYS CB C 53 36.446 35.906 0.540 1
1 753 . 6 1 1 A 53 53 LYS N N 53 123.249 128.143 -4.894 1
1 754 . 6 1 1 A 54 54 VAL H H 54 8.490 8.173 0.317 1
1 755 . 6 1 1 A 54 54 VAL HA H 54 5.159 4.883 0.276 1
1 763 . 6 1 1 A 54 54 VAL C C 54 173.473 173.237 0.236 1
1 764 . 6 1 1 A 54 54 VAL CA C 54 60.163 60.514 -0.351 1
1 765 . 6 1 1 A 54 54 VAL CB C 54 35.509 34.676 0.833 1
1 768 . 6 1 1 A 54 54 VAL N N 54 120.762 122.291 -1.529 1
1 769 . 6 1 1 A 55 55 LEU H H 55 8.636 8.635 0.001 1
1 770 . 6 1 1 A 55 55 LEU HA H 55 4.670 4.764 -0.094 1
1 780 . 6 1 1 A 55 55 LEU C C 55 173.652 174.257 -0.605 1
1 781 . 6 1 1 A 55 55 LEU CA C 55 52.289 52.963 -0.674 1
1 782 . 6 1 1 A 55 55 LEU CB C 55 42.070 44.329 -2.259 1
1 786 . 6 1 1 A 55 55 LEU N N 55 131.898 129.265 2.633 1
1 787 . 6 1 1 A 56 56 ILE H H 56 9.188 9.213 -0.025 1
1 788 . 6 1 1 A 56 56 ILE HA H 56 4.879 5.045 -0.166 1
1 798 . 6 1 1 A 56 56 ILE C C 56 174.172 174.215 -0.043 1
1 799 . 6 1 1 A 56 56 ILE CA C 56 59.976 59.956 0.020 1
1 800 . 6 1 1 A 56 56 ILE CB C 56 38.181 40.991 -2.810 1
1 804 . 6 1 1 A 56 56 ILE N N 56 126.373 126.398 -0.025 1
1 805 . 6 1 1 A 57 57 LEU H H 57 8.929 9.282 -0.353 1
1 806 . 6 1 1 A 57 57 LEU HA H 57 5.394 5.239 0.155 1
1 816 . 6 1 1 A 57 57 LEU C C 57 175.358 176.122 -0.764 1
1 817 . 6 1 1 A 57 57 LEU CA C 57 52.086 52.983 -0.897 1
1 818 . 6 1 1 A 57 57 LEU CB C 57 42.445 43.047 -0.602 1
1 822 . 6 1 1 A 57 57 LEU N N 57 126.547 127.606 -1.059 1
1 823 . 6 1 1 A 58 58 VAL H H 58 8.542 8.985 -0.443 1
1 824 . 6 1 1 A 58 58 VAL HA H 58 5.253 4.787 0.466 1
1 832 . 6 1 1 A 58 58 VAL C C 58 175.244 175.861 -0.617 1
1 833 . 6 1 1 A 58 58 VAL CA C 58 58.241 58.895 -0.654 1
1 834 . 6 1 1 A 58 58 VAL CB C 58 33.165 34.663 -1.498 1
1 837 . 6 1 1 A 58 58 VAL N N 58 114.398 120.023 -5.625 1
1 838 . 6 1 1 A 59 59 SER H H 59 8.797 8.882 -0.085 1
1 839 . 6 1 1 A 59 59 SER HA H 59 5.063 4.474 0.589 1
1 842 . 6 1 1 A 59 59 SER C C 59 174.172 173.532 0.640 1
1 843 . 6 1 1 A 59 59 SER CA C 59 59.320 60.713 -1.393 1
1 844 . 6 1 1 A 59 59 SER CB C 59 65.600 63.772 1.828 1
1 845 . 6 1 1 A 59 59 SER N N 59 115.497 116.490 -0.993 1
1 846 . 6 1 1 A 60 60 ASN H H 60 7.730 7.895 -0.165 1
1 847 . 6 1 1 A 60 60 ASN HA H 60 4.811 5.129 -0.318 1
1 852 . 6 1 1 A 60 60 ASN C C 60 174.464 174.781 -0.317 1
1 853 . 6 1 1 A 60 60 ASN CA C 60 52.007 52.062 -0.055 1
1 854 . 6 1 1 A 60 60 ASN CB C 60 40.336 42.042 -1.706 1
1 855 . 6 1 1 A 60 60 ASN N N 60 117.522 115.931 1.591 1
1 857 . 6 1 1 A 61 61 ASP H H 61 8.577 9.086 -0.509 1
1 858 . 6 1 1 A 61 61 ASP HA H 61 4.365 4.286 0.079 1
1 861 . 6 1 1 A 61 61 ASP C C 61 177.357 178.388 -1.031 1
1 862 . 6 1 1 A 61 61 ASP CA C 61 57.351 56.917 0.434 1
1 863 . 6 1 1 A 61 61 ASP CB C 61 40.383 40.360 0.023 1
1 864 . 6 1 1 A 61 61 ASP N N 61 119.431 121.869 -2.438 1
1 865 . 6 1 1 A 62 62 GLU H H 62 8.405 8.210 0.195 1
1 866 . 6 1 1 A 62 62 GLU HA H 62 4.121 4.074 0.047 1
1 871 . 6 1 1 A 62 62 GLU C C 62 179.615 179.433 0.182 1
1 872 . 6 1 1 A 62 62 GLU CA C 62 59.593 59.445 0.148 1
1 873 . 6 1 1 A 62 62 GLU CB C 62 28.478 29.554 -1.076 1
1 875 . 6 1 1 A 62 62 GLU N N 62 122.150 120.931 1.219 1
1 876 . 6 1 1 A 63 63 GLU H H 63 8.384 8.184 0.200 1
1 877 . 6 1 1 A 63 63 GLU HA H 63 3.913 4.017 -0.104 1
1 882 . 6 1 1 A 63 63 GLU C C 63 178.478 179.035 -0.557 1
1 883 . 6 1 1 A 63 63 GLU CA C 63 58.273 59.133 -0.860 1
1 884 . 6 1 1 A 63 63 GLU CB C 63 29.931 29.457 0.474 1
1 886 . 6 1 1 A 63 63 GLU N N 63 119.084 120.986 -1.902 1
1 887 . 6 1 1 A 64 64 LEU H H 64 7.717 8.316 -0.599 1
1 888 . 6 1 1 A 64 64 LEU HA H 64 3.750 4.045 -0.295 1
1 898 . 6 1 1 A 64 64 LEU C C 64 177.535 178.097 -0.562 1
1 899 . 6 1 1 A 64 64 LEU CA C 64 58.944 58.329 0.615 1
1 900 . 6 1 1 A 64 64 LEU CB C 64 41.695 41.480 0.215 1
1 904 . 6 1 1 A 64 64 LEU N N 64 120.357 121.879 -1.522 1
1 905 . 6 1 1 A 65 65 ASP H H 65 7.922 8.410 -0.488 1
1 906 . 6 1 1 A 65 65 ASP HA H 65 4.313 4.207 0.106 1
1 909 . 6 1 1 A 65 65 ASP C C 65 179.095 178.690 0.405 1
1 910 . 6 1 1 A 65 65 ASP CA C 65 57.272 57.870 -0.598 1
1 911 . 6 1 1 A 65 65 ASP CB C 65 40.196 41.939 -1.743 1
1 912 . 6 1 1 A 65 65 ASP N N 65 118.100 118.229 -0.129 1
1 913 . 6 1 1 A 66 66 LYS H H 66 7.802 7.817 -0.015 1
1 914 . 6 1 1 A 66 66 LYS HA H 66 4.078 3.997 0.081 1
1 923 . 6 1 1 A 66 66 LYS C C 66 178.624 179.051 -0.427 1
1 924 . 6 1 1 A 66 66 LYS CA C 66 58.429 59.261 -0.832 1
1 925 . 6 1 1 A 66 66 LYS CB C 66 31.727 32.162 -0.435 1
1 929 . 6 1 1 A 66 66 LYS N N 66 119.343 117.736 1.607 1
1 930 . 6 1 1 A 67 67 ALA H H 67 8.480 8.253 0.227 1
1 931 . 6 1 1 A 67 67 ALA HA H 67 3.853 4.116 -0.263 1
1 935 . 6 1 1 A 67 67 ALA C C 67 178.591 179.539 -0.948 1
1 936 . 6 1 1 A 67 67 ALA CA C 67 55.403 55.480 -0.077 1
1 937 . 6 1 1 A 67 67 ALA CB C 67 17.793 18.306 -0.513 1
1 938 . 6 1 1 A 67 67 ALA N N 67 121.562 122.338 -0.776 1
1 939 . 6 1 1 A 68 68 LYS H H 68 8.186 7.742 0.444 1
1 940 . 6 1 1 A 68 68 LYS HA H 68 3.805 4.055 -0.250 1
1 949 . 6 1 1 A 68 68 LYS C C 68 179.095 178.959 0.136 1
1 950 . 6 1 1 A 68 68 LYS CA C 68 59.952 59.264 0.688 1
1 951 . 6 1 1 A 68 68 LYS CB C 68 32.181 32.051 0.130 1
1 955 . 6 1 1 A 68 68 LYS N N 68 116.165 116.833 -0.668 1
1 956 . 6 1 1 A 69 69 GLU H H 69 7.904 7.994 -0.090 1
1 957 . 6 1 1 A 69 69 GLU HA H 69 3.995 4.041 -0.046 1
1 962 . 6 1 1 A 69 69 GLU C C 69 179.079 179.148 -0.069 1
1 963 . 6 1 1 A 69 69 GLU CA C 69 59.022 59.175 -0.153 1
1 964 . 6 1 1 A 69 69 GLU CB C 69 29.274 29.470 -0.196 1
1 966 . 6 1 1 A 69 69 GLU N N 69 119.489 119.349 0.140 1
1 967 . 6 1 1 A 70 70 LEU H H 70 7.962 8.270 -0.308 1
1 968 . 6 1 1 A 70 70 LEU HA H 70 4.020 3.914 0.106 1
1 978 . 6 1 1 A 70 70 LEU C C 70 178.738 178.888 -0.150 1
1 979 . 6 1 1 A 70 70 LEU CA C 70 57.486 57.867 -0.381 1
1 980 . 6 1 1 A 70 70 LEU CB C 70 41.695 41.602 0.093 1
1 984 . 6 1 1 A 70 70 LEU N N 70 119.431 120.047 -0.616 1
1 985 . 6 1 1 A 71 71 ALA H H 71 8.260 8.262 -0.002 1
1 986 . 6 1 1 A 71 71 ALA HA H 71 3.845 4.044 -0.199 1
1 990 . 6 1 1 A 71 71 ALA C C 71 179.518 180.044 -0.526 1
1 991 . 6 1 1 A 71 71 ALA CA C 71 55.139 55.724 -0.585 1
1 992 . 6 1 1 A 71 71 ALA CB C 71 18.487 18.389 0.098 1
1 993 . 6 1 1 A 71 71 ALA N N 71 119.604 120.957 -1.353 1
1 994 . 6 1 1 A 72 72 GLN H H 72 7.910 8.421 -0.511 1
1 995 . 6 1 1 A 72 72 GLN HA H 72 4.154 3.955 0.199 1
1 1002 . 6 1 1 A 72 72 GLN C C 72 178.900 178.809 0.091 1
1 1003 . 6 1 1 A 72 72 GLN CA C 72 58.194 59.041 -0.847 1
1 1004 . 6 1 1 A 72 72 GLN CB C 72 28.056 28.248 -0.192 1
1 1006 . 6 1 1 A 72 72 GLN N N 72 115.960 117.579 -1.619 1
1 1008 . 6 1 1 A 73 73 LYS H H 73 7.841 7.918 -0.077 1
1 1009 . 6 1 1 A 73 73 LYS HA H 73 4.171 4.171 0.000 1
1 1018 . 6 1 1 A 73 73 LYS C C 73 177.730 177.940 -0.210 1
1 1019 . 6 1 1 A 73 73 LYS CA C 73 57.867 58.664 -0.797 1
1 1020 . 6 1 1 A 73 73 LYS CB C 73 32.277 32.163 0.114 1
1 1024 . 6 1 1 A 73 73 LYS N N 73 119.027 119.020 0.007 1
1 1025 . 6 1 1 A 74 74 MET H H 74 7.746 7.930 -0.184 1
1 1026 . 6 1 1 A 74 74 MET HA H 74 4.403 4.561 -0.158 1
1 1034 . 6 1 1 A 74 74 MET C C 74 174.416 175.139 -0.723 1
1 1035 . 6 1 1 A 74 74 MET CA C 74 55.194 55.362 -0.168 1
1 1036 . 6 1 1 A 74 74 MET CB C 74 33.366 33.232 0.134 1
1 1039 . 6 1 1 A 74 74 MET N N 74 115.786 115.951 -0.165 1
1 1040 . 6 1 1 A 75 75 GLU H H 75 8.076 7.968 0.108 1
1 1041 . 6 1 1 A 75 75 GLU HA H 75 4.001 3.966 0.035 1
1 1046 . 6 1 1 A 75 75 GLU C C 75 175.130 175.252 -0.122 1
1 1047 . 6 1 1 A 75 75 GLU CA C 75 56.722 57.524 -0.802 1
1 1048 . 6 1 1 A 75 75 GLU CB C 75 27.118 27.079 0.039 1
1 1050 . 6 1 1 A 75 75 GLU N N 75 116.249 115.870 0.379 1
1 1051 . 6 1 1 A 76 76 ILE H H 76 7.560 7.969 -0.409 1
1 1052 . 6 1 1 A 76 76 ILE HA H 76 4.428 4.365 0.063 1
1 1062 . 6 1 1 A 76 76 ILE C C 76 174.529 174.885 -0.356 1
1 1063 . 6 1 1 A 76 76 ILE CA C 76 58.475 60.192 -1.717 1
1 1064 . 6 1 1 A 76 76 ILE CB C 76 40.337 39.029 1.308 1
1 1068 . 6 1 1 A 76 76 ILE N N 76 115.960 120.074 -4.114 1
1 1069 . 6 1 1 A 77 77 ASP H H 77 8.889 8.639 0.250 1
1 1070 . 6 1 1 A 77 77 ASP HA H 77 4.569 4.904 -0.335 1
1 1073 . 6 1 1 A 77 77 ASP C C 77 174.123 176.130 -2.007 1
1 1074 . 6 1 1 A 77 77 ASP CA C 77 54.069 54.322 -0.253 1
1 1075 . 6 1 1 A 77 77 ASP CB C 77 40.233 41.054 -0.821 1
1 1076 . 6 1 1 A 77 77 ASP N N 77 126.142 128.248 -2.106 1
1 1077 . 6 1 1 A 78 78 VAL H H 78 7.754 8.886 -1.132 1
1 1078 . 6 1 1 A 78 78 VAL HA H 78 5.192 5.033 0.159 1
1 1086 . 6 1 1 A 78 78 VAL C C 78 174.968 174.127 0.841 1
1 1087 . 6 1 1 A 78 78 VAL CA C 78 58.804 58.827 -0.023 1
1 1088 . 6 1 1 A 78 78 VAL CB C 78 35.293 35.047 0.246 1
1 1091 . 6 1 1 A 78 78 VAL N N 78 122.844 117.528 5.316 1
1 1092 . 6 1 1 A 79 79 ARG H H 79 8.499 8.933 -0.434 1
1 1093 . 6 1 1 A 79 79 ARG HA H 79 4.712 4.600 0.112 1
1 1100 . 6 1 1 A 79 79 ARG C C 79 174.221 175.228 -1.007 1
1 1101 . 6 1 1 A 79 79 ARG CA C 79 54.117 55.170 -1.053 1
1 1102 . 6 1 1 A 79 79 ARG CB C 79 31.196 30.311 0.885 1
1 1105 . 6 1 1 A 79 79 ARG N N 79 125.637 121.977 3.660 1
1 1106 . 6 1 1 A 80 80 THR H H 80 8.416 8.566 -0.150 1
1 1107 . 6 1 1 A 80 80 THR HA H 80 5.332 4.637 0.695 1
1 1112 . 6 1 1 A 80 80 THR C C 80 174.497 174.221 0.276 1
1 1113 . 6 1 1 A 80 80 THR CA C 80 59.694 61.072 -1.378 1
1 1114 . 6 1 1 A 80 80 THR CB C 80 69.772 69.792 -0.020 1
1 1116 . 6 1 1 A 80 80 THR N N 80 118.084 117.788 0.296 1
1 1117 . 6 1 1 A 81 81 ARG H H 81 8.758 9.025 -0.267 1
1 1118 . 6 1 1 A 81 81 ARG HA H 81 4.362 4.853 -0.491 1
1 1126 . 6 1 1 A 81 81 ARG C C 81 173.733 173.901 -0.168 1
1 1127 . 6 1 1 A 81 81 ARG CA C 81 53.273 53.653 -0.380 1
1 1128 . 6 1 1 A 81 81 ARG CB C 81 33.915 33.101 0.814 1
1 1131 . 6 1 1 A 81 81 ARG N N 81 122.844 124.482 -1.638 1
1 1133 . 6 1 1 A 82 82 LYS H H 82 8.721 8.617 0.104 1
1 1134 . 6 1 1 A 82 82 LYS HA H 82 4.701 5.154 -0.453 1
1 1143 . 6 1 1 A 82 82 LYS C C 82 175.667 175.616 0.051 1
1 1144 . 6 1 1 A 82 82 LYS CA C 82 54.960 54.904 0.056 1
1 1145 . 6 1 1 A 82 82 LYS CB C 82 32.603 34.482 -1.879 1
1 1149 . 6 1 1 A 82 82 LYS N N 82 124.668 123.503 1.165 1
1 1150 . 6 1 1 A 83 83 VAL H H 83 9.112 9.030 0.082 1
1 1151 . 6 1 1 A 83 83 VAL HA H 83 4.796 4.906 -0.110 1
1 1159 . 6 1 1 A 83 83 VAL C C 83 174.594 175.068 -0.474 1
1 1160 . 6 1 1 A 83 83 VAL CA C 83 59.413 59.886 -0.473 1
1 1161 . 6 1 1 A 83 83 VAL CB C 83 35.298 35.301 -0.003 1
1 1164 . 6 1 1 A 83 83 VAL N N 83 122.381 120.348 2.033 1
1 1165 . 6 1 1 A 84 84 THR H H 84 9.200 8.687 0.513 1
1 1166 . 6 1 1 A 84 84 THR HA H 84 4.579 4.636 -0.057 1
1 1171 . 6 1 1 A 84 84 THR C C 84 173.993 174.232 -0.239 1
1 1172 . 6 1 1 A 84 84 THR CA C 84 60.960 61.523 -0.563 1
1 1173 . 6 1 1 A 84 84 THR CB C 84 70.100 70.109 -0.009 1
1 1175 . 6 1 1 A 84 84 THR N N 84 113.183 115.443 -2.260 1
1 1176 . 6 1 1 A 85 85 SER H H 85 7.688 7.820 -0.132 1
1 1177 . 6 1 1 A 85 85 SER HA H 85 5.136 4.872 0.264 1
1 1180 . 6 1 1 A 85 85 SER CA C 85 55.205 55.374 -0.169 1
1 1181 . 6 1 1 A 85 85 SER CB C 85 64.376 64.499 -0.123 1
1 1182 . 6 1 1 A 85 85 SER N N 85 115.555 117.363 -1.808 1
1 1183 . 6 1 1 A 86 86 PRO HA H 86 4.090 4.310 -0.220 1
1 1190 . 6 1 1 A 86 86 PRO C C 86 177.227 177.880 -0.653 1
1 1191 . 6 1 1 A 86 86 PRO CA C 86 65.038 65.748 -0.710 1
1 1192 . 6 1 1 A 86 86 PRO CB C 86 31.711 31.736 -0.025 1
1 1195 . 6 1 1 A 87 87 ASP H H 87 8.131 8.554 -0.423 1
1 1196 . 6 1 1 A 87 87 ASP HA H 87 4.223 4.358 -0.135 1
1 1199 . 6 1 1 A 87 87 ASP C C 87 178.721 179.178 -0.457 1
1 1200 . 6 1 1 A 87 87 ASP CA C 87 57.311 56.735 0.576 1
1 1201 . 6 1 1 A 87 87 ASP CB C 87 40.102 40.089 0.013 1
1 1202 . 6 1 1 A 87 87 ASP N N 87 115.381 116.248 -0.867 1
1 1203 . 6 1 1 A 88 88 GLU H H 88 7.571 7.968 -0.397 1
1 1204 . 6 1 1 A 88 88 GLU HA H 88 3.659 4.059 -0.400 1
1 1209 . 6 1 1 A 88 88 GLU C C 88 177.097 178.705 -1.608 1
1 1210 . 6 1 1 A 88 88 GLU CA C 88 58.729 58.818 -0.089 1
1 1211 . 6 1 1 A 88 88 GLU CB C 88 30.052 29.742 0.310 1
1 1213 . 6 1 1 A 88 88 GLU N N 88 120.009 120.871 -0.862 1
1 1214 . 6 1 1 A 89 89 ALA H H 89 7.423 8.197 -0.774 1
1 1215 . 6 1 1 A 89 89 ALA HA H 89 3.900 4.327 -0.427 1
1 1219 . 6 1 1 A 89 89 ALA C C 89 178.267 180.040 -1.773 1
1 1220 . 6 1 1 A 89 89 ALA CA C 89 55.607 55.127 0.480 1
1 1221 . 6 1 1 A 89 89 ALA CB C 89 17.348 18.242 -0.894 1
1 1222 . 6 1 1 A 89 89 ALA N N 89 118.873 122.119 -3.246 1
1 1223 . 6 1 1 A 90 90 LYS H H 90 8.046 7.955 0.091 1
1 1224 . 6 1 1 A 90 90 LYS HA H 90 3.669 3.992 -0.323 1
1 1233 . 6 1 1 A 90 90 LYS C C 90 177.649 179.141 -1.492 1
1 1234 . 6 1 1 A 90 90 LYS CA C 90 60.351 59.889 0.462 1
1 1235 . 6 1 1 A 90 90 LYS CB C 90 32.087 32.374 -0.287 1
1 1239 . 6 1 1 A 90 90 LYS N N 90 114.834 117.320 -2.486 1
1 1240 . 6 1 1 A 91 91 ARG H H 91 7.468 7.626 -0.158 1
1 1241 . 6 1 1 A 91 91 ARG HA H 91 3.887 3.901 -0.014 1
1 1249 . 6 1 1 A 91 91 ARG C C 91 178.998 179.117 -0.119 1
1 1250 . 6 1 1 A 91 91 ARG CA C 91 59.164 59.180 -0.016 1
1 1251 . 6 1 1 A 91 91 ARG CB C 91 29.274 29.818 -0.544 1
1 1254 . 6 1 1 A 91 91 ARG N N 91 119.029 119.283 -0.254 1
1 1256 . 6 1 1 A 92 92 TRP H H 92 8.136 8.060 0.076 1
1 1257 . 6 1 1 A 92 92 TRP HA H 92 4.818 4.502 0.316 1
1 1266 . 6 1 1 A 92 92 TRP C C 92 179.566 179.091 0.475 1
1 1267 . 6 1 1 A 92 92 TRP CA C 92 58.663 59.447 -0.784 1
1 1268 . 6 1 1 A 92 92 TRP CB C 92 29.790 29.247 0.543 1
1 1274 . 6 1 1 A 92 92 TRP N N 92 118.100 120.209 -2.109 1
1 1276 . 6 1 1 A 93 93 ILE H H 93 8.363 8.524 -0.161 1
1 1277 . 6 1 1 A 93 93 ILE HA H 93 3.544 3.796 -0.252 1
1 1287 . 6 1 1 A 93 93 ILE C C 93 176.820 178.405 -1.585 1
1 1288 . 6 1 1 A 93 93 ILE CA C 93 66.225 65.453 0.772 1
1 1289 . 6 1 1 A 93 93 ILE CB C 93 37.571 37.824 -0.253 1
1 1293 . 6 1 1 A 93 93 ILE N N 93 120.588 120.501 0.087 1
1 1294 . 6 1 1 A 94 94 LYS H H 94 8.264 7.700 0.564 1
1 1295 . 6 1 1 A 94 94 LYS HA H 94 3.865 3.922 -0.057 1
1 1304 . 6 1 1 A 94 94 LYS C C 94 179.258 178.772 0.486 1
1 1305 . 6 1 1 A 94 94 LYS CA C 94 59.889 59.340 0.549 1
1 1306 . 6 1 1 A 94 94 LYS CB C 94 32.225 31.984 0.241 1
1 1310 . 6 1 1 A 94 94 LYS N N 94 121.687 120.869 0.818 1
1 1311 . 6 1 1 A 95 95 GLU H H 95 8.360 8.488 -0.128 1
1 1312 . 6 1 1 A 95 95 GLU HA H 95 4.023 4.036 -0.013 1
1 1317 . 6 1 1 A 95 95 GLU C C 95 178.884 179.279 -0.395 1
1 1318 . 6 1 1 A 95 95 GLU CA C 95 59.366 59.522 -0.156 1
1 1319 . 6 1 1 A 95 95 GLU CB C 95 29.508 29.533 -0.025 1
1 1321 . 6 1 1 A 95 95 GLU N N 95 118.505 118.483 0.022 1
1 1322 . 6 1 1 A 96 96 PHE H H 96 8.212 8.459 -0.247 1
1 1323 . 6 1 1 A 96 96 PHE HA H 96 4.512 4.189 0.323 1
1 1331 . 6 1 1 A 96 96 PHE C C 96 176.820 177.564 -0.744 1
1 1332 . 6 1 1 A 96 96 PHE CA C 96 59.608 61.270 -1.662 1
1 1333 . 6 1 1 A 96 96 PHE CB C 96 40.431 39.054 1.377 1
1 1339 . 6 1 1 A 96 96 PHE N N 96 120.369 122.243 -1.874 1
1 1340 . 6 1 1 A 97 97 SER H H 97 8.216 8.397 -0.181 1
1 1341 . 6 1 1 A 97 97 SER HA H 97 3.816 3.989 -0.173 1
1 1344 . 6 1 1 A 97 97 SER C C 97 175.618 177.010 -1.392 1
1 1345 . 6 1 1 A 97 97 SER CA C 97 60.492 61.295 -0.803 1
1 1346 . 6 1 1 A 97 97 SER CB C 97 63.022 63.147 -0.125 1
1 1347 . 6 1 1 A 97 97 SER N N 97 111.969 114.103 -2.134 1
1 1348 . 6 1 1 A 98 98 GLU H H 98 7.655 8.004 -0.349 1
1 1349 . 6 1 1 A 98 98 GLU HA H 98 4.187 4.072 0.115 1
1 1354 . 6 1 1 A 98 98 GLU C C 98 177.698 179.482 -1.784 1
1 1355 . 6 1 1 A 98 98 GLU CA C 98 57.069 59.130 -2.061 1
1 1356 . 6 1 1 A 98 98 GLU CB C 98 29.321 29.271 0.050 1
1 1358 . 6 1 1 A 98 98 GLU N N 98 120.588 121.740 -1.152 1
1 1359 . 6 1 1 A 99 99 GLU H H 99 7.794 7.664 0.130 1
1 1360 . 6 1 1 A 99 99 GLU HA H 99 4.123 4.009 0.114 1
1 1365 . 6 1 1 A 99 99 GLU C C 99 177.665 177.323 0.342 1
1 1366 . 6 1 1 A 99 99 GLU CA C 99 57.304 57.348 -0.044 1
1 1367 . 6 1 1 A 99 99 GLU CB C 99 29.368 29.566 -0.198 1
1 1369 . 6 1 1 A 99 99 GLU N N 99 120.067 119.021 1.046 1
1 1370 . 6 1 1 A 100 100 GLY H H 100 8.138 8.728 -0.590 1
1 1371 . 6 1 1 A 100 100 GLY HA2 H 100 3.865 3.875 -0.010 1
1 1372 . 6 1 1 A 100 100 GLY HA3 H 100 3.715 3.885 -0.170 1
1 1373 . 6 1 1 A 100 100 GLY C C 100 174.464 174.010 0.454 1
1 1374 . 6 1 1 A 100 100 GLY CA C 100 45.305 45.566 -0.261 1
1 1375 . 6 1 1 A 100 100 GLY N N 100 107.802 108.608 -0.806 1
1 1376 . 6 1 1 A 101 101 GLY H H 101 8.023 8.400 -0.377 1
1 1377 . 6 1 1 A 101 101 GLY HA2 H 101 3.865 4.062 -0.197 1
1 1378 . 6 1 1 A 101 101 GLY HA3 H 101 3.892 4.087 -0.195 1
1 1379 . 6 1 1 A 101 101 GLY C C 101 174.204 174.225 -0.021 1
1 1380 . 6 1 1 A 101 101 GLY CA C 101 45.036 45.015 0.021 1
1 1381 . 6 1 1 A 101 101 GLY N N 101 108.032 107.098 0.934 1
1 1382 . 6 1 1 A 102 102 SER H H 102 8.059 8.593 -0.534 1
1 1383 . 6 1 1 A 102 102 SER HA H 102 4.380 4.358 0.022 1
1 1386 . 6 1 1 A 102 102 SER C C 102 174.627 175.706 -1.079 1
1 1387 . 6 1 1 A 102 102 SER CA C 102 58.194 58.349 -0.155 1
1 1388 . 6 1 1 A 102 102 SER CB C 102 63.538 63.344 0.194 1
1 1389 . 6 1 1 A 102 102 SER N N 102 115.266 120.735 -5.469 1
1 1390 . 6 1 1 A 103 103 LEU H H 103 8.287 7.611 0.676 1
1 1391 . 6 1 1 A 103 103 LEU HA H 103 4.301 3.950 0.351 1
1 1401 . 6 1 1 A 103 103 LEU C C 103 177.292 177.237 0.055 1
1 1402 . 6 1 1 A 103 103 LEU CA C 103 55.007 57.978 -2.971 1
1 1403 . 6 1 1 A 103 103 LEU CB C 103 42.023 41.423 0.600 1
1 1407 . 6 1 1 A 103 103 LEU N N 103 123.596 122.392 1.204 1
1 1408 . 6 1 1 A 104 104 GLU H H 104 8.216 7.663 0.553 1
1 1409 . 6 1 1 A 104 104 GLU HA H 104 4.126 4.386 -0.260 1
1 1414 . 6 1 1 A 104 104 GLU CA C 104 56.518 55.249 1.269 1
1 1415 . 6 1 1 A 104 104 GLU CB C 104 29.837 29.102 0.735 1
1 1417 . 6 1 1 A 104 104 GLU N N 104 120.510 116.599 3.911 1
1 1418 . 6 1 1 A 105 105 HIS HA H 105 4.593 4.848 -0.255 1
1 1421 . 6 1 1 A 105 105 HIS C C 105 173.766 175.197 -1.431 1
1 1422 . 6 1 1 A 105 105 HIS CA C 105 55.536 56.806 -1.270 1
1 1423 . 6 1 1 A 105 105 HIS CB C 105 30.001 31.026 -1.025 1
1 1424 . 6 1 1 A 106 106 HIS H H 106 8.154 9.145 -0.991 1
1 1425 . 6 1 1 A 106 106 HIS HA H 106 4.407 5.155 -0.748 1
1 1428 . 6 1 1 A 106 106 HIS CA C 106 56.920 53.898 3.022 1
1 1429 . 6 1 1 A 106 106 HIS CB C 106 30.001 32.427 -2.426 1
1 14 . 7 1 1 A 2 2 LEU H H 2 8.509 9.197 -0.688 1
1 15 . 7 1 1 A 2 2 LEU HA H 2 4.463 4.535 -0.072 1
1 25 . 7 1 1 A 2 2 LEU C C 2 173.944 176.160 -2.216 1
1 26 . 7 1 1 A 2 2 LEU CA C 2 54.471 54.436 0.035 1
1 27 . 7 1 1 A 2 2 LEU CB C 2 43.595 42.501 1.094 1
1 31 . 7 1 1 A 2 2 LEU N N 2 127.160 127.624 -0.464 1
1 32 . 7 1 1 A 3 3 LEU H H 3 7.844 8.511 -0.667 1
1 33 . 7 1 1 A 3 3 LEU HA H 3 5.128 5.312 -0.184 1
1 43 . 7 1 1 A 3 3 LEU C C 3 175.423 174.903 0.520 1
1 44 . 7 1 1 A 3 3 LEU CA C 3 53.566 52.603 0.963 1
1 45 . 7 1 1 A 3 3 LEU CB C 3 44.039 43.580 0.459 1
1 49 . 7 1 1 A 3 3 LEU N N 3 122.555 124.281 -1.726 1
1 50 . 7 1 1 A 4 4 TYR H H 4 8.360 8.957 -0.597 1
1 51 . 7 1 1 A 4 4 TYR HA H 4 5.143 5.210 -0.067 1
1 58 . 7 1 1 A 4 4 TYR C C 4 174.481 175.008 -0.527 1
1 59 . 7 1 1 A 4 4 TYR CA C 4 56.577 55.980 0.597 1
1 60 . 7 1 1 A 4 4 TYR CB C 4 43.840 42.963 0.877 1
1 65 . 7 1 1 A 4 4 TYR N N 4 119.315 123.170 -3.855 1
1 66 . 7 1 1 A 5 5 VAL H H 5 8.918 8.884 0.034 1
1 67 . 7 1 1 A 5 5 VAL HA H 5 5.106 4.958 0.148 1
1 75 . 7 1 1 A 5 5 VAL C C 5 174.042 174.659 -0.617 1
1 76 . 7 1 1 A 5 5 VAL CA C 5 59.852 61.163 -1.311 1
1 77 . 7 1 1 A 5 5 VAL CB C 5 33.816 34.393 -0.577 1
1 80 . 7 1 1 A 5 5 VAL N N 5 119.952 120.353 -0.401 1
1 81 . 7 1 1 A 6 6 LEU H H 6 9.315 9.427 -0.112 1
1 82 . 7 1 1 A 6 6 LEU HA H 6 5.466 5.002 0.464 1
1 92 . 7 1 1 A 6 6 LEU C C 6 175.049 174.615 0.434 1
1 93 . 7 1 1 A 6 6 LEU CA C 6 52.090 53.598 -1.508 1
1 94 . 7 1 1 A 6 6 LEU CB C 6 44.103 42.974 1.129 1
1 98 . 7 1 1 A 6 6 LEU N N 6 126.917 127.503 -0.586 1
1 99 . 7 1 1 A 7 7 ILE H H 7 8.458 8.729 -0.271 1
1 100 . 7 1 1 A 7 7 ILE HA H 7 5.131 4.895 0.236 1
1 110 . 7 1 1 A 7 7 ILE C C 7 173.213 173.728 -0.515 1
1 111 . 7 1 1 A 7 7 ILE CA C 7 58.463 59.916 -1.453 1
1 112 . 7 1 1 A 7 7 ILE CB C 7 41.020 40.336 0.684 1
1 116 . 7 1 1 A 7 7 ILE N N 7 119.778 126.254 -6.476 1
1 117 . 7 1 1 A 8 8 ILE H H 8 8.797 9.287 -0.490 1
1 118 . 7 1 1 A 8 8 ILE HA H 8 4.611 4.801 -0.190 1
1 128 . 7 1 1 A 8 8 ILE C C 8 174.611 174.861 -0.250 1
1 129 . 7 1 1 A 8 8 ILE CA C 8 60.227 60.565 -0.338 1
1 130 . 7 1 1 A 8 8 ILE CB C 8 37.665 37.395 0.270 1
1 134 . 7 1 1 A 8 8 ILE N N 8 128.919 133.040 -4.121 1
1 135 . 7 1 1 A 9 9 SER H H 9 7.811 8.765 -0.954 1
1 136 . 7 1 1 A 9 9 SER HA H 9 4.429 4.984 -0.555 1
1 140 . 7 1 1 A 9 9 SER C C 9 172.937 173.622 -0.685 1
1 141 . 7 1 1 A 9 9 SER CA C 9 58.241 56.974 1.267 1
1 142 . 7 1 1 A 9 9 SER CB C 9 64.261 64.182 0.079 1
1 143 . 7 1 1 A 9 9 SER N N 9 116.365 121.996 -5.631 1
1 144 . 7 1 1 A 10 10 ASN H H 10 8.641 8.903 -0.262 1
1 145 . 7 1 1 A 10 10 ASN HA H 10 4.938 4.856 0.082 1
1 150 . 7 1 1 A 10 10 ASN C C 10 174.497 175.041 -0.544 1
1 151 . 7 1 1 A 10 10 ASN CA C 10 52.221 52.799 -0.578 1
1 152 . 7 1 1 A 10 10 ASN CB C 10 39.128 39.788 -0.660 1
1 153 . 7 1 1 A 10 10 ASN N N 10 122.612 122.219 0.393 1
1 155 . 7 1 1 A 11 11 ASP H H 11 8.673 7.347 1.326 1
1 156 . 7 1 1 A 11 11 ASP HA H 11 4.596 4.768 -0.172 1
1 159 . 7 1 1 A 11 11 ASP C C 11 175.342 176.115 -0.773 1
1 160 . 7 1 1 A 11 11 ASP CA C 11 53.233 53.913 -0.680 1
1 161 . 7 1 1 A 11 11 ASP CB C 11 40.965 40.375 0.590 1
1 162 . 7 1 1 A 11 11 ASP N N 11 122.717 120.080 2.637 1
1 163 . 7 1 1 A 12 12 LYS H H 12 8.562 8.602 -0.040 1
1 164 . 7 1 1 A 12 12 LYS HA H 12 3.854 3.970 -0.116 1
1 173 . 7 1 1 A 12 12 LYS C C 12 178.754 178.342 0.412 1
1 174 . 7 1 1 A 12 12 LYS CA C 12 59.581 60.294 -0.713 1
1 175 . 7 1 1 A 12 12 LYS CB C 12 32.378 32.546 -0.168 1
1 179 . 7 1 1 A 12 12 LYS N N 12 125.737 125.618 0.119 1
1 180 . 7 1 1 A 13 13 LYS H H 13 8.075 7.570 0.505 1
1 181 . 7 1 1 A 13 13 LYS HA H 13 4.154 4.075 0.079 1
1 190 . 7 1 1 A 13 13 LYS C C 13 178.315 179.162 -0.847 1
1 191 . 7 1 1 A 13 13 LYS CA C 13 58.532 59.195 -0.663 1
1 192 . 7 1 1 A 13 13 LYS CB C 13 31.452 32.460 -1.008 1
1 196 . 7 1 1 A 13 13 LYS N N 13 119.604 119.830 -0.226 1
1 197 . 7 1 1 A 14 14 LEU H H 14 7.552 7.700 -0.148 1
1 198 . 7 1 1 A 14 14 LEU HA H 14 3.682 4.056 -0.374 1
1 208 . 7 1 1 A 14 14 LEU C C 14 178.429 179.048 -0.619 1
1 209 . 7 1 1 A 14 14 LEU CA C 14 58.999 58.049 0.950 1
1 210 . 7 1 1 A 14 14 LEU CB C 14 41.228 41.513 -0.285 1
1 214 . 7 1 1 A 14 14 LEU N N 14 122.266 120.893 1.373 1
1 215 . 7 1 1 A 15 15 ILE H H 15 8.074 8.008 0.066 1
1 216 . 7 1 1 A 15 15 ILE HA H 15 3.264 3.549 -0.285 1
1 226 . 7 1 1 A 15 15 ILE C C 15 177.000 178.080 -1.080 1
1 227 . 7 1 1 A 15 15 ILE CA C 15 65.939 64.919 1.020 1
1 228 . 7 1 1 A 15 15 ILE CB C 15 37.983 37.097 0.886 1
1 232 . 7 1 1 A 15 15 ILE N N 15 118.214 119.733 -1.519 1
1 233 . 7 1 1 A 16 16 GLU H H 16 8.016 8.457 -0.441 1
1 234 . 7 1 1 A 16 16 GLU HA H 16 4.045 3.924 0.121 1
1 239 . 7 1 1 A 16 16 GLU C C 16 179.388 179.590 -0.202 1
1 240 . 7 1 1 A 16 16 GLU CA C 16 59.032 59.940 -0.908 1
1 241 . 7 1 1 A 16 16 GLU CB C 16 29.200 29.212 -0.012 1
1 243 . 7 1 1 A 16 16 GLU N N 16 118.484 120.987 -2.503 1
1 244 . 7 1 1 A 17 17 GLU H H 17 8.063 7.870 0.193 1
1 245 . 7 1 1 A 17 17 GLU HA H 17 4.053 4.011 0.042 1
1 250 . 7 1 1 A 17 17 GLU C C 17 179.306 179.198 0.108 1
1 251 . 7 1 1 A 17 17 GLU CA C 17 58.636 59.257 -0.621 1
1 252 . 7 1 1 A 17 17 GLU CB C 17 29.011 29.537 -0.526 1
1 254 . 7 1 1 A 17 17 GLU N N 17 118.100 120.470 -2.370 1
1 255 . 7 1 1 A 18 18 ALA H H 18 8.655 8.014 0.641 1
1 256 . 7 1 1 A 18 18 ALA HA H 18 3.775 4.048 -0.273 1
1 260 . 7 1 1 A 18 18 ALA C C 18 178.559 179.952 -1.393 1
1 261 . 7 1 1 A 18 18 ALA CA C 18 54.960 55.416 -0.456 1
1 262 . 7 1 1 A 18 18 ALA CB C 18 17.960 18.349 -0.389 1
1 263 . 7 1 1 A 18 18 ALA N N 18 122.439 122.578 -0.139 1
1 264 . 7 1 1 A 19 19 ARG H H 19 8.900 8.296 0.604 1
1 265 . 7 1 1 A 19 19 ARG HA H 19 3.809 4.068 -0.259 1
1 273 . 7 1 1 A 19 19 ARG C C 19 178.721 178.838 -0.117 1
1 274 . 7 1 1 A 19 19 ARG CA C 19 59.976 59.566 0.410 1
1 275 . 7 1 1 A 19 19 ARG CB C 19 29.572 29.868 -0.296 1
1 278 . 7 1 1 A 19 19 ARG N N 19 118.563 117.734 0.829 1
1 280 . 7 1 1 A 20 20 LYS H H 20 7.792 7.837 -0.045 1
1 281 . 7 1 1 A 20 20 LYS HA H 20 4.052 4.053 -0.001 1
1 290 . 7 1 1 A 20 20 LYS C C 20 179.648 179.612 0.036 1
1 291 . 7 1 1 A 20 20 LYS CA C 20 59.296 59.364 -0.068 1
1 292 . 7 1 1 A 20 20 LYS CB C 20 32.216 32.473 -0.257 1
1 296 . 7 1 1 A 20 20 LYS N N 20 118.638 119.246 -0.608 1
1 297 . 7 1 1 A 21 21 MET H H 21 7.684 8.375 -0.691 1
1 298 . 7 1 1 A 21 21 MET HA H 21 4.411 4.113 0.298 1
1 306 . 7 1 1 A 21 21 MET C C 21 177.909 178.077 -0.168 1
1 307 . 7 1 1 A 21 21 MET CA C 21 57.009 59.267 -2.258 1
1 308 . 7 1 1 A 21 21 MET CB C 21 32.028 31.979 0.049 1
1 311 . 7 1 1 A 21 21 MET N N 21 118.100 118.372 -0.272 1
1 312 . 7 1 1 A 22 22 ALA H H 22 8.815 8.410 0.405 1
1 313 . 7 1 1 A 22 22 ALA HA H 22 3.826 3.970 -0.144 1
1 317 . 7 1 1 A 22 22 ALA C C 22 178.835 179.891 -1.056 1
1 318 . 7 1 1 A 22 22 ALA CA C 22 55.427 55.493 -0.066 1
1 319 . 7 1 1 A 22 22 ALA CB C 22 18.059 18.348 -0.289 1
1 320 . 7 1 1 A 22 22 ALA N N 22 122.150 121.435 0.715 1
1 321 . 7 1 1 A 23 23 GLU H H 23 8.276 7.683 0.593 1
1 322 . 7 1 1 A 23 23 GLU HA H 23 4.146 3.959 0.187 1
1 327 . 7 1 1 A 23 23 GLU C C 23 180.151 179.199 0.952 1
1 328 . 7 1 1 A 23 23 GLU CA C 23 58.999 59.396 -0.397 1
1 329 . 7 1 1 A 23 23 GLU CB C 23 29.160 29.524 -0.364 1
1 331 . 7 1 1 A 23 23 GLU N N 23 117.001 117.874 -0.873 1
1 332 . 7 1 1 A 24 24 LYS H H 24 7.573 7.854 -0.281 1
1 333 . 7 1 1 A 24 24 LYS HA H 24 4.101 4.042 0.059 1
1 342 . 7 1 1 A 24 24 LYS C C 24 177.145 178.579 -1.434 1
1 343 . 7 1 1 A 24 24 LYS CA C 24 58.261 59.282 -1.021 1
1 344 . 7 1 1 A 24 24 LYS CB C 24 32.079 32.160 -0.081 1
1 348 . 7 1 1 A 24 24 LYS N N 24 119.960 119.475 0.485 1
1 349 . 7 1 1 A 25 25 ALA H H 25 7.710 7.845 -0.135 1
1 350 . 7 1 1 A 25 25 ALA HA H 25 4.413 4.395 0.018 1
1 354 . 7 1 1 A 25 25 ALA C C 25 175.325 176.484 -1.159 1
1 355 . 7 1 1 A 25 25 ALA CA C 25 51.208 51.898 -0.690 1
1 356 . 7 1 1 A 25 25 ALA CB C 25 18.520 19.372 -0.852 1
1 357 . 7 1 1 A 25 25 ALA N N 25 119.257 118.502 0.755 1
1 358 . 7 1 1 A 26 26 ASN H H 26 7.840 8.072 -0.232 1
1 359 . 7 1 1 A 26 26 ASN HA H 26 4.357 4.356 0.001 1
1 364 . 7 1 1 A 26 26 ASN C C 26 173.587 174.338 -0.751 1
1 365 . 7 1 1 A 26 26 ASN CA C 26 54.307 54.549 -0.242 1
1 366 . 7 1 1 A 26 26 ASN CB C 26 36.972 37.189 -0.217 1
1 367 . 7 1 1 A 26 26 ASN N N 26 115.266 113.502 1.764 1
1 369 . 7 1 1 A 27 27 LEU H H 27 8.241 8.031 0.210 1
1 370 . 7 1 1 A 27 27 LEU HA H 27 4.652 4.366 0.286 1
1 380 . 7 1 1 A 27 27 LEU C C 27 175.894 176.217 -0.323 1
1 381 . 7 1 1 A 27 27 LEU CA C 27 52.923 54.159 -1.236 1
1 382 . 7 1 1 A 27 27 LEU CB C 27 44.090 42.980 1.110 1
1 386 . 7 1 1 A 27 27 LEU N N 27 116.828 119.352 -2.524 1
1 387 . 7 1 1 A 28 28 GLU H H 28 7.798 8.092 -0.294 1
1 388 . 7 1 1 A 28 28 GLU HA H 28 4.310 4.928 -0.618 1
1 393 . 7 1 1 A 28 28 GLU C C 28 173.944 174.919 -0.975 1
1 394 . 7 1 1 A 28 28 GLU CA C 28 55.460 55.532 -0.072 1
1 395 . 7 1 1 A 28 28 GLU CB C 28 30.512 31.160 -0.648 1
1 397 . 7 1 1 A 28 28 GLU N N 28 121.340 122.841 -1.501 1
1 398 . 7 1 1 A 29 29 LEU H H 29 8.451 8.982 -0.531 1
1 399 . 7 1 1 A 29 29 LEU HA H 29 5.662 5.412 0.250 1
1 409 . 7 1 1 A 29 29 LEU C C 29 176.902 174.736 2.166 1
1 410 . 7 1 1 A 29 29 LEU CA C 29 53.186 53.507 -0.321 1
1 411 . 7 1 1 A 29 29 LEU CB C 29 44.914 45.420 -0.506 1
1 415 . 7 1 1 A 29 29 LEU N N 29 126.547 129.332 -2.785 1
1 416 . 7 1 1 A 30 30 ARG H H 30 9.094 9.262 -0.168 1
1 417 . 7 1 1 A 30 30 ARG HA H 30 4.910 4.939 -0.029 1
1 425 . 7 1 1 A 30 30 ARG C C 30 175.147 175.553 -0.406 1
1 426 . 7 1 1 A 30 30 ARG CA C 30 53.417 54.419 -1.002 1
1 427 . 7 1 1 A 30 30 ARG CB C 30 32.555 32.419 0.136 1
1 430 . 7 1 1 A 30 30 ARG N N 30 125.043 126.297 -1.254 1
1 432 . 7 1 1 A 31 31 THR H H 31 8.496 8.600 -0.104 1
1 433 . 7 1 1 A 31 31 THR HA H 31 4.888 4.664 0.224 1
1 438 . 7 1 1 A 31 31 THR C C 31 173.961 174.163 -0.202 1
1 439 . 7 1 1 A 31 31 THR CA C 31 60.445 61.198 -0.753 1
1 440 . 7 1 1 A 31 31 THR CB C 31 69.492 69.783 -0.291 1
1 442 . 7 1 1 A 31 31 THR N N 31 114.745 116.459 -1.714 1
1 443 . 7 1 1 A 32 32 VAL H H 32 8.480 9.134 -0.654 1
1 444 . 7 1 1 A 32 32 VAL HA H 32 4.411 4.685 -0.274 1
1 452 . 7 1 1 A 32 32 VAL C C 32 175.082 175.531 -0.449 1
1 453 . 7 1 1 A 32 32 VAL CA C 32 60.946 61.130 -0.184 1
1 454 . 7 1 1 A 32 32 VAL CB C 32 34.487 33.902 0.585 1
1 457 . 7 1 1 A 32 32 VAL N N 32 122.324 126.010 -3.686 1
1 458 . 7 1 1 A 33 33 LYS H H 33 9.304 8.883 0.421 1
1 459 . 7 1 1 A 33 33 LYS HA H 33 4.534 4.599 -0.065 1
1 468 . 7 1 1 A 33 33 LYS C C 33 176.740 176.276 0.464 1
1 469 . 7 1 1 A 33 33 LYS CA C 33 56.846 56.929 -0.083 1
1 470 . 7 1 1 A 33 33 LYS CB C 33 34.355 34.984 -0.629 1
1 474 . 7 1 1 A 33 33 LYS N N 33 123.654 125.686 -2.032 1
1 475 . 7 1 1 A 34 34 THR H H 34 7.245 7.677 -0.432 1
1 476 . 7 1 1 A 34 34 THR HA H 34 4.780 4.723 0.057 1
1 481 . 7 1 1 A 34 34 THR C C 34 174.529 175.392 -0.863 1
1 482 . 7 1 1 A 34 34 THR CA C 34 58.859 59.181 -0.322 1
1 483 . 7 1 1 A 34 34 THR CB C 34 73.023 71.929 1.094 1
1 485 . 7 1 1 A 34 34 THR N N 34 106.300 111.601 -5.301 1
1 486 . 7 1 1 A 35 35 GLU H H 35 9.174 9.112 0.062 1
1 487 . 7 1 1 A 35 35 GLU HA H 35 3.886 3.983 -0.097 1
1 492 . 7 1 1 A 35 35 GLU C C 35 177.714 177.601 0.113 1
1 493 . 7 1 1 A 35 35 GLU CA C 35 59.233 59.582 -0.349 1
1 494 . 7 1 1 A 35 35 GLU CB C 35 29.377 29.416 -0.039 1
1 496 . 7 1 1 A 35 35 GLU N N 35 121.919 121.958 -0.039 1
1 497 . 7 1 1 A 36 36 ASP H H 36 8.185 8.475 -0.290 1
1 498 . 7 1 1 A 36 36 ASP HA H 36 4.289 4.318 -0.029 1
1 501 . 7 1 1 A 36 36 ASP C C 36 178.348 178.555 -0.207 1
1 502 . 7 1 1 A 36 36 ASP CA C 36 56.962 57.830 -0.868 1
1 503 . 7 1 1 A 36 36 ASP CB C 36 40.214 42.292 -2.078 1
1 504 . 7 1 1 A 36 36 ASP N N 36 118.332 119.832 -1.500 1
1 505 . 7 1 1 A 37 37 GLU H H 37 7.741 7.649 0.092 1
1 506 . 7 1 1 A 37 37 GLU HA H 37 3.708 3.891 -0.183 1
1 511 . 7 1 1 A 37 37 GLU C C 37 177.324 178.909 -1.585 1
1 512 . 7 1 1 A 37 37 GLU CA C 37 58.698 59.157 -0.459 1
1 513 . 7 1 1 A 37 37 GLU CB C 37 30.199 29.480 0.719 1
1 515 . 7 1 1 A 37 37 GLU N N 37 120.704 118.965 1.739 1
1 516 . 7 1 1 A 38 38 LEU H H 38 7.531 8.067 -0.536 1
1 517 . 7 1 1 A 38 38 LEU HA H 38 3.873 4.238 -0.365 1
1 527 . 7 1 1 A 38 38 LEU C C 38 177.357 178.620 -1.263 1
1 528 . 7 1 1 A 38 38 LEU CA C 38 58.305 58.493 -0.188 1
1 529 . 7 1 1 A 38 38 LEU CB C 38 40.837 41.568 -0.731 1
1 533 . 7 1 1 A 38 38 LEU N N 38 119.200 122.090 -2.890 1
1 534 . 7 1 1 A 39 39 LYS H H 39 8.083 7.895 0.188 1
1 535 . 7 1 1 A 39 39 LYS HA H 39 3.608 3.929 -0.321 1
1 544 . 7 1 1 A 39 39 LYS C C 39 177.373 178.904 -1.531 1
1 545 . 7 1 1 A 39 39 LYS CA C 39 60.290 59.653 0.637 1
1 546 . 7 1 1 A 39 39 LYS CB C 39 32.178 32.322 -0.144 1
1 550 . 7 1 1 A 39 39 LYS N N 39 116.943 118.968 -2.025 1
1 551 . 7 1 1 A 40 40 LYS H H 40 7.632 7.910 -0.278 1
1 552 . 7 1 1 A 40 40 LYS HA H 40 3.864 3.933 -0.069 1
1 561 . 7 1 1 A 40 40 LYS C C 40 179.566 178.642 0.924 1
1 562 . 7 1 1 A 40 40 LYS CA C 40 58.993 58.863 0.130 1
1 563 . 7 1 1 A 40 40 LYS CB C 40 31.758 31.761 -0.003 1
1 567 . 7 1 1 A 40 40 LYS N N 40 118.274 118.857 -0.583 1
1 568 . 7 1 1 A 41 41 TYR H H 41 7.823 8.008 -0.185 1
1 569 . 7 1 1 A 41 41 TYR HA H 41 3.926 3.982 -0.056 1
1 576 . 7 1 1 A 41 41 TYR C C 41 176.625 177.800 -1.175 1
1 577 . 7 1 1 A 41 41 TYR CA C 41 59.757 60.817 -1.060 1
1 578 . 7 1 1 A 41 41 TYR CB C 41 36.901 38.326 -1.425 1
1 583 . 7 1 1 A 41 41 TYR N N 41 117.811 118.948 -1.137 1
1 584 . 7 1 1 A 42 42 LEU H H 42 7.964 8.283 -0.319 1
1 585 . 7 1 1 A 42 42 LEU HA H 42 3.704 4.042 -0.338 1
1 595 . 7 1 1 A 42 42 LEU C C 42 178.396 179.165 -0.769 1
1 596 . 7 1 1 A 42 42 LEU CA C 42 58.237 57.527 0.710 1
1 597 . 7 1 1 A 42 42 LEU CB C 42 40.507 40.862 -0.355 1
1 601 . 7 1 1 A 42 42 LEU N N 42 115.960 120.080 -4.120 1
1 602 . 7 1 1 A 43 43 GLU H H 43 8.193 8.216 -0.023 1
1 603 . 7 1 1 A 43 43 GLU HA H 43 3.882 3.882 0.000 1
1 608 . 7 1 1 A 43 43 GLU C C 43 179.193 178.828 0.365 1
1 609 . 7 1 1 A 43 43 GLU CA C 43 59.122 59.773 -0.651 1
1 610 . 7 1 1 A 43 43 GLU CB C 43 29.244 29.076 0.168 1
1 612 . 7 1 1 A 43 43 GLU N N 43 117.175 119.945 -2.770 1
1 613 . 7 1 1 A 44 44 GLU H H 44 7.601 7.907 -0.306 1
1 614 . 7 1 1 A 44 44 GLU HA H 44 3.936 4.010 -0.074 1
1 619 . 7 1 1 A 44 44 GLU C C 44 179.875 178.948 0.927 1
1 620 . 7 1 1 A 44 44 GLU CA C 44 58.867 59.095 -0.228 1
1 621 . 7 1 1 A 44 44 GLU CB C 44 28.648 28.973 -0.325 1
1 623 . 7 1 1 A 44 44 GLU N N 44 120.472 119.538 0.934 1
1 624 . 7 1 1 A 45 45 PHE H H 45 8.260 7.465 0.795 1
1 625 . 7 1 1 A 45 45 PHE HA H 45 4.520 4.363 0.157 1
1 633 . 7 1 1 A 45 45 PHE C C 45 177.942 178.456 -0.514 1
1 634 . 7 1 1 A 45 45 PHE CA C 45 55.945 61.571 -5.626 1
1 635 . 7 1 1 A 45 45 PHE CB C 45 36.680 38.074 -1.394 1
1 641 . 7 1 1 A 45 45 PHE N N 45 119.272 118.861 0.411 1
1 642 . 7 1 1 A 46 46 ARG H H 46 8.023 8.143 -0.120 1
1 643 . 7 1 1 A 46 46 ARG HA H 46 4.074 3.936 0.138 1
1 651 . 7 1 1 A 46 46 ARG C C 46 177.617 178.784 -1.167 1
1 652 . 7 1 1 A 46 46 ARG CA C 46 58.194 59.616 -1.422 1
1 653 . 7 1 1 A 46 46 ARG CB C 46 29.737 29.968 -0.231 1
1 656 . 7 1 1 A 46 46 ARG N N 46 118.136 121.229 -3.093 1
1 658 . 7 1 1 A 47 47 LYS H H 47 7.470 8.079 -0.609 1
1 659 . 7 1 1 A 47 47 LYS HA H 47 4.143 4.012 0.131 1
1 668 . 7 1 1 A 47 47 LYS C C 47 177.324 178.793 -1.469 1
1 669 . 7 1 1 A 47 47 LYS CA C 47 57.726 59.561 -1.835 1
1 670 . 7 1 1 A 47 47 LYS CB C 47 32.409 32.168 0.241 1
1 674 . 7 1 1 A 47 47 LYS N N 47 116.943 119.693 -2.750 1
1 675 . 7 1 1 A 48 48 GLU H H 48 7.615 8.288 -0.673 1
1 676 . 7 1 1 A 48 48 GLU HA H 48 4.428 4.619 -0.191 1
1 681 . 7 1 1 A 48 48 GLU C C 48 176.869 176.652 0.217 1
1 682 . 7 1 1 A 48 48 GLU CA C 48 55.945 56.348 -0.403 1
1 683 . 7 1 1 A 48 48 GLU CB C 48 29.696 30.282 -0.586 1
1 685 . 7 1 1 A 48 48 GLU N N 48 118.852 118.298 0.554 1
1 686 . 7 1 1 A 49 49 SER H H 49 7.725 7.875 -0.150 1
1 687 . 7 1 1 A 49 49 SER HA H 49 4.244 4.179 0.065 1
1 690 . 7 1 1 A 49 49 SER C C 49 174.838 176.859 -2.021 1
1 691 . 7 1 1 A 49 49 SER CA C 49 59.366 60.898 -1.532 1
1 692 . 7 1 1 A 49 49 SER CB C 49 63.116 63.130 -0.014 1
1 693 . 7 1 1 A 49 49 SER N N 49 114.224 116.903 -2.679 1
1 694 . 7 1 1 A 50 50 GLN H H 50 8.548 8.110 0.438 1
1 695 . 7 1 1 A 50 50 GLN HA H 50 4.398 4.108 0.290 1
1 702 . 7 1 1 A 50 50 GLN C C 50 175.732 176.921 -1.189 1
1 703 . 7 1 1 A 50 50 GLN CA C 50 56.272 59.092 -2.820 1
1 704 . 7 1 1 A 50 50 GLN CB C 50 28.946 28.700 0.246 1
1 706 . 7 1 1 A 50 50 GLN N N 50 120.125 120.306 -0.181 1
1 708 . 7 1 1 A 51 51 ASN H H 51 8.534 8.063 0.471 1
1 709 . 7 1 1 A 51 51 ASN HA H 51 4.980 4.991 -0.011 1
1 714 . 7 1 1 A 51 51 ASN C C 51 173.717 174.354 -0.637 1
1 715 . 7 1 1 A 51 51 ASN CA C 51 52.804 52.839 -0.035 1
1 716 . 7 1 1 A 51 51 ASN CB C 51 39.583 40.216 -0.633 1
1 717 . 7 1 1 A 51 51 ASN N N 51 118.158 113.956 4.202 1
1 719 . 7 1 1 A 52 52 ILE H H 52 7.492 7.275 0.217 1
1 720 . 7 1 1 A 52 52 ILE HA H 52 5.338 4.907 0.431 1
1 730 . 7 1 1 A 52 52 ILE C C 52 175.049 174.516 0.533 1
1 731 . 7 1 1 A 52 52 ILE CA C 52 59.364 60.459 -1.095 1
1 732 . 7 1 1 A 52 52 ILE CB C 52 42.163 40.592 1.571 1
1 736 . 7 1 1 A 52 52 ILE N N 52 117.927 122.095 -4.168 1
1 737 . 7 1 1 A 53 53 LYS H H 53 8.467 9.136 -0.669 1
1 738 . 7 1 1 A 53 53 LYS HA H 53 5.044 5.161 -0.117 1
1 747 . 7 1 1 A 53 53 LYS C C 53 175.082 175.309 -0.227 1
1 748 . 7 1 1 A 53 53 LYS CA C 53 55.429 54.950 0.479 1
1 749 . 7 1 1 A 53 53 LYS CB C 53 36.446 35.559 0.887 1
1 753 . 7 1 1 A 53 53 LYS N N 53 123.249 127.571 -4.322 1
1 754 . 7 1 1 A 54 54 VAL H H 54 8.490 9.087 -0.597 1
1 755 . 7 1 1 A 54 54 VAL HA H 54 5.159 4.655 0.504 1
1 763 . 7 1 1 A 54 54 VAL C C 54 173.473 173.803 -0.330 1
1 764 . 7 1 1 A 54 54 VAL CA C 54 60.163 61.267 -1.104 1
1 765 . 7 1 1 A 54 54 VAL CB C 54 35.509 32.983 2.526 1
1 768 . 7 1 1 A 54 54 VAL N N 54 120.762 125.430 -4.668 1
1 769 . 7 1 1 A 55 55 LEU H H 55 8.636 8.794 -0.158 1
1 770 . 7 1 1 A 55 55 LEU HA H 55 4.670 4.425 0.245 1
1 780 . 7 1 1 A 55 55 LEU C C 55 173.652 174.315 -0.663 1
1 781 . 7 1 1 A 55 55 LEU CA C 55 52.289 53.238 -0.949 1
1 782 . 7 1 1 A 55 55 LEU CB C 55 42.070 42.485 -0.415 1
1 786 . 7 1 1 A 55 55 LEU N N 55 131.898 129.391 2.507 1
1 787 . 7 1 1 A 56 56 ILE H H 56 9.188 9.066 0.122 1
1 788 . 7 1 1 A 56 56 ILE HA H 56 4.879 5.082 -0.203 1
1 798 . 7 1 1 A 56 56 ILE C C 56 174.172 174.344 -0.172 1
1 799 . 7 1 1 A 56 56 ILE CA C 56 59.976 59.699 0.277 1
1 800 . 7 1 1 A 56 56 ILE CB C 56 38.181 39.331 -1.150 1
1 804 . 7 1 1 A 56 56 ILE N N 56 126.373 128.747 -2.374 1
1 805 . 7 1 1 A 57 57 LEU H H 57 8.929 9.185 -0.256 1
1 806 . 7 1 1 A 57 57 LEU HA H 57 5.394 5.105 0.289 1
1 816 . 7 1 1 A 57 57 LEU C C 57 175.358 175.887 -0.529 1
1 817 . 7 1 1 A 57 57 LEU CA C 57 52.086 53.459 -1.373 1
1 818 . 7 1 1 A 57 57 LEU CB C 57 42.445 43.175 -0.730 1
1 822 . 7 1 1 A 57 57 LEU N N 57 126.547 128.381 -1.834 1
1 823 . 7 1 1 A 58 58 VAL H H 58 8.542 8.848 -0.306 1
1 824 . 7 1 1 A 58 58 VAL HA H 58 5.253 4.830 0.423 1
1 832 . 7 1 1 A 58 58 VAL C C 58 175.244 176.204 -0.960 1
1 833 . 7 1 1 A 58 58 VAL CA C 58 58.241 59.205 -0.964 1
1 834 . 7 1 1 A 58 58 VAL CB C 58 33.165 34.779 -1.614 1
1 837 . 7 1 1 A 58 58 VAL N N 58 114.398 122.816 -8.418 1
1 838 . 7 1 1 A 59 59 SER H H 59 8.797 8.908 -0.111 1
1 839 . 7 1 1 A 59 59 SER HA H 59 5.063 4.541 0.522 1
1 842 . 7 1 1 A 59 59 SER C C 59 174.172 173.407 0.765 1
1 843 . 7 1 1 A 59 59 SER CA C 59 59.320 61.207 -1.887 1
1 844 . 7 1 1 A 59 59 SER CB C 59 65.600 63.213 2.387 1
1 845 . 7 1 1 A 59 59 SER N N 59 115.497 116.466 -0.969 1
1 846 . 7 1 1 A 60 60 ASN H H 60 7.730 8.089 -0.359 1
1 847 . 7 1 1 A 60 60 ASN HA H 60 4.811 5.133 -0.322 1
1 852 . 7 1 1 A 60 60 ASN C C 60 174.464 175.277 -0.813 1
1 853 . 7 1 1 A 60 60 ASN CA C 60 52.007 51.932 0.075 1
1 854 . 7 1 1 A 60 60 ASN CB C 60 40.336 40.669 -0.333 1
1 855 . 7 1 1 A 60 60 ASN N N 60 117.522 116.694 0.828 1
1 857 . 7 1 1 A 61 61 ASP H H 61 8.577 8.921 -0.344 1
1 858 . 7 1 1 A 61 61 ASP HA H 61 4.365 4.259 0.106 1
1 861 . 7 1 1 A 61 61 ASP C C 61 177.357 178.267 -0.910 1
1 862 . 7 1 1 A 61 61 ASP CA C 61 57.351 57.312 0.039 1
1 863 . 7 1 1 A 61 61 ASP CB C 61 40.383 40.422 -0.039 1
1 864 . 7 1 1 A 61 61 ASP N N 61 119.431 121.646 -2.215 1
1 865 . 7 1 1 A 62 62 GLU H H 62 8.405 8.437 -0.032 1
1 866 . 7 1 1 A 62 62 GLU HA H 62 4.121 3.989 0.132 1
1 871 . 7 1 1 A 62 62 GLU C C 62 179.615 179.106 0.509 1
1 872 . 7 1 1 A 62 62 GLU CA C 62 59.593 59.814 -0.221 1
1 873 . 7 1 1 A 62 62 GLU CB C 62 28.478 29.230 -0.752 1
1 875 . 7 1 1 A 62 62 GLU N N 62 122.150 119.436 2.714 1
1 876 . 7 1 1 A 63 63 GLU H H 63 8.384 8.129 0.255 1
1 877 . 7 1 1 A 63 63 GLU HA H 63 3.913 4.031 -0.118 1
1 882 . 7 1 1 A 63 63 GLU C C 63 178.478 179.050 -0.572 1
1 883 . 7 1 1 A 63 63 GLU CA C 63 58.273 59.063 -0.790 1
1 884 . 7 1 1 A 63 63 GLU CB C 63 29.931 29.571 0.360 1
1 886 . 7 1 1 A 63 63 GLU N N 63 119.084 119.329 -0.245 1
1 887 . 7 1 1 A 64 64 LEU H H 64 7.717 8.143 -0.426 1
1 888 . 7 1 1 A 64 64 LEU HA H 64 3.750 4.053 -0.303 1
1 898 . 7 1 1 A 64 64 LEU C C 64 177.535 178.132 -0.597 1
1 899 . 7 1 1 A 64 64 LEU CA C 64 58.944 58.200 0.744 1
1 900 . 7 1 1 A 64 64 LEU CB C 64 41.695 41.308 0.387 1
1 904 . 7 1 1 A 64 64 LEU N N 64 120.357 122.063 -1.706 1
1 905 . 7 1 1 A 65 65 ASP H H 65 7.922 8.243 -0.321 1
1 906 . 7 1 1 A 65 65 ASP HA H 65 4.313 4.317 -0.004 1
1 909 . 7 1 1 A 65 65 ASP C C 65 179.095 179.147 -0.052 1
1 910 . 7 1 1 A 65 65 ASP CA C 65 57.272 57.230 0.042 1
1 911 . 7 1 1 A 65 65 ASP CB C 65 40.196 40.372 -0.176 1
1 912 . 7 1 1 A 65 65 ASP N N 65 118.100 117.875 0.225 1
1 913 . 7 1 1 A 66 66 LYS H H 66 7.802 7.946 -0.144 1
1 914 . 7 1 1 A 66 66 LYS HA H 66 4.078 3.969 0.109 1
1 923 . 7 1 1 A 66 66 LYS C C 66 178.624 179.032 -0.408 1
1 924 . 7 1 1 A 66 66 LYS CA C 66 58.429 59.171 -0.742 1
1 925 . 7 1 1 A 66 66 LYS CB C 66 31.727 32.228 -0.501 1
1 929 . 7 1 1 A 66 66 LYS N N 66 119.343 119.132 0.211 1
1 930 . 7 1 1 A 67 67 ALA H H 67 8.480 8.269 0.211 1
1 931 . 7 1 1 A 67 67 ALA HA H 67 3.853 4.062 -0.209 1
1 935 . 7 1 1 A 67 67 ALA C C 67 178.591 179.475 -0.884 1
1 936 . 7 1 1 A 67 67 ALA CA C 67 55.403 55.462 -0.059 1
1 937 . 7 1 1 A 67 67 ALA CB C 67 17.793 18.710 -0.917 1
1 938 . 7 1 1 A 67 67 ALA N N 67 121.562 121.963 -0.401 1
1 939 . 7 1 1 A 68 68 LYS H H 68 8.186 7.842 0.344 1
1 940 . 7 1 1 A 68 68 LYS HA H 68 3.805 4.003 -0.198 1
1 949 . 7 1 1 A 68 68 LYS C C 68 179.095 178.759 0.336 1
1 950 . 7 1 1 A 68 68 LYS CA C 68 59.952 59.272 0.680 1
1 951 . 7 1 1 A 68 68 LYS CB C 68 32.181 31.906 0.275 1
1 955 . 7 1 1 A 68 68 LYS N N 68 116.165 117.093 -0.928 1
1 956 . 7 1 1 A 69 69 GLU H H 69 7.904 8.177 -0.273 1
1 957 . 7 1 1 A 69 69 GLU HA H 69 3.995 4.054 -0.059 1
1 962 . 7 1 1 A 69 69 GLU C C 69 179.079 178.930 0.149 1
1 963 . 7 1 1 A 69 69 GLU CA C 69 59.022 59.161 -0.139 1
1 964 . 7 1 1 A 69 69 GLU CB C 69 29.274 29.516 -0.242 1
1 966 . 7 1 1 A 69 69 GLU N N 69 119.489 119.496 -0.007 1
1 967 . 7 1 1 A 70 70 LEU H H 70 7.962 8.025 -0.063 1
1 968 . 7 1 1 A 70 70 LEU HA H 70 4.020 4.008 0.012 1
1 978 . 7 1 1 A 70 70 LEU C C 70 178.738 179.025 -0.287 1
1 979 . 7 1 1 A 70 70 LEU CA C 70 57.486 57.906 -0.420 1
1 980 . 7 1 1 A 70 70 LEU CB C 70 41.695 41.478 0.217 1
1 984 . 7 1 1 A 70 70 LEU N N 70 119.431 120.348 -0.917 1
1 985 . 7 1 1 A 71 71 ALA H H 71 8.260 8.099 0.161 1
1 986 . 7 1 1 A 71 71 ALA HA H 71 3.845 4.057 -0.212 1
1 990 . 7 1 1 A 71 71 ALA C C 71 179.518 180.124 -0.606 1
1 991 . 7 1 1 A 71 71 ALA CA C 71 55.139 55.576 -0.437 1
1 992 . 7 1 1 A 71 71 ALA CB C 71 18.487 18.457 0.030 1
1 993 . 7 1 1 A 71 71 ALA N N 71 119.604 121.798 -2.194 1
1 994 . 7 1 1 A 72 72 GLN H H 72 7.910 8.007 -0.097 1
1 995 . 7 1 1 A 72 72 GLN HA H 72 4.154 4.061 0.093 1
1 1002 . 7 1 1 A 72 72 GLN C C 72 178.900 178.396 0.504 1
1 1003 . 7 1 1 A 72 72 GLN CA C 72 58.194 58.348 -0.154 1
1 1004 . 7 1 1 A 72 72 GLN CB C 72 28.056 28.280 -0.224 1
1 1006 . 7 1 1 A 72 72 GLN N N 72 115.960 117.452 -1.492 1
1 1008 . 7 1 1 A 73 73 LYS H H 73 7.841 8.268 -0.427 1
1 1009 . 7 1 1 A 73 73 LYS HA H 73 4.171 4.205 -0.034 1
1 1018 . 7 1 1 A 73 73 LYS C C 73 177.730 177.775 -0.045 1
1 1019 . 7 1 1 A 73 73 LYS CA C 73 57.867 58.228 -0.361 1
1 1020 . 7 1 1 A 73 73 LYS CB C 73 32.277 32.547 -0.270 1
1 1024 . 7 1 1 A 73 73 LYS N N 73 119.027 118.398 0.629 1
1 1025 . 7 1 1 A 74 74 MET H H 74 7.746 7.763 -0.017 1
1 1026 . 7 1 1 A 74 74 MET HA H 74 4.403 4.619 -0.216 1
1 1034 . 7 1 1 A 74 74 MET C C 74 174.416 175.101 -0.685 1
1 1035 . 7 1 1 A 74 74 MET CA C 74 55.194 54.828 0.366 1
1 1036 . 7 1 1 A 74 74 MET CB C 74 33.366 33.335 0.031 1
1 1039 . 7 1 1 A 74 74 MET N N 74 115.786 116.006 -0.220 1
1 1040 . 7 1 1 A 75 75 GLU H H 75 8.076 8.012 0.064 1
1 1041 . 7 1 1 A 75 75 GLU HA H 75 4.001 3.871 0.130 1
1 1046 . 7 1 1 A 75 75 GLU C C 75 175.130 174.932 0.198 1
1 1047 . 7 1 1 A 75 75 GLU CA C 75 56.722 57.452 -0.730 1
1 1048 . 7 1 1 A 75 75 GLU CB C 75 27.118 27.567 -0.449 1
1 1050 . 7 1 1 A 75 75 GLU N N 75 116.249 116.534 -0.285 1
1 1051 . 7 1 1 A 76 76 ILE H H 76 7.560 7.668 -0.108 1
1 1052 . 7 1 1 A 76 76 ILE HA H 76 4.428 4.686 -0.258 1
1 1062 . 7 1 1 A 76 76 ILE C C 76 174.529 174.659 -0.130 1
1 1063 . 7 1 1 A 76 76 ILE CA C 76 58.475 59.484 -1.009 1
1 1064 . 7 1 1 A 76 76 ILE CB C 76 40.337 41.718 -1.381 1
1 1068 . 7 1 1 A 76 76 ILE N N 76 115.960 118.915 -2.955 1
1 1069 . 7 1 1 A 77 77 ASP H H 77 8.889 8.514 0.375 1
1 1070 . 7 1 1 A 77 77 ASP HA H 77 4.569 5.004 -0.435 1
1 1073 . 7 1 1 A 77 77 ASP C C 77 174.123 176.042 -1.919 1
1 1074 . 7 1 1 A 77 77 ASP CA C 77 54.069 54.325 -0.256 1
1 1075 . 7 1 1 A 77 77 ASP CB C 77 40.233 41.474 -1.241 1
1 1076 . 7 1 1 A 77 77 ASP N N 77 126.142 125.869 0.273 1
1 1077 . 7 1 1 A 78 78 VAL H H 78 7.754 8.930 -1.176 1
1 1078 . 7 1 1 A 78 78 VAL HA H 78 5.192 5.343 -0.151 1
1 1086 . 7 1 1 A 78 78 VAL C C 78 174.968 173.801 1.167 1
1 1087 . 7 1 1 A 78 78 VAL CA C 78 58.804 58.707 0.097 1
1 1088 . 7 1 1 A 78 78 VAL CB C 78 35.293 36.033 -0.740 1
1 1091 . 7 1 1 A 78 78 VAL N N 78 122.844 117.395 5.449 1
1 1092 . 7 1 1 A 79 79 ARG H H 79 8.499 8.980 -0.481 1
1 1093 . 7 1 1 A 79 79 ARG HA H 79 4.712 4.798 -0.086 1
1 1100 . 7 1 1 A 79 79 ARG C C 79 174.221 174.560 -0.339 1
1 1101 . 7 1 1 A 79 79 ARG CA C 79 54.117 54.973 -0.856 1
1 1102 . 7 1 1 A 79 79 ARG CB C 79 31.196 32.093 -0.897 1
1 1105 . 7 1 1 A 79 79 ARG N N 79 125.637 122.157 3.480 1
1 1106 . 7 1 1 A 80 80 THR H H 80 8.416 8.853 -0.437 1
1 1107 . 7 1 1 A 80 80 THR HA H 80 5.332 4.912 0.420 1
1 1112 . 7 1 1 A 80 80 THR C C 80 174.497 174.098 0.399 1
1 1113 . 7 1 1 A 80 80 THR CA C 80 59.694 61.889 -2.195 1
1 1114 . 7 1 1 A 80 80 THR CB C 80 69.772 69.773 -0.001 1
1 1116 . 7 1 1 A 80 80 THR N N 80 118.084 120.377 -2.293 1
1 1117 . 7 1 1 A 81 81 ARG H H 81 8.758 9.008 -0.250 1
1 1118 . 7 1 1 A 81 81 ARG HA H 81 4.362 4.796 -0.434 1
1 1126 . 7 1 1 A 81 81 ARG C C 81 173.733 173.903 -0.170 1
1 1127 . 7 1 1 A 81 81 ARG CA C 81 53.273 53.820 -0.547 1
1 1128 . 7 1 1 A 81 81 ARG CB C 81 33.915 33.725 0.190 1
1 1131 . 7 1 1 A 81 81 ARG N N 81 122.844 124.932 -2.088 1
1 1133 . 7 1 1 A 82 82 LYS H H 82 8.721 8.723 -0.002 1
1 1134 . 7 1 1 A 82 82 LYS HA H 82 4.701 5.117 -0.416 1
1 1143 . 7 1 1 A 82 82 LYS C C 82 175.667 175.406 0.261 1
1 1144 . 7 1 1 A 82 82 LYS CA C 82 54.960 54.804 0.156 1
1 1145 . 7 1 1 A 82 82 LYS CB C 82 32.603 34.936 -2.333 1
1 1149 . 7 1 1 A 82 82 LYS N N 82 124.668 123.802 0.866 1
1 1150 . 7 1 1 A 83 83 VAL H H 83 9.112 9.385 -0.273 1
1 1151 . 7 1 1 A 83 83 VAL HA H 83 4.796 4.930 -0.134 1
1 1159 . 7 1 1 A 83 83 VAL C C 83 174.594 175.332 -0.738 1
1 1160 . 7 1 1 A 83 83 VAL CA C 83 59.413 60.123 -0.710 1
1 1161 . 7 1 1 A 83 83 VAL CB C 83 35.298 34.550 0.748 1
1 1164 . 7 1 1 A 83 83 VAL N N 83 122.381 122.158 0.223 1
1 1165 . 7 1 1 A 84 84 THR H H 84 9.200 8.677 0.523 1
1 1166 . 7 1 1 A 84 84 THR HA H 84 4.579 4.605 -0.026 1
1 1171 . 7 1 1 A 84 84 THR C C 84 173.993 174.718 -0.725 1
1 1172 . 7 1 1 A 84 84 THR CA C 84 60.960 61.990 -1.030 1
1 1173 . 7 1 1 A 84 84 THR CB C 84 70.100 70.206 -0.106 1
1 1175 . 7 1 1 A 84 84 THR N N 84 113.183 115.543 -2.360 1
1 1176 . 7 1 1 A 85 85 SER H H 85 7.688 7.869 -0.181 1
1 1177 . 7 1 1 A 85 85 SER HA H 85 5.136 4.684 0.452 1
1 1180 . 7 1 1 A 85 85 SER CA C 85 55.205 56.279 -1.074 1
1 1181 . 7 1 1 A 85 85 SER CB C 85 64.376 63.782 0.594 1
1 1182 . 7 1 1 A 85 85 SER N N 85 115.555 117.680 -2.125 1
1 1183 . 7 1 1 A 86 86 PRO HA H 86 4.090 4.216 -0.126 1
1 1190 . 7 1 1 A 86 86 PRO C C 86 177.227 177.632 -0.405 1
1 1191 . 7 1 1 A 86 86 PRO CA C 86 65.038 65.633 -0.595 1
1 1192 . 7 1 1 A 86 86 PRO CB C 86 31.711 31.925 -0.214 1
1 1195 . 7 1 1 A 87 87 ASP H H 87 8.131 8.434 -0.303 1
1 1196 . 7 1 1 A 87 87 ASP HA H 87 4.223 4.333 -0.110 1
1 1199 . 7 1 1 A 87 87 ASP C C 87 178.721 178.401 0.320 1
1 1200 . 7 1 1 A 87 87 ASP CA C 87 57.311 57.032 0.279 1
1 1201 . 7 1 1 A 87 87 ASP CB C 87 40.102 41.996 -1.894 1
1 1202 . 7 1 1 A 87 87 ASP N N 87 115.381 117.486 -2.105 1
1 1203 . 7 1 1 A 88 88 GLU H H 88 7.571 7.902 -0.331 1
1 1204 . 7 1 1 A 88 88 GLU HA H 88 3.659 4.064 -0.405 1
1 1209 . 7 1 1 A 88 88 GLU C C 88 177.097 178.696 -1.599 1
1 1210 . 7 1 1 A 88 88 GLU CA C 88 58.729 58.908 -0.179 1
1 1211 . 7 1 1 A 88 88 GLU CB C 88 30.052 29.532 0.520 1
1 1213 . 7 1 1 A 88 88 GLU N N 88 120.009 119.034 0.975 1
1 1214 . 7 1 1 A 89 89 ALA H H 89 7.423 8.058 -0.635 1
1 1215 . 7 1 1 A 89 89 ALA HA H 89 3.900 4.278 -0.378 1
1 1219 . 7 1 1 A 89 89 ALA C C 89 178.267 180.001 -1.734 1
1 1220 . 7 1 1 A 89 89 ALA CA C 89 55.607 55.245 0.362 1
1 1221 . 7 1 1 A 89 89 ALA CB C 89 17.348 18.383 -1.035 1
1 1222 . 7 1 1 A 89 89 ALA N N 89 118.873 122.206 -3.333 1
1 1223 . 7 1 1 A 90 90 LYS H H 90 8.046 8.086 -0.040 1
1 1224 . 7 1 1 A 90 90 LYS HA H 90 3.669 3.977 -0.308 1
1 1233 . 7 1 1 A 90 90 LYS C C 90 177.649 179.120 -1.471 1
1 1234 . 7 1 1 A 90 90 LYS CA C 90 60.351 59.840 0.511 1
1 1235 . 7 1 1 A 90 90 LYS CB C 90 32.087 32.342 -0.255 1
1 1239 . 7 1 1 A 90 90 LYS N N 90 114.834 117.306 -2.472 1
1 1240 . 7 1 1 A 91 91 ARG H H 91 7.468 7.866 -0.398 1
1 1241 . 7 1 1 A 91 91 ARG HA H 91 3.887 3.872 0.015 1
1 1249 . 7 1 1 A 91 91 ARG C C 91 178.998 179.178 -0.180 1
1 1250 . 7 1 1 A 91 91 ARG CA C 91 59.164 59.213 -0.049 1
1 1251 . 7 1 1 A 91 91 ARG CB C 91 29.274 29.778 -0.504 1
1 1254 . 7 1 1 A 91 91 ARG N N 91 119.029 119.165 -0.136 1
1 1256 . 7 1 1 A 92 92 TRP H H 92 8.136 7.917 0.219 1
1 1257 . 7 1 1 A 92 92 TRP HA H 92 4.818 4.499 0.319 1
1 1266 . 7 1 1 A 92 92 TRP C C 92 179.566 179.094 0.472 1
1 1267 . 7 1 1 A 92 92 TRP CA C 92 58.663 59.306 -0.643 1
1 1268 . 7 1 1 A 92 92 TRP CB C 92 29.790 29.288 0.502 1
1 1274 . 7 1 1 A 92 92 TRP N N 92 118.100 120.095 -1.995 1
1 1276 . 7 1 1 A 93 93 ILE H H 93 8.363 8.407 -0.044 1
1 1277 . 7 1 1 A 93 93 ILE HA H 93 3.544 3.743 -0.199 1
1 1287 . 7 1 1 A 93 93 ILE C C 93 176.820 178.167 -1.347 1
1 1288 . 7 1 1 A 93 93 ILE CA C 93 66.225 65.514 0.711 1
1 1289 . 7 1 1 A 93 93 ILE CB C 93 37.571 37.930 -0.359 1
1 1293 . 7 1 1 A 93 93 ILE N N 93 120.588 120.457 0.131 1
1 1294 . 7 1 1 A 94 94 LYS H H 94 8.264 7.781 0.483 1
1 1295 . 7 1 1 A 94 94 LYS HA H 94 3.865 4.022 -0.157 1
1 1304 . 7 1 1 A 94 94 LYS C C 94 179.258 178.601 0.657 1
1 1305 . 7 1 1 A 94 94 LYS CA C 94 59.889 59.801 0.088 1
1 1306 . 7 1 1 A 94 94 LYS CB C 94 32.225 32.078 0.147 1
1 1310 . 7 1 1 A 94 94 LYS N N 94 121.687 120.462 1.225 1
1 1311 . 7 1 1 A 95 95 GLU H H 95 8.360 8.284 0.076 1
1 1312 . 7 1 1 A 95 95 GLU HA H 95 4.023 4.049 -0.026 1
1 1317 . 7 1 1 A 95 95 GLU C C 95 178.884 179.250 -0.366 1
1 1318 . 7 1 1 A 95 95 GLU CA C 95 59.366 59.637 -0.271 1
1 1319 . 7 1 1 A 95 95 GLU CB C 95 29.508 29.451 0.057 1
1 1321 . 7 1 1 A 95 95 GLU N N 95 118.505 117.968 0.537 1
1 1322 . 7 1 1 A 96 96 PHE H H 96 8.212 8.519 -0.307 1
1 1323 . 7 1 1 A 96 96 PHE HA H 96 4.512 4.515 -0.003 1
1 1331 . 7 1 1 A 96 96 PHE C C 96 176.820 178.013 -1.193 1
1 1332 . 7 1 1 A 96 96 PHE CA C 96 59.608 61.323 -1.715 1
1 1333 . 7 1 1 A 96 96 PHE CB C 96 40.431 39.259 1.172 1
1 1339 . 7 1 1 A 96 96 PHE N N 96 120.369 122.043 -1.674 1
1 1340 . 7 1 1 A 97 97 SER H H 97 8.216 8.264 -0.048 1
1 1341 . 7 1 1 A 97 97 SER HA H 97 3.816 4.093 -0.277 1
1 1344 . 7 1 1 A 97 97 SER C C 97 175.618 176.459 -0.841 1
1 1345 . 7 1 1 A 97 97 SER CA C 97 60.492 60.914 -0.422 1
1 1346 . 7 1 1 A 97 97 SER CB C 97 63.022 62.603 0.419 1
1 1347 . 7 1 1 A 97 97 SER N N 97 111.969 112.353 -0.384 1
1 1348 . 7 1 1 A 98 98 GLU H H 98 7.655 7.452 0.203 1
1 1349 . 7 1 1 A 98 98 GLU HA H 98 4.187 4.149 0.038 1
1 1354 . 7 1 1 A 98 98 GLU C C 98 177.698 179.296 -1.598 1
1 1355 . 7 1 1 A 98 98 GLU CA C 98 57.069 58.180 -1.111 1
1 1356 . 7 1 1 A 98 98 GLU CB C 98 29.321 29.515 -0.194 1
1 1358 . 7 1 1 A 98 98 GLU N N 98 120.588 121.287 -0.699 1
1 1359 . 7 1 1 A 99 99 GLU H H 99 7.794 7.822 -0.028 1
1 1360 . 7 1 1 A 99 99 GLU HA H 99 4.123 3.999 0.124 1
1 1365 . 7 1 1 A 99 99 GLU C C 99 177.665 177.576 0.089 1
1 1366 . 7 1 1 A 99 99 GLU CA C 99 57.304 58.622 -1.318 1
1 1367 . 7 1 1 A 99 99 GLU CB C 99 29.368 29.509 -0.141 1
1 1369 . 7 1 1 A 99 99 GLU N N 99 120.067 120.270 -0.203 1
1 1370 . 7 1 1 A 100 100 GLY H H 100 8.138 8.018 0.120 1
1 1371 . 7 1 1 A 100 100 GLY HA2 H 100 3.865 3.629 0.236 1
1 1372 . 7 1 1 A 100 100 GLY HA3 H 100 3.715 3.742 -0.027 1
1 1373 . 7 1 1 A 100 100 GLY C C 100 174.464 174.140 0.324 1
1 1374 . 7 1 1 A 100 100 GLY CA C 100 45.305 47.098 -1.793 1
1 1375 . 7 1 1 A 100 100 GLY N N 100 107.802 108.043 -0.241 1
1 1376 . 7 1 1 A 101 101 GLY H H 101 8.023 8.022 0.001 1
1 1377 . 7 1 1 A 101 101 GLY HA2 H 101 3.865 4.152 -0.287 1
1 1378 . 7 1 1 A 101 101 GLY HA3 H 101 3.892 4.167 -0.275 1
1 1379 . 7 1 1 A 101 101 GLY C C 101 174.204 173.069 1.135 1
1 1380 . 7 1 1 A 101 101 GLY CA C 101 45.036 45.650 -0.614 1
1 1381 . 7 1 1 A 101 101 GLY N N 101 108.032 110.107 -2.075 1
1 1382 . 7 1 1 A 102 102 SER H H 102 8.059 8.732 -0.673 1
1 1383 . 7 1 1 A 102 102 SER HA H 102 4.380 4.670 -0.290 1
1 1386 . 7 1 1 A 102 102 SER C C 102 174.627 174.326 0.301 1
1 1387 . 7 1 1 A 102 102 SER CA C 102 58.194 57.630 0.564 1
1 1388 . 7 1 1 A 102 102 SER CB C 102 63.538 62.297 1.241 1
1 1389 . 7 1 1 A 102 102 SER N N 102 115.266 116.240 -0.974 1
1 1390 . 7 1 1 A 103 103 LEU H H 103 8.287 7.899 0.388 1
1 1391 . 7 1 1 A 103 103 LEU HA H 103 4.301 4.288 0.013 1
1 1401 . 7 1 1 A 103 103 LEU C C 103 177.292 177.680 -0.388 1
1 1402 . 7 1 1 A 103 103 LEU CA C 103 55.007 57.839 -2.832 1
1 1403 . 7 1 1 A 103 103 LEU CB C 103 42.023 42.110 -0.087 1
1 1407 . 7 1 1 A 103 103 LEU N N 103 123.596 127.909 -4.313 1
1 1408 . 7 1 1 A 104 104 GLU H H 104 8.216 7.707 0.509 1
1 1409 . 7 1 1 A 104 104 GLU HA H 104 4.126 4.560 -0.434 1
1 1414 . 7 1 1 A 104 104 GLU CA C 104 56.518 56.604 -0.086 1
1 1415 . 7 1 1 A 104 104 GLU CB C 104 29.837 30.197 -0.360 1
1 1417 . 7 1 1 A 104 104 GLU N N 104 120.510 116.995 3.515 1
1 1418 . 7 1 1 A 105 105 HIS HA H 105 4.593 4.144 0.449 1
1 1421 . 7 1 1 A 105 105 HIS C C 105 173.766 175.416 -1.650 1
1 1422 . 7 1 1 A 105 105 HIS CA C 105 55.536 59.249 -3.713 1
1 1423 . 7 1 1 A 105 105 HIS CB C 105 30.001 30.200 -0.199 1
1 1424 . 7 1 1 A 106 106 HIS H H 106 8.154 8.185 -0.031 1
1 1425 . 7 1 1 A 106 106 HIS HA H 106 4.407 4.176 0.231 1
1 1428 . 7 1 1 A 106 106 HIS CA C 106 56.920 57.263 -0.343 1
1 1429 . 7 1 1 A 106 106 HIS CB C 106 30.001 29.107 0.894 1
1 14 . 8 1 1 A 2 2 LEU H H 2 8.509 9.125 -0.616 1
1 15 . 8 1 1 A 2 2 LEU HA H 2 4.463 4.541 -0.078 1
1 25 . 8 1 1 A 2 2 LEU C C 2 173.944 176.094 -2.150 1
1 26 . 8 1 1 A 2 2 LEU CA C 2 54.471 54.682 -0.211 1
1 27 . 8 1 1 A 2 2 LEU CB C 2 43.595 42.611 0.984 1
1 31 . 8 1 1 A 2 2 LEU N N 2 127.160 127.036 0.124 1
1 32 . 8 1 1 A 3 3 LEU H H 3 7.844 8.441 -0.597 1
1 33 . 8 1 1 A 3 3 LEU HA H 3 5.128 5.530 -0.402 1
1 43 . 8 1 1 A 3 3 LEU C C 3 175.423 175.004 0.419 1
1 44 . 8 1 1 A 3 3 LEU CA C 3 53.566 52.976 0.590 1
1 45 . 8 1 1 A 3 3 LEU CB C 3 44.039 44.667 -0.628 1
1 49 . 8 1 1 A 3 3 LEU N N 3 122.555 124.485 -1.930 1
1 50 . 8 1 1 A 4 4 TYR H H 4 8.360 8.905 -0.545 1
1 51 . 8 1 1 A 4 4 TYR HA H 4 5.143 5.086 0.057 1
1 58 . 8 1 1 A 4 4 TYR C C 4 174.481 174.958 -0.477 1
1 59 . 8 1 1 A 4 4 TYR CA C 4 56.577 56.480 0.097 1
1 60 . 8 1 1 A 4 4 TYR CB C 4 43.840 43.003 0.837 1
1 65 . 8 1 1 A 4 4 TYR N N 4 119.315 122.901 -3.586 1
1 66 . 8 1 1 A 5 5 VAL H H 5 8.918 9.023 -0.105 1
1 67 . 8 1 1 A 5 5 VAL HA H 5 5.106 4.955 0.151 1
1 75 . 8 1 1 A 5 5 VAL C C 5 174.042 174.452 -0.410 1
1 76 . 8 1 1 A 5 5 VAL CA C 5 59.852 60.721 -0.869 1
1 77 . 8 1 1 A 5 5 VAL CB C 5 33.816 34.225 -0.409 1
1 80 . 8 1 1 A 5 5 VAL N N 5 119.952 121.465 -1.513 1
1 81 . 8 1 1 A 6 6 LEU H H 6 9.315 9.472 -0.157 1
1 82 . 8 1 1 A 6 6 LEU HA H 6 5.466 5.277 0.189 1
1 92 . 8 1 1 A 6 6 LEU C C 6 175.049 175.010 0.039 1
1 93 . 8 1 1 A 6 6 LEU CA C 6 52.090 53.148 -1.058 1
1 94 . 8 1 1 A 6 6 LEU CB C 6 44.103 43.510 0.593 1
1 98 . 8 1 1 A 6 6 LEU N N 6 126.917 126.138 0.779 1
1 99 . 8 1 1 A 7 7 ILE H H 7 8.458 8.893 -0.435 1
1 100 . 8 1 1 A 7 7 ILE HA H 7 5.131 5.086 0.045 1
1 110 . 8 1 1 A 7 7 ILE C C 7 173.213 173.935 -0.722 1
1 111 . 8 1 1 A 7 7 ILE CA C 7 58.463 59.646 -1.183 1
1 112 . 8 1 1 A 7 7 ILE CB C 7 41.020 40.799 0.221 1
1 116 . 8 1 1 A 7 7 ILE N N 7 119.778 126.698 -6.920 1
1 117 . 8 1 1 A 8 8 ILE H H 8 8.797 9.219 -0.422 1
1 118 . 8 1 1 A 8 8 ILE HA H 8 4.611 4.901 -0.290 1
1 128 . 8 1 1 A 8 8 ILE C C 8 174.611 174.448 0.163 1
1 129 . 8 1 1 A 8 8 ILE CA C 8 60.227 60.497 -0.270 1
1 130 . 8 1 1 A 8 8 ILE CB C 8 37.665 39.493 -1.828 1
1 134 . 8 1 1 A 8 8 ILE N N 8 128.919 129.056 -0.137 1
1 135 . 8 1 1 A 9 9 SER H H 9 7.811 8.800 -0.989 1
1 136 . 8 1 1 A 9 9 SER HA H 9 4.429 4.990 -0.561 1
1 140 . 8 1 1 A 9 9 SER C C 9 172.937 173.660 -0.723 1
1 141 . 8 1 1 A 9 9 SER CA C 9 58.241 57.033 1.208 1
1 142 . 8 1 1 A 9 9 SER CB C 9 64.261 64.276 -0.015 1
1 143 . 8 1 1 A 9 9 SER N N 9 116.365 121.632 -5.267 1
1 144 . 8 1 1 A 10 10 ASN H H 10 8.641 8.867 -0.226 1
1 145 . 8 1 1 A 10 10 ASN HA H 10 4.938 4.795 0.143 1
1 150 . 8 1 1 A 10 10 ASN C C 10 174.497 174.766 -0.269 1
1 151 . 8 1 1 A 10 10 ASN CA C 10 52.221 53.794 -1.573 1
1 152 . 8 1 1 A 10 10 ASN CB C 10 39.128 39.526 -0.398 1
1 153 . 8 1 1 A 10 10 ASN N N 10 122.612 122.258 0.354 1
1 155 . 8 1 1 A 11 11 ASP H H 11 8.673 7.301 1.372 1
1 156 . 8 1 1 A 11 11 ASP HA H 11 4.596 4.823 -0.227 1
1 159 . 8 1 1 A 11 11 ASP C C 11 175.342 176.174 -0.832 1
1 160 . 8 1 1 A 11 11 ASP CA C 11 53.233 53.592 -0.359 1
1 161 . 8 1 1 A 11 11 ASP CB C 11 40.965 40.322 0.643 1
1 162 . 8 1 1 A 11 11 ASP N N 11 122.717 119.947 2.770 1
1 163 . 8 1 1 A 12 12 LYS H H 12 8.562 8.670 -0.108 1
1 164 . 8 1 1 A 12 12 LYS HA H 12 3.854 4.029 -0.175 1
1 173 . 8 1 1 A 12 12 LYS C C 12 178.754 178.337 0.417 1
1 174 . 8 1 1 A 12 12 LYS CA C 12 59.581 60.030 -0.449 1
1 175 . 8 1 1 A 12 12 LYS CB C 12 32.378 32.210 0.168 1
1 179 . 8 1 1 A 12 12 LYS N N 12 125.737 126.094 -0.357 1
1 180 . 8 1 1 A 13 13 LYS H H 13 8.075 7.750 0.325 1
1 181 . 8 1 1 A 13 13 LYS HA H 13 4.154 4.109 0.045 1
1 190 . 8 1 1 A 13 13 LYS C C 13 178.315 179.138 -0.823 1
1 191 . 8 1 1 A 13 13 LYS CA C 13 58.532 59.049 -0.517 1
1 192 . 8 1 1 A 13 13 LYS CB C 13 31.452 32.520 -1.068 1
1 196 . 8 1 1 A 13 13 LYS N N 13 119.604 120.196 -0.592 1
1 197 . 8 1 1 A 14 14 LEU H H 14 7.552 7.863 -0.311 1
1 198 . 8 1 1 A 14 14 LEU HA H 14 3.682 4.053 -0.371 1
1 208 . 8 1 1 A 14 14 LEU C C 14 178.429 178.352 0.077 1
1 209 . 8 1 1 A 14 14 LEU CA C 14 58.999 58.115 0.884 1
1 210 . 8 1 1 A 14 14 LEU CB C 14 41.228 41.393 -0.165 1
1 214 . 8 1 1 A 14 14 LEU N N 14 122.266 121.103 1.163 1
1 215 . 8 1 1 A 15 15 ILE H H 15 8.074 8.236 -0.162 1
1 216 . 8 1 1 A 15 15 ILE HA H 15 3.264 3.520 -0.256 1
1 226 . 8 1 1 A 15 15 ILE C C 15 177.000 178.118 -1.118 1
1 227 . 8 1 1 A 15 15 ILE CA C 15 65.939 65.492 0.447 1
1 228 . 8 1 1 A 15 15 ILE CB C 15 37.983 37.814 0.169 1
1 232 . 8 1 1 A 15 15 ILE N N 15 118.214 119.858 -1.644 1
1 233 . 8 1 1 A 16 16 GLU H H 16 8.016 8.411 -0.395 1
1 234 . 8 1 1 A 16 16 GLU HA H 16 4.045 3.929 0.116 1
1 239 . 8 1 1 A 16 16 GLU C C 16 179.388 179.648 -0.260 1
1 240 . 8 1 1 A 16 16 GLU CA C 16 59.032 59.947 -0.915 1
1 241 . 8 1 1 A 16 16 GLU CB C 16 29.200 29.279 -0.079 1
1 243 . 8 1 1 A 16 16 GLU N N 16 118.484 118.833 -0.349 1
1 244 . 8 1 1 A 17 17 GLU H H 17 8.063 8.414 -0.351 1
1 245 . 8 1 1 A 17 17 GLU HA H 17 4.053 4.062 -0.009 1
1 250 . 8 1 1 A 17 17 GLU C C 17 179.306 179.096 0.210 1
1 251 . 8 1 1 A 17 17 GLU CA C 17 58.636 59.248 -0.612 1
1 252 . 8 1 1 A 17 17 GLU CB C 17 29.011 29.347 -0.336 1
1 254 . 8 1 1 A 17 17 GLU N N 17 118.100 120.521 -2.421 1
1 255 . 8 1 1 A 18 18 ALA H H 18 8.655 8.406 0.249 1
1 256 . 8 1 1 A 18 18 ALA HA H 18 3.775 4.025 -0.250 1
1 260 . 8 1 1 A 18 18 ALA C C 18 178.559 179.590 -1.031 1
1 261 . 8 1 1 A 18 18 ALA CA C 18 54.960 55.413 -0.453 1
1 262 . 8 1 1 A 18 18 ALA CB C 18 17.960 18.195 -0.235 1
1 263 . 8 1 1 A 18 18 ALA N N 18 122.439 122.558 -0.119 1
1 264 . 8 1 1 A 19 19 ARG H H 19 8.900 8.119 0.781 1
1 265 . 8 1 1 A 19 19 ARG HA H 19 3.809 4.111 -0.302 1
1 273 . 8 1 1 A 19 19 ARG C C 19 178.721 178.949 -0.228 1
1 274 . 8 1 1 A 19 19 ARG CA C 19 59.976 59.780 0.196 1
1 275 . 8 1 1 A 19 19 ARG CB C 19 29.572 29.748 -0.176 1
1 278 . 8 1 1 A 19 19 ARG N N 19 118.563 117.693 0.870 1
1 280 . 8 1 1 A 20 20 LYS H H 20 7.792 8.212 -0.420 1
1 281 . 8 1 1 A 20 20 LYS HA H 20 4.052 4.033 0.019 1
1 290 . 8 1 1 A 20 20 LYS C C 20 179.648 179.838 -0.190 1
1 291 . 8 1 1 A 20 20 LYS CA C 20 59.296 58.824 0.472 1
1 292 . 8 1 1 A 20 20 LYS CB C 20 32.216 32.191 0.025 1
1 296 . 8 1 1 A 20 20 LYS N N 20 118.638 119.714 -1.076 1
1 297 . 8 1 1 A 21 21 MET H H 21 7.684 8.067 -0.383 1
1 298 . 8 1 1 A 21 21 MET HA H 21 4.411 4.152 0.259 1
1 306 . 8 1 1 A 21 21 MET C C 21 177.909 178.080 -0.171 1
1 307 . 8 1 1 A 21 21 MET CA C 21 57.009 59.143 -2.134 1
1 308 . 8 1 1 A 21 21 MET CB C 21 32.028 32.866 -0.838 1
1 311 . 8 1 1 A 21 21 MET N N 21 118.100 118.890 -0.790 1
1 312 . 8 1 1 A 22 22 ALA H H 22 8.815 8.500 0.315 1
1 313 . 8 1 1 A 22 22 ALA HA H 22 3.826 3.954 -0.128 1
1 317 . 8 1 1 A 22 22 ALA C C 22 178.835 180.056 -1.221 1
1 318 . 8 1 1 A 22 22 ALA CA C 22 55.427 55.521 -0.094 1
1 319 . 8 1 1 A 22 22 ALA CB C 22 18.059 18.607 -0.548 1
1 320 . 8 1 1 A 22 22 ALA N N 22 122.150 121.255 0.895 1
1 321 . 8 1 1 A 23 23 GLU H H 23 8.276 8.284 -0.008 1
1 322 . 8 1 1 A 23 23 GLU HA H 23 4.146 3.992 0.154 1
1 327 . 8 1 1 A 23 23 GLU C C 23 180.151 179.370 0.781 1
1 328 . 8 1 1 A 23 23 GLU CA C 23 58.999 59.560 -0.561 1
1 329 . 8 1 1 A 23 23 GLU CB C 23 29.160 29.402 -0.242 1
1 331 . 8 1 1 A 23 23 GLU N N 23 117.001 117.977 -0.976 1
1 332 . 8 1 1 A 24 24 LYS H H 24 7.573 7.744 -0.171 1
1 333 . 8 1 1 A 24 24 LYS HA H 24 4.101 4.098 0.003 1
1 342 . 8 1 1 A 24 24 LYS C C 24 177.145 177.683 -0.538 1
1 343 . 8 1 1 A 24 24 LYS CA C 24 58.261 58.860 -0.599 1
1 344 . 8 1 1 A 24 24 LYS CB C 24 32.079 32.081 -0.002 1
1 348 . 8 1 1 A 24 24 LYS N N 24 119.960 119.300 0.660 1
1 349 . 8 1 1 A 25 25 ALA H H 25 7.710 7.671 0.039 1
1 350 . 8 1 1 A 25 25 ALA HA H 25 4.413 4.365 0.048 1
1 354 . 8 1 1 A 25 25 ALA C C 25 175.325 176.591 -1.266 1
1 355 . 8 1 1 A 25 25 ALA CA C 25 51.208 51.676 -0.468 1
1 356 . 8 1 1 A 25 25 ALA CB C 25 18.520 19.008 -0.488 1
1 357 . 8 1 1 A 25 25 ALA N N 25 119.257 118.969 0.288 1
1 358 . 8 1 1 A 26 26 ASN H H 26 7.840 8.083 -0.243 1
1 359 . 8 1 1 A 26 26 ASN HA H 26 4.357 4.355 0.002 1
1 364 . 8 1 1 A 26 26 ASN C C 26 173.587 174.077 -0.490 1
1 365 . 8 1 1 A 26 26 ASN CA C 26 54.307 54.474 -0.167 1
1 366 . 8 1 1 A 26 26 ASN CB C 26 36.972 37.096 -0.124 1
1 367 . 8 1 1 A 26 26 ASN N N 26 115.266 113.419 1.847 1
1 369 . 8 1 1 A 27 27 LEU H H 27 8.241 7.892 0.349 1
1 370 . 8 1 1 A 27 27 LEU HA H 27 4.652 4.534 0.118 1
1 380 . 8 1 1 A 27 27 LEU C C 27 175.894 175.751 0.143 1
1 381 . 8 1 1 A 27 27 LEU CA C 27 52.923 53.487 -0.564 1
1 382 . 8 1 1 A 27 27 LEU CB C 27 44.090 43.286 0.804 1
1 386 . 8 1 1 A 27 27 LEU N N 27 116.828 119.498 -2.670 1
1 387 . 8 1 1 A 28 28 GLU H H 28 7.798 8.478 -0.680 1
1 388 . 8 1 1 A 28 28 GLU HA H 28 4.310 4.604 -0.294 1
1 393 . 8 1 1 A 28 28 GLU C C 28 173.944 174.963 -1.019 1
1 394 . 8 1 1 A 28 28 GLU CA C 28 55.460 55.716 -0.256 1
1 395 . 8 1 1 A 28 28 GLU CB C 28 30.512 30.640 -0.128 1
1 397 . 8 1 1 A 28 28 GLU N N 28 121.340 123.749 -2.409 1
1 398 . 8 1 1 A 29 29 LEU H H 29 8.451 8.910 -0.459 1
1 399 . 8 1 1 A 29 29 LEU HA H 29 5.662 5.327 0.335 1
1 409 . 8 1 1 A 29 29 LEU C C 29 176.902 174.962 1.940 1
1 410 . 8 1 1 A 29 29 LEU CA C 29 53.186 53.946 -0.760 1
1 411 . 8 1 1 A 29 29 LEU CB C 29 44.914 44.223 0.691 1
1 415 . 8 1 1 A 29 29 LEU N N 29 126.547 129.315 -2.768 1
1 416 . 8 1 1 A 30 30 ARG H H 30 9.094 9.269 -0.175 1
1 417 . 8 1 1 A 30 30 ARG HA H 30 4.910 4.768 0.142 1
1 425 . 8 1 1 A 30 30 ARG C C 30 175.147 175.770 -0.623 1
1 426 . 8 1 1 A 30 30 ARG CA C 30 53.417 54.461 -1.044 1
1 427 . 8 1 1 A 30 30 ARG CB C 30 32.555 32.649 -0.094 1
1 430 . 8 1 1 A 30 30 ARG N N 30 125.043 126.410 -1.367 1
1 432 . 8 1 1 A 31 31 THR H H 31 8.496 8.385 0.111 1
1 433 . 8 1 1 A 31 31 THR HA H 31 4.888 4.897 -0.009 1
1 438 . 8 1 1 A 31 31 THR C C 31 173.961 173.791 0.170 1
1 439 . 8 1 1 A 31 31 THR CA C 31 60.445 61.018 -0.573 1
1 440 . 8 1 1 A 31 31 THR CB C 31 69.492 69.737 -0.245 1
1 442 . 8 1 1 A 31 31 THR N N 31 114.745 115.178 -0.433 1
1 443 . 8 1 1 A 32 32 VAL H H 32 8.480 9.021 -0.541 1
1 444 . 8 1 1 A 32 32 VAL HA H 32 4.411 4.361 0.050 1
1 452 . 8 1 1 A 32 32 VAL C C 32 175.082 175.700 -0.618 1
1 453 . 8 1 1 A 32 32 VAL CA C 32 60.946 62.648 -1.702 1
1 454 . 8 1 1 A 32 32 VAL CB C 32 34.487 31.954 2.533 1
1 457 . 8 1 1 A 32 32 VAL N N 32 122.324 126.995 -4.671 1
1 458 . 8 1 1 A 33 33 LYS H H 33 9.304 8.664 0.640 1
1 459 . 8 1 1 A 33 33 LYS HA H 33 4.534 4.583 -0.049 1
1 468 . 8 1 1 A 33 33 LYS C C 33 176.740 176.407 0.333 1
1 469 . 8 1 1 A 33 33 LYS CA C 33 56.846 57.032 -0.186 1
1 470 . 8 1 1 A 33 33 LYS CB C 33 34.355 34.452 -0.097 1
1 474 . 8 1 1 A 33 33 LYS N N 33 123.654 126.489 -2.835 1
1 475 . 8 1 1 A 34 34 THR H H 34 7.245 7.564 -0.319 1
1 476 . 8 1 1 A 34 34 THR HA H 34 4.780 4.631 0.149 1
1 481 . 8 1 1 A 34 34 THR C C 34 174.529 175.582 -1.053 1
1 482 . 8 1 1 A 34 34 THR CA C 34 58.859 59.955 -1.096 1
1 483 . 8 1 1 A 34 34 THR CB C 34 73.023 72.634 0.389 1
1 485 . 8 1 1 A 34 34 THR N N 34 106.300 110.886 -4.586 1
1 486 . 8 1 1 A 35 35 GLU H H 35 9.174 8.860 0.314 1
1 487 . 8 1 1 A 35 35 GLU HA H 35 3.886 3.948 -0.062 1
1 492 . 8 1 1 A 35 35 GLU C C 35 177.714 177.521 0.193 1
1 493 . 8 1 1 A 35 35 GLU CA C 35 59.233 59.617 -0.384 1
1 494 . 8 1 1 A 35 35 GLU CB C 35 29.377 29.431 -0.054 1
1 496 . 8 1 1 A 35 35 GLU N N 35 121.919 122.127 -0.208 1
1 497 . 8 1 1 A 36 36 ASP H H 36 8.185 8.387 -0.202 1
1 498 . 8 1 1 A 36 36 ASP HA H 36 4.289 4.266 0.023 1
1 501 . 8 1 1 A 36 36 ASP C C 36 178.348 178.489 -0.141 1
1 502 . 8 1 1 A 36 36 ASP CA C 36 56.962 57.670 -0.708 1
1 503 . 8 1 1 A 36 36 ASP CB C 36 40.214 42.065 -1.851 1
1 504 . 8 1 1 A 36 36 ASP N N 36 118.332 119.795 -1.463 1
1 505 . 8 1 1 A 37 37 GLU H H 37 7.741 7.458 0.283 1
1 506 . 8 1 1 A 37 37 GLU HA H 37 3.708 3.670 0.038 1
1 511 . 8 1 1 A 37 37 GLU C C 37 177.324 178.551 -1.227 1
1 512 . 8 1 1 A 37 37 GLU CA C 37 58.698 58.929 -0.231 1
1 513 . 8 1 1 A 37 37 GLU CB C 37 30.199 29.401 0.798 1
1 515 . 8 1 1 A 37 37 GLU N N 37 120.704 118.910 1.794 1
1 516 . 8 1 1 A 38 38 LEU H H 38 7.531 7.828 -0.297 1
1 517 . 8 1 1 A 38 38 LEU HA H 38 3.873 4.098 -0.225 1
1 527 . 8 1 1 A 38 38 LEU C C 38 177.357 178.370 -1.013 1
1 528 . 8 1 1 A 38 38 LEU CA C 38 58.305 58.181 0.124 1
1 529 . 8 1 1 A 38 38 LEU CB C 38 40.837 41.524 -0.687 1
1 533 . 8 1 1 A 38 38 LEU N N 38 119.200 121.427 -2.227 1
1 534 . 8 1 1 A 39 39 LYS H H 39 8.083 7.776 0.307 1
1 535 . 8 1 1 A 39 39 LYS HA H 39 3.608 3.929 -0.321 1
1 544 . 8 1 1 A 39 39 LYS C C 39 177.373 178.741 -1.368 1
1 545 . 8 1 1 A 39 39 LYS CA C 39 60.290 59.471 0.819 1
1 546 . 8 1 1 A 39 39 LYS CB C 39 32.178 32.344 -0.166 1
1 550 . 8 1 1 A 39 39 LYS N N 39 116.943 118.627 -1.684 1
1 551 . 8 1 1 A 40 40 LYS H H 40 7.632 8.045 -0.413 1
1 552 . 8 1 1 A 40 40 LYS HA H 40 3.864 3.919 -0.055 1
1 561 . 8 1 1 A 40 40 LYS C C 40 179.566 178.397 1.169 1
1 562 . 8 1 1 A 40 40 LYS CA C 40 58.993 58.829 0.164 1
1 563 . 8 1 1 A 40 40 LYS CB C 40 31.758 31.879 -0.121 1
1 567 . 8 1 1 A 40 40 LYS N N 40 118.274 119.050 -0.776 1
1 568 . 8 1 1 A 41 41 TYR H H 41 7.823 7.611 0.212 1
1 569 . 8 1 1 A 41 41 TYR HA H 41 3.926 3.982 -0.056 1
1 576 . 8 1 1 A 41 41 TYR C C 41 176.625 177.729 -1.104 1
1 577 . 8 1 1 A 41 41 TYR CA C 41 59.757 60.720 -0.963 1
1 578 . 8 1 1 A 41 41 TYR CB C 41 36.901 38.044 -1.143 1
1 583 . 8 1 1 A 41 41 TYR N N 41 117.811 119.227 -1.416 1
1 584 . 8 1 1 A 42 42 LEU H H 42 7.964 8.178 -0.214 1
1 585 . 8 1 1 A 42 42 LEU HA H 42 3.704 3.968 -0.264 1
1 595 . 8 1 1 A 42 42 LEU C C 42 178.396 179.045 -0.649 1
1 596 . 8 1 1 A 42 42 LEU CA C 42 58.237 57.841 0.396 1
1 597 . 8 1 1 A 42 42 LEU CB C 42 40.507 41.351 -0.844 1
1 601 . 8 1 1 A 42 42 LEU N N 42 115.960 119.988 -4.028 1
1 602 . 8 1 1 A 43 43 GLU H H 43 8.193 8.425 -0.232 1
1 603 . 8 1 1 A 43 43 GLU HA H 43 3.882 3.860 0.022 1
1 608 . 8 1 1 A 43 43 GLU C C 43 179.193 179.134 0.059 1
1 609 . 8 1 1 A 43 43 GLU CA C 43 59.122 59.818 -0.696 1
1 610 . 8 1 1 A 43 43 GLU CB C 43 29.244 29.069 0.175 1
1 612 . 8 1 1 A 43 43 GLU N N 43 117.175 118.287 -1.112 1
1 613 . 8 1 1 A 44 44 GLU H H 44 7.601 7.545 0.056 1
1 614 . 8 1 1 A 44 44 GLU HA H 44 3.936 3.948 -0.012 1
1 619 . 8 1 1 A 44 44 GLU C C 44 179.875 179.265 0.610 1
1 620 . 8 1 1 A 44 44 GLU CA C 44 58.867 59.314 -0.447 1
1 621 . 8 1 1 A 44 44 GLU CB C 44 28.648 29.233 -0.585 1
1 623 . 8 1 1 A 44 44 GLU N N 44 120.472 119.528 0.944 1
1 624 . 8 1 1 A 45 45 PHE H H 45 8.260 7.545 0.715 1
1 625 . 8 1 1 A 45 45 PHE HA H 45 4.520 4.212 0.308 1
1 633 . 8 1 1 A 45 45 PHE C C 45 177.942 178.316 -0.374 1
1 634 . 8 1 1 A 45 45 PHE CA C 45 55.945 61.258 -5.313 1
1 635 . 8 1 1 A 45 45 PHE CB C 45 36.680 38.351 -1.671 1
1 641 . 8 1 1 A 45 45 PHE N N 45 119.272 119.297 -0.025 1
1 642 . 8 1 1 A 46 46 ARG H H 46 8.023 8.176 -0.153 1
1 643 . 8 1 1 A 46 46 ARG HA H 46 4.074 4.005 0.069 1
1 651 . 8 1 1 A 46 46 ARG C C 46 177.617 178.953 -1.336 1
1 652 . 8 1 1 A 46 46 ARG CA C 46 58.194 59.240 -1.046 1
1 653 . 8 1 1 A 46 46 ARG CB C 46 29.737 29.918 -0.181 1
1 656 . 8 1 1 A 46 46 ARG N N 46 118.136 120.938 -2.802 1
1 658 . 8 1 1 A 47 47 LYS H H 47 7.470 7.979 -0.509 1
1 659 . 8 1 1 A 47 47 LYS HA H 47 4.143 4.161 -0.018 1
1 668 . 8 1 1 A 47 47 LYS C C 47 177.324 178.655 -1.331 1
1 669 . 8 1 1 A 47 47 LYS CA C 47 57.726 59.483 -1.757 1
1 670 . 8 1 1 A 47 47 LYS CB C 47 32.409 32.074 0.335 1
1 674 . 8 1 1 A 47 47 LYS N N 47 116.943 119.699 -2.756 1
1 675 . 8 1 1 A 48 48 GLU H H 48 7.615 8.246 -0.631 1
1 676 . 8 1 1 A 48 48 GLU HA H 48 4.428 4.408 0.020 1
1 681 . 8 1 1 A 48 48 GLU C C 48 176.869 177.501 -0.632 1
1 682 . 8 1 1 A 48 48 GLU CA C 48 55.945 56.843 -0.898 1
1 683 . 8 1 1 A 48 48 GLU CB C 48 29.696 30.146 -0.450 1
1 685 . 8 1 1 A 48 48 GLU N N 48 118.852 117.703 1.149 1
1 686 . 8 1 1 A 49 49 SER H H 49 7.725 8.042 -0.317 1
1 687 . 8 1 1 A 49 49 SER HA H 49 4.244 4.286 -0.042 1
1 690 . 8 1 1 A 49 49 SER C C 49 174.838 176.560 -1.722 1
1 691 . 8 1 1 A 49 49 SER CA C 49 59.366 60.811 -1.445 1
1 692 . 8 1 1 A 49 49 SER CB C 49 63.116 63.188 -0.072 1
1 693 . 8 1 1 A 49 49 SER N N 49 114.224 116.560 -2.336 1
1 694 . 8 1 1 A 50 50 GLN H H 50 8.548 8.007 0.541 1
1 695 . 8 1 1 A 50 50 GLN HA H 50 4.398 4.133 0.265 1
1 702 . 8 1 1 A 50 50 GLN C C 50 175.732 176.485 -0.753 1
1 703 . 8 1 1 A 50 50 GLN CA C 50 56.272 58.627 -2.355 1
1 704 . 8 1 1 A 50 50 GLN CB C 50 28.946 28.822 0.124 1
1 706 . 8 1 1 A 50 50 GLN N N 50 120.125 119.533 0.592 1
1 708 . 8 1 1 A 51 51 ASN H H 51 8.534 8.048 0.486 1
1 709 . 8 1 1 A 51 51 ASN HA H 51 4.980 4.889 0.091 1
1 714 . 8 1 1 A 51 51 ASN C C 51 173.717 173.805 -0.088 1
1 715 . 8 1 1 A 51 51 ASN CA C 51 52.804 52.595 0.209 1
1 716 . 8 1 1 A 51 51 ASN CB C 51 39.583 39.512 0.071 1
1 717 . 8 1 1 A 51 51 ASN N N 51 118.158 113.745 4.413 1
1 719 . 8 1 1 A 52 52 ILE H H 52 7.492 7.590 -0.098 1
1 720 . 8 1 1 A 52 52 ILE HA H 52 5.338 5.480 -0.142 1
1 730 . 8 1 1 A 52 52 ILE C C 52 175.049 174.113 0.936 1
1 731 . 8 1 1 A 52 52 ILE CA C 52 59.364 59.544 -0.180 1
1 732 . 8 1 1 A 52 52 ILE CB C 52 42.163 42.042 0.121 1
1 736 . 8 1 1 A 52 52 ILE N N 52 117.927 121.335 -3.408 1
1 737 . 8 1 1 A 53 53 LYS H H 53 8.467 9.041 -0.574 1
1 738 . 8 1 1 A 53 53 LYS HA H 53 5.044 5.279 -0.235 1
1 747 . 8 1 1 A 53 53 LYS C C 53 175.082 175.320 -0.238 1
1 748 . 8 1 1 A 53 53 LYS CA C 53 55.429 54.799 0.630 1
1 749 . 8 1 1 A 53 53 LYS CB C 53 36.446 36.892 -0.446 1
1 753 . 8 1 1 A 53 53 LYS N N 53 123.249 127.298 -4.049 1
1 754 . 8 1 1 A 54 54 VAL H H 54 8.490 8.602 -0.112 1
1 755 . 8 1 1 A 54 54 VAL HA H 54 5.159 4.884 0.275 1
1 763 . 8 1 1 A 54 54 VAL C C 54 173.473 173.684 -0.211 1
1 764 . 8 1 1 A 54 54 VAL CA C 54 60.163 60.828 -0.665 1
1 765 . 8 1 1 A 54 54 VAL CB C 54 35.509 33.946 1.563 1
1 768 . 8 1 1 A 54 54 VAL N N 54 120.762 124.032 -3.270 1
1 769 . 8 1 1 A 55 55 LEU H H 55 8.636 8.949 -0.313 1
1 770 . 8 1 1 A 55 55 LEU HA H 55 4.670 4.703 -0.033 1
1 780 . 8 1 1 A 55 55 LEU C C 55 173.652 174.606 -0.954 1
1 781 . 8 1 1 A 55 55 LEU CA C 55 52.289 53.080 -0.791 1
1 782 . 8 1 1 A 55 55 LEU CB C 55 42.070 43.424 -1.354 1
1 786 . 8 1 1 A 55 55 LEU N N 55 131.898 129.326 2.572 1
1 787 . 8 1 1 A 56 56 ILE H H 56 9.188 9.274 -0.086 1
1 788 . 8 1 1 A 56 56 ILE HA H 56 4.879 5.197 -0.318 1
1 798 . 8 1 1 A 56 56 ILE C C 56 174.172 174.411 -0.239 1
1 799 . 8 1 1 A 56 56 ILE CA C 56 59.976 59.826 0.150 1
1 800 . 8 1 1 A 56 56 ILE CB C 56 38.181 39.252 -1.071 1
1 804 . 8 1 1 A 56 56 ILE N N 56 126.373 128.769 -2.396 1
1 805 . 8 1 1 A 57 57 LEU H H 57 8.929 9.119 -0.190 1
1 806 . 8 1 1 A 57 57 LEU HA H 57 5.394 5.079 0.315 1
1 816 . 8 1 1 A 57 57 LEU C C 57 175.358 175.669 -0.311 1
1 817 . 8 1 1 A 57 57 LEU CA C 57 52.086 53.502 -1.416 1
1 818 . 8 1 1 A 57 57 LEU CB C 57 42.445 43.177 -0.732 1
1 822 . 8 1 1 A 57 57 LEU N N 57 126.547 128.225 -1.678 1
1 823 . 8 1 1 A 58 58 VAL H H 58 8.542 9.166 -0.624 1
1 824 . 8 1 1 A 58 58 VAL HA H 58 5.253 4.889 0.364 1
1 832 . 8 1 1 A 58 58 VAL C C 58 175.244 175.605 -0.361 1
1 833 . 8 1 1 A 58 58 VAL CA C 58 58.241 59.370 -1.129 1
1 834 . 8 1 1 A 58 58 VAL CB C 58 33.165 34.452 -1.287 1
1 837 . 8 1 1 A 58 58 VAL N N 58 114.398 121.873 -7.475 1
1 838 . 8 1 1 A 59 59 SER H H 59 8.797 8.570 0.227 1
1 839 . 8 1 1 A 59 59 SER HA H 59 5.063 4.561 0.502 1
1 842 . 8 1 1 A 59 59 SER C C 59 174.172 173.904 0.268 1
1 843 . 8 1 1 A 59 59 SER CA C 59 59.320 59.818 -0.498 1
1 844 . 8 1 1 A 59 59 SER CB C 59 65.600 64.266 1.334 1
1 845 . 8 1 1 A 59 59 SER N N 59 115.497 116.336 -0.839 1
1 846 . 8 1 1 A 60 60 ASN H H 60 7.730 7.981 -0.251 1
1 847 . 8 1 1 A 60 60 ASN HA H 60 4.811 5.094 -0.283 1
1 852 . 8 1 1 A 60 60 ASN C C 60 174.464 175.469 -1.005 1
1 853 . 8 1 1 A 60 60 ASN CA C 60 52.007 52.238 -0.231 1
1 854 . 8 1 1 A 60 60 ASN CB C 60 40.336 41.179 -0.843 1
1 855 . 8 1 1 A 60 60 ASN N N 60 117.522 116.750 0.772 1
1 857 . 8 1 1 A 61 61 ASP H H 61 8.577 9.017 -0.440 1
1 858 . 8 1 1 A 61 61 ASP HA H 61 4.365 4.322 0.043 1
1 861 . 8 1 1 A 61 61 ASP C C 61 177.357 178.455 -1.098 1
1 862 . 8 1 1 A 61 61 ASP CA C 61 57.351 56.947 0.404 1
1 863 . 8 1 1 A 61 61 ASP CB C 61 40.383 39.742 0.641 1
1 864 . 8 1 1 A 61 61 ASP N N 61 119.431 122.630 -3.199 1
1 865 . 8 1 1 A 62 62 GLU H H 62 8.405 8.101 0.304 1
1 866 . 8 1 1 A 62 62 GLU HA H 62 4.121 4.009 0.112 1
1 871 . 8 1 1 A 62 62 GLU C C 62 179.615 179.547 0.068 1
1 872 . 8 1 1 A 62 62 GLU CA C 62 59.593 59.579 0.014 1
1 873 . 8 1 1 A 62 62 GLU CB C 62 28.478 29.539 -1.061 1
1 875 . 8 1 1 A 62 62 GLU N N 62 122.150 120.105 2.045 1
1 876 . 8 1 1 A 63 63 GLU H H 63 8.384 8.189 0.195 1
1 877 . 8 1 1 A 63 63 GLU HA H 63 3.913 3.978 -0.065 1
1 882 . 8 1 1 A 63 63 GLU C C 63 178.478 179.059 -0.581 1
1 883 . 8 1 1 A 63 63 GLU CA C 63 58.273 59.111 -0.838 1
1 884 . 8 1 1 A 63 63 GLU CB C 63 29.931 28.996 0.935 1
1 886 . 8 1 1 A 63 63 GLU N N 63 119.084 120.630 -1.546 1
1 887 . 8 1 1 A 64 64 LEU H H 64 7.717 7.900 -0.183 1
1 888 . 8 1 1 A 64 64 LEU HA H 64 3.750 4.041 -0.291 1
1 898 . 8 1 1 A 64 64 LEU C C 64 177.535 178.045 -0.510 1
1 899 . 8 1 1 A 64 64 LEU CA C 64 58.944 58.032 0.912 1
1 900 . 8 1 1 A 64 64 LEU CB C 64 41.695 41.481 0.214 1
1 904 . 8 1 1 A 64 64 LEU N N 64 120.357 122.164 -1.807 1
1 905 . 8 1 1 A 65 65 ASP H H 65 7.922 8.056 -0.134 1
1 906 . 8 1 1 A 65 65 ASP HA H 65 4.313 4.329 -0.016 1
1 909 . 8 1 1 A 65 65 ASP C C 65 179.095 179.032 0.063 1
1 910 . 8 1 1 A 65 65 ASP CA C 65 57.272 57.244 0.028 1
1 911 . 8 1 1 A 65 65 ASP CB C 65 40.196 40.427 -0.231 1
1 912 . 8 1 1 A 65 65 ASP N N 65 118.100 118.174 -0.074 1
1 913 . 8 1 1 A 66 66 LYS H H 66 7.802 8.053 -0.251 1
1 914 . 8 1 1 A 66 66 LYS HA H 66 4.078 3.917 0.161 1
1 923 . 8 1 1 A 66 66 LYS C C 66 178.624 178.867 -0.243 1
1 924 . 8 1 1 A 66 66 LYS CA C 66 58.429 59.665 -1.236 1
1 925 . 8 1 1 A 66 66 LYS CB C 66 31.727 32.355 -0.628 1
1 929 . 8 1 1 A 66 66 LYS N N 66 119.343 119.147 0.196 1
1 930 . 8 1 1 A 67 67 ALA H H 67 8.480 8.398 0.082 1
1 931 . 8 1 1 A 67 67 ALA HA H 67 3.853 4.085 -0.232 1
1 935 . 8 1 1 A 67 67 ALA C C 67 178.591 179.648 -1.057 1
1 936 . 8 1 1 A 67 67 ALA CA C 67 55.403 54.971 0.432 1
1 937 . 8 1 1 A 67 67 ALA CB C 67 17.793 18.483 -0.690 1
1 938 . 8 1 1 A 67 67 ALA N N 67 121.562 122.488 -0.926 1
1 939 . 8 1 1 A 68 68 LYS H H 68 8.186 7.641 0.545 1
1 940 . 8 1 1 A 68 68 LYS HA H 68 3.805 4.094 -0.289 1
1 949 . 8 1 1 A 68 68 LYS C C 68 179.095 178.689 0.406 1
1 950 . 8 1 1 A 68 68 LYS CA C 68 59.952 58.744 1.208 1
1 951 . 8 1 1 A 68 68 LYS CB C 68 32.181 31.560 0.621 1
1 955 . 8 1 1 A 68 68 LYS N N 68 116.165 116.653 -0.488 1
1 956 . 8 1 1 A 69 69 GLU H H 69 7.904 8.256 -0.352 1
1 957 . 8 1 1 A 69 69 GLU HA H 69 3.995 4.052 -0.057 1
1 962 . 8 1 1 A 69 69 GLU C C 69 179.079 179.148 -0.069 1
1 963 . 8 1 1 A 69 69 GLU CA C 69 59.022 58.992 0.030 1
1 964 . 8 1 1 A 69 69 GLU CB C 69 29.274 29.488 -0.214 1
1 966 . 8 1 1 A 69 69 GLU N N 69 119.489 119.559 -0.070 1
1 967 . 8 1 1 A 70 70 LEU H H 70 7.962 7.823 0.139 1
1 968 . 8 1 1 A 70 70 LEU HA H 70 4.020 4.002 0.018 1
1 978 . 8 1 1 A 70 70 LEU C C 70 178.738 179.345 -0.607 1
1 979 . 8 1 1 A 70 70 LEU CA C 70 57.486 58.029 -0.543 1
1 980 . 8 1 1 A 70 70 LEU CB C 70 41.695 41.574 0.121 1
1 984 . 8 1 1 A 70 70 LEU N N 70 119.431 120.805 -1.374 1
1 985 . 8 1 1 A 71 71 ALA H H 71 8.260 8.047 0.213 1
1 986 . 8 1 1 A 71 71 ALA HA H 71 3.845 4.073 -0.228 1
1 990 . 8 1 1 A 71 71 ALA C C 71 179.518 180.362 -0.844 1
1 991 . 8 1 1 A 71 71 ALA CA C 71 55.139 55.615 -0.476 1
1 992 . 8 1 1 A 71 71 ALA CB C 71 18.487 18.088 0.399 1
1 993 . 8 1 1 A 71 71 ALA N N 71 119.604 122.140 -2.536 1
1 994 . 8 1 1 A 72 72 GLN H H 72 7.910 8.330 -0.420 1
1 995 . 8 1 1 A 72 72 GLN HA H 72 4.154 4.091 0.063 1
1 1002 . 8 1 1 A 72 72 GLN C C 72 178.900 178.839 0.061 1
1 1003 . 8 1 1 A 72 72 GLN CA C 72 58.194 58.338 -0.144 1
1 1004 . 8 1 1 A 72 72 GLN CB C 72 28.056 28.332 -0.276 1
1 1006 . 8 1 1 A 72 72 GLN N N 72 115.960 117.067 -1.107 1
1 1008 . 8 1 1 A 73 73 LYS H H 73 7.841 8.228 -0.387 1
1 1009 . 8 1 1 A 73 73 LYS HA H 73 4.171 4.051 0.120 1
1 1018 . 8 1 1 A 73 73 LYS C C 73 177.730 178.240 -0.510 1
1 1019 . 8 1 1 A 73 73 LYS CA C 73 57.867 58.695 -0.828 1
1 1020 . 8 1 1 A 73 73 LYS CB C 73 32.277 32.238 0.039 1
1 1024 . 8 1 1 A 73 73 LYS N N 73 119.027 120.210 -1.183 1
1 1025 . 8 1 1 A 74 74 MET H H 74 7.746 7.602 0.144 1
1 1026 . 8 1 1 A 74 74 MET HA H 74 4.403 4.573 -0.170 1
1 1034 . 8 1 1 A 74 74 MET C C 74 174.416 174.797 -0.381 1
1 1035 . 8 1 1 A 74 74 MET CA C 74 55.194 55.260 -0.066 1
1 1036 . 8 1 1 A 74 74 MET CB C 74 33.366 33.026 0.340 1
1 1039 . 8 1 1 A 74 74 MET N N 74 115.786 115.424 0.362 1
1 1040 . 8 1 1 A 75 75 GLU H H 75 8.076 8.099 -0.023 1
1 1041 . 8 1 1 A 75 75 GLU HA H 75 4.001 3.997 0.004 1
1 1046 . 8 1 1 A 75 75 GLU C C 75 175.130 175.677 -0.547 1
1 1047 . 8 1 1 A 75 75 GLU CA C 75 56.722 57.548 -0.826 1
1 1048 . 8 1 1 A 75 75 GLU CB C 75 27.118 27.126 -0.008 1
1 1050 . 8 1 1 A 75 75 GLU N N 75 116.249 115.592 0.657 1
1 1051 . 8 1 1 A 76 76 ILE H H 76 7.560 8.224 -0.664 1
1 1052 . 8 1 1 A 76 76 ILE HA H 76 4.428 4.142 0.286 1
1 1062 . 8 1 1 A 76 76 ILE C C 76 174.529 175.023 -0.494 1
1 1063 . 8 1 1 A 76 76 ILE CA C 76 58.475 61.057 -2.582 1
1 1064 . 8 1 1 A 76 76 ILE CB C 76 40.337 37.913 2.424 1
1 1068 . 8 1 1 A 76 76 ILE N N 76 115.960 120.277 -4.317 1
1 1069 . 8 1 1 A 77 77 ASP H H 77 8.889 8.879 0.010 1
1 1070 . 8 1 1 A 77 77 ASP HA H 77 4.569 4.920 -0.351 1
1 1073 . 8 1 1 A 77 77 ASP C C 77 174.123 175.894 -1.771 1
1 1074 . 8 1 1 A 77 77 ASP CA C 77 54.069 53.535 0.534 1
1 1075 . 8 1 1 A 77 77 ASP CB C 77 40.233 41.307 -1.074 1
1 1076 . 8 1 1 A 77 77 ASP N N 77 126.142 128.842 -2.700 1
1 1077 . 8 1 1 A 78 78 VAL H H 78 7.754 8.846 -1.092 1
1 1078 . 8 1 1 A 78 78 VAL HA H 78 5.192 4.908 0.284 1
1 1086 . 8 1 1 A 78 78 VAL C C 78 174.968 174.131 0.837 1
1 1087 . 8 1 1 A 78 78 VAL CA C 78 58.804 58.735 0.069 1
1 1088 . 8 1 1 A 78 78 VAL CB C 78 35.293 35.649 -0.356 1
1 1091 . 8 1 1 A 78 78 VAL N N 78 122.844 119.894 2.950 1
1 1092 . 8 1 1 A 79 79 ARG H H 79 8.499 8.853 -0.354 1
1 1093 . 8 1 1 A 79 79 ARG HA H 79 4.712 4.578 0.134 1
1 1100 . 8 1 1 A 79 79 ARG C C 79 174.221 174.728 -0.507 1
1 1101 . 8 1 1 A 79 79 ARG CA C 79 54.117 55.360 -1.243 1
1 1102 . 8 1 1 A 79 79 ARG CB C 79 31.196 29.897 1.299 1
1 1105 . 8 1 1 A 79 79 ARG N N 79 125.637 122.087 3.550 1
1 1106 . 8 1 1 A 80 80 THR H H 80 8.416 8.892 -0.476 1
1 1107 . 8 1 1 A 80 80 THR HA H 80 5.332 4.835 0.497 1
1 1112 . 8 1 1 A 80 80 THR C C 80 174.497 173.993 0.504 1
1 1113 . 8 1 1 A 80 80 THR CA C 80 59.694 62.015 -2.321 1
1 1114 . 8 1 1 A 80 80 THR CB C 80 69.772 68.750 1.022 1
1 1116 . 8 1 1 A 80 80 THR N N 80 118.084 121.745 -3.661 1
1 1117 . 8 1 1 A 81 81 ARG H H 81 8.758 9.026 -0.268 1
1 1118 . 8 1 1 A 81 81 ARG HA H 81 4.362 4.895 -0.533 1
1 1126 . 8 1 1 A 81 81 ARG C C 81 173.733 174.100 -0.367 1
1 1127 . 8 1 1 A 81 81 ARG CA C 81 53.273 53.849 -0.576 1
1 1128 . 8 1 1 A 81 81 ARG CB C 81 33.915 33.137 0.778 1
1 1131 . 8 1 1 A 81 81 ARG N N 81 122.844 126.158 -3.314 1
1 1133 . 8 1 1 A 82 82 LYS H H 82 8.721 8.611 0.110 1
1 1134 . 8 1 1 A 82 82 LYS HA H 82 4.701 5.286 -0.585 1
1 1143 . 8 1 1 A 82 82 LYS C C 82 175.667 175.618 0.049 1
1 1144 . 8 1 1 A 82 82 LYS CA C 82 54.960 54.763 0.197 1
1 1145 . 8 1 1 A 82 82 LYS CB C 82 32.603 34.972 -2.369 1
1 1149 . 8 1 1 A 82 82 LYS N N 82 124.668 123.330 1.338 1
1 1150 . 8 1 1 A 83 83 VAL H H 83 9.112 9.321 -0.209 1
1 1151 . 8 1 1 A 83 83 VAL HA H 83 4.796 4.978 -0.182 1
1 1159 . 8 1 1 A 83 83 VAL C C 83 174.594 175.472 -0.878 1
1 1160 . 8 1 1 A 83 83 VAL CA C 83 59.413 60.258 -0.845 1
1 1161 . 8 1 1 A 83 83 VAL CB C 83 35.298 34.483 0.815 1
1 1164 . 8 1 1 A 83 83 VAL N N 83 122.381 122.998 -0.617 1
1 1165 . 8 1 1 A 84 84 THR H H 84 9.200 8.720 0.480 1
1 1166 . 8 1 1 A 84 84 THR HA H 84 4.579 4.516 0.063 1
1 1171 . 8 1 1 A 84 84 THR C C 84 173.993 174.597 -0.604 1
1 1172 . 8 1 1 A 84 84 THR CA C 84 60.960 62.359 -1.399 1
1 1173 . 8 1 1 A 84 84 THR CB C 84 70.100 69.924 0.176 1
1 1175 . 8 1 1 A 84 84 THR N N 84 113.183 114.936 -1.753 1
1 1176 . 8 1 1 A 85 85 SER H H 85 7.688 8.250 -0.562 1
1 1177 . 8 1 1 A 85 85 SER HA H 85 5.136 4.671 0.465 1
1 1180 . 8 1 1 A 85 85 SER CA C 85 55.205 56.403 -1.198 1
1 1181 . 8 1 1 A 85 85 SER CB C 85 64.376 63.569 0.807 1
1 1182 . 8 1 1 A 85 85 SER N N 85 115.555 116.366 -0.811 1
1 1183 . 8 1 1 A 86 86 PRO HA H 86 4.090 4.319 -0.229 1
1 1190 . 8 1 1 A 86 86 PRO C C 86 177.227 177.979 -0.752 1
1 1191 . 8 1 1 A 86 86 PRO CA C 86 65.038 65.766 -0.728 1
1 1192 . 8 1 1 A 86 86 PRO CB C 86 31.711 31.756 -0.045 1
1 1195 . 8 1 1 A 87 87 ASP H H 87 8.131 8.533 -0.402 1
1 1196 . 8 1 1 A 87 87 ASP HA H 87 4.223 4.339 -0.116 1
1 1199 . 8 1 1 A 87 87 ASP C C 87 178.721 179.191 -0.470 1
1 1200 . 8 1 1 A 87 87 ASP CA C 87 57.311 56.773 0.538 1
1 1201 . 8 1 1 A 87 87 ASP CB C 87 40.102 40.195 -0.093 1
1 1202 . 8 1 1 A 87 87 ASP N N 87 115.381 116.515 -1.134 1
1 1203 . 8 1 1 A 88 88 GLU H H 88 7.571 8.044 -0.473 1
1 1204 . 8 1 1 A 88 88 GLU HA H 88 3.659 4.050 -0.391 1
1 1209 . 8 1 1 A 88 88 GLU C C 88 177.097 178.671 -1.574 1
1 1210 . 8 1 1 A 88 88 GLU CA C 88 58.729 58.906 -0.177 1
1 1211 . 8 1 1 A 88 88 GLU CB C 88 30.052 29.565 0.487 1
1 1213 . 8 1 1 A 88 88 GLU N N 88 120.009 121.420 -1.411 1
1 1214 . 8 1 1 A 89 89 ALA H H 89 7.423 7.544 -0.121 1
1 1215 . 8 1 1 A 89 89 ALA HA H 89 3.900 4.366 -0.466 1
1 1219 . 8 1 1 A 89 89 ALA C C 89 178.267 180.012 -1.745 1
1 1220 . 8 1 1 A 89 89 ALA CA C 89 55.607 55.176 0.431 1
1 1221 . 8 1 1 A 89 89 ALA CB C 89 17.348 18.443 -1.095 1
1 1222 . 8 1 1 A 89 89 ALA N N 89 118.873 122.171 -3.298 1
1 1223 . 8 1 1 A 90 90 LYS H H 90 8.046 8.380 -0.334 1
1 1224 . 8 1 1 A 90 90 LYS HA H 90 3.669 3.986 -0.317 1
1 1233 . 8 1 1 A 90 90 LYS C C 90 177.649 179.081 -1.432 1
1 1234 . 8 1 1 A 90 90 LYS CA C 90 60.351 59.796 0.555 1
1 1235 . 8 1 1 A 90 90 LYS CB C 90 32.087 32.312 -0.225 1
1 1239 . 8 1 1 A 90 90 LYS N N 90 114.834 117.342 -2.508 1
1 1240 . 8 1 1 A 91 91 ARG H H 91 7.468 7.897 -0.429 1
1 1241 . 8 1 1 A 91 91 ARG HA H 91 3.887 3.902 -0.015 1
1 1249 . 8 1 1 A 91 91 ARG C C 91 178.998 179.093 -0.095 1
1 1250 . 8 1 1 A 91 91 ARG CA C 91 59.164 59.119 0.045 1
1 1251 . 8 1 1 A 91 91 ARG CB C 91 29.274 29.710 -0.436 1
1 1254 . 8 1 1 A 91 91 ARG N N 91 119.029 119.333 -0.304 1
1 1256 . 8 1 1 A 92 92 TRP H H 92 8.136 8.097 0.039 1
1 1257 . 8 1 1 A 92 92 TRP HA H 92 4.818 4.551 0.267 1
1 1266 . 8 1 1 A 92 92 TRP C C 92 179.566 179.080 0.486 1
1 1267 . 8 1 1 A 92 92 TRP CA C 92 58.663 59.480 -0.817 1
1 1268 . 8 1 1 A 92 92 TRP CB C 92 29.790 29.395 0.395 1
1 1274 . 8 1 1 A 92 92 TRP N N 92 118.100 120.345 -2.245 1
1 1276 . 8 1 1 A 93 93 ILE H H 93 8.363 8.425 -0.062 1
1 1277 . 8 1 1 A 93 93 ILE HA H 93 3.544 3.790 -0.246 1
1 1287 . 8 1 1 A 93 93 ILE C C 93 176.820 178.180 -1.360 1
1 1288 . 8 1 1 A 93 93 ILE CA C 93 66.225 65.304 0.921 1
1 1289 . 8 1 1 A 93 93 ILE CB C 93 37.571 37.364 0.207 1
1 1293 . 8 1 1 A 93 93 ILE N N 93 120.588 120.446 0.142 1
1 1294 . 8 1 1 A 94 94 LYS H H 94 8.264 7.821 0.443 1
1 1295 . 8 1 1 A 94 94 LYS HA H 94 3.865 4.128 -0.263 1
1 1304 . 8 1 1 A 94 94 LYS C C 94 179.258 178.498 0.760 1
1 1305 . 8 1 1 A 94 94 LYS CA C 94 59.889 59.764 0.125 1
1 1306 . 8 1 1 A 94 94 LYS CB C 94 32.225 31.944 0.281 1
1 1310 . 8 1 1 A 94 94 LYS N N 94 121.687 121.541 0.146 1
1 1311 . 8 1 1 A 95 95 GLU H H 95 8.360 8.539 -0.179 1
1 1312 . 8 1 1 A 95 95 GLU HA H 95 4.023 4.052 -0.029 1
1 1317 . 8 1 1 A 95 95 GLU C C 95 178.884 179.361 -0.477 1
1 1318 . 8 1 1 A 95 95 GLU CA C 95 59.366 59.705 -0.339 1
1 1319 . 8 1 1 A 95 95 GLU CB C 95 29.508 29.430 0.078 1
1 1321 . 8 1 1 A 95 95 GLU N N 95 118.505 117.943 0.562 1
1 1322 . 8 1 1 A 96 96 PHE H H 96 8.212 8.460 -0.248 1
1 1323 . 8 1 1 A 96 96 PHE HA H 96 4.512 4.315 0.197 1
1 1331 . 8 1 1 A 96 96 PHE C C 96 176.820 178.004 -1.184 1
1 1332 . 8 1 1 A 96 96 PHE CA C 96 59.608 61.279 -1.671 1
1 1333 . 8 1 1 A 96 96 PHE CB C 96 40.431 39.156 1.275 1
1 1339 . 8 1 1 A 96 96 PHE N N 96 120.369 121.988 -1.619 1
1 1340 . 8 1 1 A 97 97 SER H H 97 8.216 8.617 -0.401 1
1 1341 . 8 1 1 A 97 97 SER HA H 97 3.816 4.160 -0.344 1
1 1344 . 8 1 1 A 97 97 SER C C 97 175.618 177.542 -1.924 1
1 1345 . 8 1 1 A 97 97 SER CA C 97 60.492 61.183 -0.691 1
1 1346 . 8 1 1 A 97 97 SER CB C 97 63.022 62.621 0.401 1
1 1347 . 8 1 1 A 97 97 SER N N 97 111.969 113.650 -1.681 1
1 1348 . 8 1 1 A 98 98 GLU H H 98 7.655 7.471 0.184 1
1 1349 . 8 1 1 A 98 98 GLU HA H 98 4.187 4.222 -0.035 1
1 1354 . 8 1 1 A 98 98 GLU C C 98 177.698 179.060 -1.362 1
1 1355 . 8 1 1 A 98 98 GLU CA C 98 57.069 59.089 -2.020 1
1 1356 . 8 1 1 A 98 98 GLU CB C 98 29.321 29.707 -0.386 1
1 1358 . 8 1 1 A 98 98 GLU N N 98 120.588 124.159 -3.571 1
1 1359 . 8 1 1 A 99 99 GLU H H 99 7.794 7.898 -0.104 1
1 1360 . 8 1 1 A 99 99 GLU HA H 99 4.123 4.178 -0.055 1
1 1365 . 8 1 1 A 99 99 GLU C C 99 177.665 177.144 0.521 1
1 1366 . 8 1 1 A 99 99 GLU CA C 99 57.304 57.245 0.059 1
1 1367 . 8 1 1 A 99 99 GLU CB C 99 29.368 30.413 -1.045 1
1 1369 . 8 1 1 A 99 99 GLU N N 99 120.067 117.349 2.718 1
1 1370 . 8 1 1 A 100 100 GLY H H 100 8.138 7.897 0.241 1
1 1371 . 8 1 1 A 100 100 GLY HA2 H 100 3.865 3.677 0.188 1
1 1372 . 8 1 1 A 100 100 GLY HA3 H 100 3.715 3.780 -0.065 1
1 1373 . 8 1 1 A 100 100 GLY C C 100 174.464 174.724 -0.260 1
1 1374 . 8 1 1 A 100 100 GLY CA C 100 45.305 47.156 -1.851 1
1 1375 . 8 1 1 A 100 100 GLY N N 100 107.802 109.302 -1.500 1
1 1376 . 8 1 1 A 101 101 GLY H H 101 8.023 8.572 -0.549 1
1 1377 . 8 1 1 A 101 101 GLY HA2 H 101 3.865 4.108 -0.243 1
1 1378 . 8 1 1 A 101 101 GLY HA3 H 101 3.892 4.130 -0.238 1
1 1379 . 8 1 1 A 101 101 GLY C C 101 174.204 174.022 0.182 1
1 1380 . 8 1 1 A 101 101 GLY CA C 101 45.036 45.424 -0.388 1
1 1381 . 8 1 1 A 101 101 GLY N N 101 108.032 110.642 -2.610 1
1 1382 . 8 1 1 A 102 102 SER H H 102 8.059 8.125 -0.066 1
1 1383 . 8 1 1 A 102 102 SER HA H 102 4.380 4.209 0.171 1
1 1386 . 8 1 1 A 102 102 SER C C 102 174.627 174.626 0.001 1
1 1387 . 8 1 1 A 102 102 SER CA C 102 58.194 58.898 -0.704 1
1 1388 . 8 1 1 A 102 102 SER CB C 102 63.538 61.759 1.779 1
1 1389 . 8 1 1 A 102 102 SER N N 102 115.266 113.895 1.371 1
1 1390 . 8 1 1 A 103 103 LEU H H 103 8.287 8.198 0.089 1
1 1391 . 8 1 1 A 103 103 LEU HA H 103 4.301 4.121 0.180 1
1 1401 . 8 1 1 A 103 103 LEU C C 103 177.292 176.849 0.443 1
1 1402 . 8 1 1 A 103 103 LEU CA C 103 55.007 57.049 -2.042 1
1 1403 . 8 1 1 A 103 103 LEU CB C 103 42.023 42.038 -0.015 1
1 1407 . 8 1 1 A 103 103 LEU N N 103 123.596 128.473 -4.877 1
1 1408 . 8 1 1 A 104 104 GLU H H 104 8.216 7.907 0.309 1
1 1409 . 8 1 1 A 104 104 GLU HA H 104 4.126 4.798 -0.672 1
1 1414 . 8 1 1 A 104 104 GLU CA C 104 56.518 54.872 1.646 1
1 1415 . 8 1 1 A 104 104 GLU CB C 104 29.837 33.205 -3.368 1
1 1417 . 8 1 1 A 104 104 GLU N N 104 120.510 113.557 6.953 1
1 1418 . 8 1 1 A 105 105 HIS HA H 105 4.593 5.150 -0.557 1
1 1421 . 8 1 1 A 105 105 HIS C C 105 173.766 174.521 -0.755 1
1 1422 . 8 1 1 A 105 105 HIS CA C 105 55.536 54.611 0.925 1
1 1423 . 8 1 1 A 105 105 HIS CB C 105 30.001 32.231 -2.230 1
1 1424 . 8 1 1 A 106 106 HIS H H 106 8.154 8.726 -0.572 1
1 1425 . 8 1 1 A 106 106 HIS HA H 106 4.407 4.234 0.173 1
1 1428 . 8 1 1 A 106 106 HIS CA C 106 56.920 59.031 -2.111 1
1 1429 . 8 1 1 A 106 106 HIS CB C 106 30.001 30.050 -0.049 1
1 14 . 9 1 1 A 2 2 LEU H H 2 8.509 8.933 -0.424 1
1 15 . 9 1 1 A 2 2 LEU HA H 2 4.463 4.480 -0.017 1
1 25 . 9 1 1 A 2 2 LEU C C 2 173.944 176.238 -2.294 1
1 26 . 9 1 1 A 2 2 LEU CA C 2 54.471 55.136 -0.665 1
1 27 . 9 1 1 A 2 2 LEU CB C 2 43.595 41.782 1.813 1
1 31 . 9 1 1 A 2 2 LEU N N 2 127.160 126.652 0.508 1
1 32 . 9 1 1 A 3 3 LEU H H 3 7.844 8.471 -0.627 1
1 33 . 9 1 1 A 3 3 LEU HA H 3 5.128 5.520 -0.392 1
1 43 . 9 1 1 A 3 3 LEU C C 3 175.423 175.080 0.343 1
1 44 . 9 1 1 A 3 3 LEU CA C 3 53.566 52.708 0.858 1
1 45 . 9 1 1 A 3 3 LEU CB C 3 44.039 44.243 -0.204 1
1 49 . 9 1 1 A 3 3 LEU N N 3 122.555 125.115 -2.560 1
1 50 . 9 1 1 A 4 4 TYR H H 4 8.360 9.100 -0.740 1
1 51 . 9 1 1 A 4 4 TYR HA H 4 5.143 5.268 -0.125 1
1 58 . 9 1 1 A 4 4 TYR C C 4 174.481 174.863 -0.382 1
1 59 . 9 1 1 A 4 4 TYR CA C 4 56.577 55.989 0.588 1
1 60 . 9 1 1 A 4 4 TYR CB C 4 43.840 43.130 0.710 1
1 65 . 9 1 1 A 4 4 TYR N N 4 119.315 122.925 -3.610 1
1 66 . 9 1 1 A 5 5 VAL H H 5 8.918 8.851 0.067 1
1 67 . 9 1 1 A 5 5 VAL HA H 5 5.106 4.993 0.113 1
1 75 . 9 1 1 A 5 5 VAL C C 5 174.042 174.936 -0.894 1
1 76 . 9 1 1 A 5 5 VAL CA C 5 59.852 60.436 -0.584 1
1 77 . 9 1 1 A 5 5 VAL CB C 5 33.816 35.577 -1.761 1
1 80 . 9 1 1 A 5 5 VAL N N 5 119.952 120.245 -0.293 1
1 81 . 9 1 1 A 6 6 LEU H H 6 9.315 9.242 0.073 1
1 82 . 9 1 1 A 6 6 LEU HA H 6 5.466 5.387 0.079 1
1 92 . 9 1 1 A 6 6 LEU C C 6 175.049 174.962 0.087 1
1 93 . 9 1 1 A 6 6 LEU CA C 6 52.090 53.349 -1.259 1
1 94 . 9 1 1 A 6 6 LEU CB C 6 44.103 44.607 -0.504 1
1 98 . 9 1 1 A 6 6 LEU N N 6 126.917 126.271 0.646 1
1 99 . 9 1 1 A 7 7 ILE H H 7 8.458 9.028 -0.570 1
1 100 . 9 1 1 A 7 7 ILE HA H 7 5.131 5.254 -0.123 1
1 110 . 9 1 1 A 7 7 ILE C C 7 173.213 173.763 -0.550 1
1 111 . 9 1 1 A 7 7 ILE CA C 7 58.463 59.494 -1.031 1
1 112 . 9 1 1 A 7 7 ILE CB C 7 41.020 41.090 -0.070 1
1 116 . 9 1 1 A 7 7 ILE N N 7 119.778 126.766 -6.988 1
1 117 . 9 1 1 A 8 8 ILE H H 8 8.797 9.419 -0.622 1
1 118 . 9 1 1 A 8 8 ILE HA H 8 4.611 4.898 -0.287 1
1 128 . 9 1 1 A 8 8 ILE C C 8 174.611 174.841 -0.230 1
1 129 . 9 1 1 A 8 8 ILE CA C 8 60.227 60.411 -0.184 1
1 130 . 9 1 1 A 8 8 ILE CB C 8 37.665 39.063 -1.398 1
1 134 . 9 1 1 A 8 8 ILE N N 8 128.919 129.715 -0.796 1
1 135 . 9 1 1 A 9 9 SER H H 9 7.811 8.795 -0.984 1
1 136 . 9 1 1 A 9 9 SER HA H 9 4.429 4.956 -0.527 1
1 140 . 9 1 1 A 9 9 SER C C 9 172.937 172.754 0.183 1
1 141 . 9 1 1 A 9 9 SER CA C 9 58.241 56.953 1.288 1
1 142 . 9 1 1 A 9 9 SER CB C 9 64.261 64.178 0.083 1
1 143 . 9 1 1 A 9 9 SER N N 9 116.365 121.740 -5.375 1
1 144 . 9 1 1 A 10 10 ASN H H 10 8.641 8.593 0.048 1
1 145 . 9 1 1 A 10 10 ASN HA H 10 4.938 5.053 -0.115 1
1 150 . 9 1 1 A 10 10 ASN C C 10 174.497 174.787 -0.290 1
1 151 . 9 1 1 A 10 10 ASN CA C 10 52.221 53.065 -0.844 1
1 152 . 9 1 1 A 10 10 ASN CB C 10 39.128 39.362 -0.234 1
1 153 . 9 1 1 A 10 10 ASN N N 10 122.612 120.799 1.813 1
1 155 . 9 1 1 A 11 11 ASP H H 11 8.673 7.293 1.380 1
1 156 . 9 1 1 A 11 11 ASP HA H 11 4.596 4.844 -0.248 1
1 159 . 9 1 1 A 11 11 ASP C C 11 175.342 176.139 -0.797 1
1 160 . 9 1 1 A 11 11 ASP CA C 11 53.233 53.161 0.072 1
1 161 . 9 1 1 A 11 11 ASP CB C 11 40.965 41.028 -0.063 1
1 162 . 9 1 1 A 11 11 ASP N N 11 122.717 119.932 2.785 1
1 163 . 9 1 1 A 12 12 LYS H H 12 8.562 8.783 -0.221 1
1 164 . 9 1 1 A 12 12 LYS HA H 12 3.854 4.092 -0.238 1
1 173 . 9 1 1 A 12 12 LYS C C 12 178.754 178.444 0.310 1
1 174 . 9 1 1 A 12 12 LYS CA C 12 59.581 59.630 -0.049 1
1 175 . 9 1 1 A 12 12 LYS CB C 12 32.378 32.089 0.289 1
1 179 . 9 1 1 A 12 12 LYS N N 12 125.737 125.877 -0.140 1
1 180 . 9 1 1 A 13 13 LYS H H 13 8.075 7.870 0.205 1
1 181 . 9 1 1 A 13 13 LYS HA H 13 4.154 4.144 0.010 1
1 190 . 9 1 1 A 13 13 LYS C C 13 178.315 179.138 -0.823 1
1 191 . 9 1 1 A 13 13 LYS CA C 13 58.532 59.124 -0.592 1
1 192 . 9 1 1 A 13 13 LYS CB C 13 31.452 32.544 -1.092 1
1 196 . 9 1 1 A 13 13 LYS N N 13 119.604 119.892 -0.288 1
1 197 . 9 1 1 A 14 14 LEU H H 14 7.552 7.562 -0.010 1
1 198 . 9 1 1 A 14 14 LEU HA H 14 3.682 4.089 -0.407 1
1 208 . 9 1 1 A 14 14 LEU C C 14 178.429 178.393 0.036 1
1 209 . 9 1 1 A 14 14 LEU CA C 14 58.999 57.941 1.058 1
1 210 . 9 1 1 A 14 14 LEU CB C 14 41.228 41.631 -0.403 1
1 214 . 9 1 1 A 14 14 LEU N N 14 122.266 120.860 1.406 1
1 215 . 9 1 1 A 15 15 ILE H H 15 8.074 8.203 -0.129 1
1 216 . 9 1 1 A 15 15 ILE HA H 15 3.264 3.469 -0.205 1
1 226 . 9 1 1 A 15 15 ILE C C 15 177.000 177.760 -0.760 1
1 227 . 9 1 1 A 15 15 ILE CA C 15 65.939 65.559 0.380 1
1 228 . 9 1 1 A 15 15 ILE CB C 15 37.983 37.845 0.138 1
1 232 . 9 1 1 A 15 15 ILE N N 15 118.214 119.630 -1.416 1
1 233 . 9 1 1 A 16 16 GLU H H 16 8.016 8.649 -0.633 1
1 234 . 9 1 1 A 16 16 GLU HA H 16 4.045 3.914 0.131 1
1 239 . 9 1 1 A 16 16 GLU C C 16 179.388 179.682 -0.294 1
1 240 . 9 1 1 A 16 16 GLU CA C 16 59.032 59.936 -0.904 1
1 241 . 9 1 1 A 16 16 GLU CB C 16 29.200 29.244 -0.044 1
1 243 . 9 1 1 A 16 16 GLU N N 16 118.484 118.682 -0.198 1
1 244 . 9 1 1 A 17 17 GLU H H 17 8.063 7.907 0.156 1
1 245 . 9 1 1 A 17 17 GLU HA H 17 4.053 4.035 0.018 1
1 250 . 9 1 1 A 17 17 GLU C C 17 179.306 179.263 0.043 1
1 251 . 9 1 1 A 17 17 GLU CA C 17 58.636 59.413 -0.777 1
1 252 . 9 1 1 A 17 17 GLU CB C 17 29.011 29.242 -0.231 1
1 254 . 9 1 1 A 17 17 GLU N N 17 118.100 120.368 -2.268 1
1 255 . 9 1 1 A 18 18 ALA H H 18 8.655 7.965 0.690 1
1 256 . 9 1 1 A 18 18 ALA HA H 18 3.775 4.037 -0.262 1
1 260 . 9 1 1 A 18 18 ALA C C 18 178.559 179.732 -1.173 1
1 261 . 9 1 1 A 18 18 ALA CA C 18 54.960 55.332 -0.372 1
1 262 . 9 1 1 A 18 18 ALA CB C 18 17.960 18.199 -0.239 1
1 263 . 9 1 1 A 18 18 ALA N N 18 122.439 122.978 -0.539 1
1 264 . 9 1 1 A 19 19 ARG H H 19 8.900 7.798 1.102 1
1 265 . 9 1 1 A 19 19 ARG HA H 19 3.809 4.084 -0.275 1
1 273 . 9 1 1 A 19 19 ARG C C 19 178.721 178.916 -0.195 1
1 274 . 9 1 1 A 19 19 ARG CA C 19 59.976 59.642 0.334 1
1 275 . 9 1 1 A 19 19 ARG CB C 19 29.572 29.800 -0.228 1
1 278 . 9 1 1 A 19 19 ARG N N 19 118.563 117.629 0.934 1
1 280 . 9 1 1 A 20 20 LYS H H 20 7.792 8.130 -0.338 1
1 281 . 9 1 1 A 20 20 LYS HA H 20 4.052 4.039 0.013 1
1 290 . 9 1 1 A 20 20 LYS C C 20 179.648 179.666 -0.018 1
1 291 . 9 1 1 A 20 20 LYS CA C 20 59.296 59.275 0.021 1
1 292 . 9 1 1 A 20 20 LYS CB C 20 32.216 32.341 -0.125 1
1 296 . 9 1 1 A 20 20 LYS N N 20 118.638 119.440 -0.802 1
1 297 . 9 1 1 A 21 21 MET H H 21 7.684 8.046 -0.362 1
1 298 . 9 1 1 A 21 21 MET HA H 21 4.411 4.164 0.247 1
1 306 . 9 1 1 A 21 21 MET C C 21 177.909 178.328 -0.419 1
1 307 . 9 1 1 A 21 21 MET CA C 21 57.009 59.270 -2.261 1
1 308 . 9 1 1 A 21 21 MET CB C 21 32.028 32.461 -0.433 1
1 311 . 9 1 1 A 21 21 MET N N 21 118.100 118.353 -0.253 1
1 312 . 9 1 1 A 22 22 ALA H H 22 8.815 8.202 0.613 1
1 313 . 9 1 1 A 22 22 ALA HA H 22 3.826 3.989 -0.163 1
1 317 . 9 1 1 A 22 22 ALA C C 22 178.835 180.048 -1.213 1
1 318 . 9 1 1 A 22 22 ALA CA C 22 55.427 55.477 -0.050 1
1 319 . 9 1 1 A 22 22 ALA CB C 22 18.059 18.340 -0.281 1
1 320 . 9 1 1 A 22 22 ALA N N 22 122.150 121.383 0.767 1
1 321 . 9 1 1 A 23 23 GLU H H 23 8.276 8.213 0.063 1
1 322 . 9 1 1 A 23 23 GLU HA H 23 4.146 3.948 0.198 1
1 327 . 9 1 1 A 23 23 GLU C C 23 180.151 179.198 0.953 1
1 328 . 9 1 1 A 23 23 GLU CA C 23 58.999 59.571 -0.572 1
1 329 . 9 1 1 A 23 23 GLU CB C 23 29.160 29.226 -0.066 1
1 331 . 9 1 1 A 23 23 GLU N N 23 117.001 117.879 -0.878 1
1 332 . 9 1 1 A 24 24 LYS H H 24 7.573 8.079 -0.506 1
1 333 . 9 1 1 A 24 24 LYS HA H 24 4.101 4.180 -0.079 1
1 342 . 9 1 1 A 24 24 LYS C C 24 177.145 177.569 -0.424 1
1 343 . 9 1 1 A 24 24 LYS CA C 24 58.261 58.609 -0.348 1
1 344 . 9 1 1 A 24 24 LYS CB C 24 32.079 32.310 -0.231 1
1 348 . 9 1 1 A 24 24 LYS N N 24 119.960 118.336 1.624 1
1 349 . 9 1 1 A 25 25 ALA H H 25 7.710 7.757 -0.047 1
1 350 . 9 1 1 A 25 25 ALA HA H 25 4.413 4.363 0.050 1
1 354 . 9 1 1 A 25 25 ALA C C 25 175.325 176.983 -1.658 1
1 355 . 9 1 1 A 25 25 ALA CA C 25 51.208 51.605 -0.397 1
1 356 . 9 1 1 A 25 25 ALA CB C 25 18.520 18.726 -0.206 1
1 357 . 9 1 1 A 25 25 ALA N N 25 119.257 118.957 0.300 1
1 358 . 9 1 1 A 26 26 ASN H H 26 7.840 7.993 -0.153 1
1 359 . 9 1 1 A 26 26 ASN HA H 26 4.357 4.305 0.052 1
1 364 . 9 1 1 A 26 26 ASN C C 26 173.587 173.616 -0.029 1
1 365 . 9 1 1 A 26 26 ASN CA C 26 54.307 54.471 -0.164 1
1 366 . 9 1 1 A 26 26 ASN CB C 26 36.972 37.495 -0.523 1
1 367 . 9 1 1 A 26 26 ASN N N 26 115.266 115.520 -0.254 1
1 369 . 9 1 1 A 27 27 LEU H H 27 8.241 7.976 0.265 1
1 370 . 9 1 1 A 27 27 LEU HA H 27 4.652 4.692 -0.040 1
1 380 . 9 1 1 A 27 27 LEU C C 27 175.894 175.835 0.059 1
1 381 . 9 1 1 A 27 27 LEU CA C 27 52.923 53.483 -0.560 1
1 382 . 9 1 1 A 27 27 LEU CB C 27 44.090 44.038 0.052 1
1 386 . 9 1 1 A 27 27 LEU N N 27 116.828 119.681 -2.853 1
1 387 . 9 1 1 A 28 28 GLU H H 28 7.798 8.506 -0.708 1
1 388 . 9 1 1 A 28 28 GLU HA H 28 4.310 4.766 -0.456 1
1 393 . 9 1 1 A 28 28 GLU C C 28 173.944 174.991 -1.047 1
1 394 . 9 1 1 A 28 28 GLU CA C 28 55.460 55.959 -0.499 1
1 395 . 9 1 1 A 28 28 GLU CB C 28 30.512 30.851 -0.339 1
1 397 . 9 1 1 A 28 28 GLU N N 28 121.340 122.690 -1.350 1
1 398 . 9 1 1 A 29 29 LEU H H 29 8.451 9.022 -0.571 1
1 399 . 9 1 1 A 29 29 LEU HA H 29 5.662 5.626 0.036 1
1 409 . 9 1 1 A 29 29 LEU C C 29 176.902 175.087 1.815 1
1 410 . 9 1 1 A 29 29 LEU CA C 29 53.186 53.590 -0.404 1
1 411 . 9 1 1 A 29 29 LEU CB C 29 44.914 45.309 -0.395 1
1 415 . 9 1 1 A 29 29 LEU N N 29 126.547 127.548 -1.001 1
1 416 . 9 1 1 A 30 30 ARG H H 30 9.094 9.276 -0.182 1
1 417 . 9 1 1 A 30 30 ARG HA H 30 4.910 4.753 0.157 1
1 425 . 9 1 1 A 30 30 ARG C C 30 175.147 175.678 -0.531 1
1 426 . 9 1 1 A 30 30 ARG CA C 30 53.417 54.446 -1.029 1
1 427 . 9 1 1 A 30 30 ARG CB C 30 32.555 33.115 -0.560 1
1 430 . 9 1 1 A 30 30 ARG N N 30 125.043 126.377 -1.334 1
1 432 . 9 1 1 A 31 31 THR H H 31 8.496 8.480 0.016 1
1 433 . 9 1 1 A 31 31 THR HA H 31 4.888 4.876 0.012 1
1 438 . 9 1 1 A 31 31 THR C C 31 173.961 174.256 -0.295 1
1 439 . 9 1 1 A 31 31 THR CA C 31 60.445 61.186 -0.741 1
1 440 . 9 1 1 A 31 31 THR CB C 31 69.492 69.786 -0.294 1
1 442 . 9 1 1 A 31 31 THR N N 31 114.745 115.190 -0.445 1
1 443 . 9 1 1 A 32 32 VAL H H 32 8.480 9.157 -0.677 1
1 444 . 9 1 1 A 32 32 VAL HA H 32 4.411 4.252 0.159 1
1 452 . 9 1 1 A 32 32 VAL C C 32 175.082 175.724 -0.642 1
1 453 . 9 1 1 A 32 32 VAL CA C 32 60.946 63.112 -2.166 1
1 454 . 9 1 1 A 32 32 VAL CB C 32 34.487 31.833 2.654 1
1 457 . 9 1 1 A 32 32 VAL N N 32 122.324 127.047 -4.723 1
1 458 . 9 1 1 A 33 33 LYS H H 33 9.304 9.010 0.294 1
1 459 . 9 1 1 A 33 33 LYS HA H 33 4.534 4.603 -0.069 1
1 468 . 9 1 1 A 33 33 LYS C C 33 176.740 176.577 0.163 1
1 469 . 9 1 1 A 33 33 LYS CA C 33 56.846 56.953 -0.107 1
1 470 . 9 1 1 A 33 33 LYS CB C 33 34.355 34.646 -0.291 1
1 474 . 9 1 1 A 33 33 LYS N N 33 123.654 126.718 -3.064 1
1 475 . 9 1 1 A 34 34 THR H H 34 7.245 7.557 -0.312 1
1 476 . 9 1 1 A 34 34 THR HA H 34 4.780 4.536 0.244 1
1 481 . 9 1 1 A 34 34 THR C C 34 174.529 175.277 -0.748 1
1 482 . 9 1 1 A 34 34 THR CA C 34 58.859 59.950 -1.091 1
1 483 . 9 1 1 A 34 34 THR CB C 34 73.023 72.357 0.666 1
1 485 . 9 1 1 A 34 34 THR N N 34 106.300 111.039 -4.739 1
1 486 . 9 1 1 A 35 35 GLU H H 35 9.174 8.742 0.432 1
1 487 . 9 1 1 A 35 35 GLU HA H 35 3.886 3.915 -0.029 1
1 492 . 9 1 1 A 35 35 GLU C C 35 177.714 177.299 0.415 1
1 493 . 9 1 1 A 35 35 GLU CA C 35 59.233 59.597 -0.364 1
1 494 . 9 1 1 A 35 35 GLU CB C 35 29.377 29.077 0.300 1
1 496 . 9 1 1 A 35 35 GLU N N 35 121.919 122.079 -0.160 1
1 497 . 9 1 1 A 36 36 ASP H H 36 8.185 8.208 -0.023 1
1 498 . 9 1 1 A 36 36 ASP HA H 36 4.289 4.231 0.058 1
1 501 . 9 1 1 A 36 36 ASP C C 36 178.348 178.454 -0.106 1
1 502 . 9 1 1 A 36 36 ASP CA C 36 56.962 57.276 -0.314 1
1 503 . 9 1 1 A 36 36 ASP CB C 36 40.214 41.327 -1.113 1
1 504 . 9 1 1 A 36 36 ASP N N 36 118.332 119.863 -1.531 1
1 505 . 9 1 1 A 37 37 GLU H H 37 7.741 7.905 -0.164 1
1 506 . 9 1 1 A 37 37 GLU HA H 37 3.708 3.537 0.171 1
1 511 . 9 1 1 A 37 37 GLU C C 37 177.324 178.532 -1.208 1
1 512 . 9 1 1 A 37 37 GLU CA C 37 58.698 58.937 -0.239 1
1 513 . 9 1 1 A 37 37 GLU CB C 37 30.199 29.042 1.157 1
1 515 . 9 1 1 A 37 37 GLU N N 37 120.704 118.489 2.215 1
1 516 . 9 1 1 A 38 38 LEU H H 38 7.531 7.909 -0.378 1
1 517 . 9 1 1 A 38 38 LEU HA H 38 3.873 3.996 -0.123 1
1 527 . 9 1 1 A 38 38 LEU C C 38 177.357 178.403 -1.046 1
1 528 . 9 1 1 A 38 38 LEU CA C 38 58.305 58.243 0.062 1
1 529 . 9 1 1 A 38 38 LEU CB C 38 40.837 41.659 -0.822 1
1 533 . 9 1 1 A 38 38 LEU N N 38 119.200 121.771 -2.571 1
1 534 . 9 1 1 A 39 39 LYS H H 39 8.083 7.654 0.429 1
1 535 . 9 1 1 A 39 39 LYS HA H 39 3.608 3.923 -0.315 1
1 544 . 9 1 1 A 39 39 LYS C C 39 177.373 178.786 -1.413 1
1 545 . 9 1 1 A 39 39 LYS CA C 39 60.290 59.697 0.593 1
1 546 . 9 1 1 A 39 39 LYS CB C 39 32.178 32.340 -0.162 1
1 550 . 9 1 1 A 39 39 LYS N N 39 116.943 118.806 -1.863 1
1 551 . 9 1 1 A 40 40 LYS H H 40 7.632 7.830 -0.198 1
1 552 . 9 1 1 A 40 40 LYS HA H 40 3.864 4.044 -0.180 1
1 561 . 9 1 1 A 40 40 LYS C C 40 179.566 178.404 1.162 1
1 562 . 9 1 1 A 40 40 LYS CA C 40 58.993 58.807 0.186 1
1 563 . 9 1 1 A 40 40 LYS CB C 40 31.758 31.861 -0.103 1
1 567 . 9 1 1 A 40 40 LYS N N 40 118.274 119.350 -1.076 1
1 568 . 9 1 1 A 41 41 TYR H H 41 7.823 7.972 -0.149 1
1 569 . 9 1 1 A 41 41 TYR HA H 41 3.926 4.010 -0.084 1
1 576 . 9 1 1 A 41 41 TYR C C 41 176.625 177.917 -1.292 1
1 577 . 9 1 1 A 41 41 TYR CA C 41 59.757 60.748 -0.991 1
1 578 . 9 1 1 A 41 41 TYR CB C 41 36.901 37.892 -0.991 1
1 583 . 9 1 1 A 41 41 TYR N N 41 117.811 119.318 -1.507 1
1 584 . 9 1 1 A 42 42 LEU H H 42 7.964 8.370 -0.406 1
1 585 . 9 1 1 A 42 42 LEU HA H 42 3.704 4.128 -0.424 1
1 595 . 9 1 1 A 42 42 LEU C C 42 178.396 179.239 -0.843 1
1 596 . 9 1 1 A 42 42 LEU CA C 42 58.237 57.939 0.298 1
1 597 . 9 1 1 A 42 42 LEU CB C 42 40.507 41.410 -0.903 1
1 601 . 9 1 1 A 42 42 LEU N N 42 115.960 120.022 -4.062 1
1 602 . 9 1 1 A 43 43 GLU H H 43 8.193 8.168 0.025 1
1 603 . 9 1 1 A 43 43 GLU HA H 43 3.882 3.900 -0.018 1
1 608 . 9 1 1 A 43 43 GLU C C 43 179.193 179.265 -0.072 1
1 609 . 9 1 1 A 43 43 GLU CA C 43 59.122 59.840 -0.718 1
1 610 . 9 1 1 A 43 43 GLU CB C 43 29.244 29.288 -0.044 1
1 612 . 9 1 1 A 43 43 GLU N N 43 117.175 119.381 -2.206 1
1 613 . 9 1 1 A 44 44 GLU H H 44 7.601 7.860 -0.259 1
1 614 . 9 1 1 A 44 44 GLU HA H 44 3.936 3.906 0.030 1
1 619 . 9 1 1 A 44 44 GLU C C 44 179.875 178.906 0.969 1
1 620 . 9 1 1 A 44 44 GLU CA C 44 58.867 59.216 -0.349 1
1 621 . 9 1 1 A 44 44 GLU CB C 44 28.648 29.119 -0.471 1
1 623 . 9 1 1 A 44 44 GLU N N 44 120.472 119.702 0.770 1
1 624 . 9 1 1 A 45 45 PHE H H 45 8.260 7.555 0.705 1
1 625 . 9 1 1 A 45 45 PHE HA H 45 4.520 4.226 0.294 1
1 633 . 9 1 1 A 45 45 PHE C C 45 177.942 178.473 -0.531 1
1 634 . 9 1 1 A 45 45 PHE CA C 45 55.945 61.200 -5.255 1
1 635 . 9 1 1 A 45 45 PHE CB C 45 36.680 37.918 -1.238 1
1 641 . 9 1 1 A 45 45 PHE N N 45 119.272 119.120 0.152 1
1 642 . 9 1 1 A 46 46 ARG H H 46 8.023 8.115 -0.092 1
1 643 . 9 1 1 A 46 46 ARG HA H 46 4.074 4.002 0.072 1
1 651 . 9 1 1 A 46 46 ARG C C 46 177.617 178.857 -1.240 1
1 652 . 9 1 1 A 46 46 ARG CA C 46 58.194 59.267 -1.073 1
1 653 . 9 1 1 A 46 46 ARG CB C 46 29.737 29.956 -0.219 1
1 656 . 9 1 1 A 46 46 ARG N N 46 118.136 121.090 -2.954 1
1 658 . 9 1 1 A 47 47 LYS H H 47 7.470 7.531 -0.061 1
1 659 . 9 1 1 A 47 47 LYS HA H 47 4.143 4.122 0.021 1
1 668 . 9 1 1 A 47 47 LYS C C 47 177.324 178.064 -0.740 1
1 669 . 9 1 1 A 47 47 LYS CA C 47 57.726 59.647 -1.921 1
1 670 . 9 1 1 A 47 47 LYS CB C 47 32.409 32.277 0.132 1
1 674 . 9 1 1 A 47 47 LYS N N 47 116.943 120.179 -3.236 1
1 675 . 9 1 1 A 48 48 GLU H H 48 7.615 7.636 -0.021 1
1 676 . 9 1 1 A 48 48 GLU HA H 48 4.428 4.721 -0.293 1
1 681 . 9 1 1 A 48 48 GLU C C 48 176.869 176.822 0.047 1
1 682 . 9 1 1 A 48 48 GLU CA C 48 55.945 55.855 0.090 1
1 683 . 9 1 1 A 48 48 GLU CB C 48 29.696 29.773 -0.077 1
1 685 . 9 1 1 A 48 48 GLU N N 48 118.852 115.977 2.875 1
1 686 . 9 1 1 A 49 49 SER H H 49 7.725 7.768 -0.043 1
1 687 . 9 1 1 A 49 49 SER HA H 49 4.244 4.541 -0.297 1
1 690 . 9 1 1 A 49 49 SER C C 49 174.838 174.928 -0.090 1
1 691 . 9 1 1 A 49 49 SER CA C 49 59.366 58.868 0.498 1
1 692 . 9 1 1 A 49 49 SER CB C 49 63.116 62.312 0.804 1
1 693 . 9 1 1 A 49 49 SER N N 49 114.224 117.122 -2.898 1
1 694 . 9 1 1 A 50 50 GLN H H 50 8.548 8.216 0.332 1
1 695 . 9 1 1 A 50 50 GLN HA H 50 4.398 4.425 -0.027 1
1 702 . 9 1 1 A 50 50 GLN C C 50 175.732 176.601 -0.869 1
1 703 . 9 1 1 A 50 50 GLN CA C 50 56.272 57.213 -0.941 1
1 704 . 9 1 1 A 50 50 GLN CB C 50 28.946 30.316 -1.370 1
1 706 . 9 1 1 A 50 50 GLN N N 50 120.125 121.408 -1.283 1
1 708 . 9 1 1 A 51 51 ASN H H 51 8.534 8.226 0.308 1
1 709 . 9 1 1 A 51 51 ASN HA H 51 4.980 4.902 0.078 1
1 714 . 9 1 1 A 51 51 ASN C C 51 173.717 173.782 -0.065 1
1 715 . 9 1 1 A 51 51 ASN CA C 51 52.804 52.416 0.388 1
1 716 . 9 1 1 A 51 51 ASN CB C 51 39.583 38.787 0.796 1
1 717 . 9 1 1 A 51 51 ASN N N 51 118.158 116.687 1.471 1
1 719 . 9 1 1 A 52 52 ILE H H 52 7.492 7.914 -0.422 1
1 720 . 9 1 1 A 52 52 ILE HA H 52 5.338 5.724 -0.386 1
1 730 . 9 1 1 A 52 52 ILE C C 52 175.049 173.721 1.328 1
1 731 . 9 1 1 A 52 52 ILE CA C 52 59.364 59.172 0.192 1
1 732 . 9 1 1 A 52 52 ILE CB C 52 42.163 42.250 -0.087 1
1 736 . 9 1 1 A 52 52 ILE N N 52 117.927 122.445 -4.518 1
1 737 . 9 1 1 A 53 53 LYS H H 53 8.467 9.082 -0.615 1
1 738 . 9 1 1 A 53 53 LYS HA H 53 5.044 5.296 -0.252 1
1 747 . 9 1 1 A 53 53 LYS C C 53 175.082 175.259 -0.177 1
1 748 . 9 1 1 A 53 53 LYS CA C 53 55.429 54.852 0.577 1
1 749 . 9 1 1 A 53 53 LYS CB C 53 36.446 36.537 -0.091 1
1 753 . 9 1 1 A 53 53 LYS N N 53 123.249 127.483 -4.234 1
1 754 . 9 1 1 A 54 54 VAL H H 54 8.490 8.735 -0.245 1
1 755 . 9 1 1 A 54 54 VAL HA H 54 5.159 5.244 -0.085 1
1 763 . 9 1 1 A 54 54 VAL C C 54 173.473 173.711 -0.238 1
1 764 . 9 1 1 A 54 54 VAL CA C 54 60.163 60.659 -0.496 1
1 765 . 9 1 1 A 54 54 VAL CB C 54 35.509 34.146 1.363 1
1 768 . 9 1 1 A 54 54 VAL N N 54 120.762 123.839 -3.077 1
1 769 . 9 1 1 A 55 55 LEU H H 55 8.636 8.855 -0.219 1
1 770 . 9 1 1 A 55 55 LEU HA H 55 4.670 4.590 0.080 1
1 780 . 9 1 1 A 55 55 LEU C C 55 173.652 174.490 -0.838 1
1 781 . 9 1 1 A 55 55 LEU CA C 55 52.289 53.175 -0.886 1
1 782 . 9 1 1 A 55 55 LEU CB C 55 42.070 42.983 -0.913 1
1 786 . 9 1 1 A 55 55 LEU N N 55 131.898 129.163 2.735 1
1 787 . 9 1 1 A 56 56 ILE H H 56 9.188 9.408 -0.220 1
1 788 . 9 1 1 A 56 56 ILE HA H 56 4.879 5.242 -0.363 1
1 798 . 9 1 1 A 56 56 ILE C C 56 174.172 174.397 -0.225 1
1 799 . 9 1 1 A 56 56 ILE CA C 56 59.976 59.566 0.410 1
1 800 . 9 1 1 A 56 56 ILE CB C 56 38.181 38.753 -0.572 1
1 804 . 9 1 1 A 56 56 ILE N N 56 126.373 128.701 -2.328 1
1 805 . 9 1 1 A 57 57 LEU H H 57 8.929 9.285 -0.356 1
1 806 . 9 1 1 A 57 57 LEU HA H 57 5.394 5.234 0.160 1
1 816 . 9 1 1 A 57 57 LEU C C 57 175.358 176.115 -0.757 1
1 817 . 9 1 1 A 57 57 LEU CA C 57 52.086 53.234 -1.148 1
1 818 . 9 1 1 A 57 57 LEU CB C 57 42.445 43.610 -1.165 1
1 822 . 9 1 1 A 57 57 LEU N N 57 126.547 127.659 -1.112 1
1 823 . 9 1 1 A 58 58 VAL H H 58 8.542 8.603 -0.061 1
1 824 . 9 1 1 A 58 58 VAL HA H 58 5.253 4.867 0.386 1
1 832 . 9 1 1 A 58 58 VAL C C 58 175.244 175.722 -0.478 1
1 833 . 9 1 1 A 58 58 VAL CA C 58 58.241 58.963 -0.722 1
1 834 . 9 1 1 A 58 58 VAL CB C 58 33.165 35.006 -1.841 1
1 837 . 9 1 1 A 58 58 VAL N N 58 114.398 119.466 -5.068 1
1 838 . 9 1 1 A 59 59 SER H H 59 8.797 8.271 0.526 1
1 839 . 9 1 1 A 59 59 SER HA H 59 5.063 4.702 0.361 1
1 842 . 9 1 1 A 59 59 SER C C 59 174.172 174.655 -0.483 1
1 843 . 9 1 1 A 59 59 SER CA C 59 59.320 60.949 -1.629 1
1 844 . 9 1 1 A 59 59 SER CB C 59 65.600 64.014 1.586 1
1 845 . 9 1 1 A 59 59 SER N N 59 115.497 118.315 -2.818 1
1 846 . 9 1 1 A 60 60 ASN H H 60 7.730 8.063 -0.333 1
1 847 . 9 1 1 A 60 60 ASN HA H 60 4.811 5.099 -0.288 1
1 852 . 9 1 1 A 60 60 ASN C C 60 174.464 175.806 -1.342 1
1 853 . 9 1 1 A 60 60 ASN CA C 60 52.007 51.966 0.041 1
1 854 . 9 1 1 A 60 60 ASN CB C 60 40.336 40.574 -0.238 1
1 855 . 9 1 1 A 60 60 ASN N N 60 117.522 117.225 0.297 1
1 857 . 9 1 1 A 61 61 ASP H H 61 8.577 8.948 -0.371 1
1 858 . 9 1 1 A 61 61 ASP HA H 61 4.365 4.348 0.017 1
1 861 . 9 1 1 A 61 61 ASP C C 61 177.357 178.517 -1.160 1
1 862 . 9 1 1 A 61 61 ASP CA C 61 57.351 56.496 0.855 1
1 863 . 9 1 1 A 61 61 ASP CB C 61 40.383 39.934 0.449 1
1 864 . 9 1 1 A 61 61 ASP N N 61 119.431 121.755 -2.324 1
1 865 . 9 1 1 A 62 62 GLU H H 62 8.405 8.366 0.039 1
1 866 . 9 1 1 A 62 62 GLU HA H 62 4.121 4.033 0.088 1
1 871 . 9 1 1 A 62 62 GLU C C 62 179.615 178.953 0.662 1
1 872 . 9 1 1 A 62 62 GLU CA C 62 59.593 59.582 0.011 1
1 873 . 9 1 1 A 62 62 GLU CB C 62 28.478 29.184 -0.706 1
1 875 . 9 1 1 A 62 62 GLU N N 62 122.150 120.355 1.795 1
1 876 . 9 1 1 A 63 63 GLU H H 63 8.384 8.242 0.142 1
1 877 . 9 1 1 A 63 63 GLU HA H 63 3.913 4.005 -0.092 1
1 882 . 9 1 1 A 63 63 GLU C C 63 178.478 179.101 -0.623 1
1 883 . 9 1 1 A 63 63 GLU CA C 63 58.273 59.165 -0.892 1
1 884 . 9 1 1 A 63 63 GLU CB C 63 29.931 28.961 0.970 1
1 886 . 9 1 1 A 63 63 GLU N N 63 119.084 119.338 -0.254 1
1 887 . 9 1 1 A 64 64 LEU H H 64 7.717 7.912 -0.195 1
1 888 . 9 1 1 A 64 64 LEU HA H 64 3.750 3.994 -0.244 1
1 898 . 9 1 1 A 64 64 LEU C C 64 177.535 178.179 -0.644 1
1 899 . 9 1 1 A 64 64 LEU CA C 64 58.944 58.605 0.339 1
1 900 . 9 1 1 A 64 64 LEU CB C 64 41.695 41.644 0.051 1
1 904 . 9 1 1 A 64 64 LEU N N 64 120.357 122.431 -2.074 1
1 905 . 9 1 1 A 65 65 ASP H H 65 7.922 8.108 -0.186 1
1 906 . 9 1 1 A 65 65 ASP HA H 65 4.313 4.257 0.056 1
1 909 . 9 1 1 A 65 65 ASP C C 65 179.095 178.737 0.358 1
1 910 . 9 1 1 A 65 65 ASP CA C 65 57.272 57.895 -0.623 1
1 911 . 9 1 1 A 65 65 ASP CB C 65 40.196 41.558 -1.362 1
1 912 . 9 1 1 A 65 65 ASP N N 65 118.100 118.595 -0.495 1
1 913 . 9 1 1 A 66 66 LYS H H 66 7.802 7.940 -0.138 1
1 914 . 9 1 1 A 66 66 LYS HA H 66 4.078 3.981 0.097 1
1 923 . 9 1 1 A 66 66 LYS C C 66 178.624 178.817 -0.193 1
1 924 . 9 1 1 A 66 66 LYS CA C 66 58.429 59.581 -1.152 1
1 925 . 9 1 1 A 66 66 LYS CB C 66 31.727 32.300 -0.573 1
1 929 . 9 1 1 A 66 66 LYS N N 66 119.343 118.031 1.312 1
1 930 . 9 1 1 A 67 67 ALA H H 67 8.480 8.422 0.058 1
1 931 . 9 1 1 A 67 67 ALA HA H 67 3.853 4.120 -0.267 1
1 935 . 9 1 1 A 67 67 ALA C C 67 178.591 179.521 -0.930 1
1 936 . 9 1 1 A 67 67 ALA CA C 67 55.403 55.381 0.022 1
1 937 . 9 1 1 A 67 67 ALA CB C 67 17.793 18.434 -0.641 1
1 938 . 9 1 1 A 67 67 ALA N N 67 121.562 122.522 -0.960 1
1 939 . 9 1 1 A 68 68 LYS H H 68 8.186 7.697 0.489 1
1 940 . 9 1 1 A 68 68 LYS HA H 68 3.805 4.049 -0.244 1
1 949 . 9 1 1 A 68 68 LYS C C 68 179.095 178.664 0.431 1
1 950 . 9 1 1 A 68 68 LYS CA C 68 59.952 58.917 1.035 1
1 951 . 9 1 1 A 68 68 LYS CB C 68 32.181 31.756 0.425 1
1 955 . 9 1 1 A 68 68 LYS N N 68 116.165 116.640 -0.475 1
1 956 . 9 1 1 A 69 69 GLU H H 69 7.904 8.287 -0.383 1
1 957 . 9 1 1 A 69 69 GLU HA H 69 3.995 4.052 -0.057 1
1 962 . 9 1 1 A 69 69 GLU C C 69 179.079 179.364 -0.285 1
1 963 . 9 1 1 A 69 69 GLU CA C 69 59.022 58.982 0.040 1
1 964 . 9 1 1 A 69 69 GLU CB C 69 29.274 29.257 0.017 1
1 966 . 9 1 1 A 69 69 GLU N N 69 119.489 119.436 0.053 1
1 967 . 9 1 1 A 70 70 LEU H H 70 7.962 7.865 0.097 1
1 968 . 9 1 1 A 70 70 LEU HA H 70 4.020 3.880 0.140 1
1 978 . 9 1 1 A 70 70 LEU C C 70 178.738 178.931 -0.193 1
1 979 . 9 1 1 A 70 70 LEU CA C 70 57.486 57.928 -0.442 1
1 980 . 9 1 1 A 70 70 LEU CB C 70 41.695 41.341 0.354 1
1 984 . 9 1 1 A 70 70 LEU N N 70 119.431 119.921 -0.490 1
1 985 . 9 1 1 A 71 71 ALA H H 71 8.260 8.166 0.094 1
1 986 . 9 1 1 A 71 71 ALA HA H 71 3.845 4.047 -0.202 1
1 990 . 9 1 1 A 71 71 ALA C C 71 179.518 179.722 -0.204 1
1 991 . 9 1 1 A 71 71 ALA CA C 71 55.139 54.600 0.539 1
1 992 . 9 1 1 A 71 71 ALA CB C 71 18.487 18.496 -0.009 1
1 993 . 9 1 1 A 71 71 ALA N N 71 119.604 121.888 -2.284 1
1 994 . 9 1 1 A 72 72 GLN H H 72 7.910 8.009 -0.099 1
1 995 . 9 1 1 A 72 72 GLN HA H 72 4.154 4.047 0.107 1
1 1002 . 9 1 1 A 72 72 GLN C C 72 178.900 178.897 0.003 1
1 1003 . 9 1 1 A 72 72 GLN CA C 72 58.194 58.678 -0.484 1
1 1004 . 9 1 1 A 72 72 GLN CB C 72 28.056 28.518 -0.462 1
1 1006 . 9 1 1 A 72 72 GLN N N 72 115.960 117.741 -1.781 1
1 1008 . 9 1 1 A 73 73 LYS H H 73 7.841 8.140 -0.299 1
1 1009 . 9 1 1 A 73 73 LYS HA H 73 4.171 4.183 -0.012 1
1 1018 . 9 1 1 A 73 73 LYS C C 73 177.730 177.794 -0.064 1
1 1019 . 9 1 1 A 73 73 LYS CA C 73 57.867 58.506 -0.639 1
1 1020 . 9 1 1 A 73 73 LYS CB C 73 32.277 32.239 0.038 1
1 1024 . 9 1 1 A 73 73 LYS N N 73 119.027 119.118 -0.091 1
1 1025 . 9 1 1 A 74 74 MET H H 74 7.746 7.604 0.142 1
1 1026 . 9 1 1 A 74 74 MET HA H 74 4.403 4.596 -0.193 1
1 1034 . 9 1 1 A 74 74 MET C C 74 174.416 175.001 -0.585 1
1 1035 . 9 1 1 A 74 74 MET CA C 74 55.194 55.002 0.192 1
1 1036 . 9 1 1 A 74 74 MET CB C 74 33.366 33.225 0.141 1
1 1039 . 9 1 1 A 74 74 MET N N 74 115.786 115.403 0.383 1
1 1040 . 9 1 1 A 75 75 GLU H H 75 8.076 7.893 0.183 1
1 1041 . 9 1 1 A 75 75 GLU HA H 75 4.001 3.884 0.117 1
1 1046 . 9 1 1 A 75 75 GLU C C 75 175.130 174.982 0.148 1
1 1047 . 9 1 1 A 75 75 GLU CA C 75 56.722 57.410 -0.688 1
1 1048 . 9 1 1 A 75 75 GLU CB C 75 27.118 27.684 -0.566 1
1 1050 . 9 1 1 A 75 75 GLU N N 75 116.249 116.486 -0.237 1
1 1051 . 9 1 1 A 76 76 ILE H H 76 7.560 7.731 -0.171 1
1 1052 . 9 1 1 A 76 76 ILE HA H 76 4.428 4.611 -0.183 1
1 1062 . 9 1 1 A 76 76 ILE C C 76 174.529 174.667 -0.138 1
1 1063 . 9 1 1 A 76 76 ILE CA C 76 58.475 59.786 -1.311 1
1 1064 . 9 1 1 A 76 76 ILE CB C 76 40.337 41.249 -0.912 1
1 1068 . 9 1 1 A 76 76 ILE N N 76 115.960 119.401 -3.441 1
1 1069 . 9 1 1 A 77 77 ASP H H 77 8.889 8.841 0.048 1
1 1070 . 9 1 1 A 77 77 ASP HA H 77 4.569 4.845 -0.276 1
1 1073 . 9 1 1 A 77 77 ASP C C 77 174.123 175.900 -1.777 1
1 1074 . 9 1 1 A 77 77 ASP CA C 77 54.069 53.512 0.557 1
1 1075 . 9 1 1 A 77 77 ASP CB C 77 40.233 41.061 -0.828 1
1 1076 . 9 1 1 A 77 77 ASP N N 77 126.142 127.607 -1.465 1
1 1077 . 9 1 1 A 78 78 VAL H H 78 7.754 8.780 -1.026 1
1 1078 . 9 1 1 A 78 78 VAL HA H 78 5.192 5.202 -0.010 1
1 1086 . 9 1 1 A 78 78 VAL C C 78 174.968 174.419 0.549 1
1 1087 . 9 1 1 A 78 78 VAL CA C 78 58.804 58.708 0.096 1
1 1088 . 9 1 1 A 78 78 VAL CB C 78 35.293 35.989 -0.696 1
1 1091 . 9 1 1 A 78 78 VAL N N 78 122.844 119.914 2.930 1
1 1092 . 9 1 1 A 79 79 ARG H H 79 8.499 8.799 -0.300 1
1 1093 . 9 1 1 A 79 79 ARG HA H 79 4.712 4.861 -0.149 1
1 1100 . 9 1 1 A 79 79 ARG C C 79 174.221 175.054 -0.833 1
1 1101 . 9 1 1 A 79 79 ARG CA C 79 54.117 54.879 -0.762 1
1 1102 . 9 1 1 A 79 79 ARG CB C 79 31.196 31.659 -0.463 1
1 1105 . 9 1 1 A 79 79 ARG N N 79 125.637 121.521 4.116 1
1 1106 . 9 1 1 A 80 80 THR H H 80 8.416 8.823 -0.407 1
1 1107 . 9 1 1 A 80 80 THR HA H 80 5.332 4.707 0.625 1
1 1112 . 9 1 1 A 80 80 THR C C 80 174.497 173.856 0.641 1
1 1113 . 9 1 1 A 80 80 THR CA C 80 59.694 61.966 -2.272 1
1 1114 . 9 1 1 A 80 80 THR CB C 80 69.772 68.358 1.414 1
1 1116 . 9 1 1 A 80 80 THR N N 80 118.084 121.871 -3.787 1
1 1117 . 9 1 1 A 81 81 ARG H H 81 8.758 9.150 -0.392 1
1 1118 . 9 1 1 A 81 81 ARG HA H 81 4.362 4.653 -0.291 1
1 1126 . 9 1 1 A 81 81 ARG C C 81 173.733 174.026 -0.293 1
1 1127 . 9 1 1 A 81 81 ARG CA C 81 53.273 53.988 -0.715 1
1 1128 . 9 1 1 A 81 81 ARG CB C 81 33.915 32.716 1.199 1
1 1131 . 9 1 1 A 81 81 ARG N N 81 122.844 126.352 -3.508 1
1 1133 . 9 1 1 A 82 82 LYS H H 82 8.721 8.532 0.189 1
1 1134 . 9 1 1 A 82 82 LYS HA H 82 4.701 5.194 -0.493 1
1 1143 . 9 1 1 A 82 82 LYS C C 82 175.667 175.645 0.022 1
1 1144 . 9 1 1 A 82 82 LYS CA C 82 54.960 54.967 -0.007 1
1 1145 . 9 1 1 A 82 82 LYS CB C 82 32.603 34.148 -1.545 1
1 1149 . 9 1 1 A 82 82 LYS N N 82 124.668 123.306 1.362 1
1 1150 . 9 1 1 A 83 83 VAL H H 83 9.112 9.356 -0.244 1
1 1151 . 9 1 1 A 83 83 VAL HA H 83 4.796 4.901 -0.105 1
1 1159 . 9 1 1 A 83 83 VAL C C 83 174.594 175.139 -0.545 1
1 1160 . 9 1 1 A 83 83 VAL CA C 83 59.413 59.924 -0.511 1
1 1161 . 9 1 1 A 83 83 VAL CB C 83 35.298 35.114 0.184 1
1 1164 . 9 1 1 A 83 83 VAL N N 83 122.381 120.572 1.809 1
1 1165 . 9 1 1 A 84 84 THR H H 84 9.200 8.856 0.344 1
1 1166 . 9 1 1 A 84 84 THR HA H 84 4.579 4.680 -0.101 1
1 1171 . 9 1 1 A 84 84 THR C C 84 173.993 174.664 -0.671 1
1 1172 . 9 1 1 A 84 84 THR CA C 84 60.960 61.077 -0.117 1
1 1173 . 9 1 1 A 84 84 THR CB C 84 70.100 69.707 0.393 1
1 1175 . 9 1 1 A 84 84 THR N N 84 113.183 115.670 -2.487 1
1 1176 . 9 1 1 A 85 85 SER H H 85 7.688 7.792 -0.104 1
1 1177 . 9 1 1 A 85 85 SER HA H 85 5.136 4.996 0.140 1
1 1180 . 9 1 1 A 85 85 SER CA C 85 55.205 55.581 -0.376 1
1 1181 . 9 1 1 A 85 85 SER CB C 85 64.376 65.745 -1.369 1
1 1182 . 9 1 1 A 85 85 SER N N 85 115.555 116.402 -0.847 1
1 1183 . 9 1 1 A 86 86 PRO HA H 86 4.090 4.248 -0.158 1
1 1190 . 9 1 1 A 86 86 PRO C C 86 177.227 177.897 -0.670 1
1 1191 . 9 1 1 A 86 86 PRO CA C 86 65.038 65.514 -0.476 1
1 1192 . 9 1 1 A 86 86 PRO CB C 86 31.711 31.710 0.001 1
1 1195 . 9 1 1 A 87 87 ASP H H 87 8.131 8.479 -0.348 1
1 1196 . 9 1 1 A 87 87 ASP HA H 87 4.223 4.360 -0.137 1
1 1199 . 9 1 1 A 87 87 ASP C C 87 178.721 179.284 -0.563 1
1 1200 . 9 1 1 A 87 87 ASP CA C 87 57.311 56.490 0.821 1
1 1201 . 9 1 1 A 87 87 ASP CB C 87 40.102 40.041 0.061 1
1 1202 . 9 1 1 A 87 87 ASP N N 87 115.381 116.851 -1.470 1
1 1203 . 9 1 1 A 88 88 GLU H H 88 7.571 8.167 -0.596 1
1 1204 . 9 1 1 A 88 88 GLU HA H 88 3.659 4.047 -0.388 1
1 1209 . 9 1 1 A 88 88 GLU C C 88 177.097 178.872 -1.775 1
1 1210 . 9 1 1 A 88 88 GLU CA C 88 58.729 58.830 -0.101 1
1 1211 . 9 1 1 A 88 88 GLU CB C 88 30.052 29.890 0.162 1
1 1213 . 9 1 1 A 88 88 GLU N N 88 120.009 120.554 -0.545 1
1 1214 . 9 1 1 A 89 89 ALA H H 89 7.423 7.903 -0.480 1
1 1215 . 9 1 1 A 89 89 ALA HA H 89 3.900 4.283 -0.383 1
1 1219 . 9 1 1 A 89 89 ALA C C 89 178.267 180.008 -1.741 1
1 1220 . 9 1 1 A 89 89 ALA CA C 89 55.607 55.219 0.388 1
1 1221 . 9 1 1 A 89 89 ALA CB C 89 17.348 18.472 -1.124 1
1 1222 . 9 1 1 A 89 89 ALA N N 89 118.873 122.366 -3.493 1
1 1223 . 9 1 1 A 90 90 LYS H H 90 8.046 8.262 -0.216 1
1 1224 . 9 1 1 A 90 90 LYS HA H 90 3.669 4.045 -0.376 1
1 1233 . 9 1 1 A 90 90 LYS C C 90 177.649 179.081 -1.432 1
1 1234 . 9 1 1 A 90 90 LYS CA C 90 60.351 59.842 0.509 1
1 1235 . 9 1 1 A 90 90 LYS CB C 90 32.087 32.209 -0.122 1
1 1239 . 9 1 1 A 90 90 LYS N N 90 114.834 117.383 -2.549 1
1 1240 . 9 1 1 A 91 91 ARG H H 91 7.468 8.024 -0.556 1
1 1241 . 9 1 1 A 91 91 ARG HA H 91 3.887 3.935 -0.048 1
1 1249 . 9 1 1 A 91 91 ARG C C 91 178.998 179.225 -0.227 1
1 1250 . 9 1 1 A 91 91 ARG CA C 91 59.164 59.079 0.085 1
1 1251 . 9 1 1 A 91 91 ARG CB C 91 29.274 29.816 -0.542 1
1 1254 . 9 1 1 A 91 91 ARG N N 91 119.029 119.808 -0.779 1
1 1256 . 9 1 1 A 92 92 TRP H H 92 8.136 8.373 -0.237 1
1 1257 . 9 1 1 A 92 92 TRP HA H 92 4.818 4.508 0.310 1
1 1266 . 9 1 1 A 92 92 TRP C C 92 179.566 179.132 0.434 1
1 1267 . 9 1 1 A 92 92 TRP CA C 92 58.663 59.572 -0.909 1
1 1268 . 9 1 1 A 92 92 TRP CB C 92 29.790 29.326 0.464 1
1 1274 . 9 1 1 A 92 92 TRP N N 92 118.100 120.431 -2.331 1
1 1276 . 9 1 1 A 93 93 ILE H H 93 8.363 8.582 -0.219 1
1 1277 . 9 1 1 A 93 93 ILE HA H 93 3.544 3.855 -0.311 1
1 1287 . 9 1 1 A 93 93 ILE C C 93 176.820 178.351 -1.531 1
1 1288 . 9 1 1 A 93 93 ILE CA C 93 66.225 65.530 0.695 1
1 1289 . 9 1 1 A 93 93 ILE CB C 93 37.571 37.674 -0.103 1
1 1293 . 9 1 1 A 93 93 ILE N N 93 120.588 120.214 0.374 1
1 1294 . 9 1 1 A 94 94 LYS H H 94 8.264 7.727 0.537 1
1 1295 . 9 1 1 A 94 94 LYS HA H 94 3.865 4.019 -0.154 1
1 1304 . 9 1 1 A 94 94 LYS C C 94 179.258 179.263 -0.005 1
1 1305 . 9 1 1 A 94 94 LYS CA C 94 59.889 59.883 0.006 1
1 1306 . 9 1 1 A 94 94 LYS CB C 94 32.225 32.500 -0.275 1
1 1310 . 9 1 1 A 94 94 LYS N N 94 121.687 121.171 0.516 1
1 1311 . 9 1 1 A 95 95 GLU H H 95 8.360 8.399 -0.039 1
1 1312 . 9 1 1 A 95 95 GLU HA H 95 4.023 4.270 -0.247 1
1 1317 . 9 1 1 A 95 95 GLU C C 95 178.884 178.899 -0.015 1
1 1318 . 9 1 1 A 95 95 GLU CA C 95 59.366 59.240 0.126 1
1 1319 . 9 1 1 A 95 95 GLU CB C 95 29.508 28.732 0.776 1
1 1321 . 9 1 1 A 95 95 GLU N N 95 118.505 117.582 0.923 1
1 1322 . 9 1 1 A 96 96 PHE H H 96 8.212 8.653 -0.441 1
1 1323 . 9 1 1 A 96 96 PHE HA H 96 4.512 4.325 0.187 1
1 1331 . 9 1 1 A 96 96 PHE C C 96 176.820 178.374 -1.554 1
1 1332 . 9 1 1 A 96 96 PHE CA C 96 59.608 61.398 -1.790 1
1 1333 . 9 1 1 A 96 96 PHE CB C 96 40.431 39.190 1.241 1
1 1339 . 9 1 1 A 96 96 PHE N N 96 120.369 122.182 -1.813 1
1 1340 . 9 1 1 A 97 97 SER H H 97 8.216 8.085 0.131 1
1 1341 . 9 1 1 A 97 97 SER HA H 97 3.816 4.027 -0.211 1
1 1344 . 9 1 1 A 97 97 SER C C 97 175.618 176.853 -1.235 1
1 1345 . 9 1 1 A 97 97 SER CA C 97 60.492 61.413 -0.921 1
1 1346 . 9 1 1 A 97 97 SER CB C 97 63.022 63.059 -0.037 1
1 1347 . 9 1 1 A 97 97 SER N N 97 111.969 114.308 -2.339 1
1 1348 . 9 1 1 A 98 98 GLU H H 98 7.655 7.605 0.050 1
1 1349 . 9 1 1 A 98 98 GLU HA H 98 4.187 4.253 -0.066 1
1 1354 . 9 1 1 A 98 98 GLU C C 98 177.698 178.993 -1.295 1
1 1355 . 9 1 1 A 98 98 GLU CA C 98 57.069 58.517 -1.448 1
1 1356 . 9 1 1 A 98 98 GLU CB C 98 29.321 29.316 0.005 1
1 1358 . 9 1 1 A 98 98 GLU N N 98 120.588 121.427 -0.839 1
1 1359 . 9 1 1 A 99 99 GLU H H 99 7.794 7.506 0.288 1
1 1360 . 9 1 1 A 99 99 GLU HA H 99 4.123 3.980 0.143 1
1 1365 . 9 1 1 A 99 99 GLU C C 99 177.665 177.608 0.057 1
1 1366 . 9 1 1 A 99 99 GLU CA C 99 57.304 58.638 -1.334 1
1 1367 . 9 1 1 A 99 99 GLU CB C 99 29.368 29.447 -0.079 1
1 1369 . 9 1 1 A 99 99 GLU N N 99 120.067 118.700 1.367 1
1 1370 . 9 1 1 A 100 100 GLY H H 100 8.138 8.355 -0.217 1
1 1371 . 9 1 1 A 100 100 GLY HA2 H 100 3.865 3.771 0.094 1
1 1372 . 9 1 1 A 100 100 GLY HA3 H 100 3.715 3.791 -0.076 1
1 1373 . 9 1 1 A 100 100 GLY C C 100 174.464 175.076 -0.612 1
1 1374 . 9 1 1 A 100 100 GLY CA C 100 45.305 46.246 -0.941 1
1 1375 . 9 1 1 A 100 100 GLY N N 100 107.802 108.133 -0.331 1
1 1376 . 9 1 1 A 101 101 GLY H H 101 8.023 8.377 -0.354 1
1 1377 . 9 1 1 A 101 101 GLY HA2 H 101 3.865 3.858 0.007 1
1 1378 . 9 1 1 A 101 101 GLY HA3 H 101 3.892 3.888 0.004 1
1 1379 . 9 1 1 A 101 101 GLY C C 101 174.204 174.446 -0.242 1
1 1380 . 9 1 1 A 101 101 GLY CA C 101 45.036 46.646 -1.610 1
1 1381 . 9 1 1 A 101 101 GLY N N 101 108.032 107.742 0.290 1
1 1382 . 9 1 1 A 102 102 SER H H 102 8.059 8.214 -0.155 1
1 1383 . 9 1 1 A 102 102 SER HA H 102 4.380 4.459 -0.079 1
1 1386 . 9 1 1 A 102 102 SER C C 102 174.627 173.959 0.668 1
1 1387 . 9 1 1 A 102 102 SER CA C 102 58.194 58.067 0.127 1
1 1388 . 9 1 1 A 102 102 SER CB C 102 63.538 61.408 2.130 1
1 1389 . 9 1 1 A 102 102 SER N N 102 115.266 115.454 -0.188 1
1 1390 . 9 1 1 A 103 103 LEU H H 103 8.287 8.055 0.232 1
1 1391 . 9 1 1 A 103 103 LEU HA H 103 4.301 4.245 0.056 1
1 1401 . 9 1 1 A 103 103 LEU C C 103 177.292 176.567 0.725 1
1 1402 . 9 1 1 A 103 103 LEU CA C 103 55.007 54.931 0.076 1
1 1403 . 9 1 1 A 103 103 LEU CB C 103 42.023 41.765 0.258 1
1 1407 . 9 1 1 A 103 103 LEU N N 103 123.596 127.416 -3.820 1
1 1408 . 9 1 1 A 104 104 GLU H H 104 8.216 7.452 0.764 1
1 1409 . 9 1 1 A 104 104 GLU HA H 104 4.126 4.418 -0.292 1
1 1414 . 9 1 1 A 104 104 GLU CA C 104 56.518 55.585 0.933 1
1 1415 . 9 1 1 A 104 104 GLU CB C 104 29.837 30.058 -0.221 1
1 1417 . 9 1 1 A 104 104 GLU N N 104 120.510 119.131 1.379 1
1 1418 . 9 1 1 A 105 105 HIS HA H 105 4.593 5.091 -0.498 1
1 1421 . 9 1 1 A 105 105 HIS C C 105 173.766 174.006 -0.240 1
1 1422 . 9 1 1 A 105 105 HIS CA C 105 55.536 54.665 0.871 1
1 1423 . 9 1 1 A 105 105 HIS CB C 105 30.001 34.586 -4.585 1
1 1424 . 9 1 1 A 106 106 HIS H H 106 8.154 9.015 -0.861 1
1 1425 . 9 1 1 A 106 106 HIS HA H 106 4.407 5.098 -0.691 1
1 1428 . 9 1 1 A 106 106 HIS CA C 106 56.920 54.557 2.363 1
1 1429 . 9 1 1 A 106 106 HIS CB C 106 30.001 30.997 -0.996 1
1 14 . 10 1 1 A 2 2 LEU H H 2 8.509 9.165 -0.656 1
1 15 . 10 1 1 A 2 2 LEU HA H 2 4.463 5.260 -0.797 1
1 25 . 10 1 1 A 2 2 LEU C C 2 173.944 176.227 -2.283 1
1 26 . 10 1 1 A 2 2 LEU CA C 2 54.471 53.471 1.000 1
1 27 . 10 1 1 A 2 2 LEU CB C 2 43.595 44.539 -0.944 1
1 31 . 10 1 1 A 2 2 LEU N N 2 127.160 126.458 0.702 1
1 32 . 10 1 1 A 3 3 LEU H H 3 7.844 8.755 -0.911 1
1 33 . 10 1 1 A 3 3 LEU HA H 3 5.128 5.439 -0.311 1
1 43 . 10 1 1 A 3 3 LEU C C 3 175.423 175.184 0.239 1
1 44 . 10 1 1 A 3 3 LEU CA C 3 53.566 53.186 0.380 1
1 45 . 10 1 1 A 3 3 LEU CB C 3 44.039 44.857 -0.818 1
1 49 . 10 1 1 A 3 3 LEU N N 3 122.555 122.544 0.011 1
1 50 . 10 1 1 A 4 4 TYR H H 4 8.360 9.413 -1.053 1
1 51 . 10 1 1 A 4 4 TYR HA H 4 5.143 5.274 -0.131 1
1 58 . 10 1 1 A 4 4 TYR C C 4 174.481 174.891 -0.410 1
1 59 . 10 1 1 A 4 4 TYR CA C 4 56.577 56.160 0.417 1
1 60 . 10 1 1 A 4 4 TYR CB C 4 43.840 43.162 0.678 1
1 65 . 10 1 1 A 4 4 TYR N N 4 119.315 122.876 -3.561 1
1 66 . 10 1 1 A 5 5 VAL H H 5 8.918 8.815 0.103 1
1 67 . 10 1 1 A 5 5 VAL HA H 5 5.106 4.845 0.261 1
1 75 . 10 1 1 A 5 5 VAL C C 5 174.042 174.731 -0.689 1
1 76 . 10 1 1 A 5 5 VAL CA C 5 59.852 60.717 -0.865 1
1 77 . 10 1 1 A 5 5 VAL CB C 5 33.816 34.589 -0.773 1
1 80 . 10 1 1 A 5 5 VAL N N 5 119.952 120.497 -0.545 1
1 81 . 10 1 1 A 6 6 LEU H H 6 9.315 9.376 -0.061 1
1 82 . 10 1 1 A 6 6 LEU HA H 6 5.466 5.098 0.368 1
1 92 . 10 1 1 A 6 6 LEU C C 6 175.049 174.847 0.202 1
1 93 . 10 1 1 A 6 6 LEU CA C 6 52.090 53.250 -1.160 1
1 94 . 10 1 1 A 6 6 LEU CB C 6 44.103 43.096 1.007 1
1 98 . 10 1 1 A 6 6 LEU N N 6 126.917 126.594 0.323 1
1 99 . 10 1 1 A 7 7 ILE H H 7 8.458 8.831 -0.373 1
1 100 . 10 1 1 A 7 7 ILE HA H 7 5.131 5.028 0.103 1
1 110 . 10 1 1 A 7 7 ILE C C 7 173.213 173.669 -0.456 1
1 111 . 10 1 1 A 7 7 ILE CA C 7 58.463 59.943 -1.480 1
1 112 . 10 1 1 A 7 7 ILE CB C 7 41.020 40.713 0.307 1
1 116 . 10 1 1 A 7 7 ILE N N 7 119.778 126.350 -6.572 1
1 117 . 10 1 1 A 8 8 ILE H H 8 8.797 9.453 -0.656 1
1 118 . 10 1 1 A 8 8 ILE HA H 8 4.611 5.034 -0.423 1
1 128 . 10 1 1 A 8 8 ILE C C 8 174.611 174.757 -0.146 1
1 129 . 10 1 1 A 8 8 ILE CA C 8 60.227 60.361 -0.134 1
1 130 . 10 1 1 A 8 8 ILE CB C 8 37.665 38.176 -0.511 1
1 134 . 10 1 1 A 8 8 ILE N N 8 128.919 132.005 -3.086 1
1 135 . 10 1 1 A 9 9 SER H H 9 7.811 8.281 -0.470 1
1 136 . 10 1 1 A 9 9 SER HA H 9 4.429 5.038 -0.609 1
1 140 . 10 1 1 A 9 9 SER C C 9 172.937 173.059 -0.122 1
1 141 . 10 1 1 A 9 9 SER CA C 9 58.241 57.029 1.212 1
1 142 . 10 1 1 A 9 9 SER CB C 9 64.261 64.454 -0.193 1
1 143 . 10 1 1 A 9 9 SER N N 9 116.365 121.668 -5.303 1
1 144 . 10 1 1 A 10 10 ASN H H 10 8.641 8.585 0.056 1
1 145 . 10 1 1 A 10 10 ASN HA H 10 4.938 4.945 -0.007 1
1 150 . 10 1 1 A 10 10 ASN C C 10 174.497 174.914 -0.417 1
1 151 . 10 1 1 A 10 10 ASN CA C 10 52.221 54.317 -2.096 1
1 152 . 10 1 1 A 10 10 ASN CB C 10 39.128 40.242 -1.114 1
1 153 . 10 1 1 A 10 10 ASN N N 10 122.612 121.147 1.465 1
1 155 . 10 1 1 A 11 11 ASP H H 11 8.673 7.439 1.234 1
1 156 . 10 1 1 A 11 11 ASP HA H 11 4.596 4.644 -0.048 1
1 159 . 10 1 1 A 11 11 ASP C C 11 175.342 176.888 -1.546 1
1 160 . 10 1 1 A 11 11 ASP CA C 11 53.233 54.180 -0.947 1
1 161 . 10 1 1 A 11 11 ASP CB C 11 40.965 42.192 -1.227 1
1 162 . 10 1 1 A 11 11 ASP N N 11 122.717 119.101 3.616 1
1 163 . 10 1 1 A 12 12 LYS H H 12 8.562 8.816 -0.254 1
1 164 . 10 1 1 A 12 12 LYS HA H 12 3.854 3.959 -0.105 1
1 173 . 10 1 1 A 12 12 LYS C C 12 178.754 178.059 0.695 1
1 174 . 10 1 1 A 12 12 LYS CA C 12 59.581 60.177 -0.596 1
1 175 . 10 1 1 A 12 12 LYS CB C 12 32.378 32.712 -0.334 1
1 179 . 10 1 1 A 12 12 LYS N N 12 125.737 126.720 -0.983 1
1 180 . 10 1 1 A 13 13 LYS H H 13 8.075 7.758 0.317 1
1 181 . 10 1 1 A 13 13 LYS HA H 13 4.154 4.056 0.098 1
1 190 . 10 1 1 A 13 13 LYS C C 13 178.315 178.852 -0.537 1
1 191 . 10 1 1 A 13 13 LYS CA C 13 58.532 59.011 -0.479 1
1 192 . 10 1 1 A 13 13 LYS CB C 13 31.452 32.425 -0.973 1
1 196 . 10 1 1 A 13 13 LYS N N 13 119.604 120.068 -0.464 1
1 197 . 10 1 1 A 14 14 LEU H H 14 7.552 8.141 -0.589 1
1 198 . 10 1 1 A 14 14 LEU HA H 14 3.682 4.037 -0.355 1
1 208 . 10 1 1 A 14 14 LEU C C 14 178.429 178.176 0.253 1
1 209 . 10 1 1 A 14 14 LEU CA C 14 58.999 58.304 0.695 1
1 210 . 10 1 1 A 14 14 LEU CB C 14 41.228 41.291 -0.063 1
1 214 . 10 1 1 A 14 14 LEU N N 14 122.266 121.462 0.804 1
1 215 . 10 1 1 A 15 15 ILE H H 15 8.074 7.911 0.163 1
1 216 . 10 1 1 A 15 15 ILE HA H 15 3.264 3.463 -0.199 1
1 226 . 10 1 1 A 15 15 ILE C C 15 177.000 177.802 -0.802 1
1 227 . 10 1 1 A 15 15 ILE CA C 15 65.939 65.645 0.294 1
1 228 . 10 1 1 A 15 15 ILE CB C 15 37.983 38.173 -0.190 1
1 232 . 10 1 1 A 15 15 ILE N N 15 118.214 120.210 -1.996 1
1 233 . 10 1 1 A 16 16 GLU H H 16 8.016 8.307 -0.291 1
1 234 . 10 1 1 A 16 16 GLU HA H 16 4.045 3.969 0.076 1
1 239 . 10 1 1 A 16 16 GLU C C 16 179.388 179.548 -0.160 1
1 240 . 10 1 1 A 16 16 GLU CA C 16 59.032 59.642 -0.610 1
1 241 . 10 1 1 A 16 16 GLU CB C 16 29.200 29.216 -0.016 1
1 243 . 10 1 1 A 16 16 GLU N N 16 118.484 118.706 -0.222 1
1 244 . 10 1 1 A 17 17 GLU H H 17 8.063 8.436 -0.373 1
1 245 . 10 1 1 A 17 17 GLU HA H 17 4.053 3.999 0.054 1
1 250 . 10 1 1 A 17 17 GLU C C 17 179.306 179.217 0.089 1
1 251 . 10 1 1 A 17 17 GLU CA C 17 58.636 59.303 -0.667 1
1 252 . 10 1 1 A 17 17 GLU CB C 17 29.011 29.492 -0.481 1
1 254 . 10 1 1 A 17 17 GLU N N 17 118.100 120.861 -2.761 1
1 255 . 10 1 1 A 18 18 ALA H H 18 8.655 8.063 0.592 1
1 256 . 10 1 1 A 18 18 ALA HA H 18 3.775 4.043 -0.268 1
1 260 . 10 1 1 A 18 18 ALA C C 18 178.559 179.640 -1.081 1
1 261 . 10 1 1 A 18 18 ALA CA C 18 54.960 55.400 -0.440 1
1 262 . 10 1 1 A 18 18 ALA CB C 18 17.960 18.234 -0.274 1
1 263 . 10 1 1 A 18 18 ALA N N 18 122.439 122.582 -0.143 1
1 264 . 10 1 1 A 19 19 ARG H H 19 8.900 7.931 0.969 1
1 265 . 10 1 1 A 19 19 ARG HA H 19 3.809 4.117 -0.308 1
1 273 . 10 1 1 A 19 19 ARG C C 19 178.721 178.976 -0.255 1
1 274 . 10 1 1 A 19 19 ARG CA C 19 59.976 59.830 0.146 1
1 275 . 10 1 1 A 19 19 ARG CB C 19 29.572 29.873 -0.301 1
1 278 . 10 1 1 A 19 19 ARG N N 19 118.563 117.789 0.774 1
1 280 . 10 1 1 A 20 20 LYS H H 20 7.792 7.970 -0.178 1
1 281 . 10 1 1 A 20 20 LYS HA H 20 4.052 4.062 -0.010 1
1 290 . 10 1 1 A 20 20 LYS C C 20 179.648 179.801 -0.153 1
1 291 . 10 1 1 A 20 20 LYS CA C 20 59.296 59.380 -0.084 1
1 292 . 10 1 1 A 20 20 LYS CB C 20 32.216 32.140 0.076 1
1 296 . 10 1 1 A 20 20 LYS N N 20 118.638 119.613 -0.975 1
1 297 . 10 1 1 A 21 21 MET H H 21 7.684 8.113 -0.429 1
1 298 . 10 1 1 A 21 21 MET HA H 21 4.411 4.109 0.302 1
1 306 . 10 1 1 A 21 21 MET C C 21 177.909 178.003 -0.094 1
1 307 . 10 1 1 A 21 21 MET CA C 21 57.009 59.547 -2.538 1
1 308 . 10 1 1 A 21 21 MET CB C 21 32.028 32.818 -0.790 1
1 311 . 10 1 1 A 21 21 MET N N 21 118.100 118.399 -0.299 1
1 312 . 10 1 1 A 22 22 ALA H H 22 8.815 8.422 0.393 1
1 313 . 10 1 1 A 22 22 ALA HA H 22 3.826 3.960 -0.134 1
1 317 . 10 1 1 A 22 22 ALA C C 22 178.835 180.090 -1.255 1
1 318 . 10 1 1 A 22 22 ALA CA C 22 55.427 55.562 -0.135 1
1 319 . 10 1 1 A 22 22 ALA CB C 22 18.059 18.616 -0.557 1
1 320 . 10 1 1 A 22 22 ALA N N 22 122.150 121.544 0.606 1
1 321 . 10 1 1 A 23 23 GLU H H 23 8.276 8.262 0.014 1
1 322 . 10 1 1 A 23 23 GLU HA H 23 4.146 3.983 0.163 1
1 327 . 10 1 1 A 23 23 GLU C C 23 180.151 179.383 0.768 1
1 328 . 10 1 1 A 23 23 GLU CA C 23 58.999 59.557 -0.558 1
1 329 . 10 1 1 A 23 23 GLU CB C 23 29.160 29.540 -0.380 1
1 331 . 10 1 1 A 23 23 GLU N N 23 117.001 117.969 -0.968 1
1 332 . 10 1 1 A 24 24 LYS H H 24 7.573 7.801 -0.228 1
1 333 . 10 1 1 A 24 24 LYS HA H 24 4.101 4.046 0.055 1
1 342 . 10 1 1 A 24 24 LYS C C 24 177.145 177.994 -0.849 1
1 343 . 10 1 1 A 24 24 LYS CA C 24 58.261 58.991 -0.730 1
1 344 . 10 1 1 A 24 24 LYS CB C 24 32.079 32.295 -0.216 1
1 348 . 10 1 1 A 24 24 LYS N N 24 119.960 119.559 0.401 1
1 349 . 10 1 1 A 25 25 ALA H H 25 7.710 7.616 0.094 1
1 350 . 10 1 1 A 25 25 ALA HA H 25 4.413 4.345 0.068 1
1 354 . 10 1 1 A 25 25 ALA C C 25 175.325 177.357 -2.032 1
1 355 . 10 1 1 A 25 25 ALA CA C 25 51.208 51.610 -0.402 1
1 356 . 10 1 1 A 25 25 ALA CB C 25 18.520 18.913 -0.393 1
1 357 . 10 1 1 A 25 25 ALA N N 25 119.257 118.579 0.678 1
1 358 . 10 1 1 A 26 26 ASN H H 26 7.840 7.979 -0.139 1
1 359 . 10 1 1 A 26 26 ASN HA H 26 4.357 4.292 0.065 1
1 364 . 10 1 1 A 26 26 ASN C C 26 173.587 173.883 -0.296 1
1 365 . 10 1 1 A 26 26 ASN CA C 26 54.307 54.521 -0.214 1
1 366 . 10 1 1 A 26 26 ASN CB C 26 36.972 37.814 -0.842 1
1 367 . 10 1 1 A 26 26 ASN N N 26 115.266 115.735 -0.469 1
1 369 . 10 1 1 A 27 27 LEU H H 27 8.241 8.088 0.153 1
1 370 . 10 1 1 A 27 27 LEU HA H 27 4.652 4.303 0.349 1
1 380 . 10 1 1 A 27 27 LEU C C 27 175.894 176.459 -0.565 1
1 381 . 10 1 1 A 27 27 LEU CA C 27 52.923 54.383 -1.460 1
1 382 . 10 1 1 A 27 27 LEU CB C 27 44.090 42.557 1.533 1
1 386 . 10 1 1 A 27 27 LEU N N 27 116.828 120.356 -3.528 1
1 387 . 10 1 1 A 28 28 GLU H H 28 7.798 8.442 -0.644 1
1 388 . 10 1 1 A 28 28 GLU HA H 28 4.310 5.001 -0.691 1
1 393 . 10 1 1 A 28 28 GLU C C 28 173.944 174.921 -0.977 1
1 394 . 10 1 1 A 28 28 GLU CA C 28 55.460 55.260 0.200 1
1 395 . 10 1 1 A 28 28 GLU CB C 28 30.512 31.385 -0.873 1
1 397 . 10 1 1 A 28 28 GLU N N 28 121.340 123.004 -1.664 1
1 398 . 10 1 1 A 29 29 LEU H H 29 8.451 8.878 -0.427 1
1 399 . 10 1 1 A 29 29 LEU HA H 29 5.662 5.303 0.359 1
1 409 . 10 1 1 A 29 29 LEU C C 29 176.902 174.700 2.202 1
1 410 . 10 1 1 A 29 29 LEU CA C 29 53.186 53.913 -0.727 1
1 411 . 10 1 1 A 29 29 LEU CB C 29 44.914 45.806 -0.892 1
1 415 . 10 1 1 A 29 29 LEU N N 29 126.547 127.581 -1.034 1
1 416 . 10 1 1 A 30 30 ARG H H 30 9.094 9.175 -0.081 1
1 417 . 10 1 1 A 30 30 ARG HA H 30 4.910 4.710 0.200 1
1 425 . 10 1 1 A 30 30 ARG C C 30 175.147 175.970 -0.823 1
1 426 . 10 1 1 A 30 30 ARG CA C 30 53.417 54.575 -1.158 1
1 427 . 10 1 1 A 30 30 ARG CB C 30 32.555 31.655 0.900 1
1 430 . 10 1 1 A 30 30 ARG N N 30 125.043 126.412 -1.369 1
1 432 . 10 1 1 A 31 31 THR H H 31 8.496 8.409 0.087 1
1 433 . 10 1 1 A 31 31 THR HA H 31 4.888 4.759 0.129 1
1 438 . 10 1 1 A 31 31 THR C C 31 173.961 174.364 -0.403 1
1 439 . 10 1 1 A 31 31 THR CA C 31 60.445 61.113 -0.668 1
1 440 . 10 1 1 A 31 31 THR CB C 31 69.492 69.867 -0.375 1
1 442 . 10 1 1 A 31 31 THR N N 31 114.745 115.842 -1.097 1
1 443 . 10 1 1 A 32 32 VAL H H 32 8.480 9.237 -0.757 1
1 444 . 10 1 1 A 32 32 VAL HA H 32 4.411 5.049 -0.638 1
1 452 . 10 1 1 A 32 32 VAL C C 32 175.082 175.280 -0.198 1
1 453 . 10 1 1 A 32 32 VAL CA C 32 60.946 60.687 0.259 1
1 454 . 10 1 1 A 32 32 VAL CB C 32 34.487 35.050 -0.563 1
1 457 . 10 1 1 A 32 32 VAL N N 32 122.324 125.209 -2.885 1
1 458 . 10 1 1 A 33 33 LYS H H 33 9.304 8.934 0.370 1
1 459 . 10 1 1 A 33 33 LYS HA H 33 4.534 4.619 -0.085 1
1 468 . 10 1 1 A 33 33 LYS C C 33 176.740 176.325 0.415 1
1 469 . 10 1 1 A 33 33 LYS CA C 33 56.846 56.971 -0.125 1
1 470 . 10 1 1 A 33 33 LYS CB C 33 34.355 35.100 -0.745 1
1 474 . 10 1 1 A 33 33 LYS N N 33 123.654 124.306 -0.652 1
1 475 . 10 1 1 A 34 34 THR H H 34 7.245 7.849 -0.604 1
1 476 . 10 1 1 A 34 34 THR HA H 34 4.780 4.735 0.045 1
1 481 . 10 1 1 A 34 34 THR C C 34 174.529 175.451 -0.922 1
1 482 . 10 1 1 A 34 34 THR CA C 34 58.859 59.239 -0.380 1
1 483 . 10 1 1 A 34 34 THR CB C 34 73.023 71.966 1.057 1
1 485 . 10 1 1 A 34 34 THR N N 34 106.300 111.753 -5.453 1
1 486 . 10 1 1 A 35 35 GLU H H 35 9.174 9.180 -0.006 1
1 487 . 10 1 1 A 35 35 GLU HA H 35 3.886 3.935 -0.049 1
1 492 . 10 1 1 A 35 35 GLU C C 35 177.714 177.903 -0.189 1
1 493 . 10 1 1 A 35 35 GLU CA C 35 59.233 59.479 -0.246 1
1 494 . 10 1 1 A 35 35 GLU CB C 35 29.377 29.378 -0.001 1
1 496 . 10 1 1 A 35 35 GLU N N 35 121.919 121.941 -0.022 1
1 497 . 10 1 1 A 36 36 ASP H H 36 8.185 8.287 -0.102 1
1 498 . 10 1 1 A 36 36 ASP HA H 36 4.289 4.378 -0.089 1
1 501 . 10 1 1 A 36 36 ASP C C 36 178.348 179.330 -0.982 1
1 502 . 10 1 1 A 36 36 ASP CA C 36 56.962 56.390 0.572 1
1 503 . 10 1 1 A 36 36 ASP CB C 36 40.214 40.229 -0.015 1
1 504 . 10 1 1 A 36 36 ASP N N 36 118.332 120.341 -2.009 1
1 505 . 10 1 1 A 37 37 GLU H H 37 7.741 7.559 0.182 1
1 506 . 10 1 1 A 37 37 GLU HA H 37 3.708 3.840 -0.132 1
1 511 . 10 1 1 A 37 37 GLU C C 37 177.324 178.628 -1.304 1
1 512 . 10 1 1 A 37 37 GLU CA C 37 58.698 59.022 -0.324 1
1 513 . 10 1 1 A 37 37 GLU CB C 37 30.199 29.883 0.316 1
1 515 . 10 1 1 A 37 37 GLU N N 37 120.704 121.162 -0.458 1
1 516 . 10 1 1 A 38 38 LEU H H 38 7.531 8.055 -0.524 1
1 517 . 10 1 1 A 38 38 LEU HA H 38 3.873 4.227 -0.354 1
1 527 . 10 1 1 A 38 38 LEU C C 38 177.357 178.553 -1.196 1
1 528 . 10 1 1 A 38 38 LEU CA C 38 58.305 58.129 0.176 1
1 529 . 10 1 1 A 38 38 LEU CB C 38 40.837 41.588 -0.751 1
1 533 . 10 1 1 A 38 38 LEU N N 38 119.200 121.988 -2.788 1
1 534 . 10 1 1 A 39 39 LYS H H 39 8.083 8.365 -0.282 1
1 535 . 10 1 1 A 39 39 LYS HA H 39 3.608 3.900 -0.292 1
1 544 . 10 1 1 A 39 39 LYS C C 39 177.373 178.736 -1.363 1
1 545 . 10 1 1 A 39 39 LYS CA C 39 60.290 59.629 0.661 1
1 546 . 10 1 1 A 39 39 LYS CB C 39 32.178 32.347 -0.169 1
1 550 . 10 1 1 A 39 39 LYS N N 39 116.943 118.723 -1.780 1
1 551 . 10 1 1 A 40 40 LYS H H 40 7.632 7.943 -0.311 1
1 552 . 10 1 1 A 40 40 LYS HA H 40 3.864 4.116 -0.252 1
1 561 . 10 1 1 A 40 40 LYS C C 40 179.566 178.281 1.285 1
1 562 . 10 1 1 A 40 40 LYS CA C 40 58.993 58.943 0.050 1
1 563 . 10 1 1 A 40 40 LYS CB C 40 31.758 31.844 -0.086 1
1 567 . 10 1 1 A 40 40 LYS N N 40 118.274 119.048 -0.774 1
1 568 . 10 1 1 A 41 41 TYR H H 41 7.823 7.595 0.228 1
1 569 . 10 1 1 A 41 41 TYR HA H 41 3.926 3.981 -0.055 1
1 576 . 10 1 1 A 41 41 TYR C C 41 176.625 177.769 -1.144 1
1 577 . 10 1 1 A 41 41 TYR CA C 41 59.757 60.707 -0.950 1
1 578 . 10 1 1 A 41 41 TYR CB C 41 36.901 37.931 -1.030 1
1 583 . 10 1 1 A 41 41 TYR N N 41 117.811 119.170 -1.359 1
1 584 . 10 1 1 A 42 42 LEU H H 42 7.964 8.286 -0.322 1
1 585 . 10 1 1 A 42 42 LEU HA H 42 3.704 3.970 -0.266 1
1 595 . 10 1 1 A 42 42 LEU C C 42 178.396 179.082 -0.686 1
1 596 . 10 1 1 A 42 42 LEU CA C 42 58.237 57.916 0.321 1
1 597 . 10 1 1 A 42 42 LEU CB C 42 40.507 41.342 -0.835 1
1 601 . 10 1 1 A 42 42 LEU N N 42 115.960 119.953 -3.993 1
1 602 . 10 1 1 A 43 43 GLU H H 43 8.193 8.212 -0.019 1
1 603 . 10 1 1 A 43 43 GLU HA H 43 3.882 3.874 0.008 1
1 608 . 10 1 1 A 43 43 GLU C C 43 179.193 178.765 0.428 1
1 609 . 10 1 1 A 43 43 GLU CA C 43 59.122 59.921 -0.799 1
1 610 . 10 1 1 A 43 43 GLU CB C 43 29.244 29.147 0.097 1
1 612 . 10 1 1 A 43 43 GLU N N 43 117.175 118.285 -1.110 1
1 613 . 10 1 1 A 44 44 GLU H H 44 7.601 7.829 -0.228 1
1 614 . 10 1 1 A 44 44 GLU HA H 44 3.936 3.961 -0.025 1
1 619 . 10 1 1 A 44 44 GLU C C 44 179.875 179.193 0.682 1
1 620 . 10 1 1 A 44 44 GLU CA C 44 58.867 59.374 -0.507 1
1 621 . 10 1 1 A 44 44 GLU CB C 44 28.648 29.220 -0.572 1
1 623 . 10 1 1 A 44 44 GLU N N 44 120.472 119.337 1.135 1
1 624 . 10 1 1 A 45 45 PHE H H 45 8.260 7.776 0.484 1
1 625 . 10 1 1 A 45 45 PHE HA H 45 4.520 4.090 0.430 1
1 633 . 10 1 1 A 45 45 PHE C C 45 177.942 178.290 -0.348 1
1 634 . 10 1 1 A 45 45 PHE CA C 45 55.945 61.338 -5.393 1
1 635 . 10 1 1 A 45 45 PHE CB C 45 36.680 38.448 -1.768 1
1 641 . 10 1 1 A 45 45 PHE N N 45 119.272 119.433 -0.161 1
1 642 . 10 1 1 A 46 46 ARG H H 46 8.023 8.090 -0.067 1
1 643 . 10 1 1 A 46 46 ARG HA H 46 4.074 3.993 0.081 1
1 651 . 10 1 1 A 46 46 ARG C C 46 177.617 178.956 -1.339 1
1 652 . 10 1 1 A 46 46 ARG CA C 46 58.194 59.468 -1.274 1
1 653 . 10 1 1 A 46 46 ARG CB C 46 29.737 29.979 -0.242 1
1 656 . 10 1 1 A 46 46 ARG N N 46 118.136 119.877 -1.741 1
1 658 . 10 1 1 A 47 47 LYS H H 47 7.470 7.934 -0.464 1
1 659 . 10 1 1 A 47 47 LYS HA H 47 4.143 4.158 -0.015 1
1 668 . 10 1 1 A 47 47 LYS C C 47 177.324 178.329 -1.005 1
1 669 . 10 1 1 A 47 47 LYS CA C 47 57.726 59.371 -1.645 1
1 670 . 10 1 1 A 47 47 LYS CB C 47 32.409 32.134 0.275 1
1 674 . 10 1 1 A 47 47 LYS N N 47 116.943 118.995 -2.052 1
1 675 . 10 1 1 A 48 48 GLU H H 48 7.615 8.082 -0.467 1
1 676 . 10 1 1 A 48 48 GLU HA H 48 4.428 4.401 0.027 1
1 681 . 10 1 1 A 48 48 GLU C C 48 176.869 177.445 -0.576 1
1 682 . 10 1 1 A 48 48 GLU CA C 48 55.945 56.960 -1.015 1
1 683 . 10 1 1 A 48 48 GLU CB C 48 29.696 30.355 -0.659 1
1 685 . 10 1 1 A 48 48 GLU N N 48 118.852 118.209 0.643 1
1 686 . 10 1 1 A 49 49 SER H H 49 7.725 7.872 -0.147 1
1 687 . 10 1 1 A 49 49 SER HA H 49 4.244 4.153 0.091 1
1 690 . 10 1 1 A 49 49 SER C C 49 174.838 176.814 -1.976 1
1 691 . 10 1 1 A 49 49 SER CA C 49 59.366 60.872 -1.506 1
1 692 . 10 1 1 A 49 49 SER CB C 49 63.116 63.127 -0.011 1
1 693 . 10 1 1 A 49 49 SER N N 49 114.224 116.573 -2.349 1
1 694 . 10 1 1 A 50 50 GLN H H 50 8.548 8.020 0.528 1
1 695 . 10 1 1 A 50 50 GLN HA H 50 4.398 4.149 0.249 1
1 702 . 10 1 1 A 50 50 GLN C C 50 175.732 176.526 -0.794 1
1 703 . 10 1 1 A 50 50 GLN CA C 50 56.272 58.452 -2.180 1
1 704 . 10 1 1 A 50 50 GLN CB C 50 28.946 28.871 0.075 1
1 706 . 10 1 1 A 50 50 GLN N N 50 120.125 119.701 0.424 1
1 708 . 10 1 1 A 51 51 ASN H H 51 8.534 8.151 0.383 1
1 709 . 10 1 1 A 51 51 ASN HA H 51 4.980 4.977 0.003 1
1 714 . 10 1 1 A 51 51 ASN C C 51 173.717 173.995 -0.278 1
1 715 . 10 1 1 A 51 51 ASN CA C 51 52.804 52.544 0.260 1
1 716 . 10 1 1 A 51 51 ASN CB C 51 39.583 39.578 0.005 1
1 717 . 10 1 1 A 51 51 ASN N N 51 118.158 114.473 3.685 1
1 719 . 10 1 1 A 52 52 ILE H H 52 7.492 7.621 -0.129 1
1 720 . 10 1 1 A 52 52 ILE HA H 52 5.338 5.107 0.231 1
1 730 . 10 1 1 A 52 52 ILE C C 52 175.049 174.276 0.773 1
1 731 . 10 1 1 A 52 52 ILE CA C 52 59.364 59.948 -0.584 1
1 732 . 10 1 1 A 52 52 ILE CB C 52 42.163 41.078 1.085 1
1 736 . 10 1 1 A 52 52 ILE N N 52 117.927 121.285 -3.358 1
1 737 . 10 1 1 A 53 53 LYS H H 53 8.467 9.177 -0.710 1
1 738 . 10 1 1 A 53 53 LYS HA H 53 5.044 5.265 -0.221 1
1 747 . 10 1 1 A 53 53 LYS C C 53 175.082 175.531 -0.449 1
1 748 . 10 1 1 A 53 53 LYS CA C 53 55.429 54.944 0.485 1
1 749 . 10 1 1 A 53 53 LYS CB C 53 36.446 35.318 1.128 1
1 753 . 10 1 1 A 53 53 LYS N N 53 123.249 128.141 -4.892 1
1 754 . 10 1 1 A 54 54 VAL H H 54 8.490 9.377 -0.887 1
1 755 . 10 1 1 A 54 54 VAL HA H 54 5.159 4.957 0.202 1
1 763 . 10 1 1 A 54 54 VAL C C 54 173.473 173.826 -0.353 1
1 764 . 10 1 1 A 54 54 VAL CA C 54 60.163 61.020 -0.857 1
1 765 . 10 1 1 A 54 54 VAL CB C 54 35.509 33.700 1.809 1
1 768 . 10 1 1 A 54 54 VAL N N 54 120.762 123.458 -2.696 1
1 769 . 10 1 1 A 55 55 LEU H H 55 8.636 8.410 0.226 1
1 770 . 10 1 1 A 55 55 LEU HA H 55 4.670 4.569 0.101 1
1 780 . 10 1 1 A 55 55 LEU C C 55 173.652 174.252 -0.600 1
1 781 . 10 1 1 A 55 55 LEU CA C 55 52.289 53.347 -1.058 1
1 782 . 10 1 1 A 55 55 LEU CB C 55 42.070 42.734 -0.664 1
1 786 . 10 1 1 A 55 55 LEU N N 55 131.898 129.351 2.547 1
1 787 . 10 1 1 A 56 56 ILE H H 56 9.188 9.039 0.149 1
1 788 . 10 1 1 A 56 56 ILE HA H 56 4.879 5.102 -0.223 1
1 798 . 10 1 1 A 56 56 ILE C C 56 174.172 174.430 -0.258 1
1 799 . 10 1 1 A 56 56 ILE CA C 56 59.976 59.927 0.049 1
1 800 . 10 1 1 A 56 56 ILE CB C 56 38.181 39.185 -1.004 1
1 804 . 10 1 1 A 56 56 ILE N N 56 126.373 128.675 -2.302 1
1 805 . 10 1 1 A 57 57 LEU H H 57 8.929 9.255 -0.326 1
1 806 . 10 1 1 A 57 57 LEU HA H 57 5.394 5.230 0.164 1
1 816 . 10 1 1 A 57 57 LEU C C 57 175.358 176.209 -0.851 1
1 817 . 10 1 1 A 57 57 LEU CA C 57 52.086 53.005 -0.919 1
1 818 . 10 1 1 A 57 57 LEU CB C 57 42.445 42.734 -0.289 1
1 822 . 10 1 1 A 57 57 LEU N N 57 126.547 128.676 -2.129 1
1 823 . 10 1 1 A 58 58 VAL H H 58 8.542 8.877 -0.335 1
1 824 . 10 1 1 A 58 58 VAL HA H 58 5.253 4.800 0.453 1
1 832 . 10 1 1 A 58 58 VAL C C 58 175.244 175.985 -0.741 1
1 833 . 10 1 1 A 58 58 VAL CA C 58 58.241 59.034 -0.793 1
1 834 . 10 1 1 A 58 58 VAL CB C 58 33.165 34.798 -1.633 1
1 837 . 10 1 1 A 58 58 VAL N N 58 114.398 120.999 -6.601 1
1 838 . 10 1 1 A 59 59 SER H H 59 8.797 8.836 -0.039 1
1 839 . 10 1 1 A 59 59 SER HA H 59 5.063 4.439 0.624 1
1 842 . 10 1 1 A 59 59 SER C C 59 174.172 174.113 0.059 1
1 843 . 10 1 1 A 59 59 SER CA C 59 59.320 60.591 -1.271 1
1 844 . 10 1 1 A 59 59 SER CB C 59 65.600 63.301 2.299 1
1 845 . 10 1 1 A 59 59 SER N N 59 115.497 116.281 -0.784 1
1 846 . 10 1 1 A 60 60 ASN H H 60 7.730 8.146 -0.416 1
1 847 . 10 1 1 A 60 60 ASN HA H 60 4.811 5.073 -0.262 1
1 852 . 10 1 1 A 60 60 ASN C C 60 174.464 175.914 -1.450 1
1 853 . 10 1 1 A 60 60 ASN CA C 60 52.007 52.087 -0.080 1
1 854 . 10 1 1 A 60 60 ASN CB C 60 40.336 40.462 -0.126 1
1 855 . 10 1 1 A 60 60 ASN N N 60 117.522 117.950 -0.428 1
1 857 . 10 1 1 A 61 61 ASP H H 61 8.577 8.988 -0.411 1
1 858 . 10 1 1 A 61 61 ASP HA H 61 4.365 4.299 0.066 1
1 861 . 10 1 1 A 61 61 ASP C C 61 177.357 178.379 -1.022 1
1 862 . 10 1 1 A 61 61 ASP CA C 61 57.351 57.048 0.303 1
1 863 . 10 1 1 A 61 61 ASP CB C 61 40.383 39.698 0.685 1
1 864 . 10 1 1 A 61 61 ASP N N 61 119.431 122.097 -2.666 1
1 865 . 10 1 1 A 62 62 GLU H H 62 8.405 8.517 -0.112 1
1 866 . 10 1 1 A 62 62 GLU HA H 62 4.121 3.987 0.134 1
1 871 . 10 1 1 A 62 62 GLU C C 62 179.615 179.059 0.556 1
1 872 . 10 1 1 A 62 62 GLU CA C 62 59.593 59.824 -0.231 1
1 873 . 10 1 1 A 62 62 GLU CB C 62 28.478 29.154 -0.676 1
1 875 . 10 1 1 A 62 62 GLU N N 62 122.150 119.855 2.295 1
1 876 . 10 1 1 A 63 63 GLU H H 63 8.384 8.234 0.150 1
1 877 . 10 1 1 A 63 63 GLU HA H 63 3.913 4.004 -0.091 1
1 882 . 10 1 1 A 63 63 GLU C C 63 178.478 179.068 -0.590 1
1 883 . 10 1 1 A 63 63 GLU CA C 63 58.273 59.091 -0.818 1
1 884 . 10 1 1 A 63 63 GLU CB C 63 29.931 29.118 0.813 1
1 886 . 10 1 1 A 63 63 GLU N N 63 119.084 118.742 0.342 1
1 887 . 10 1 1 A 64 64 LEU H H 64 7.717 8.241 -0.524 1
1 888 . 10 1 1 A 64 64 LEU HA H 64 3.750 4.031 -0.281 1
1 898 . 10 1 1 A 64 64 LEU C C 64 177.535 178.050 -0.515 1
1 899 . 10 1 1 A 64 64 LEU CA C 64 58.944 58.411 0.533 1
1 900 . 10 1 1 A 64 64 LEU CB C 64 41.695 41.614 0.081 1
1 904 . 10 1 1 A 64 64 LEU N N 64 120.357 121.962 -1.605 1
1 905 . 10 1 1 A 65 65 ASP H H 65 7.922 8.328 -0.406 1
1 906 . 10 1 1 A 65 65 ASP HA H 65 4.313 4.232 0.081 1
1 909 . 10 1 1 A 65 65 ASP C C 65 179.095 178.597 0.498 1
1 910 . 10 1 1 A 65 65 ASP CA C 65 57.272 57.925 -0.653 1
1 911 . 10 1 1 A 65 65 ASP CB C 65 40.196 41.357 -1.161 1
1 912 . 10 1 1 A 65 65 ASP N N 65 118.100 118.577 -0.477 1
1 913 . 10 1 1 A 66 66 LYS H H 66 7.802 7.747 0.055 1
1 914 . 10 1 1 A 66 66 LYS HA H 66 4.078 3.895 0.183 1
1 923 . 10 1 1 A 66 66 LYS C C 66 178.624 178.774 -0.150 1
1 924 . 10 1 1 A 66 66 LYS CA C 66 58.429 59.578 -1.149 1
1 925 . 10 1 1 A 66 66 LYS CB C 66 31.727 32.314 -0.587 1
1 929 . 10 1 1 A 66 66 LYS N N 66 119.343 118.617 0.726 1
1 930 . 10 1 1 A 67 67 ALA H H 67 8.480 8.163 0.317 1
1 931 . 10 1 1 A 67 67 ALA HA H 67 3.853 4.099 -0.246 1
1 935 . 10 1 1 A 67 67 ALA C C 67 178.591 179.568 -0.977 1
1 936 . 10 1 1 A 67 67 ALA CA C 67 55.403 55.462 -0.059 1
1 937 . 10 1 1 A 67 67 ALA CB C 67 17.793 18.666 -0.873 1
1 938 . 10 1 1 A 67 67 ALA N N 67 121.562 122.413 -0.851 1
1 939 . 10 1 1 A 68 68 LYS H H 68 8.186 7.993 0.193 1
1 940 . 10 1 1 A 68 68 LYS HA H 68 3.805 4.030 -0.225 1
1 949 . 10 1 1 A 68 68 LYS C C 68 179.095 178.823 0.272 1
1 950 . 10 1 1 A 68 68 LYS CA C 68 59.952 59.313 0.639 1
1 951 . 10 1 1 A 68 68 LYS CB C 68 32.181 32.154 0.027 1
1 955 . 10 1 1 A 68 68 LYS N N 68 116.165 116.991 -0.826 1
1 956 . 10 1 1 A 69 69 GLU H H 69 7.904 8.300 -0.396 1
1 957 . 10 1 1 A 69 69 GLU HA H 69 3.995 4.038 -0.043 1
1 962 . 10 1 1 A 69 69 GLU C C 69 179.079 179.224 -0.145 1
1 963 . 10 1 1 A 69 69 GLU CA C 69 59.022 58.904 0.118 1
1 964 . 10 1 1 A 69 69 GLU CB C 69 29.274 29.652 -0.378 1
1 966 . 10 1 1 A 69 69 GLU N N 69 119.489 119.548 -0.059 1
1 967 . 10 1 1 A 70 70 LEU H H 70 7.962 8.099 -0.137 1
1 968 . 10 1 1 A 70 70 LEU HA H 70 4.020 3.936 0.084 1
1 978 . 10 1 1 A 70 70 LEU C C 70 178.738 178.742 -0.004 1
1 979 . 10 1 1 A 70 70 LEU CA C 70 57.486 57.835 -0.349 1
1 980 . 10 1 1 A 70 70 LEU CB C 70 41.695 42.266 -0.571 1
1 984 . 10 1 1 A 70 70 LEU N N 70 119.431 120.742 -1.311 1
1 985 . 10 1 1 A 71 71 ALA H H 71 8.260 8.512 -0.252 1
1 986 . 10 1 1 A 71 71 ALA HA H 71 3.845 4.005 -0.160 1
1 990 . 10 1 1 A 71 71 ALA C C 71 179.518 179.922 -0.404 1
1 991 . 10 1 1 A 71 71 ALA CA C 71 55.139 55.631 -0.492 1
1 992 . 10 1 1 A 71 71 ALA CB C 71 18.487 18.351 0.136 1
1 993 . 10 1 1 A 71 71 ALA N N 71 119.604 120.459 -0.855 1
1 994 . 10 1 1 A 72 72 GLN H H 72 7.910 8.330 -0.420 1
1 995 . 10 1 1 A 72 72 GLN HA H 72 4.154 3.964 0.190 1
1 1002 . 10 1 1 A 72 72 GLN C C 72 178.900 178.748 0.152 1
1 1003 . 10 1 1 A 72 72 GLN CA C 72 58.194 58.949 -0.755 1
1 1004 . 10 1 1 A 72 72 GLN CB C 72 28.056 28.390 -0.334 1
1 1006 . 10 1 1 A 72 72 GLN N N 72 115.960 117.665 -1.705 1
1 1008 . 10 1 1 A 73 73 LYS H H 73 7.841 7.784 0.057 1
1 1009 . 10 1 1 A 73 73 LYS HA H 73 4.171 4.168 0.003 1
1 1018 . 10 1 1 A 73 73 LYS C C 73 177.730 177.918 -0.188 1
1 1019 . 10 1 1 A 73 73 LYS CA C 73 57.867 58.740 -0.873 1
1 1020 . 10 1 1 A 73 73 LYS CB C 73 32.277 32.166 0.111 1
1 1024 . 10 1 1 A 73 73 LYS N N 73 119.027 118.681 0.346 1
1 1025 . 10 1 1 A 74 74 MET H H 74 7.746 8.061 -0.315 1
1 1026 . 10 1 1 A 74 74 MET HA H 74 4.403 4.518 -0.115 1
1 1034 . 10 1 1 A 74 74 MET C C 74 174.416 175.218 -0.802 1
1 1035 . 10 1 1 A 74 74 MET CA C 74 55.194 54.980 0.214 1
1 1036 . 10 1 1 A 74 74 MET CB C 74 33.366 33.142 0.224 1
1 1039 . 10 1 1 A 74 74 MET N N 74 115.786 115.531 0.255 1
1 1040 . 10 1 1 A 75 75 GLU H H 75 8.076 7.677 0.399 1
1 1041 . 10 1 1 A 75 75 GLU HA H 75 4.001 3.872 0.129 1
1 1046 . 10 1 1 A 75 75 GLU C C 75 175.130 174.924 0.206 1
1 1047 . 10 1 1 A 75 75 GLU CA C 75 56.722 57.421 -0.699 1
1 1048 . 10 1 1 A 75 75 GLU CB C 75 27.118 27.552 -0.434 1
1 1050 . 10 1 1 A 75 75 GLU N N 75 116.249 116.849 -0.600 1
1 1051 . 10 1 1 A 76 76 ILE H H 76 7.560 7.188 0.372 1
1 1052 . 10 1 1 A 76 76 ILE HA H 76 4.428 4.659 -0.231 1
1 1062 . 10 1 1 A 76 76 ILE C C 76 174.529 174.438 0.091 1
1 1063 . 10 1 1 A 76 76 ILE CA C 76 58.475 59.531 -1.056 1
1 1064 . 10 1 1 A 76 76 ILE CB C 76 40.337 41.795 -1.458 1
1 1068 . 10 1 1 A 76 76 ILE N N 76 115.960 118.897 -2.937 1
1 1069 . 10 1 1 A 77 77 ASP H H 77 8.889 8.717 0.172 1
1 1070 . 10 1 1 A 77 77 ASP HA H 77 4.569 4.846 -0.277 1
1 1073 . 10 1 1 A 77 77 ASP C C 77 174.123 176.196 -2.073 1
1 1074 . 10 1 1 A 77 77 ASP CA C 77 54.069 53.906 0.163 1
1 1075 . 10 1 1 A 77 77 ASP CB C 77 40.233 41.472 -1.239 1
1 1076 . 10 1 1 A 77 77 ASP N N 77 126.142 126.009 0.133 1
1 1077 . 10 1 1 A 78 78 VAL H H 78 7.754 8.973 -1.219 1
1 1078 . 10 1 1 A 78 78 VAL HA H 78 5.192 5.548 -0.356 1
1 1086 . 10 1 1 A 78 78 VAL C C 78 174.968 174.568 0.400 1
1 1087 . 10 1 1 A 78 78 VAL CA C 78 58.804 58.563 0.241 1
1 1088 . 10 1 1 A 78 78 VAL CB C 78 35.293 36.026 -0.733 1
1 1091 . 10 1 1 A 78 78 VAL N N 78 122.844 119.520 3.324 1
1 1092 . 10 1 1 A 79 79 ARG H H 79 8.499 8.751 -0.252 1
1 1093 . 10 1 1 A 79 79 ARG HA H 79 4.712 4.889 -0.177 1
1 1100 . 10 1 1 A 79 79 ARG C C 79 174.221 175.201 -0.980 1
1 1101 . 10 1 1 A 79 79 ARG CA C 79 54.117 54.756 -0.639 1
1 1102 . 10 1 1 A 79 79 ARG CB C 79 31.196 31.728 -0.532 1
1 1105 . 10 1 1 A 79 79 ARG N N 79 125.637 121.376 4.261 1
1 1106 . 10 1 1 A 80 80 THR H H 80 8.416 8.518 -0.102 1
1 1107 . 10 1 1 A 80 80 THR HA H 80 5.332 4.768 0.564 1
1 1112 . 10 1 1 A 80 80 THR C C 80 174.497 174.115 0.382 1
1 1113 . 10 1 1 A 80 80 THR CA C 80 59.694 61.277 -1.583 1
1 1114 . 10 1 1 A 80 80 THR CB C 80 69.772 69.757 0.015 1
1 1116 . 10 1 1 A 80 80 THR N N 80 118.084 117.308 0.776 1
1 1117 . 10 1 1 A 81 81 ARG H H 81 8.758 8.901 -0.143 1
1 1118 . 10 1 1 A 81 81 ARG HA H 81 4.362 4.785 -0.423 1
1 1126 . 10 1 1 A 81 81 ARG C C 81 173.733 173.999 -0.266 1
1 1127 . 10 1 1 A 81 81 ARG CA C 81 53.273 53.773 -0.500 1
1 1128 . 10 1 1 A 81 81 ARG CB C 81 33.915 33.100 0.815 1
1 1131 . 10 1 1 A 81 81 ARG N N 81 122.844 123.522 -0.678 1
1 1133 . 10 1 1 A 82 82 LYS H H 82 8.721 8.493 0.228 1
1 1134 . 10 1 1 A 82 82 LYS HA H 82 4.701 4.842 -0.141 1
1 1143 . 10 1 1 A 82 82 LYS C C 82 175.667 176.249 -0.582 1
1 1144 . 10 1 1 A 82 82 LYS CA C 82 54.960 55.652 -0.692 1
1 1145 . 10 1 1 A 82 82 LYS CB C 82 32.603 33.757 -1.154 1
1 1149 . 10 1 1 A 82 82 LYS N N 82 124.668 123.532 1.136 1
1 1150 . 10 1 1 A 83 83 VAL H H 83 9.112 9.241 -0.129 1
1 1151 . 10 1 1 A 83 83 VAL HA H 83 4.796 4.993 -0.197 1
1 1159 . 10 1 1 A 83 83 VAL C C 83 174.594 175.584 -0.990 1
1 1160 . 10 1 1 A 83 83 VAL CA C 83 59.413 60.336 -0.923 1
1 1161 . 10 1 1 A 83 83 VAL CB C 83 35.298 34.381 0.917 1
1 1164 . 10 1 1 A 83 83 VAL N N 83 122.381 121.444 0.937 1
1 1165 . 10 1 1 A 84 84 THR H H 84 9.200 8.933 0.267 1
1 1166 . 10 1 1 A 84 84 THR HA H 84 4.579 4.574 0.005 1
1 1171 . 10 1 1 A 84 84 THR C C 84 173.993 174.948 -0.955 1
1 1172 . 10 1 1 A 84 84 THR CA C 84 60.960 61.772 -0.812 1
1 1173 . 10 1 1 A 84 84 THR CB C 84 70.100 69.751 0.349 1
1 1175 . 10 1 1 A 84 84 THR N N 84 113.183 115.959 -2.776 1
1 1176 . 10 1 1 A 85 85 SER H H 85 7.688 7.965 -0.277 1
1 1177 . 10 1 1 A 85 85 SER HA H 85 5.136 4.935 0.201 1
1 1180 . 10 1 1 A 85 85 SER CA C 85 55.205 55.843 -0.638 1
1 1181 . 10 1 1 A 85 85 SER CB C 85 64.376 66.165 -1.789 1
1 1182 . 10 1 1 A 85 85 SER N N 85 115.555 116.814 -1.259 1
1 1183 . 10 1 1 A 86 86 PRO HA H 86 4.090 4.253 -0.163 1
1 1190 . 10 1 1 A 86 86 PRO C C 86 177.227 177.581 -0.354 1
1 1191 . 10 1 1 A 86 86 PRO CA C 86 65.038 65.700 -0.662 1
1 1192 . 10 1 1 A 86 86 PRO CB C 86 31.711 31.725 -0.014 1
1 1195 . 10 1 1 A 87 87 ASP H H 87 8.131 8.506 -0.375 1
1 1196 . 10 1 1 A 87 87 ASP HA H 87 4.223 4.344 -0.121 1
1 1199 . 10 1 1 A 87 87 ASP C C 87 178.721 179.194 -0.473 1
1 1200 . 10 1 1 A 87 87 ASP CA C 87 57.311 56.769 0.542 1
1 1201 . 10 1 1 A 87 87 ASP CB C 87 40.102 40.044 0.058 1
1 1202 . 10 1 1 A 87 87 ASP N N 87 115.381 116.604 -1.223 1
1 1203 . 10 1 1 A 88 88 GLU H H 88 7.571 7.886 -0.315 1
1 1204 . 10 1 1 A 88 88 GLU HA H 88 3.659 4.003 -0.344 1
1 1209 . 10 1 1 A 88 88 GLU C C 88 177.097 178.669 -1.572 1
1 1210 . 10 1 1 A 88 88 GLU CA C 88 58.729 58.855 -0.126 1
1 1211 . 10 1 1 A 88 88 GLU CB C 88 30.052 29.563 0.489 1
1 1213 . 10 1 1 A 88 88 GLU N N 88 120.009 121.523 -1.514 1
1 1214 . 10 1 1 A 89 89 ALA H H 89 7.423 7.589 -0.166 1
1 1215 . 10 1 1 A 89 89 ALA HA H 89 3.900 4.327 -0.427 1
1 1219 . 10 1 1 A 89 89 ALA C C 89 178.267 180.082 -1.815 1
1 1220 . 10 1 1 A 89 89 ALA CA C 89 55.607 55.042 0.565 1
1 1221 . 10 1 1 A 89 89 ALA CB C 89 17.348 18.341 -0.993 1
1 1222 . 10 1 1 A 89 89 ALA N N 89 118.873 122.307 -3.434 1
1 1223 . 10 1 1 A 90 90 LYS H H 90 8.046 8.081 -0.035 1
1 1224 . 10 1 1 A 90 90 LYS HA H 90 3.669 3.971 -0.302 1
1 1233 . 10 1 1 A 90 90 LYS C C 90 177.649 179.034 -1.385 1
1 1234 . 10 1 1 A 90 90 LYS CA C 90 60.351 59.793 0.558 1
1 1235 . 10 1 1 A 90 90 LYS CB C 90 32.087 32.306 -0.219 1
1 1239 . 10 1 1 A 90 90 LYS N N 90 114.834 117.378 -2.544 1
1 1240 . 10 1 1 A 91 91 ARG H H 91 7.468 7.926 -0.458 1
1 1241 . 10 1 1 A 91 91 ARG HA H 91 3.887 3.894 -0.007 1
1 1249 . 10 1 1 A 91 91 ARG C C 91 178.998 178.998 0.000 1
1 1250 . 10 1 1 A 91 91 ARG CA C 91 59.164 59.026 0.138 1
1 1251 . 10 1 1 A 91 91 ARG CB C 91 29.274 29.631 -0.357 1
1 1254 . 10 1 1 A 91 91 ARG N N 91 119.029 119.319 -0.290 1
1 1256 . 10 1 1 A 92 92 TRP H H 92 8.136 8.152 -0.016 1
1 1257 . 10 1 1 A 92 92 TRP HA H 92 4.818 4.547 0.271 1
1 1266 . 10 1 1 A 92 92 TRP C C 92 179.566 178.938 0.628 1
1 1267 . 10 1 1 A 92 92 TRP CA C 92 58.663 58.968 -0.305 1
1 1268 . 10 1 1 A 92 92 TRP CB C 92 29.790 29.578 0.212 1
1 1274 . 10 1 1 A 92 92 TRP N N 92 118.100 120.437 -2.337 1
1 1276 . 10 1 1 A 93 93 ILE H H 93 8.363 8.511 -0.148 1
1 1277 . 10 1 1 A 93 93 ILE HA H 93 3.544 3.795 -0.251 1
1 1287 . 10 1 1 A 93 93 ILE C C 93 176.820 177.918 -1.098 1
1 1288 . 10 1 1 A 93 93 ILE CA C 93 66.225 65.594 0.631 1
1 1289 . 10 1 1 A 93 93 ILE CB C 93 37.571 37.864 -0.293 1
1 1293 . 10 1 1 A 93 93 ILE N N 93 120.588 120.320 0.268 1
1 1294 . 10 1 1 A 94 94 LYS H H 94 8.264 7.924 0.340 1
1 1295 . 10 1 1 A 94 94 LYS HA H 94 3.865 3.988 -0.123 1
1 1304 . 10 1 1 A 94 94 LYS C C 94 179.258 178.990 0.268 1
1 1305 . 10 1 1 A 94 94 LYS CA C 94 59.889 59.825 0.064 1
1 1306 . 10 1 1 A 94 94 LYS CB C 94 32.225 32.506 -0.281 1
1 1310 . 10 1 1 A 94 94 LYS N N 94 121.687 120.549 1.138 1
1 1311 . 10 1 1 A 95 95 GLU H H 95 8.360 8.332 0.028 1
1 1312 . 10 1 1 A 95 95 GLU HA H 95 4.023 4.075 -0.052 1
1 1317 . 10 1 1 A 95 95 GLU C C 95 178.884 179.180 -0.296 1
1 1318 . 10 1 1 A 95 95 GLU CA C 95 59.366 59.483 -0.117 1
1 1319 . 10 1 1 A 95 95 GLU CB C 95 29.508 29.716 -0.208 1
1 1321 . 10 1 1 A 95 95 GLU N N 95 118.505 117.569 0.936 1
1 1322 . 10 1 1 A 96 96 PHE H H 96 8.212 8.622 -0.410 1
1 1323 . 10 1 1 A 96 96 PHE HA H 96 4.512 4.683 -0.171 1
1 1331 . 10 1 1 A 96 96 PHE C C 96 176.820 178.217 -1.397 1
1 1332 . 10 1 1 A 96 96 PHE CA C 96 59.608 61.472 -1.864 1
1 1333 . 10 1 1 A 96 96 PHE CB C 96 40.431 39.173 1.258 1
1 1339 . 10 1 1 A 96 96 PHE N N 96 120.369 122.093 -1.724 1
1 1340 . 10 1 1 A 97 97 SER H H 97 8.216 8.431 -0.215 1
1 1341 . 10 1 1 A 97 97 SER HA H 97 3.816 4.103 -0.287 1
1 1344 . 10 1 1 A 97 97 SER C C 97 175.618 175.527 0.091 1
1 1345 . 10 1 1 A 97 97 SER CA C 97 60.492 61.173 -0.681 1
1 1346 . 10 1 1 A 97 97 SER CB C 97 63.022 62.541 0.481 1
1 1347 . 10 1 1 A 97 97 SER N N 97 111.969 113.441 -1.472 1
1 1348 . 10 1 1 A 98 98 GLU H H 98 7.655 7.724 -0.069 1
1 1349 . 10 1 1 A 98 98 GLU HA H 98 4.187 4.266 -0.079 1
1 1354 . 10 1 1 A 98 98 GLU C C 98 177.698 178.689 -0.991 1
1 1355 . 10 1 1 A 98 98 GLU CA C 98 57.069 58.004 -0.935 1
1 1356 . 10 1 1 A 98 98 GLU CB C 98 29.321 29.645 -0.324 1
1 1358 . 10 1 1 A 98 98 GLU N N 98 120.588 121.238 -0.650 1
1 1359 . 10 1 1 A 99 99 GLU H H 99 7.794 7.556 0.238 1
1 1360 . 10 1 1 A 99 99 GLU HA H 99 4.123 3.980 0.143 1
1 1365 . 10 1 1 A 99 99 GLU C C 99 177.665 177.481 0.184 1
1 1366 . 10 1 1 A 99 99 GLU CA C 99 57.304 58.582 -1.278 1
1 1367 . 10 1 1 A 99 99 GLU CB C 99 29.368 29.819 -0.451 1
1 1369 . 10 1 1 A 99 99 GLU N N 99 120.067 119.075 0.992 1
1 1370 . 10 1 1 A 100 100 GLY H H 100 8.138 8.173 -0.035 1
1 1371 . 10 1 1 A 100 100 GLY HA2 H 100 3.865 3.850 0.015 1
1 1372 . 10 1 1 A 100 100 GLY HA3 H 100 3.715 3.895 -0.180 1
1 1373 . 10 1 1 A 100 100 GLY C C 100 174.464 175.302 -0.838 1
1 1374 . 10 1 1 A 100 100 GLY CA C 100 45.305 45.563 -0.258 1
1 1375 . 10 1 1 A 100 100 GLY N N 100 107.802 108.376 -0.574 1
1 1376 . 10 1 1 A 101 101 GLY H H 101 8.023 8.653 -0.630 1
1 1377 . 10 1 1 A 101 101 GLY HA2 H 101 3.865 4.010 -0.145 1
1 1378 . 10 1 1 A 101 101 GLY HA3 H 101 3.892 4.017 -0.125 1
1 1379 . 10 1 1 A 101 101 GLY C C 101 174.204 174.888 -0.684 1
1 1380 . 10 1 1 A 101 101 GLY CA C 101 45.036 45.416 -0.380 1
1 1381 . 10 1 1 A 101 101 GLY N N 101 108.032 107.485 0.547 1
1 1382 . 10 1 1 A 102 102 SER H H 102 8.059 8.396 -0.337 1
1 1383 . 10 1 1 A 102 102 SER HA H 102 4.380 4.467 -0.087 1
1 1386 . 10 1 1 A 102 102 SER C C 102 174.627 174.077 0.550 1
1 1387 . 10 1 1 A 102 102 SER CA C 102 58.194 59.613 -1.419 1
1 1388 . 10 1 1 A 102 102 SER CB C 102 63.538 61.339 2.199 1
1 1389 . 10 1 1 A 102 102 SER N N 102 115.266 108.127 7.139 1
1 1390 . 10 1 1 A 103 103 LEU H H 103 8.287 8.004 0.283 1
1 1391 . 10 1 1 A 103 103 LEU HA H 103 4.301 3.863 0.438 1
1 1401 . 10 1 1 A 103 103 LEU C C 103 177.292 178.671 -1.379 1
1 1402 . 10 1 1 A 103 103 LEU CA C 103 55.007 57.999 -2.992 1
1 1403 . 10 1 1 A 103 103 LEU CB C 103 42.023 41.799 0.224 1
1 1407 . 10 1 1 A 103 103 LEU N N 103 123.596 121.054 2.542 1
1 1408 . 10 1 1 A 104 104 GLU H H 104 8.216 8.340 -0.124 1
1 1409 . 10 1 1 A 104 104 GLU HA H 104 4.126 3.833 0.293 1
1 1414 . 10 1 1 A 104 104 GLU CA C 104 56.518 58.954 -2.436 1
1 1415 . 10 1 1 A 104 104 GLU CB C 104 29.837 28.832 1.005 1
1 1417 . 10 1 1 A 104 104 GLU N N 104 120.510 116.859 3.651 1
1 1418 . 10 1 1 A 105 105 HIS HA H 105 4.593 4.630 -0.037 1
1 1421 . 10 1 1 A 105 105 HIS C C 105 173.766 174.392 -0.626 1
1 1422 . 10 1 1 A 105 105 HIS CA C 105 55.536 54.745 0.791 1
1 1423 . 10 1 1 A 105 105 HIS CB C 105 30.001 28.289 1.712 1
1 1424 . 10 1 1 A 106 106 HIS H H 106 8.154 8.683 -0.529 1
1 1425 . 10 1 1 A 106 106 HIS HA H 106 4.407 4.791 -0.384 1
1 1428 . 10 1 1 A 106 106 HIS CA C 106 56.920 55.224 1.696 1
1 1429 . 10 1 1 A 106 106 HIS CB C 106 30.001 28.010 1.991 1
1 14 . 11 1 1 A 2 2 LEU H H 2 8.509 9.246 -0.737 1
1 15 . 11 1 1 A 2 2 LEU HA H 2 4.463 4.700 -0.237 1
1 25 . 11 1 1 A 2 2 LEU C C 2 173.944 176.155 -2.211 1
1 26 . 11 1 1 A 2 2 LEU CA C 2 54.471 54.614 -0.143 1
1 27 . 11 1 1 A 2 2 LEU CB C 2 43.595 42.846 0.749 1
1 31 . 11 1 1 A 2 2 LEU N N 2 127.160 127.672 -0.512 1
1 32 . 11 1 1 A 3 3 LEU H H 3 7.844 8.641 -0.797 1
1 33 . 11 1 1 A 3 3 LEU HA H 3 5.128 5.419 -0.291 1
1 43 . 11 1 1 A 3 3 LEU C C 3 175.423 175.280 0.143 1
1 44 . 11 1 1 A 3 3 LEU CA C 3 53.566 53.157 0.409 1
1 45 . 11 1 1 A 3 3 LEU CB C 3 44.039 44.679 -0.640 1
1 49 . 11 1 1 A 3 3 LEU N N 3 122.555 123.726 -1.171 1
1 50 . 11 1 1 A 4 4 TYR H H 4 8.360 9.359 -0.999 1
1 51 . 11 1 1 A 4 4 TYR HA H 4 5.143 5.310 -0.167 1
1 58 . 11 1 1 A 4 4 TYR C C 4 174.481 174.966 -0.485 1
1 59 . 11 1 1 A 4 4 TYR CA C 4 56.577 55.714 0.863 1
1 60 . 11 1 1 A 4 4 TYR CB C 4 43.840 41.918 1.922 1
1 65 . 11 1 1 A 4 4 TYR N N 4 119.315 123.811 -4.496 1
1 66 . 11 1 1 A 5 5 VAL H H 5 8.918 8.889 0.029 1
1 67 . 11 1 1 A 5 5 VAL HA H 5 5.106 4.956 0.150 1
1 75 . 11 1 1 A 5 5 VAL C C 5 174.042 174.616 -0.574 1
1 76 . 11 1 1 A 5 5 VAL CA C 5 59.852 61.046 -1.194 1
1 77 . 11 1 1 A 5 5 VAL CB C 5 33.816 34.840 -1.024 1
1 80 . 11 1 1 A 5 5 VAL N N 5 119.952 120.273 -0.321 1
1 81 . 11 1 1 A 6 6 LEU H H 6 9.315 9.450 -0.135 1
1 82 . 11 1 1 A 6 6 LEU HA H 6 5.466 5.265 0.201 1
1 92 . 11 1 1 A 6 6 LEU C C 6 175.049 174.784 0.265 1
1 93 . 11 1 1 A 6 6 LEU CA C 6 52.090 53.005 -0.915 1
1 94 . 11 1 1 A 6 6 LEU CB C 6 44.103 43.484 0.619 1
1 98 . 11 1 1 A 6 6 LEU N N 6 126.917 126.479 0.438 1
1 99 . 11 1 1 A 7 7 ILE H H 7 8.458 8.815 -0.357 1
1 100 . 11 1 1 A 7 7 ILE HA H 7 5.131 5.071 0.060 1
1 110 . 11 1 1 A 7 7 ILE C C 7 173.213 173.605 -0.392 1
1 111 . 11 1 1 A 7 7 ILE CA C 7 58.463 59.986 -1.523 1
1 112 . 11 1 1 A 7 7 ILE CB C 7 41.020 40.995 0.025 1
1 116 . 11 1 1 A 7 7 ILE N N 7 119.778 126.264 -6.486 1
1 117 . 11 1 1 A 8 8 ILE H H 8 8.797 9.353 -0.556 1
1 118 . 11 1 1 A 8 8 ILE HA H 8 4.611 4.814 -0.203 1
1 128 . 11 1 1 A 8 8 ILE C C 8 174.611 174.853 -0.242 1
1 129 . 11 1 1 A 8 8 ILE CA C 8 60.227 60.354 -0.127 1
1 130 . 11 1 1 A 8 8 ILE CB C 8 37.665 37.971 -0.306 1
1 134 . 11 1 1 A 8 8 ILE N N 8 128.919 132.086 -3.167 1
1 135 . 11 1 1 A 9 9 SER H H 9 7.811 8.778 -0.967 1
1 136 . 11 1 1 A 9 9 SER HA H 9 4.429 4.988 -0.559 1
1 140 . 11 1 1 A 9 9 SER C C 9 172.937 172.843 0.094 1
1 141 . 11 1 1 A 9 9 SER CA C 9 58.241 56.956 1.285 1
1 142 . 11 1 1 A 9 9 SER CB C 9 64.261 64.332 -0.071 1
1 143 . 11 1 1 A 9 9 SER N N 9 116.365 121.818 -5.453 1
1 144 . 11 1 1 A 10 10 ASN H H 10 8.641 8.647 -0.006 1
1 145 . 11 1 1 A 10 10 ASN HA H 10 4.938 4.981 -0.043 1
1 150 . 11 1 1 A 10 10 ASN C C 10 174.497 175.177 -0.680 1
1 151 . 11 1 1 A 10 10 ASN CA C 10 52.221 53.398 -1.177 1
1 152 . 11 1 1 A 10 10 ASN CB C 10 39.128 39.412 -0.284 1
1 153 . 11 1 1 A 10 10 ASN N N 10 122.612 120.860 1.752 1
1 155 . 11 1 1 A 11 11 ASP H H 11 8.673 7.404 1.269 1
1 156 . 11 1 1 A 11 11 ASP HA H 11 4.596 4.823 -0.227 1
1 159 . 11 1 1 A 11 11 ASP C C 11 175.342 176.119 -0.777 1
1 160 . 11 1 1 A 11 11 ASP CA C 11 53.233 53.585 -0.352 1
1 161 . 11 1 1 A 11 11 ASP CB C 11 40.965 40.216 0.749 1
1 162 . 11 1 1 A 11 11 ASP N N 11 122.717 120.447 2.270 1
1 163 . 11 1 1 A 12 12 LYS H H 12 8.562 8.629 -0.067 1
1 164 . 11 1 1 A 12 12 LYS HA H 12 3.854 3.992 -0.138 1
1 173 . 11 1 1 A 12 12 LYS C C 12 178.754 178.224 0.530 1
1 174 . 11 1 1 A 12 12 LYS CA C 12 59.581 60.257 -0.676 1
1 175 . 11 1 1 A 12 12 LYS CB C 12 32.378 32.402 -0.024 1
1 179 . 11 1 1 A 12 12 LYS N N 12 125.737 126.099 -0.362 1
1 180 . 11 1 1 A 13 13 LYS H H 13 8.075 7.590 0.485 1
1 181 . 11 1 1 A 13 13 LYS HA H 13 4.154 4.031 0.123 1
1 190 . 11 1 1 A 13 13 LYS C C 13 178.315 179.237 -0.922 1
1 191 . 11 1 1 A 13 13 LYS CA C 13 58.532 59.410 -0.878 1
1 192 . 11 1 1 A 13 13 LYS CB C 13 31.452 32.278 -0.826 1
1 196 . 11 1 1 A 13 13 LYS N N 13 119.604 119.789 -0.185 1
1 197 . 11 1 1 A 14 14 LEU H H 14 7.552 7.692 -0.140 1
1 198 . 11 1 1 A 14 14 LEU HA H 14 3.682 4.037 -0.355 1
1 208 . 11 1 1 A 14 14 LEU C C 14 178.429 178.299 0.130 1
1 209 . 11 1 1 A 14 14 LEU CA C 14 58.999 58.017 0.982 1
1 210 . 11 1 1 A 14 14 LEU CB C 14 41.228 41.575 -0.347 1
1 214 . 11 1 1 A 14 14 LEU N N 14 122.266 121.204 1.062 1
1 215 . 11 1 1 A 15 15 ILE H H 15 8.074 8.004 0.070 1
1 216 . 11 1 1 A 15 15 ILE HA H 15 3.264 3.452 -0.188 1
1 226 . 11 1 1 A 15 15 ILE C C 15 177.000 177.892 -0.892 1
1 227 . 11 1 1 A 15 15 ILE CA C 15 65.939 65.777 0.162 1
1 228 . 11 1 1 A 15 15 ILE CB C 15 37.983 37.685 0.298 1
1 232 . 11 1 1 A 15 15 ILE N N 15 118.214 119.417 -1.203 1
1 233 . 11 1 1 A 16 16 GLU H H 16 8.016 8.610 -0.594 1
1 234 . 11 1 1 A 16 16 GLU HA H 16 4.045 3.907 0.138 1
1 239 . 11 1 1 A 16 16 GLU C C 16 179.388 179.573 -0.185 1
1 240 . 11 1 1 A 16 16 GLU CA C 16 59.032 59.977 -0.945 1
1 241 . 11 1 1 A 16 16 GLU CB C 16 29.200 29.279 -0.079 1
1 243 . 11 1 1 A 16 16 GLU N N 16 118.484 118.889 -0.405 1
1 244 . 11 1 1 A 17 17 GLU H H 17 8.063 8.275 -0.212 1
1 245 . 11 1 1 A 17 17 GLU HA H 17 4.053 4.070 -0.017 1
1 250 . 11 1 1 A 17 17 GLU C C 17 179.306 178.954 0.352 1
1 251 . 11 1 1 A 17 17 GLU CA C 17 58.636 59.170 -0.534 1
1 252 . 11 1 1 A 17 17 GLU CB C 17 29.011 29.286 -0.275 1
1 254 . 11 1 1 A 17 17 GLU N N 17 118.100 120.527 -2.427 1
1 255 . 11 1 1 A 18 18 ALA H H 18 8.655 8.085 0.570 1
1 256 . 11 1 1 A 18 18 ALA HA H 18 3.775 4.074 -0.299 1
1 260 . 11 1 1 A 18 18 ALA C C 18 178.559 180.068 -1.509 1
1 261 . 11 1 1 A 18 18 ALA CA C 18 54.960 55.400 -0.440 1
1 262 . 11 1 1 A 18 18 ALA CB C 18 17.960 18.328 -0.368 1
1 263 . 11 1 1 A 18 18 ALA N N 18 122.439 122.700 -0.261 1
1 264 . 11 1 1 A 19 19 ARG H H 19 8.900 8.165 0.735 1
1 265 . 11 1 1 A 19 19 ARG HA H 19 3.809 4.046 -0.237 1
1 273 . 11 1 1 A 19 19 ARG C C 19 178.721 179.155 -0.434 1
1 274 . 11 1 1 A 19 19 ARG CA C 19 59.976 59.766 0.210 1
1 275 . 11 1 1 A 19 19 ARG CB C 19 29.572 30.011 -0.439 1
1 278 . 11 1 1 A 19 19 ARG N N 19 118.563 117.773 0.790 1
1 280 . 11 1 1 A 20 20 LYS H H 20 7.792 8.085 -0.293 1
1 281 . 11 1 1 A 20 20 LYS HA H 20 4.052 4.135 -0.083 1
1 290 . 11 1 1 A 20 20 LYS C C 20 179.648 179.574 0.074 1
1 291 . 11 1 1 A 20 20 LYS CA C 20 59.296 58.922 0.374 1
1 292 . 11 1 1 A 20 20 LYS CB C 20 32.216 32.083 0.133 1
1 296 . 11 1 1 A 20 20 LYS N N 20 118.638 119.316 -0.678 1
1 297 . 11 1 1 A 21 21 MET H H 21 7.684 7.883 -0.199 1
1 298 . 11 1 1 A 21 21 MET HA H 21 4.411 4.143 0.268 1
1 306 . 11 1 1 A 21 21 MET C C 21 177.909 178.161 -0.252 1
1 307 . 11 1 1 A 21 21 MET CA C 21 57.009 59.278 -2.269 1
1 308 . 11 1 1 A 21 21 MET CB C 21 32.028 33.082 -1.054 1
1 311 . 11 1 1 A 21 21 MET N N 21 118.100 118.612 -0.512 1
1 312 . 11 1 1 A 22 22 ALA H H 22 8.815 8.356 0.459 1
1 313 . 11 1 1 A 22 22 ALA HA H 22 3.826 3.925 -0.099 1
1 317 . 11 1 1 A 22 22 ALA C C 22 178.835 180.224 -1.389 1
1 318 . 11 1 1 A 22 22 ALA CA C 22 55.427 55.555 -0.128 1
1 319 . 11 1 1 A 22 22 ALA CB C 22 18.059 18.455 -0.396 1
1 320 . 11 1 1 A 22 22 ALA N N 22 122.150 121.314 0.836 1
1 321 . 11 1 1 A 23 23 GLU H H 23 8.276 7.930 0.346 1
1 322 . 11 1 1 A 23 23 GLU HA H 23 4.146 3.983 0.163 1
1 327 . 11 1 1 A 23 23 GLU C C 23 180.151 179.496 0.655 1
1 328 . 11 1 1 A 23 23 GLU CA C 23 58.999 59.457 -0.458 1
1 329 . 11 1 1 A 23 23 GLU CB C 23 29.160 29.202 -0.042 1
1 331 . 11 1 1 A 23 23 GLU N N 23 117.001 117.806 -0.805 1
1 332 . 11 1 1 A 24 24 LYS H H 24 7.573 7.918 -0.345 1
1 333 . 11 1 1 A 24 24 LYS HA H 24 4.101 4.057 0.044 1
1 342 . 11 1 1 A 24 24 LYS C C 24 177.145 179.207 -2.062 1
1 343 . 11 1 1 A 24 24 LYS CA C 24 58.261 59.131 -0.870 1
1 344 . 11 1 1 A 24 24 LYS CB C 24 32.079 32.026 0.053 1
1 348 . 11 1 1 A 24 24 LYS N N 24 119.960 119.392 0.568 1
1 349 . 11 1 1 A 25 25 ALA H H 25 7.710 7.587 0.123 1
1 350 . 11 1 1 A 25 25 ALA HA H 25 4.413 4.300 0.113 1
1 354 . 11 1 1 A 25 25 ALA C C 25 175.325 177.290 -1.965 1
1 355 . 11 1 1 A 25 25 ALA CA C 25 51.208 52.666 -1.458 1
1 356 . 11 1 1 A 25 25 ALA CB C 25 18.520 19.551 -1.031 1
1 357 . 11 1 1 A 25 25 ALA N N 25 119.257 119.121 0.136 1
1 358 . 11 1 1 A 26 26 ASN H H 26 7.840 8.111 -0.271 1
1 359 . 11 1 1 A 26 26 ASN HA H 26 4.357 4.301 0.056 1
1 364 . 11 1 1 A 26 26 ASN C C 26 173.587 173.831 -0.244 1
1 365 . 11 1 1 A 26 26 ASN CA C 26 54.307 54.516 -0.209 1
1 366 . 11 1 1 A 26 26 ASN CB C 26 36.972 37.572 -0.600 1
1 367 . 11 1 1 A 26 26 ASN N N 26 115.266 116.119 -0.853 1
1 369 . 11 1 1 A 27 27 LEU H H 27 8.241 7.523 0.718 1
1 370 . 11 1 1 A 27 27 LEU HA H 27 4.652 4.592 0.060 1
1 380 . 11 1 1 A 27 27 LEU C C 27 175.894 175.677 0.217 1
1 381 . 11 1 1 A 27 27 LEU CA C 27 52.923 53.345 -0.422 1
1 382 . 11 1 1 A 27 27 LEU CB C 27 44.090 43.939 0.151 1
1 386 . 11 1 1 A 27 27 LEU N N 27 116.828 119.965 -3.137 1
1 387 . 11 1 1 A 28 28 GLU H H 28 7.798 8.442 -0.644 1
1 388 . 11 1 1 A 28 28 GLU HA H 28 4.310 4.496 -0.186 1
1 393 . 11 1 1 A 28 28 GLU C C 28 173.944 174.859 -0.915 1
1 394 . 11 1 1 A 28 28 GLU CA C 28 55.460 55.553 -0.093 1
1 395 . 11 1 1 A 28 28 GLU CB C 28 30.512 30.365 0.147 1
1 397 . 11 1 1 A 28 28 GLU N N 28 121.340 122.253 -0.913 1
1 398 . 11 1 1 A 29 29 LEU H H 29 8.451 8.912 -0.461 1
1 399 . 11 1 1 A 29 29 LEU HA H 29 5.662 5.340 0.322 1
1 409 . 11 1 1 A 29 29 LEU C C 29 176.902 174.922 1.980 1
1 410 . 11 1 1 A 29 29 LEU CA C 29 53.186 53.863 -0.677 1
1 411 . 11 1 1 A 29 29 LEU CB C 29 44.914 44.310 0.604 1
1 415 . 11 1 1 A 29 29 LEU N N 29 126.547 129.351 -2.804 1
1 416 . 11 1 1 A 30 30 ARG H H 30 9.094 9.233 -0.139 1
1 417 . 11 1 1 A 30 30 ARG HA H 30 4.910 4.660 0.250 1
1 425 . 11 1 1 A 30 30 ARG C C 30 175.147 175.773 -0.626 1
1 426 . 11 1 1 A 30 30 ARG CA C 30 53.417 54.392 -0.975 1
1 427 . 11 1 1 A 30 30 ARG CB C 30 32.555 32.793 -0.238 1
1 430 . 11 1 1 A 30 30 ARG N N 30 125.043 126.442 -1.399 1
1 432 . 11 1 1 A 31 31 THR H H 31 8.496 8.496 0.000 1
1 433 . 11 1 1 A 31 31 THR HA H 31 4.888 4.804 0.084 1
1 438 . 11 1 1 A 31 31 THR C C 31 173.961 174.109 -0.148 1
1 439 . 11 1 1 A 31 31 THR CA C 31 60.445 61.157 -0.712 1
1 440 . 11 1 1 A 31 31 THR CB C 31 69.492 69.962 -0.470 1
1 442 . 11 1 1 A 31 31 THR N N 31 114.745 115.639 -0.894 1
1 443 . 11 1 1 A 32 32 VAL H H 32 8.480 9.089 -0.609 1
1 444 . 11 1 1 A 32 32 VAL HA H 32 4.411 4.442 -0.031 1
1 452 . 11 1 1 A 32 32 VAL C C 32 175.082 175.807 -0.725 1
1 453 . 11 1 1 A 32 32 VAL CA C 32 60.946 61.920 -0.974 1
1 454 . 11 1 1 A 32 32 VAL CB C 32 34.487 32.672 1.815 1
1 457 . 11 1 1 A 32 32 VAL N N 32 122.324 126.528 -4.204 1
1 458 . 11 1 1 A 33 33 LYS H H 33 9.304 8.917 0.387 1
1 459 . 11 1 1 A 33 33 LYS HA H 33 4.534 4.503 0.031 1
1 468 . 11 1 1 A 33 33 LYS C C 33 176.740 176.808 -0.068 1
1 469 . 11 1 1 A 33 33 LYS CA C 33 56.846 57.293 -0.447 1
1 470 . 11 1 1 A 33 33 LYS CB C 33 34.355 33.809 0.546 1
1 474 . 11 1 1 A 33 33 LYS N N 33 123.654 126.502 -2.848 1
1 475 . 11 1 1 A 34 34 THR H H 34 7.245 7.644 -0.399 1
1 476 . 11 1 1 A 34 34 THR HA H 34 4.780 4.596 0.184 1
1 481 . 11 1 1 A 34 34 THR C C 34 174.529 175.023 -0.494 1
1 482 . 11 1 1 A 34 34 THR CA C 34 58.859 59.851 -0.992 1
1 483 . 11 1 1 A 34 34 THR CB C 34 73.023 72.159 0.864 1
1 485 . 11 1 1 A 34 34 THR N N 34 106.300 111.326 -5.026 1
1 486 . 11 1 1 A 35 35 GLU H H 35 9.174 8.805 0.369 1
1 487 . 11 1 1 A 35 35 GLU HA H 35 3.886 3.984 -0.098 1
1 492 . 11 1 1 A 35 35 GLU C C 35 177.714 177.431 0.283 1
1 493 . 11 1 1 A 35 35 GLU CA C 35 59.233 59.607 -0.374 1
1 494 . 11 1 1 A 35 35 GLU CB C 35 29.377 29.448 -0.071 1
1 496 . 11 1 1 A 35 35 GLU N N 35 121.919 121.887 0.032 1
1 497 . 11 1 1 A 36 36 ASP H H 36 8.185 8.331 -0.146 1
1 498 . 11 1 1 A 36 36 ASP HA H 36 4.289 4.290 -0.001 1
1 501 . 11 1 1 A 36 36 ASP C C 36 178.348 178.528 -0.180 1
1 502 . 11 1 1 A 36 36 ASP CA C 36 56.962 57.582 -0.620 1
1 503 . 11 1 1 A 36 36 ASP CB C 36 40.214 41.498 -1.284 1
1 504 . 11 1 1 A 36 36 ASP N N 36 118.332 119.838 -1.506 1
1 505 . 11 1 1 A 37 37 GLU H H 37 7.741 7.843 -0.102 1
1 506 . 11 1 1 A 37 37 GLU HA H 37 3.708 3.863 -0.155 1
1 511 . 11 1 1 A 37 37 GLU C C 37 177.324 179.042 -1.718 1
1 512 . 11 1 1 A 37 37 GLU CA C 37 58.698 59.221 -0.523 1
1 513 . 11 1 1 A 37 37 GLU CB C 37 30.199 29.334 0.865 1
1 515 . 11 1 1 A 37 37 GLU N N 37 120.704 119.111 1.593 1
1 516 . 11 1 1 A 38 38 LEU H H 38 7.531 8.142 -0.611 1
1 517 . 11 1 1 A 38 38 LEU HA H 38 3.873 4.172 -0.299 1
1 527 . 11 1 1 A 38 38 LEU C C 38 177.357 178.574 -1.217 1
1 528 . 11 1 1 A 38 38 LEU CA C 38 58.305 58.258 0.047 1
1 529 . 11 1 1 A 38 38 LEU CB C 38 40.837 41.708 -0.871 1
1 533 . 11 1 1 A 38 38 LEU N N 38 119.200 121.679 -2.479 1
1 534 . 11 1 1 A 39 39 LYS H H 39 8.083 8.080 0.003 1
1 535 . 11 1 1 A 39 39 LYS HA H 39 3.608 3.884 -0.276 1
1 544 . 11 1 1 A 39 39 LYS C C 39 177.373 178.962 -1.589 1
1 545 . 11 1 1 A 39 39 LYS CA C 39 60.290 59.623 0.667 1
1 546 . 11 1 1 A 39 39 LYS CB C 39 32.178 32.119 0.059 1
1 550 . 11 1 1 A 39 39 LYS N N 39 116.943 118.921 -1.978 1
1 551 . 11 1 1 A 40 40 LYS H H 40 7.632 8.004 -0.372 1
1 552 . 11 1 1 A 40 40 LYS HA H 40 3.864 3.872 -0.008 1
1 561 . 11 1 1 A 40 40 LYS C C 40 179.566 178.537 1.029 1
1 562 . 11 1 1 A 40 40 LYS CA C 40 58.993 58.907 0.086 1
1 563 . 11 1 1 A 40 40 LYS CB C 40 31.758 32.082 -0.324 1
1 567 . 11 1 1 A 40 40 LYS N N 40 118.274 119.207 -0.933 1
1 568 . 11 1 1 A 41 41 TYR H H 41 7.823 7.679 0.144 1
1 569 . 11 1 1 A 41 41 TYR HA H 41 3.926 3.990 -0.064 1
1 576 . 11 1 1 A 41 41 TYR C C 41 176.625 177.827 -1.202 1
1 577 . 11 1 1 A 41 41 TYR CA C 41 59.757 60.731 -0.974 1
1 578 . 11 1 1 A 41 41 TYR CB C 41 36.901 37.426 -0.525 1
1 583 . 11 1 1 A 41 41 TYR N N 41 117.811 119.083 -1.272 1
1 584 . 11 1 1 A 42 42 LEU H H 42 7.964 8.120 -0.156 1
1 585 . 11 1 1 A 42 42 LEU HA H 42 3.704 3.796 -0.092 1
1 595 . 11 1 1 A 42 42 LEU C C 42 178.396 179.012 -0.616 1
1 596 . 11 1 1 A 42 42 LEU CA C 42 58.237 57.777 0.460 1
1 597 . 11 1 1 A 42 42 LEU CB C 42 40.507 41.222 -0.715 1
1 601 . 11 1 1 A 42 42 LEU N N 42 115.960 120.226 -4.266 1
1 602 . 11 1 1 A 43 43 GLU H H 43 8.193 8.117 0.076 1
1 603 . 11 1 1 A 43 43 GLU HA H 43 3.882 3.834 0.048 1
1 608 . 11 1 1 A 43 43 GLU C C 43 179.193 178.996 0.197 1
1 609 . 11 1 1 A 43 43 GLU CA C 43 59.122 59.954 -0.832 1
1 610 . 11 1 1 A 43 43 GLU CB C 43 29.244 29.212 0.032 1
1 612 . 11 1 1 A 43 43 GLU N N 43 117.175 117.765 -0.590 1
1 613 . 11 1 1 A 44 44 GLU H H 44 7.601 7.647 -0.046 1
1 614 . 11 1 1 A 44 44 GLU HA H 44 3.936 3.991 -0.055 1
1 619 . 11 1 1 A 44 44 GLU C C 44 179.875 179.001 0.874 1
1 620 . 11 1 1 A 44 44 GLU CA C 44 58.867 59.223 -0.356 1
1 621 . 11 1 1 A 44 44 GLU CB C 44 28.648 29.216 -0.568 1
1 623 . 11 1 1 A 44 44 GLU N N 44 120.472 119.369 1.103 1
1 624 . 11 1 1 A 45 45 PHE H H 45 8.260 7.327 0.933 1
1 625 . 11 1 1 A 45 45 PHE HA H 45 4.520 4.236 0.284 1
1 633 . 11 1 1 A 45 45 PHE C C 45 177.942 178.351 -0.409 1
1 634 . 11 1 1 A 45 45 PHE CA C 45 55.945 60.601 -4.656 1
1 635 . 11 1 1 A 45 45 PHE CB C 45 36.680 38.039 -1.359 1
1 641 . 11 1 1 A 45 45 PHE N N 45 119.272 118.541 0.731 1
1 642 . 11 1 1 A 46 46 ARG H H 46 8.023 8.307 -0.284 1
1 643 . 11 1 1 A 46 46 ARG HA H 46 4.074 3.974 0.100 1
1 651 . 11 1 1 A 46 46 ARG C C 46 177.617 178.855 -1.238 1
1 652 . 11 1 1 A 46 46 ARG CA C 46 58.194 59.312 -1.118 1
1 653 . 11 1 1 A 46 46 ARG CB C 46 29.737 29.903 -0.166 1
1 656 . 11 1 1 A 46 46 ARG N N 46 118.136 120.041 -1.905 1
1 658 . 11 1 1 A 47 47 LYS H H 47 7.470 7.897 -0.427 1
1 659 . 11 1 1 A 47 47 LYS HA H 47 4.143 4.108 0.035 1
1 668 . 11 1 1 A 47 47 LYS C C 47 177.324 178.018 -0.694 1
1 669 . 11 1 1 A 47 47 LYS CA C 47 57.726 59.765 -2.039 1
1 670 . 11 1 1 A 47 47 LYS CB C 47 32.409 32.346 0.063 1
1 674 . 11 1 1 A 47 47 LYS N N 47 116.943 120.301 -3.358 1
1 675 . 11 1 1 A 48 48 GLU H H 48 7.615 7.321 0.294 1
1 676 . 11 1 1 A 48 48 GLU HA H 48 4.428 4.592 -0.164 1
1 681 . 11 1 1 A 48 48 GLU C C 48 176.869 176.070 0.799 1
1 682 . 11 1 1 A 48 48 GLU CA C 48 55.945 55.804 0.141 1
1 683 . 11 1 1 A 48 48 GLU CB C 48 29.696 29.651 0.045 1
1 685 . 11 1 1 A 48 48 GLU N N 48 118.852 116.290 2.562 1
1 686 . 11 1 1 A 49 49 SER H H 49 7.725 7.347 0.378 1
1 687 . 11 1 1 A 49 49 SER HA H 49 4.244 4.451 -0.207 1
1 690 . 11 1 1 A 49 49 SER C C 49 174.838 173.803 1.035 1
1 691 . 11 1 1 A 49 49 SER CA C 49 59.366 57.281 2.085 1
1 692 . 11 1 1 A 49 49 SER CB C 49 63.116 61.617 1.499 1
1 693 . 11 1 1 A 49 49 SER N N 49 114.224 117.911 -3.687 1
1 694 . 11 1 1 A 50 50 GLN H H 50 8.548 8.410 0.138 1
1 695 . 11 1 1 A 50 50 GLN HA H 50 4.398 4.542 -0.144 1
1 702 . 11 1 1 A 50 50 GLN C C 50 175.732 176.917 -1.185 1
1 703 . 11 1 1 A 50 50 GLN CA C 50 56.272 56.831 -0.559 1
1 704 . 11 1 1 A 50 50 GLN CB C 50 28.946 31.268 -2.322 1
1 706 . 11 1 1 A 50 50 GLN N N 50 120.125 125.901 -5.776 1
1 708 . 11 1 1 A 51 51 ASN H H 51 8.534 8.603 -0.069 1
1 709 . 11 1 1 A 51 51 ASN HA H 51 4.980 4.839 0.141 1
1 714 . 11 1 1 A 51 51 ASN C C 51 173.717 173.639 0.078 1
1 715 . 11 1 1 A 51 51 ASN CA C 51 52.804 52.821 -0.017 1
1 716 . 11 1 1 A 51 51 ASN CB C 51 39.583 39.175 0.408 1
1 717 . 11 1 1 A 51 51 ASN N N 51 118.158 114.991 3.167 1
1 719 . 11 1 1 A 52 52 ILE H H 52 7.492 7.417 0.075 1
1 720 . 11 1 1 A 52 52 ILE HA H 52 5.338 5.445 -0.107 1
1 730 . 11 1 1 A 52 52 ILE C C 52 175.049 174.001 1.048 1
1 731 . 11 1 1 A 52 52 ILE CA C 52 59.364 59.345 0.019 1
1 732 . 11 1 1 A 52 52 ILE CB C 52 42.163 41.764 0.399 1
1 736 . 11 1 1 A 52 52 ILE N N 52 117.927 121.147 -3.220 1
1 737 . 11 1 1 A 53 53 LYS H H 53 8.467 9.080 -0.613 1
1 738 . 11 1 1 A 53 53 LYS HA H 53 5.044 5.300 -0.256 1
1 747 . 11 1 1 A 53 53 LYS C C 53 175.082 175.426 -0.344 1
1 748 . 11 1 1 A 53 53 LYS CA C 53 55.429 54.943 0.486 1
1 749 . 11 1 1 A 53 53 LYS CB C 53 36.446 36.093 0.353 1
1 753 . 11 1 1 A 53 53 LYS N N 53 123.249 127.718 -4.469 1
1 754 . 11 1 1 A 54 54 VAL H H 54 8.490 8.859 -0.369 1
1 755 . 11 1 1 A 54 54 VAL HA H 54 5.159 4.978 0.181 1
1 763 . 11 1 1 A 54 54 VAL C C 54 173.473 173.919 -0.446 1
1 764 . 11 1 1 A 54 54 VAL CA C 54 60.163 60.927 -0.764 1
1 765 . 11 1 1 A 54 54 VAL CB C 54 35.509 33.336 2.173 1
1 768 . 11 1 1 A 54 54 VAL N N 54 120.762 124.162 -3.400 1
1 769 . 11 1 1 A 55 55 LEU H H 55 8.636 8.674 -0.038 1
1 770 . 11 1 1 A 55 55 LEU HA H 55 4.670 4.545 0.125 1
1 780 . 11 1 1 A 55 55 LEU C C 55 173.652 174.262 -0.610 1
1 781 . 11 1 1 A 55 55 LEU CA C 55 52.289 53.265 -0.976 1
1 782 . 11 1 1 A 55 55 LEU CB C 55 42.070 43.177 -1.107 1
1 786 . 11 1 1 A 55 55 LEU N N 55 131.898 129.403 2.495 1
1 787 . 11 1 1 A 56 56 ILE H H 56 9.188 9.014 0.174 1
1 788 . 11 1 1 A 56 56 ILE HA H 56 4.879 5.085 -0.206 1
1 798 . 11 1 1 A 56 56 ILE C C 56 174.172 174.309 -0.137 1
1 799 . 11 1 1 A 56 56 ILE CA C 56 59.976 59.695 0.281 1
1 800 . 11 1 1 A 56 56 ILE CB C 56 38.181 39.670 -1.489 1
1 804 . 11 1 1 A 56 56 ILE N N 56 126.373 128.319 -1.946 1
1 805 . 11 1 1 A 57 57 LEU H H 57 8.929 9.219 -0.290 1
1 806 . 11 1 1 A 57 57 LEU HA H 57 5.394 5.272 0.122 1
1 816 . 11 1 1 A 57 57 LEU C C 57 175.358 176.083 -0.725 1
1 817 . 11 1 1 A 57 57 LEU CA C 57 52.086 53.365 -1.279 1
1 818 . 11 1 1 A 57 57 LEU CB C 57 42.445 42.856 -0.411 1
1 822 . 11 1 1 A 57 57 LEU N N 57 126.547 128.437 -1.890 1
1 823 . 11 1 1 A 58 58 VAL H H 58 8.542 8.999 -0.457 1
1 824 . 11 1 1 A 58 58 VAL HA H 58 5.253 4.878 0.375 1
1 832 . 11 1 1 A 58 58 VAL C C 58 175.244 175.442 -0.198 1
1 833 . 11 1 1 A 58 58 VAL CA C 58 58.241 58.755 -0.514 1
1 834 . 11 1 1 A 58 58 VAL CB C 58 33.165 34.711 -1.546 1
1 837 . 11 1 1 A 58 58 VAL N N 58 114.398 120.708 -6.310 1
1 838 . 11 1 1 A 59 59 SER H H 59 8.797 8.263 0.534 1
1 839 . 11 1 1 A 59 59 SER HA H 59 5.063 4.676 0.387 1
1 842 . 11 1 1 A 59 59 SER C C 59 174.172 174.416 -0.244 1
1 843 . 11 1 1 A 59 59 SER CA C 59 59.320 58.822 0.498 1
1 844 . 11 1 1 A 59 59 SER CB C 59 65.600 63.742 1.858 1
1 845 . 11 1 1 A 59 59 SER N N 59 115.497 115.227 0.270 1
1 846 . 11 1 1 A 60 60 ASN H H 60 7.730 7.700 0.030 1
1 847 . 11 1 1 A 60 60 ASN HA H 60 4.811 5.049 -0.238 1
1 852 . 11 1 1 A 60 60 ASN C C 60 174.464 175.168 -0.704 1
1 853 . 11 1 1 A 60 60 ASN CA C 60 52.007 52.297 -0.290 1
1 854 . 11 1 1 A 60 60 ASN CB C 60 40.336 40.876 -0.540 1
1 855 . 11 1 1 A 60 60 ASN N N 60 117.522 119.616 -2.094 1
1 857 . 11 1 1 A 61 61 ASP H H 61 8.577 9.107 -0.530 1
1 858 . 11 1 1 A 61 61 ASP HA H 61 4.365 4.251 0.114 1
1 861 . 11 1 1 A 61 61 ASP C C 61 177.357 178.256 -0.899 1
1 862 . 11 1 1 A 61 61 ASP CA C 61 57.351 57.271 0.080 1
1 863 . 11 1 1 A 61 61 ASP CB C 61 40.383 40.534 -0.151 1
1 864 . 11 1 1 A 61 61 ASP N N 61 119.431 122.628 -3.197 1
1 865 . 11 1 1 A 62 62 GLU H H 62 8.405 8.442 -0.037 1
1 866 . 11 1 1 A 62 62 GLU HA H 62 4.121 4.044 0.077 1
1 871 . 11 1 1 A 62 62 GLU C C 62 179.615 179.090 0.525 1
1 872 . 11 1 1 A 62 62 GLU CA C 62 59.593 59.658 -0.065 1
1 873 . 11 1 1 A 62 62 GLU CB C 62 28.478 29.027 -0.549 1
1 875 . 11 1 1 A 62 62 GLU N N 62 122.150 119.496 2.654 1
1 876 . 11 1 1 A 63 63 GLU H H 63 8.384 8.232 0.152 1
1 877 . 11 1 1 A 63 63 GLU HA H 63 3.913 3.968 -0.055 1
1 882 . 11 1 1 A 63 63 GLU C C 63 178.478 179.096 -0.618 1
1 883 . 11 1 1 A 63 63 GLU CA C 63 58.273 59.176 -0.903 1
1 884 . 11 1 1 A 63 63 GLU CB C 63 29.931 29.037 0.894 1
1 886 . 11 1 1 A 63 63 GLU N N 63 119.084 118.913 0.171 1
1 887 . 11 1 1 A 64 64 LEU H H 64 7.717 8.110 -0.393 1
1 888 . 11 1 1 A 64 64 LEU HA H 64 3.750 4.038 -0.288 1
1 898 . 11 1 1 A 64 64 LEU C C 64 177.535 177.949 -0.414 1
1 899 . 11 1 1 A 64 64 LEU CA C 64 58.944 58.154 0.790 1
1 900 . 11 1 1 A 64 64 LEU CB C 64 41.695 41.463 0.232 1
1 904 . 11 1 1 A 64 64 LEU N N 64 120.357 122.146 -1.789 1
1 905 . 11 1 1 A 65 65 ASP H H 65 7.922 8.200 -0.278 1
1 906 . 11 1 1 A 65 65 ASP HA H 65 4.313 4.304 0.009 1
1 909 . 11 1 1 A 65 65 ASP C C 65 179.095 178.622 0.473 1
1 910 . 11 1 1 A 65 65 ASP CA C 65 57.272 57.733 -0.461 1
1 911 . 11 1 1 A 65 65 ASP CB C 65 40.196 40.928 -0.732 1
1 912 . 11 1 1 A 65 65 ASP N N 65 118.100 118.533 -0.433 1
1 913 . 11 1 1 A 66 66 LYS H H 66 7.802 7.958 -0.156 1
1 914 . 11 1 1 A 66 66 LYS HA H 66 4.078 3.986 0.092 1
1 923 . 11 1 1 A 66 66 LYS C C 66 178.624 179.127 -0.503 1
1 924 . 11 1 1 A 66 66 LYS CA C 66 58.429 59.243 -0.814 1
1 925 . 11 1 1 A 66 66 LYS CB C 66 31.727 32.162 -0.435 1
1 929 . 11 1 1 A 66 66 LYS N N 66 119.343 118.905 0.438 1
1 930 . 11 1 1 A 67 67 ALA H H 67 8.480 8.294 0.186 1
1 931 . 11 1 1 A 67 67 ALA HA H 67 3.853 4.117 -0.264 1
1 935 . 11 1 1 A 67 67 ALA C C 67 178.591 179.585 -0.994 1
1 936 . 11 1 1 A 67 67 ALA CA C 67 55.403 55.091 0.312 1
1 937 . 11 1 1 A 67 67 ALA CB C 67 17.793 18.546 -0.753 1
1 938 . 11 1 1 A 67 67 ALA N N 67 121.562 122.768 -1.206 1
1 939 . 11 1 1 A 68 68 LYS H H 68 8.186 7.666 0.520 1
1 940 . 11 1 1 A 68 68 LYS HA H 68 3.805 4.047 -0.242 1
1 949 . 11 1 1 A 68 68 LYS C C 68 179.095 178.740 0.355 1
1 950 . 11 1 1 A 68 68 LYS CA C 68 59.952 59.044 0.908 1
1 951 . 11 1 1 A 68 68 LYS CB C 68 32.181 31.848 0.333 1
1 955 . 11 1 1 A 68 68 LYS N N 68 116.165 116.459 -0.294 1
1 956 . 11 1 1 A 69 69 GLU H H 69 7.904 8.041 -0.137 1
1 957 . 11 1 1 A 69 69 GLU HA H 69 3.995 4.099 -0.104 1
1 962 . 11 1 1 A 69 69 GLU C C 69 179.079 179.418 -0.339 1
1 963 . 11 1 1 A 69 69 GLU CA C 69 59.022 58.873 0.149 1
1 964 . 11 1 1 A 69 69 GLU CB C 69 29.274 29.319 -0.045 1
1 966 . 11 1 1 A 69 69 GLU N N 69 119.489 119.557 -0.068 1
1 967 . 11 1 1 A 70 70 LEU H H 70 7.962 8.277 -0.315 1
1 968 . 11 1 1 A 70 70 LEU HA H 70 4.020 3.975 0.045 1
1 978 . 11 1 1 A 70 70 LEU C C 70 178.738 179.099 -0.361 1
1 979 . 11 1 1 A 70 70 LEU CA C 70 57.486 57.904 -0.418 1
1 980 . 11 1 1 A 70 70 LEU CB C 70 41.695 41.466 0.229 1
1 984 . 11 1 1 A 70 70 LEU N N 70 119.431 120.514 -1.083 1
1 985 . 11 1 1 A 71 71 ALA H H 71 8.260 8.429 -0.169 1
1 986 . 11 1 1 A 71 71 ALA HA H 71 3.845 4.115 -0.270 1
1 990 . 11 1 1 A 71 71 ALA C C 71 179.518 180.293 -0.775 1
1 991 . 11 1 1 A 71 71 ALA CA C 71 55.139 55.758 -0.619 1
1 992 . 11 1 1 A 71 71 ALA CB C 71 18.487 18.279 0.208 1
1 993 . 11 1 1 A 71 71 ALA N N 71 119.604 121.641 -2.037 1
1 994 . 11 1 1 A 72 72 GLN H H 72 7.910 8.518 -0.608 1
1 995 . 11 1 1 A 72 72 GLN HA H 72 4.154 3.971 0.183 1
1 1002 . 11 1 1 A 72 72 GLN C C 72 178.900 178.914 -0.014 1
1 1003 . 11 1 1 A 72 72 GLN CA C 72 58.194 59.128 -0.934 1
1 1004 . 11 1 1 A 72 72 GLN CB C 72 28.056 28.303 -0.247 1
1 1006 . 11 1 1 A 72 72 GLN N N 72 115.960 117.372 -1.412 1
1 1008 . 11 1 1 A 73 73 LYS H H 73 7.841 8.509 -0.668 1
1 1009 . 11 1 1 A 73 73 LYS HA H 73 4.171 4.181 -0.010 1
1 1018 . 11 1 1 A 73 73 LYS C C 73 177.730 177.972 -0.242 1
1 1019 . 11 1 1 A 73 73 LYS CA C 73 57.867 58.582 -0.715 1
1 1020 . 11 1 1 A 73 73 LYS CB C 73 32.277 32.508 -0.231 1
1 1024 . 11 1 1 A 73 73 LYS N N 73 119.027 118.867 0.160 1
1 1025 . 11 1 1 A 74 74 MET H H 74 7.746 7.950 -0.204 1
1 1026 . 11 1 1 A 74 74 MET HA H 74 4.403 4.540 -0.137 1
1 1034 . 11 1 1 A 74 74 MET C C 74 174.416 175.028 -0.612 1
1 1035 . 11 1 1 A 74 74 MET CA C 74 55.194 55.235 -0.041 1
1 1036 . 11 1 1 A 74 74 MET CB C 74 33.366 33.540 -0.174 1
1 1039 . 11 1 1 A 74 74 MET N N 74 115.786 115.470 0.316 1
1 1040 . 11 1 1 A 75 75 GLU H H 75 8.076 7.797 0.279 1
1 1041 . 11 1 1 A 75 75 GLU HA H 75 4.001 3.866 0.135 1
1 1046 . 11 1 1 A 75 75 GLU C C 75 175.130 174.752 0.378 1
1 1047 . 11 1 1 A 75 75 GLU CA C 75 56.722 57.668 -0.946 1
1 1048 . 11 1 1 A 75 75 GLU CB C 75 27.118 27.098 0.020 1
1 1050 . 11 1 1 A 75 75 GLU N N 75 116.249 116.336 -0.087 1
1 1051 . 11 1 1 A 76 76 ILE H H 76 7.560 7.817 -0.257 1
1 1052 . 11 1 1 A 76 76 ILE HA H 76 4.428 4.654 -0.226 1
1 1062 . 11 1 1 A 76 76 ILE C C 76 174.529 174.074 0.455 1
1 1063 . 11 1 1 A 76 76 ILE CA C 76 58.475 59.474 -0.999 1
1 1064 . 11 1 1 A 76 76 ILE CB C 76 40.337 41.137 -0.800 1
1 1068 . 11 1 1 A 76 76 ILE N N 76 115.960 118.925 -2.965 1
1 1069 . 11 1 1 A 77 77 ASP H H 77 8.889 8.765 0.124 1
1 1070 . 11 1 1 A 77 77 ASP HA H 77 4.569 4.961 -0.392 1
1 1073 . 11 1 1 A 77 77 ASP C C 77 174.123 175.705 -1.582 1
1 1074 . 11 1 1 A 77 77 ASP CA C 77 54.069 53.386 0.683 1
1 1075 . 11 1 1 A 77 77 ASP CB C 77 40.233 41.942 -1.709 1
1 1076 . 11 1 1 A 77 77 ASP N N 77 126.142 126.509 -0.367 1
1 1077 . 11 1 1 A 78 78 VAL H H 78 7.754 8.956 -1.202 1
1 1078 . 11 1 1 A 78 78 VAL HA H 78 5.192 5.354 -0.162 1
1 1086 . 11 1 1 A 78 78 VAL C C 78 174.968 173.744 1.224 1
1 1087 . 11 1 1 A 78 78 VAL CA C 78 58.804 58.676 0.128 1
1 1088 . 11 1 1 A 78 78 VAL CB C 78 35.293 35.826 -0.533 1
1 1091 . 11 1 1 A 78 78 VAL N N 78 122.844 119.609 3.235 1
1 1092 . 11 1 1 A 79 79 ARG H H 79 8.499 8.938 -0.439 1
1 1093 . 11 1 1 A 79 79 ARG HA H 79 4.712 4.898 -0.186 1
1 1100 . 11 1 1 A 79 79 ARG C C 79 174.221 174.640 -0.419 1
1 1101 . 11 1 1 A 79 79 ARG CA C 79 54.117 54.936 -0.819 1
1 1102 . 11 1 1 A 79 79 ARG CB C 79 31.196 32.978 -1.782 1
1 1105 . 11 1 1 A 79 79 ARG N N 79 125.637 122.139 3.498 1
1 1106 . 11 1 1 A 80 80 THR H H 80 8.416 8.513 -0.097 1
1 1107 . 11 1 1 A 80 80 THR HA H 80 5.332 5.006 0.326 1
1 1112 . 11 1 1 A 80 80 THR C C 80 174.497 173.991 0.506 1
1 1113 . 11 1 1 A 80 80 THR CA C 80 59.694 60.724 -1.030 1
1 1114 . 11 1 1 A 80 80 THR CB C 80 69.772 70.010 -0.238 1
1 1116 . 11 1 1 A 80 80 THR N N 80 118.084 117.882 0.202 1
1 1117 . 11 1 1 A 81 81 ARG H H 81 8.758 8.906 -0.148 1
1 1118 . 11 1 1 A 81 81 ARG HA H 81 4.362 4.813 -0.451 1
1 1126 . 11 1 1 A 81 81 ARG C C 81 173.733 173.946 -0.213 1
1 1127 . 11 1 1 A 81 81 ARG CA C 81 53.273 53.959 -0.686 1
1 1128 . 11 1 1 A 81 81 ARG CB C 81 33.915 33.493 0.422 1
1 1131 . 11 1 1 A 81 81 ARG N N 81 122.844 123.455 -0.611 1
1 1133 . 11 1 1 A 82 82 LYS H H 82 8.721 8.511 0.210 1
1 1134 . 11 1 1 A 82 82 LYS HA H 82 4.701 5.034 -0.333 1
1 1143 . 11 1 1 A 82 82 LYS C C 82 175.667 176.104 -0.437 1
1 1144 . 11 1 1 A 82 82 LYS CA C 82 54.960 55.713 -0.753 1
1 1145 . 11 1 1 A 82 82 LYS CB C 82 32.603 33.613 -1.010 1
1 1149 . 11 1 1 A 82 82 LYS N N 82 124.668 123.714 0.954 1
1 1150 . 11 1 1 A 83 83 VAL H H 83 9.112 9.205 -0.093 1
1 1151 . 11 1 1 A 83 83 VAL HA H 83 4.796 4.884 -0.088 1
1 1159 . 11 1 1 A 83 83 VAL C C 83 174.594 175.294 -0.700 1
1 1160 . 11 1 1 A 83 83 VAL CA C 83 59.413 60.069 -0.656 1
1 1161 . 11 1 1 A 83 83 VAL CB C 83 35.298 34.555 0.743 1
1 1164 . 11 1 1 A 83 83 VAL N N 83 122.381 122.388 -0.007 1
1 1165 . 11 1 1 A 84 84 THR H H 84 9.200 8.605 0.595 1
1 1166 . 11 1 1 A 84 84 THR HA H 84 4.579 4.596 -0.017 1
1 1171 . 11 1 1 A 84 84 THR C C 84 173.993 174.774 -0.781 1
1 1172 . 11 1 1 A 84 84 THR CA C 84 60.960 62.078 -1.118 1
1 1173 . 11 1 1 A 84 84 THR CB C 84 70.100 70.184 -0.084 1
1 1175 . 11 1 1 A 84 84 THR N N 84 113.183 115.474 -2.291 1
1 1176 . 11 1 1 A 85 85 SER H H 85 7.688 7.789 -0.101 1
1 1177 . 11 1 1 A 85 85 SER HA H 85 5.136 4.659 0.477 1
1 1180 . 11 1 1 A 85 85 SER CA C 85 55.205 56.351 -1.146 1
1 1181 . 11 1 1 A 85 85 SER CB C 85 64.376 63.633 0.743 1
1 1182 . 11 1 1 A 85 85 SER N N 85 115.555 118.130 -2.575 1
1 1183 . 11 1 1 A 86 86 PRO HA H 86 4.090 4.312 -0.222 1
1 1190 . 11 1 1 A 86 86 PRO C C 86 177.227 177.839 -0.612 1
1 1191 . 11 1 1 A 86 86 PRO CA C 86 65.038 65.687 -0.649 1
1 1192 . 11 1 1 A 86 86 PRO CB C 86 31.711 31.826 -0.115 1
1 1195 . 11 1 1 A 87 87 ASP H H 87 8.131 8.979 -0.848 1
1 1196 . 11 1 1 A 87 87 ASP HA H 87 4.223 4.328 -0.105 1
1 1199 . 11 1 1 A 87 87 ASP C C 87 178.721 178.925 -0.204 1
1 1200 . 11 1 1 A 87 87 ASP CA C 87 57.311 57.128 0.183 1
1 1201 . 11 1 1 A 87 87 ASP CB C 87 40.102 40.114 -0.012 1
1 1202 . 11 1 1 A 87 87 ASP N N 87 115.381 117.091 -1.710 1
1 1203 . 11 1 1 A 88 88 GLU H H 88 7.571 7.855 -0.284 1
1 1204 . 11 1 1 A 88 88 GLU HA H 88 3.659 4.067 -0.408 1
1 1209 . 11 1 1 A 88 88 GLU C C 88 177.097 178.745 -1.648 1
1 1210 . 11 1 1 A 88 88 GLU CA C 88 58.729 58.900 -0.171 1
1 1211 . 11 1 1 A 88 88 GLU CB C 88 30.052 29.565 0.487 1
1 1213 . 11 1 1 A 88 88 GLU N N 88 120.009 119.816 0.193 1
1 1214 . 11 1 1 A 89 89 ALA H H 89 7.423 7.637 -0.214 1
1 1215 . 11 1 1 A 89 89 ALA HA H 89 3.900 4.336 -0.436 1
1 1219 . 11 1 1 A 89 89 ALA C C 89 178.267 180.062 -1.795 1
1 1220 . 11 1 1 A 89 89 ALA CA C 89 55.607 55.194 0.413 1
1 1221 . 11 1 1 A 89 89 ALA CB C 89 17.348 18.500 -1.152 1
1 1222 . 11 1 1 A 89 89 ALA N N 89 118.873 122.416 -3.543 1
1 1223 . 11 1 1 A 90 90 LYS H H 90 8.046 8.139 -0.093 1
1 1224 . 11 1 1 A 90 90 LYS HA H 90 3.669 3.987 -0.318 1
1 1233 . 11 1 1 A 90 90 LYS C C 90 177.649 178.992 -1.343 1
1 1234 . 11 1 1 A 90 90 LYS CA C 90 60.351 59.746 0.605 1
1 1235 . 11 1 1 A 90 90 LYS CB C 90 32.087 32.313 -0.226 1
1 1239 . 11 1 1 A 90 90 LYS N N 90 114.834 117.414 -2.580 1
1 1240 . 11 1 1 A 91 91 ARG H H 91 7.468 7.817 -0.349 1
1 1241 . 11 1 1 A 91 91 ARG HA H 91 3.887 3.933 -0.046 1
1 1249 . 11 1 1 A 91 91 ARG C C 91 178.998 179.074 -0.076 1
1 1250 . 11 1 1 A 91 91 ARG CA C 91 59.164 59.028 0.136 1
1 1251 . 11 1 1 A 91 91 ARG CB C 91 29.274 29.749 -0.475 1
1 1254 . 11 1 1 A 91 91 ARG N N 91 119.029 119.378 -0.349 1
1 1256 . 11 1 1 A 92 92 TRP H H 92 8.136 8.204 -0.068 1
1 1257 . 11 1 1 A 92 92 TRP HA H 92 4.818 4.557 0.261 1
1 1266 . 11 1 1 A 92 92 TRP C C 92 179.566 178.899 0.667 1
1 1267 . 11 1 1 A 92 92 TRP CA C 92 58.663 58.926 -0.263 1
1 1268 . 11 1 1 A 92 92 TRP CB C 92 29.790 29.519 0.271 1
1 1274 . 11 1 1 A 92 92 TRP N N 92 118.100 120.570 -2.470 1
1 1276 . 11 1 1 A 93 93 ILE H H 93 8.363 8.463 -0.100 1
1 1277 . 11 1 1 A 93 93 ILE HA H 93 3.544 3.762 -0.218 1
1 1287 . 11 1 1 A 93 93 ILE C C 93 176.820 178.049 -1.229 1
1 1288 . 11 1 1 A 93 93 ILE CA C 93 66.225 65.388 0.837 1
1 1289 . 11 1 1 A 93 93 ILE CB C 93 37.571 37.827 -0.256 1
1 1293 . 11 1 1 A 93 93 ILE N N 93 120.588 120.387 0.201 1
1 1294 . 11 1 1 A 94 94 LYS H H 94 8.264 7.815 0.449 1
1 1295 . 11 1 1 A 94 94 LYS HA H 94 3.865 3.994 -0.129 1
1 1304 . 11 1 1 A 94 94 LYS C C 94 179.258 179.011 0.247 1
1 1305 . 11 1 1 A 94 94 LYS CA C 94 59.889 59.820 0.069 1
1 1306 . 11 1 1 A 94 94 LYS CB C 94 32.225 32.359 -0.134 1
1 1310 . 11 1 1 A 94 94 LYS N N 94 121.687 120.658 1.029 1
1 1311 . 11 1 1 A 95 95 GLU H H 95 8.360 8.306 0.054 1
1 1312 . 11 1 1 A 95 95 GLU HA H 95 4.023 4.119 -0.096 1
1 1317 . 11 1 1 A 95 95 GLU C C 95 178.884 179.102 -0.218 1
1 1318 . 11 1 1 A 95 95 GLU CA C 95 59.366 59.113 0.253 1
1 1319 . 11 1 1 A 95 95 GLU CB C 95 29.508 29.553 -0.045 1
1 1321 . 11 1 1 A 95 95 GLU N N 95 118.505 117.730 0.775 1
1 1322 . 11 1 1 A 96 96 PHE H H 96 8.212 8.595 -0.383 1
1 1323 . 11 1 1 A 96 96 PHE HA H 96 4.512 4.317 0.195 1
1 1331 . 11 1 1 A 96 96 PHE C C 96 176.820 178.062 -1.242 1
1 1332 . 11 1 1 A 96 96 PHE CA C 96 59.608 61.525 -1.917 1
1 1333 . 11 1 1 A 96 96 PHE CB C 96 40.431 39.180 1.251 1
1 1339 . 11 1 1 A 96 96 PHE N N 96 120.369 122.361 -1.992 1
1 1340 . 11 1 1 A 97 97 SER H H 97 8.216 7.902 0.314 1
1 1341 . 11 1 1 A 97 97 SER HA H 97 3.816 4.088 -0.272 1
1 1344 . 11 1 1 A 97 97 SER C C 97 175.618 177.382 -1.764 1
1 1345 . 11 1 1 A 97 97 SER CA C 97 60.492 61.536 -1.044 1
1 1346 . 11 1 1 A 97 97 SER CB C 97 63.022 62.747 0.275 1
1 1347 . 11 1 1 A 97 97 SER N N 97 111.969 114.182 -2.213 1
1 1348 . 11 1 1 A 98 98 GLU H H 98 7.655 8.006 -0.351 1
1 1349 . 11 1 1 A 98 98 GLU HA H 98 4.187 4.031 0.156 1
1 1354 . 11 1 1 A 98 98 GLU C C 98 177.698 179.758 -2.060 1
1 1355 . 11 1 1 A 98 98 GLU CA C 98 57.069 59.620 -2.551 1
1 1356 . 11 1 1 A 98 98 GLU CB C 98 29.321 29.299 0.022 1
1 1358 . 11 1 1 A 98 98 GLU N N 98 120.588 121.762 -1.174 1
1 1359 . 11 1 1 A 99 99 GLU H H 99 7.794 7.865 -0.071 1
1 1360 . 11 1 1 A 99 99 GLU HA H 99 4.123 4.211 -0.088 1
1 1365 . 11 1 1 A 99 99 GLU C C 99 177.665 177.656 0.009 1
1 1366 . 11 1 1 A 99 99 GLU CA C 99 57.304 58.958 -1.654 1
1 1367 . 11 1 1 A 99 99 GLU CB C 99 29.368 29.279 0.089 1
1 1369 . 11 1 1 A 99 99 GLU N N 99 120.067 119.362 0.705 1
1 1370 . 11 1 1 A 100 100 GLY H H 100 8.138 7.989 0.149 1
1 1371 . 11 1 1 A 100 100 GLY HA2 H 100 3.865 3.769 0.096 1
1 1372 . 11 1 1 A 100 100 GLY HA3 H 100 3.715 3.814 -0.099 1
1 1373 . 11 1 1 A 100 100 GLY C C 100 174.464 175.171 -0.707 1
1 1374 . 11 1 1 A 100 100 GLY CA C 100 45.305 46.559 -1.254 1
1 1375 . 11 1 1 A 100 100 GLY N N 100 107.802 108.551 -0.749 1
1 1376 . 11 1 1 A 101 101 GLY H H 101 8.023 8.428 -0.405 1
1 1377 . 11 1 1 A 101 101 GLY HA2 H 101 3.865 3.835 0.030 1
1 1378 . 11 1 1 A 101 101 GLY HA3 H 101 3.892 3.866 0.026 1
1 1379 . 11 1 1 A 101 101 GLY C C 101 174.204 174.800 -0.596 1
1 1380 . 11 1 1 A 101 101 GLY CA C 101 45.036 45.485 -0.449 1
1 1381 . 11 1 1 A 101 101 GLY N N 101 108.032 106.855 1.177 1
1 1382 . 11 1 1 A 102 102 SER H H 102 8.059 8.492 -0.433 1
1 1383 . 11 1 1 A 102 102 SER HA H 102 4.380 3.890 0.490 1
1 1386 . 11 1 1 A 102 102 SER C C 102 174.627 175.365 -0.738 1
1 1387 . 11 1 1 A 102 102 SER CA C 102 58.194 59.674 -1.480 1
1 1388 . 11 1 1 A 102 102 SER CB C 102 63.538 62.870 0.668 1
1 1389 . 11 1 1 A 102 102 SER N N 102 115.266 114.676 0.590 1
1 1390 . 11 1 1 A 103 103 LEU H H 103 8.287 8.015 0.272 1
1 1391 . 11 1 1 A 103 103 LEU HA H 103 4.301 4.030 0.271 1
1 1401 . 11 1 1 A 103 103 LEU C C 103 177.292 179.866 -2.574 1
1 1402 . 11 1 1 A 103 103 LEU CA C 103 55.007 57.653 -2.646 1
1 1403 . 11 1 1 A 103 103 LEU CB C 103 42.023 41.139 0.884 1
1 1407 . 11 1 1 A 103 103 LEU N N 103 123.596 121.735 1.861 1
1 1408 . 11 1 1 A 104 104 GLU H H 104 8.216 8.147 0.069 1
1 1409 . 11 1 1 A 104 104 GLU HA H 104 4.126 4.070 0.056 1
1 1414 . 11 1 1 A 104 104 GLU CA C 104 56.518 59.383 -2.865 1
1 1415 . 11 1 1 A 104 104 GLU CB C 104 29.837 29.399 0.438 1
1 1417 . 11 1 1 A 104 104 GLU N N 104 120.510 119.735 0.775 1
1 1418 . 11 1 1 A 105 105 HIS HA H 105 4.593 4.395 0.198 1
1 1421 . 11 1 1 A 105 105 HIS C C 105 173.766 175.216 -1.450 1
1 1422 . 11 1 1 A 105 105 HIS CA C 105 55.536 55.422 0.114 1
1 1423 . 11 1 1 A 105 105 HIS CB C 105 30.001 29.253 0.748 1
1 1424 . 11 1 1 A 106 106 HIS H H 106 8.154 7.473 0.681 1
1 1425 . 11 1 1 A 106 106 HIS HA H 106 4.407 4.271 0.136 1
1 1428 . 11 1 1 A 106 106 HIS CA C 106 56.920 55.280 1.640 1
1 1429 . 11 1 1 A 106 106 HIS CB C 106 30.001 28.807 1.194 1
1 14 . 12 1 1 A 2 2 LEU H H 2 8.509 8.651 -0.142 1
1 15 . 12 1 1 A 2 2 LEU HA H 2 4.463 4.473 -0.010 1
1 25 . 12 1 1 A 2 2 LEU C C 2 173.944 176.176 -2.232 1
1 26 . 12 1 1 A 2 2 LEU CA C 2 54.471 55.033 -0.562 1
1 27 . 12 1 1 A 2 2 LEU CB C 2 43.595 41.400 2.195 1
1 31 . 12 1 1 A 2 2 LEU N N 2 127.160 125.552 1.608 1
1 32 . 12 1 1 A 3 3 LEU H H 3 7.844 8.566 -0.722 1
1 33 . 12 1 1 A 3 3 LEU HA H 3 5.128 5.645 -0.517 1
1 43 . 12 1 1 A 3 3 LEU C C 3 175.423 175.179 0.244 1
1 44 . 12 1 1 A 3 3 LEU CA C 3 53.566 53.150 0.416 1
1 45 . 12 1 1 A 3 3 LEU CB C 3 44.039 45.008 -0.969 1
1 49 . 12 1 1 A 3 3 LEU N N 3 122.555 125.521 -2.966 1
1 50 . 12 1 1 A 4 4 TYR H H 4 8.360 8.996 -0.636 1
1 51 . 12 1 1 A 4 4 TYR HA H 4 5.143 5.211 -0.068 1
1 58 . 12 1 1 A 4 4 TYR C C 4 174.481 174.952 -0.471 1
1 59 . 12 1 1 A 4 4 TYR CA C 4 56.577 55.818 0.759 1
1 60 . 12 1 1 A 4 4 TYR CB C 4 43.840 42.612 1.228 1
1 65 . 12 1 1 A 4 4 TYR N N 4 119.315 123.244 -3.929 1
1 66 . 12 1 1 A 5 5 VAL H H 5 8.918 8.805 0.113 1
1 67 . 12 1 1 A 5 5 VAL HA H 5 5.106 4.890 0.216 1
1 75 . 12 1 1 A 5 5 VAL C C 5 174.042 174.535 -0.493 1
1 76 . 12 1 1 A 5 5 VAL CA C 5 59.852 60.923 -1.071 1
1 77 . 12 1 1 A 5 5 VAL CB C 5 33.816 34.313 -0.497 1
1 80 . 12 1 1 A 5 5 VAL N N 5 119.952 120.093 -0.141 1
1 81 . 12 1 1 A 6 6 LEU H H 6 9.315 9.376 -0.061 1
1 82 . 12 1 1 A 6 6 LEU HA H 6 5.466 5.239 0.227 1
1 92 . 12 1 1 A 6 6 LEU C C 6 175.049 174.958 0.091 1
1 93 . 12 1 1 A 6 6 LEU CA C 6 52.090 53.068 -0.978 1
1 94 . 12 1 1 A 6 6 LEU CB C 6 44.103 43.444 0.659 1
1 98 . 12 1 1 A 6 6 LEU N N 6 126.917 126.472 0.445 1
1 99 . 12 1 1 A 7 7 ILE H H 7 8.458 8.852 -0.394 1
1 100 . 12 1 1 A 7 7 ILE HA H 7 5.131 5.145 -0.014 1
1 110 . 12 1 1 A 7 7 ILE C C 7 173.213 173.804 -0.591 1
1 111 . 12 1 1 A 7 7 ILE CA C 7 58.463 59.534 -1.071 1
1 112 . 12 1 1 A 7 7 ILE CB C 7 41.020 40.879 0.141 1
1 116 . 12 1 1 A 7 7 ILE N N 7 119.778 126.416 -6.638 1
1 117 . 12 1 1 A 8 8 ILE H H 8 8.797 9.249 -0.452 1
1 118 . 12 1 1 A 8 8 ILE HA H 8 4.611 4.852 -0.241 1
1 128 . 12 1 1 A 8 8 ILE C C 8 174.611 174.814 -0.203 1
1 129 . 12 1 1 A 8 8 ILE CA C 8 60.227 60.357 -0.130 1
1 130 . 12 1 1 A 8 8 ILE CB C 8 37.665 38.917 -1.252 1
1 134 . 12 1 1 A 8 8 ILE N N 8 128.919 129.902 -0.983 1
1 135 . 12 1 1 A 9 9 SER H H 9 7.811 8.781 -0.970 1
1 136 . 12 1 1 A 9 9 SER HA H 9 4.429 4.997 -0.568 1
1 140 . 12 1 1 A 9 9 SER C C 9 172.937 172.835 0.102 1
1 141 . 12 1 1 A 9 9 SER CA C 9 58.241 57.038 1.203 1
1 142 . 12 1 1 A 9 9 SER CB C 9 64.261 64.213 0.048 1
1 143 . 12 1 1 A 9 9 SER N N 9 116.365 121.832 -5.467 1
1 144 . 12 1 1 A 10 10 ASN H H 10 8.641 8.657 -0.016 1
1 145 . 12 1 1 A 10 10 ASN HA H 10 4.938 5.022 -0.084 1
1 150 . 12 1 1 A 10 10 ASN C C 10 174.497 175.191 -0.694 1
1 151 . 12 1 1 A 10 10 ASN CA C 10 52.221 53.340 -1.119 1
1 152 . 12 1 1 A 10 10 ASN CB C 10 39.128 38.953 0.175 1
1 153 . 12 1 1 A 10 10 ASN N N 10 122.612 120.771 1.841 1
1 155 . 12 1 1 A 11 11 ASP H H 11 8.673 7.377 1.296 1
1 156 . 12 1 1 A 11 11 ASP HA H 11 4.596 4.817 -0.221 1
1 159 . 12 1 1 A 11 11 ASP C C 11 175.342 176.065 -0.723 1
1 160 . 12 1 1 A 11 11 ASP CA C 11 53.233 53.904 -0.671 1
1 161 . 12 1 1 A 11 11 ASP CB C 11 40.965 40.334 0.631 1
1 162 . 12 1 1 A 11 11 ASP N N 11 122.717 120.205 2.512 1
1 163 . 12 1 1 A 12 12 LYS H H 12 8.562 8.648 -0.086 1
1 164 . 12 1 1 A 12 12 LYS HA H 12 3.854 3.933 -0.079 1
1 173 . 12 1 1 A 12 12 LYS C C 12 178.754 178.383 0.371 1
1 174 . 12 1 1 A 12 12 LYS CA C 12 59.581 60.257 -0.676 1
1 175 . 12 1 1 A 12 12 LYS CB C 12 32.378 32.697 -0.319 1
1 179 . 12 1 1 A 12 12 LYS N N 12 125.737 125.710 0.027 1
1 180 . 12 1 1 A 13 13 LYS H H 13 8.075 7.600 0.475 1
1 181 . 12 1 1 A 13 13 LYS HA H 13 4.154 4.107 0.047 1
1 190 . 12 1 1 A 13 13 LYS C C 13 178.315 179.131 -0.816 1
1 191 . 12 1 1 A 13 13 LYS CA C 13 58.532 59.057 -0.525 1
1 192 . 12 1 1 A 13 13 LYS CB C 13 31.452 32.606 -1.154 1
1 196 . 12 1 1 A 13 13 LYS N N 13 119.604 119.802 -0.198 1
1 197 . 12 1 1 A 14 14 LEU H H 14 7.552 7.759 -0.207 1
1 198 . 12 1 1 A 14 14 LEU HA H 14 3.682 4.037 -0.355 1
1 208 . 12 1 1 A 14 14 LEU C C 14 178.429 178.099 0.330 1
1 209 . 12 1 1 A 14 14 LEU CA C 14 58.999 58.170 0.829 1
1 210 . 12 1 1 A 14 14 LEU CB C 14 41.228 41.571 -0.343 1
1 214 . 12 1 1 A 14 14 LEU N N 14 122.266 120.920 1.346 1
1 215 . 12 1 1 A 15 15 ILE H H 15 8.074 8.207 -0.133 1
1 216 . 12 1 1 A 15 15 ILE HA H 15 3.264 3.464 -0.200 1
1 226 . 12 1 1 A 15 15 ILE C C 15 177.000 177.976 -0.976 1
1 227 . 12 1 1 A 15 15 ILE CA C 15 65.939 65.617 0.322 1
1 228 . 12 1 1 A 15 15 ILE CB C 15 37.983 37.901 0.082 1
1 232 . 12 1 1 A 15 15 ILE N N 15 118.214 120.036 -1.822 1
1 233 . 12 1 1 A 16 16 GLU H H 16 8.016 8.316 -0.300 1
1 234 . 12 1 1 A 16 16 GLU HA H 16 4.045 4.007 0.038 1
1 239 . 12 1 1 A 16 16 GLU C C 16 179.388 179.543 -0.155 1
1 240 . 12 1 1 A 16 16 GLU CA C 16 59.032 59.659 -0.627 1
1 241 . 12 1 1 A 16 16 GLU CB C 16 29.200 29.275 -0.075 1
1 243 . 12 1 1 A 16 16 GLU N N 16 118.484 118.736 -0.252 1
1 244 . 12 1 1 A 17 17 GLU H H 17 8.063 8.370 -0.307 1
1 245 . 12 1 1 A 17 17 GLU HA H 17 4.053 4.030 0.023 1
1 250 . 12 1 1 A 17 17 GLU C C 17 179.306 179.181 0.125 1
1 251 . 12 1 1 A 17 17 GLU CA C 17 58.636 59.261 -0.625 1
1 252 . 12 1 1 A 17 17 GLU CB C 17 29.011 29.487 -0.476 1
1 254 . 12 1 1 A 17 17 GLU N N 17 118.100 120.635 -2.535 1
1 255 . 12 1 1 A 18 18 ALA H H 18 8.655 8.293 0.362 1
1 256 . 12 1 1 A 18 18 ALA HA H 18 3.775 4.007 -0.232 1
1 260 . 12 1 1 A 18 18 ALA C C 18 178.559 179.519 -0.960 1
1 261 . 12 1 1 A 18 18 ALA CA C 18 54.960 55.480 -0.520 1
1 262 . 12 1 1 A 18 18 ALA CB C 18 17.960 18.183 -0.223 1
1 263 . 12 1 1 A 18 18 ALA N N 18 122.439 122.689 -0.250 1
1 264 . 12 1 1 A 19 19 ARG H H 19 8.900 8.311 0.589 1
1 265 . 12 1 1 A 19 19 ARG HA H 19 3.809 4.038 -0.229 1
1 273 . 12 1 1 A 19 19 ARG C C 19 178.721 179.238 -0.517 1
1 274 . 12 1 1 A 19 19 ARG CA C 19 59.976 59.863 0.113 1
1 275 . 12 1 1 A 19 19 ARG CB C 19 29.572 30.088 -0.516 1
1 278 . 12 1 1 A 19 19 ARG N N 19 118.563 117.801 0.762 1
1 280 . 12 1 1 A 20 20 LYS H H 20 7.792 8.069 -0.277 1
1 281 . 12 1 1 A 20 20 LYS HA H 20 4.052 4.046 0.006 1
1 290 . 12 1 1 A 20 20 LYS C C 20 179.648 179.610 0.038 1
1 291 . 12 1 1 A 20 20 LYS CA C 20 59.296 58.846 0.450 1
1 292 . 12 1 1 A 20 20 LYS CB C 20 32.216 31.835 0.381 1
1 296 . 12 1 1 A 20 20 LYS N N 20 118.638 119.260 -0.622 1
1 297 . 12 1 1 A 21 21 MET H H 21 7.684 7.999 -0.315 1
1 298 . 12 1 1 A 21 21 MET HA H 21 4.411 4.113 0.298 1
1 306 . 12 1 1 A 21 21 MET C C 21 177.909 178.031 -0.122 1
1 307 . 12 1 1 A 21 21 MET CA C 21 57.009 59.281 -2.272 1
1 308 . 12 1 1 A 21 21 MET CB C 21 32.028 32.505 -0.477 1
1 311 . 12 1 1 A 21 21 MET N N 21 118.100 118.604 -0.504 1
1 312 . 12 1 1 A 22 22 ALA H H 22 8.815 8.615 0.200 1
1 313 . 12 1 1 A 22 22 ALA HA H 22 3.826 3.912 -0.086 1
1 317 . 12 1 1 A 22 22 ALA C C 22 178.835 179.977 -1.142 1
1 318 . 12 1 1 A 22 22 ALA CA C 22 55.427 55.602 -0.175 1
1 319 . 12 1 1 A 22 22 ALA CB C 22 18.059 18.426 -0.367 1
1 320 . 12 1 1 A 22 22 ALA N N 22 122.150 121.421 0.729 1
1 321 . 12 1 1 A 23 23 GLU H H 23 8.276 8.096 0.180 1
1 322 . 12 1 1 A 23 23 GLU HA H 23 4.146 3.968 0.178 1
1 327 . 12 1 1 A 23 23 GLU C C 23 180.151 179.448 0.703 1
1 328 . 12 1 1 A 23 23 GLU CA C 23 58.999 59.561 -0.562 1
1 329 . 12 1 1 A 23 23 GLU CB C 23 29.160 29.559 -0.399 1
1 331 . 12 1 1 A 23 23 GLU N N 23 117.001 118.018 -1.017 1
1 332 . 12 1 1 A 24 24 LYS H H 24 7.573 7.740 -0.167 1
1 333 . 12 1 1 A 24 24 LYS HA H 24 4.101 4.025 0.076 1
1 342 . 12 1 1 A 24 24 LYS C C 24 177.145 178.253 -1.108 1
1 343 . 12 1 1 A 24 24 LYS CA C 24 58.261 59.100 -0.839 1
1 344 . 12 1 1 A 24 24 LYS CB C 24 32.079 32.195 -0.116 1
1 348 . 12 1 1 A 24 24 LYS N N 24 119.960 119.531 0.429 1
1 349 . 12 1 1 A 25 25 ALA H H 25 7.710 7.695 0.015 1
1 350 . 12 1 1 A 25 25 ALA HA H 25 4.413 4.386 0.027 1
1 354 . 12 1 1 A 25 25 ALA C C 25 175.325 177.313 -1.988 1
1 355 . 12 1 1 A 25 25 ALA CA C 25 51.208 51.727 -0.519 1
1 356 . 12 1 1 A 25 25 ALA CB C 25 18.520 19.102 -0.582 1
1 357 . 12 1 1 A 25 25 ALA N N 25 119.257 118.556 0.701 1
1 358 . 12 1 1 A 26 26 ASN H H 26 7.840 8.051 -0.211 1
1 359 . 12 1 1 A 26 26 ASN HA H 26 4.357 4.278 0.079 1
1 364 . 12 1 1 A 26 26 ASN C C 26 173.587 173.843 -0.256 1
1 365 . 12 1 1 A 26 26 ASN CA C 26 54.307 54.559 -0.252 1
1 366 . 12 1 1 A 26 26 ASN CB C 26 36.972 38.217 -1.245 1
1 367 . 12 1 1 A 26 26 ASN N N 26 115.266 115.390 -0.124 1
1 369 . 12 1 1 A 27 27 LEU H H 27 8.241 7.915 0.326 1
1 370 . 12 1 1 A 27 27 LEU HA H 27 4.652 4.374 0.278 1
1 380 . 12 1 1 A 27 27 LEU C C 27 175.894 176.109 -0.215 1
1 381 . 12 1 1 A 27 27 LEU CA C 27 52.923 53.857 -0.934 1
1 382 . 12 1 1 A 27 27 LEU CB C 27 44.090 43.031 1.059 1
1 386 . 12 1 1 A 27 27 LEU N N 27 116.828 120.551 -3.723 1
1 387 . 12 1 1 A 28 28 GLU H H 28 7.798 8.436 -0.638 1
1 388 . 12 1 1 A 28 28 GLU HA H 28 4.310 4.963 -0.653 1
1 393 . 12 1 1 A 28 28 GLU C C 28 173.944 174.802 -0.858 1
1 394 . 12 1 1 A 28 28 GLU CA C 28 55.460 55.215 0.245 1
1 395 . 12 1 1 A 28 28 GLU CB C 28 30.512 31.517 -1.005 1
1 397 . 12 1 1 A 28 28 GLU N N 28 121.340 123.030 -1.690 1
1 398 . 12 1 1 A 29 29 LEU H H 29 8.451 8.845 -0.394 1
1 399 . 12 1 1 A 29 29 LEU HA H 29 5.662 5.438 0.224 1
1 409 . 12 1 1 A 29 29 LEU C C 29 176.902 174.811 2.091 1
1 410 . 12 1 1 A 29 29 LEU CA C 29 53.186 53.688 -0.502 1
1 411 . 12 1 1 A 29 29 LEU CB C 29 44.914 45.135 -0.221 1
1 415 . 12 1 1 A 29 29 LEU N N 29 126.547 129.159 -2.612 1
1 416 . 12 1 1 A 30 30 ARG H H 30 9.094 9.147 -0.053 1
1 417 . 12 1 1 A 30 30 ARG HA H 30 4.910 4.808 0.102 1
1 425 . 12 1 1 A 30 30 ARG C C 30 175.147 175.597 -0.450 1
1 426 . 12 1 1 A 30 30 ARG CA C 30 53.417 54.395 -0.978 1
1 427 . 12 1 1 A 30 30 ARG CB C 30 32.555 33.025 -0.470 1
1 430 . 12 1 1 A 30 30 ARG N N 30 125.043 126.243 -1.200 1
1 432 . 12 1 1 A 31 31 THR H H 31 8.496 8.602 -0.106 1
1 433 . 12 1 1 A 31 31 THR HA H 31 4.888 4.743 0.145 1
1 438 . 12 1 1 A 31 31 THR C C 31 173.961 174.099 -0.138 1
1 439 . 12 1 1 A 31 31 THR CA C 31 60.445 61.240 -0.795 1
1 440 . 12 1 1 A 31 31 THR CB C 31 69.492 69.481 0.011 1
1 442 . 12 1 1 A 31 31 THR N N 31 114.745 116.304 -1.559 1
1 443 . 12 1 1 A 32 32 VAL H H 32 8.480 9.081 -0.601 1
1 444 . 12 1 1 A 32 32 VAL HA H 32 4.411 4.407 0.004 1
1 452 . 12 1 1 A 32 32 VAL C C 32 175.082 175.716 -0.634 1
1 453 . 12 1 1 A 32 32 VAL CA C 32 60.946 62.703 -1.757 1
1 454 . 12 1 1 A 32 32 VAL CB C 32 34.487 31.519 2.968 1
1 457 . 12 1 1 A 32 32 VAL N N 32 122.324 127.040 -4.716 1
1 458 . 12 1 1 A 33 33 LYS H H 33 9.304 9.053 0.251 1
1 459 . 12 1 1 A 33 33 LYS HA H 33 4.534 4.393 0.141 1
1 468 . 12 1 1 A 33 33 LYS C C 33 176.740 176.707 0.033 1
1 469 . 12 1 1 A 33 33 LYS CA C 33 56.846 57.603 -0.757 1
1 470 . 12 1 1 A 33 33 LYS CB C 33 34.355 33.383 0.972 1
1 474 . 12 1 1 A 33 33 LYS N N 33 123.654 127.612 -3.958 1
1 475 . 12 1 1 A 34 34 THR H H 34 7.245 7.684 -0.439 1
1 476 . 12 1 1 A 34 34 THR HA H 34 4.780 4.598 0.182 1
1 481 . 12 1 1 A 34 34 THR C C 34 174.529 175.310 -0.781 1
1 482 . 12 1 1 A 34 34 THR CA C 34 58.859 59.957 -1.098 1
1 483 . 12 1 1 A 34 34 THR CB C 34 73.023 72.376 0.647 1
1 485 . 12 1 1 A 34 34 THR N N 34 106.300 111.219 -4.919 1
1 486 . 12 1 1 A 35 35 GLU H H 35 9.174 8.779 0.395 1
1 487 . 12 1 1 A 35 35 GLU HA H 35 3.886 4.004 -0.118 1
1 492 . 12 1 1 A 35 35 GLU C C 35 177.714 177.378 0.336 1
1 493 . 12 1 1 A 35 35 GLU CA C 35 59.233 59.541 -0.308 1
1 494 . 12 1 1 A 35 35 GLU CB C 35 29.377 29.500 -0.123 1
1 496 . 12 1 1 A 35 35 GLU N N 35 121.919 122.017 -0.098 1
1 497 . 12 1 1 A 36 36 ASP H H 36 8.185 8.414 -0.229 1
1 498 . 12 1 1 A 36 36 ASP HA H 36 4.289 4.295 -0.006 1
1 501 . 12 1 1 A 36 36 ASP C C 36 178.348 178.563 -0.215 1
1 502 . 12 1 1 A 36 36 ASP CA C 36 56.962 57.743 -0.781 1
1 503 . 12 1 1 A 36 36 ASP CB C 36 40.214 42.110 -1.896 1
1 504 . 12 1 1 A 36 36 ASP N N 36 118.332 119.614 -1.282 1
1 505 . 12 1 1 A 37 37 GLU H H 37 7.741 7.716 0.025 1
1 506 . 12 1 1 A 37 37 GLU HA H 37 3.708 3.772 -0.064 1
1 511 . 12 1 1 A 37 37 GLU C C 37 177.324 178.617 -1.293 1
1 512 . 12 1 1 A 37 37 GLU CA C 37 58.698 59.152 -0.454 1
1 513 . 12 1 1 A 37 37 GLU CB C 37 30.199 29.279 0.920 1
1 515 . 12 1 1 A 37 37 GLU N N 37 120.704 119.063 1.641 1
1 516 . 12 1 1 A 38 38 LEU H H 38 7.531 8.326 -0.795 1
1 517 . 12 1 1 A 38 38 LEU HA H 38 3.873 4.211 -0.338 1
1 527 . 12 1 1 A 38 38 LEU C C 38 177.357 178.496 -1.139 1
1 528 . 12 1 1 A 38 38 LEU CA C 38 58.305 58.397 -0.092 1
1 529 . 12 1 1 A 38 38 LEU CB C 38 40.837 41.563 -0.726 1
1 533 . 12 1 1 A 38 38 LEU N N 38 119.200 122.004 -2.804 1
1 534 . 12 1 1 A 39 39 LYS H H 39 8.083 8.274 -0.191 1
1 535 . 12 1 1 A 39 39 LYS HA H 39 3.608 3.916 -0.308 1
1 544 . 12 1 1 A 39 39 LYS C C 39 177.373 178.932 -1.559 1
1 545 . 12 1 1 A 39 39 LYS CA C 39 60.290 59.742 0.548 1
1 546 . 12 1 1 A 39 39 LYS CB C 39 32.178 32.432 -0.254 1
1 550 . 12 1 1 A 39 39 LYS N N 39 116.943 118.824 -1.881 1
1 551 . 12 1 1 A 40 40 LYS H H 40 7.632 7.998 -0.366 1
1 552 . 12 1 1 A 40 40 LYS HA H 40 3.864 3.870 -0.006 1
1 561 . 12 1 1 A 40 40 LYS C C 40 179.566 178.411 1.155 1
1 562 . 12 1 1 A 40 40 LYS CA C 40 58.993 58.907 0.086 1
1 563 . 12 1 1 A 40 40 LYS CB C 40 31.758 31.901 -0.143 1
1 567 . 12 1 1 A 40 40 LYS N N 40 118.274 118.977 -0.703 1
1 568 . 12 1 1 A 41 41 TYR H H 41 7.823 7.560 0.263 1
1 569 . 12 1 1 A 41 41 TYR HA H 41 3.926 3.937 -0.011 1
1 576 . 12 1 1 A 41 41 TYR C C 41 176.625 177.952 -1.327 1
1 577 . 12 1 1 A 41 41 TYR CA C 41 59.757 60.554 -0.797 1
1 578 . 12 1 1 A 41 41 TYR CB C 41 36.901 38.102 -1.201 1
1 583 . 12 1 1 A 41 41 TYR N N 41 117.811 118.760 -0.949 1
1 584 . 12 1 1 A 42 42 LEU H H 42 7.964 8.441 -0.477 1
1 585 . 12 1 1 A 42 42 LEU HA H 42 3.704 4.096 -0.392 1
1 595 . 12 1 1 A 42 42 LEU C C 42 178.396 179.630 -1.234 1
1 596 . 12 1 1 A 42 42 LEU CA C 42 58.237 58.033 0.204 1
1 597 . 12 1 1 A 42 42 LEU CB C 42 40.507 41.371 -0.864 1
1 601 . 12 1 1 A 42 42 LEU N N 42 115.960 120.344 -4.384 1
1 602 . 12 1 1 A 43 43 GLU H H 43 8.193 8.367 -0.174 1
1 603 . 12 1 1 A 43 43 GLU HA H 43 3.882 3.957 -0.075 1
1 608 . 12 1 1 A 43 43 GLU C C 43 179.193 179.387 -0.194 1
1 609 . 12 1 1 A 43 43 GLU CA C 43 59.122 59.555 -0.433 1
1 610 . 12 1 1 A 43 43 GLU CB C 43 29.244 29.057 0.187 1
1 612 . 12 1 1 A 43 43 GLU N N 43 117.175 117.510 -0.335 1
1 613 . 12 1 1 A 44 44 GLU H H 44 7.601 7.768 -0.167 1
1 614 . 12 1 1 A 44 44 GLU HA H 44 3.936 3.970 -0.034 1
1 619 . 12 1 1 A 44 44 GLU C C 44 179.875 179.068 0.807 1
1 620 . 12 1 1 A 44 44 GLU CA C 44 58.867 59.330 -0.463 1
1 621 . 12 1 1 A 44 44 GLU CB C 44 28.648 29.173 -0.525 1
1 623 . 12 1 1 A 44 44 GLU N N 44 120.472 119.593 0.879 1
1 624 . 12 1 1 A 45 45 PHE H H 45 8.260 7.877 0.383 1
1 625 . 12 1 1 A 45 45 PHE HA H 45 4.520 4.084 0.436 1
1 633 . 12 1 1 A 45 45 PHE C C 45 177.942 178.401 -0.459 1
1 634 . 12 1 1 A 45 45 PHE CA C 45 55.945 61.078 -5.133 1
1 635 . 12 1 1 A 45 45 PHE CB C 45 36.680 38.084 -1.404 1
1 641 . 12 1 1 A 45 45 PHE N N 45 119.272 119.351 -0.079 1
1 642 . 12 1 1 A 46 46 ARG H H 46 8.023 8.388 -0.365 1
1 643 . 12 1 1 A 46 46 ARG HA H 46 4.074 4.000 0.074 1
1 651 . 12 1 1 A 46 46 ARG C C 46 177.617 179.030 -1.413 1
1 652 . 12 1 1 A 46 46 ARG CA C 46 58.194 59.608 -1.414 1
1 653 . 12 1 1 A 46 46 ARG CB C 46 29.737 29.896 -0.159 1
1 656 . 12 1 1 A 46 46 ARG N N 46 118.136 119.907 -1.771 1
1 658 . 12 1 1 A 47 47 LYS H H 47 7.470 7.741 -0.271 1
1 659 . 12 1 1 A 47 47 LYS HA H 47 4.143 4.129 0.014 1
1 668 . 12 1 1 A 47 47 LYS C C 47 177.324 178.085 -0.761 1
1 669 . 12 1 1 A 47 47 LYS CA C 47 57.726 58.961 -1.235 1
1 670 . 12 1 1 A 47 47 LYS CB C 47 32.409 32.198 0.211 1
1 674 . 12 1 1 A 47 47 LYS N N 47 116.943 119.253 -2.310 1
1 675 . 12 1 1 A 48 48 GLU H H 48 7.615 7.815 -0.200 1
1 676 . 12 1 1 A 48 48 GLU HA H 48 4.428 4.734 -0.306 1
1 681 . 12 1 1 A 48 48 GLU C C 48 176.869 177.004 -0.135 1
1 682 . 12 1 1 A 48 48 GLU CA C 48 55.945 55.837 0.108 1
1 683 . 12 1 1 A 48 48 GLU CB C 48 29.696 30.038 -0.342 1
1 685 . 12 1 1 A 48 48 GLU N N 48 118.852 115.825 3.027 1
1 686 . 12 1 1 A 49 49 SER H H 49 7.725 7.915 -0.190 1
1 687 . 12 1 1 A 49 49 SER HA H 49 4.244 4.331 -0.087 1
1 690 . 12 1 1 A 49 49 SER C C 49 174.838 174.812 0.026 1
1 691 . 12 1 1 A 49 49 SER CA C 49 59.366 60.084 -0.718 1
1 692 . 12 1 1 A 49 49 SER CB C 49 63.116 62.276 0.840 1
1 693 . 12 1 1 A 49 49 SER N N 49 114.224 114.871 -0.647 1
1 694 . 12 1 1 A 50 50 GLN H H 50 8.548 8.127 0.421 1
1 695 . 12 1 1 A 50 50 GLN HA H 50 4.398 4.316 0.082 1
1 702 . 12 1 1 A 50 50 GLN C C 50 175.732 176.696 -0.964 1
1 703 . 12 1 1 A 50 50 GLN CA C 50 56.272 57.696 -1.424 1
1 704 . 12 1 1 A 50 50 GLN CB C 50 28.946 29.800 -0.854 1
1 706 . 12 1 1 A 50 50 GLN N N 50 120.125 119.807 0.318 1
1 708 . 12 1 1 A 51 51 ASN H H 51 8.534 7.868 0.666 1
1 709 . 12 1 1 A 51 51 ASN HA H 51 4.980 4.906 0.074 1
1 714 . 12 1 1 A 51 51 ASN C C 51 173.717 173.646 0.071 1
1 715 . 12 1 1 A 51 51 ASN CA C 51 52.804 52.513 0.291 1
1 716 . 12 1 1 A 51 51 ASN CB C 51 39.583 39.140 0.443 1
1 717 . 12 1 1 A 51 51 ASN N N 51 118.158 115.952 2.206 1
1 719 . 12 1 1 A 52 52 ILE H H 52 7.492 7.713 -0.221 1
1 720 . 12 1 1 A 52 52 ILE HA H 52 5.338 5.731 -0.393 1
1 730 . 12 1 1 A 52 52 ILE C C 52 175.049 173.769 1.280 1
1 731 . 12 1 1 A 52 52 ILE CA C 52 59.364 59.189 0.175 1
1 732 . 12 1 1 A 52 52 ILE CB C 52 42.163 41.855 0.308 1
1 736 . 12 1 1 A 52 52 ILE N N 52 117.927 121.493 -3.566 1
1 737 . 12 1 1 A 53 53 LYS H H 53 8.467 9.166 -0.699 1
1 738 . 12 1 1 A 53 53 LYS HA H 53 5.044 5.469 -0.425 1
1 747 . 12 1 1 A 53 53 LYS C C 53 175.082 175.126 -0.044 1
1 748 . 12 1 1 A 53 53 LYS CA C 53 55.429 54.758 0.671 1
1 749 . 12 1 1 A 53 53 LYS CB C 53 36.446 37.313 -0.867 1
1 753 . 12 1 1 A 53 53 LYS N N 53 123.249 127.566 -4.317 1
1 754 . 12 1 1 A 54 54 VAL H H 54 8.490 8.855 -0.365 1
1 755 . 12 1 1 A 54 54 VAL HA H 54 5.159 5.075 0.084 1
1 763 . 12 1 1 A 54 54 VAL C C 54 173.473 173.472 0.001 1
1 764 . 12 1 1 A 54 54 VAL CA C 54 60.163 60.755 -0.592 1
1 765 . 12 1 1 A 54 54 VAL CB C 54 35.509 34.372 1.137 1
1 768 . 12 1 1 A 54 54 VAL N N 54 120.762 122.491 -1.729 1
1 769 . 12 1 1 A 55 55 LEU H H 55 8.636 8.694 -0.058 1
1 770 . 12 1 1 A 55 55 LEU HA H 55 4.670 4.599 0.071 1
1 780 . 12 1 1 A 55 55 LEU C C 55 173.652 174.462 -0.810 1
1 781 . 12 1 1 A 55 55 LEU CA C 55 52.289 53.063 -0.774 1
1 782 . 12 1 1 A 55 55 LEU CB C 55 42.070 43.031 -0.961 1
1 786 . 12 1 1 A 55 55 LEU N N 55 131.898 129.068 2.830 1
1 787 . 12 1 1 A 56 56 ILE H H 56 9.188 9.308 -0.120 1
1 788 . 12 1 1 A 56 56 ILE HA H 56 4.879 4.912 -0.033 1
1 798 . 12 1 1 A 56 56 ILE C C 56 174.172 174.292 -0.120 1
1 799 . 12 1 1 A 56 56 ILE CA C 56 59.976 60.147 -0.171 1
1 800 . 12 1 1 A 56 56 ILE CB C 56 38.181 39.214 -1.033 1
1 804 . 12 1 1 A 56 56 ILE N N 56 126.373 128.362 -1.989 1
1 805 . 12 1 1 A 57 57 LEU H H 57 8.929 9.363 -0.434 1
1 806 . 12 1 1 A 57 57 LEU HA H 57 5.394 5.381 0.013 1
1 816 . 12 1 1 A 57 57 LEU C C 57 175.358 176.149 -0.791 1
1 817 . 12 1 1 A 57 57 LEU CA C 57 52.086 53.248 -1.162 1
1 818 . 12 1 1 A 57 57 LEU CB C 57 42.445 42.829 -0.384 1
1 822 . 12 1 1 A 57 57 LEU N N 57 126.547 128.942 -2.395 1
1 823 . 12 1 1 A 58 58 VAL H H 58 8.542 8.954 -0.412 1
1 824 . 12 1 1 A 58 58 VAL HA H 58 5.253 4.810 0.443 1
1 832 . 12 1 1 A 58 58 VAL C C 58 175.244 176.165 -0.921 1
1 833 . 12 1 1 A 58 58 VAL CA C 58 58.241 59.227 -0.986 1
1 834 . 12 1 1 A 58 58 VAL CB C 58 33.165 34.409 -1.244 1
1 837 . 12 1 1 A 58 58 VAL N N 58 114.398 123.132 -8.734 1
1 838 . 12 1 1 A 59 59 SER H H 59 8.797 8.792 0.005 1
1 839 . 12 1 1 A 59 59 SER HA H 59 5.063 4.388 0.675 1
1 842 . 12 1 1 A 59 59 SER C C 59 174.172 174.069 0.103 1
1 843 . 12 1 1 A 59 59 SER CA C 59 59.320 60.982 -1.662 1
1 844 . 12 1 1 A 59 59 SER CB C 59 65.600 63.132 2.468 1
1 845 . 12 1 1 A 59 59 SER N N 59 115.497 116.361 -0.864 1
1 846 . 12 1 1 A 60 60 ASN H H 60 7.730 8.054 -0.324 1
1 847 . 12 1 1 A 60 60 ASN HA H 60 4.811 5.146 -0.335 1
1 852 . 12 1 1 A 60 60 ASN C C 60 174.464 175.279 -0.815 1
1 853 . 12 1 1 A 60 60 ASN CA C 60 52.007 52.109 -0.102 1
1 854 . 12 1 1 A 60 60 ASN CB C 60 40.336 40.624 -0.288 1
1 855 . 12 1 1 A 60 60 ASN N N 60 117.522 117.739 -0.217 1
1 857 . 12 1 1 A 61 61 ASP H H 61 8.577 8.951 -0.374 1
1 858 . 12 1 1 A 61 61 ASP HA H 61 4.365 4.258 0.107 1
1 861 . 12 1 1 A 61 61 ASP C C 61 177.357 178.292 -0.935 1
1 862 . 12 1 1 A 61 61 ASP CA C 61 57.351 57.087 0.264 1
1 863 . 12 1 1 A 61 61 ASP CB C 61 40.383 40.370 0.013 1
1 864 . 12 1 1 A 61 61 ASP N N 61 119.431 121.486 -2.055 1
1 865 . 12 1 1 A 62 62 GLU H H 62 8.405 8.495 -0.090 1
1 866 . 12 1 1 A 62 62 GLU HA H 62 4.121 4.018 0.103 1
1 871 . 12 1 1 A 62 62 GLU C C 62 179.615 178.944 0.671 1
1 872 . 12 1 1 A 62 62 GLU CA C 62 59.593 59.653 -0.060 1
1 873 . 12 1 1 A 62 62 GLU CB C 62 28.478 29.019 -0.541 1
1 875 . 12 1 1 A 62 62 GLU N N 62 122.150 119.669 2.481 1
1 876 . 12 1 1 A 63 63 GLU H H 63 8.384 8.214 0.170 1
1 877 . 12 1 1 A 63 63 GLU HA H 63 3.913 4.018 -0.105 1
1 882 . 12 1 1 A 63 63 GLU C C 63 178.478 179.130 -0.652 1
1 883 . 12 1 1 A 63 63 GLU CA C 63 58.273 59.148 -0.875 1
1 884 . 12 1 1 A 63 63 GLU CB C 63 29.931 29.132 0.799 1
1 886 . 12 1 1 A 63 63 GLU N N 63 119.084 118.695 0.389 1
1 887 . 12 1 1 A 64 64 LEU H H 64 7.717 8.211 -0.494 1
1 888 . 12 1 1 A 64 64 LEU HA H 64 3.750 4.042 -0.292 1
1 898 . 12 1 1 A 64 64 LEU C C 64 177.535 178.068 -0.533 1
1 899 . 12 1 1 A 64 64 LEU CA C 64 58.944 58.408 0.536 1
1 900 . 12 1 1 A 64 64 LEU CB C 64 41.695 41.471 0.224 1
1 904 . 12 1 1 A 64 64 LEU N N 64 120.357 121.926 -1.569 1
1 905 . 12 1 1 A 65 65 ASP H H 65 7.922 8.343 -0.421 1
1 906 . 12 1 1 A 65 65 ASP HA H 65 4.313 4.261 0.052 1
1 909 . 12 1 1 A 65 65 ASP C C 65 179.095 178.588 0.507 1
1 910 . 12 1 1 A 65 65 ASP CA C 65 57.272 58.030 -0.758 1
1 911 . 12 1 1 A 65 65 ASP CB C 65 40.196 41.284 -1.088 1
1 912 . 12 1 1 A 65 65 ASP N N 65 118.100 118.679 -0.579 1
1 913 . 12 1 1 A 66 66 LYS H H 66 7.802 7.912 -0.110 1
1 914 . 12 1 1 A 66 66 LYS HA H 66 4.078 3.997 0.081 1
1 923 . 12 1 1 A 66 66 LYS C C 66 178.624 178.848 -0.224 1
1 924 . 12 1 1 A 66 66 LYS CA C 66 58.429 59.233 -0.804 1
1 925 . 12 1 1 A 66 66 LYS CB C 66 31.727 32.218 -0.491 1
1 929 . 12 1 1 A 66 66 LYS N N 66 119.343 118.988 0.355 1
1 930 . 12 1 1 A 67 67 ALA H H 67 8.480 8.179 0.301 1
1 931 . 12 1 1 A 67 67 ALA HA H 67 3.853 4.114 -0.261 1
1 935 . 12 1 1 A 67 67 ALA C C 67 178.591 179.427 -0.836 1
1 936 . 12 1 1 A 67 67 ALA CA C 67 55.403 55.443 -0.040 1
1 937 . 12 1 1 A 67 67 ALA CB C 67 17.793 18.584 -0.791 1
1 938 . 12 1 1 A 67 67 ALA N N 67 121.562 122.389 -0.827 1
1 939 . 12 1 1 A 68 68 LYS H H 68 8.186 7.834 0.352 1
1 940 . 12 1 1 A 68 68 LYS HA H 68 3.805 4.037 -0.232 1
1 949 . 12 1 1 A 68 68 LYS C C 68 179.095 178.834 0.261 1
1 950 . 12 1 1 A 68 68 LYS CA C 68 59.952 59.267 0.685 1
1 951 . 12 1 1 A 68 68 LYS CB C 68 32.181 31.938 0.243 1
1 955 . 12 1 1 A 68 68 LYS N N 68 116.165 117.026 -0.861 1
1 956 . 12 1 1 A 69 69 GLU H H 69 7.904 8.308 -0.404 1
1 957 . 12 1 1 A 69 69 GLU HA H 69 3.995 4.010 -0.015 1
1 962 . 12 1 1 A 69 69 GLU C C 69 179.079 179.364 -0.285 1
1 963 . 12 1 1 A 69 69 GLU CA C 69 59.022 59.131 -0.109 1
1 964 . 12 1 1 A 69 69 GLU CB C 69 29.274 29.350 -0.076 1
1 966 . 12 1 1 A 69 69 GLU N N 69 119.489 119.478 0.011 1
1 967 . 12 1 1 A 70 70 LEU H H 70 7.962 7.872 0.090 1
1 968 . 12 1 1 A 70 70 LEU HA H 70 4.020 4.008 0.012 1
1 978 . 12 1 1 A 70 70 LEU C C 70 178.738 178.974 -0.236 1
1 979 . 12 1 1 A 70 70 LEU CA C 70 57.486 57.949 -0.463 1
1 980 . 12 1 1 A 70 70 LEU CB C 70 41.695 41.448 0.247 1
1 984 . 12 1 1 A 70 70 LEU N N 70 119.431 120.404 -0.973 1
1 985 . 12 1 1 A 71 71 ALA H H 71 8.260 8.301 -0.041 1
1 986 . 12 1 1 A 71 71 ALA HA H 71 3.845 4.072 -0.227 1
1 990 . 12 1 1 A 71 71 ALA C C 71 179.518 179.738 -0.220 1
1 991 . 12 1 1 A 71 71 ALA CA C 71 55.139 55.280 -0.141 1
1 992 . 12 1 1 A 71 71 ALA CB C 71 18.487 18.148 0.339 1
1 993 . 12 1 1 A 71 71 ALA N N 71 119.604 121.914 -2.310 1
1 994 . 12 1 1 A 72 72 GLN H H 72 7.910 8.351 -0.441 1
1 995 . 12 1 1 A 72 72 GLN HA H 72 4.154 3.953 0.201 1
1 1002 . 12 1 1 A 72 72 GLN C C 72 178.900 178.917 -0.017 1
1 1003 . 12 1 1 A 72 72 GLN CA C 72 58.194 59.032 -0.838 1
1 1004 . 12 1 1 A 72 72 GLN CB C 72 28.056 28.360 -0.304 1
1 1006 . 12 1 1 A 72 72 GLN N N 72 115.960 117.682 -1.722 1
1 1008 . 12 1 1 A 73 73 LYS H H 73 7.841 8.189 -0.348 1
1 1009 . 12 1 1 A 73 73 LYS HA H 73 4.171 4.135 0.036 1
1 1018 . 12 1 1 A 73 73 LYS C C 73 177.730 178.049 -0.319 1
1 1019 . 12 1 1 A 73 73 LYS CA C 73 57.867 58.703 -0.836 1
1 1020 . 12 1 1 A 73 73 LYS CB C 73 32.277 32.097 0.180 1
1 1024 . 12 1 1 A 73 73 LYS N N 73 119.027 119.135 -0.108 1
1 1025 . 12 1 1 A 74 74 MET H H 74 7.746 7.764 -0.018 1
1 1026 . 12 1 1 A 74 74 MET HA H 74 4.403 4.558 -0.155 1
1 1034 . 12 1 1 A 74 74 MET C C 74 174.416 174.994 -0.578 1
1 1035 . 12 1 1 A 74 74 MET CA C 74 55.194 55.096 0.098 1
1 1036 . 12 1 1 A 74 74 MET CB C 74 33.366 33.367 -0.001 1
1 1039 . 12 1 1 A 74 74 MET N N 74 115.786 115.176 0.610 1
1 1040 . 12 1 1 A 75 75 GLU H H 75 8.076 7.811 0.265 1
1 1041 . 12 1 1 A 75 75 GLU HA H 75 4.001 3.958 0.043 1
1 1046 . 12 1 1 A 75 75 GLU C C 75 175.130 174.990 0.140 1
1 1047 . 12 1 1 A 75 75 GLU CA C 75 56.722 57.298 -0.576 1
1 1048 . 12 1 1 A 75 75 GLU CB C 75 27.118 27.880 -0.762 1
1 1050 . 12 1 1 A 75 75 GLU N N 75 116.249 116.679 -0.430 1
1 1051 . 12 1 1 A 76 76 ILE H H 76 7.560 7.746 -0.186 1
1 1052 . 12 1 1 A 76 76 ILE HA H 76 4.428 4.683 -0.255 1
1 1062 . 12 1 1 A 76 76 ILE C C 76 174.529 174.624 -0.095 1
1 1063 . 12 1 1 A 76 76 ILE CA C 76 58.475 59.475 -1.000 1
1 1064 . 12 1 1 A 76 76 ILE CB C 76 40.337 41.284 -0.947 1
1 1068 . 12 1 1 A 76 76 ILE N N 76 115.960 119.696 -3.736 1
1 1069 . 12 1 1 A 77 77 ASP H H 77 8.889 8.633 0.256 1
1 1070 . 12 1 1 A 77 77 ASP HA H 77 4.569 5.050 -0.481 1
1 1073 . 12 1 1 A 77 77 ASP C C 77 174.123 175.897 -1.774 1
1 1074 . 12 1 1 A 77 77 ASP CA C 77 54.069 54.062 0.007 1
1 1075 . 12 1 1 A 77 77 ASP CB C 77 40.233 40.797 -0.564 1
1 1076 . 12 1 1 A 77 77 ASP N N 77 126.142 126.857 -0.715 1
1 1077 . 12 1 1 A 78 78 VAL H H 78 7.754 8.897 -1.143 1
1 1078 . 12 1 1 A 78 78 VAL HA H 78 5.192 5.466 -0.274 1
1 1086 . 12 1 1 A 78 78 VAL C C 78 174.968 174.302 0.666 1
1 1087 . 12 1 1 A 78 78 VAL CA C 78 58.804 58.723 0.081 1
1 1088 . 12 1 1 A 78 78 VAL CB C 78 35.293 35.778 -0.485 1
1 1091 . 12 1 1 A 78 78 VAL N N 78 122.844 116.887 5.957 1
1 1092 . 12 1 1 A 79 79 ARG H H 79 8.499 8.810 -0.311 1
1 1093 . 12 1 1 A 79 79 ARG HA H 79 4.712 5.021 -0.309 1
1 1100 . 12 1 1 A 79 79 ARG C C 79 174.221 174.979 -0.758 1
1 1101 . 12 1 1 A 79 79 ARG CA C 79 54.117 54.661 -0.544 1
1 1102 . 12 1 1 A 79 79 ARG CB C 79 31.196 32.054 -0.858 1
1 1105 . 12 1 1 A 79 79 ARG N N 79 125.637 122.012 3.625 1
1 1106 . 12 1 1 A 80 80 THR H H 80 8.416 8.643 -0.227 1
1 1107 . 12 1 1 A 80 80 THR HA H 80 5.332 5.296 0.036 1
1 1112 . 12 1 1 A 80 80 THR C C 80 174.497 173.852 0.645 1
1 1113 . 12 1 1 A 80 80 THR CA C 80 59.694 60.730 -1.036 1
1 1114 . 12 1 1 A 80 80 THR CB C 80 69.772 70.122 -0.350 1
1 1116 . 12 1 1 A 80 80 THR N N 80 118.084 117.578 0.506 1
1 1117 . 12 1 1 A 81 81 ARG H H 81 8.758 8.883 -0.125 1
1 1118 . 12 1 1 A 81 81 ARG HA H 81 4.362 4.709 -0.347 1
1 1126 . 12 1 1 A 81 81 ARG C C 81 173.733 173.957 -0.224 1
1 1127 . 12 1 1 A 81 81 ARG CA C 81 53.273 53.946 -0.673 1
1 1128 . 12 1 1 A 81 81 ARG CB C 81 33.915 33.385 0.530 1
1 1131 . 12 1 1 A 81 81 ARG N N 81 122.844 125.214 -2.370 1
1 1133 . 12 1 1 A 82 82 LYS H H 82 8.721 8.610 0.111 1
1 1134 . 12 1 1 A 82 82 LYS HA H 82 4.701 5.061 -0.360 1
1 1143 . 12 1 1 A 82 82 LYS C C 82 175.667 175.783 -0.116 1
1 1144 . 12 1 1 A 82 82 LYS CA C 82 54.960 55.167 -0.207 1
1 1145 . 12 1 1 A 82 82 LYS CB C 82 32.603 34.181 -1.578 1
1 1149 . 12 1 1 A 82 82 LYS N N 82 124.668 123.728 0.940 1
1 1150 . 12 1 1 A 83 83 VAL H H 83 9.112 9.096 0.016 1
1 1151 . 12 1 1 A 83 83 VAL HA H 83 4.796 4.909 -0.113 1
1 1159 . 12 1 1 A 83 83 VAL C C 83 174.594 175.069 -0.475 1
1 1160 . 12 1 1 A 83 83 VAL CA C 83 59.413 59.903 -0.490 1
1 1161 . 12 1 1 A 83 83 VAL CB C 83 35.298 34.912 0.386 1
1 1164 . 12 1 1 A 83 83 VAL N N 83 122.381 121.099 1.282 1
1 1165 . 12 1 1 A 84 84 THR H H 84 9.200 8.847 0.353 1
1 1166 . 12 1 1 A 84 84 THR HA H 84 4.579 4.699 -0.120 1
1 1171 . 12 1 1 A 84 84 THR C C 84 173.993 174.526 -0.533 1
1 1172 . 12 1 1 A 84 84 THR CA C 84 60.960 60.851 0.109 1
1 1173 . 12 1 1 A 84 84 THR CB C 84 70.100 69.427 0.673 1
1 1175 . 12 1 1 A 84 84 THR N N 84 113.183 115.554 -2.371 1
1 1176 . 12 1 1 A 85 85 SER H H 85 7.688 7.838 -0.150 1
1 1177 . 12 1 1 A 85 85 SER HA H 85 5.136 4.975 0.161 1
1 1180 . 12 1 1 A 85 85 SER CA C 85 55.205 55.675 -0.470 1
1 1181 . 12 1 1 A 85 85 SER CB C 85 64.376 65.741 -1.365 1
1 1182 . 12 1 1 A 85 85 SER N N 85 115.555 116.330 -0.775 1
1 1183 . 12 1 1 A 86 86 PRO HA H 86 4.090 4.323 -0.233 1
1 1190 . 12 1 1 A 86 86 PRO C C 86 177.227 178.291 -1.064 1
1 1191 . 12 1 1 A 86 86 PRO CA C 86 65.038 65.929 -0.891 1
1 1192 . 12 1 1 A 86 86 PRO CB C 86 31.711 31.628 0.083 1
1 1195 . 12 1 1 A 87 87 ASP H H 87 8.131 8.547 -0.416 1
1 1196 . 12 1 1 A 87 87 ASP HA H 87 4.223 4.323 -0.100 1
1 1199 . 12 1 1 A 87 87 ASP C C 87 178.721 179.314 -0.593 1
1 1200 . 12 1 1 A 87 87 ASP CA C 87 57.311 56.871 0.440 1
1 1201 . 12 1 1 A 87 87 ASP CB C 87 40.102 40.313 -0.211 1
1 1202 . 12 1 1 A 87 87 ASP N N 87 115.381 117.265 -1.884 1
1 1203 . 12 1 1 A 88 88 GLU H H 88 7.571 8.054 -0.483 1
1 1204 . 12 1 1 A 88 88 GLU HA H 88 3.659 4.094 -0.435 1
1 1209 . 12 1 1 A 88 88 GLU C C 88 177.097 178.808 -1.711 1
1 1210 . 12 1 1 A 88 88 GLU CA C 88 58.729 58.921 -0.192 1
1 1211 . 12 1 1 A 88 88 GLU CB C 88 30.052 29.654 0.398 1
1 1213 . 12 1 1 A 88 88 GLU N N 88 120.009 121.203 -1.194 1
1 1214 . 12 1 1 A 89 89 ALA H H 89 7.423 7.773 -0.350 1
1 1215 . 12 1 1 A 89 89 ALA HA H 89 3.900 4.329 -0.429 1
1 1219 . 12 1 1 A 89 89 ALA C C 89 178.267 179.988 -1.721 1
1 1220 . 12 1 1 A 89 89 ALA CA C 89 55.607 55.123 0.484 1
1 1221 . 12 1 1 A 89 89 ALA CB C 89 17.348 18.538 -1.190 1
1 1222 . 12 1 1 A 89 89 ALA N N 89 118.873 122.189 -3.316 1
1 1223 . 12 1 1 A 90 90 LYS H H 90 8.046 8.504 -0.458 1
1 1224 . 12 1 1 A 90 90 LYS HA H 90 3.669 3.943 -0.274 1
1 1233 . 12 1 1 A 90 90 LYS C C 90 177.649 179.048 -1.399 1
1 1234 . 12 1 1 A 90 90 LYS CA C 90 60.351 59.873 0.478 1
1 1235 . 12 1 1 A 90 90 LYS CB C 90 32.087 32.328 -0.241 1
1 1239 . 12 1 1 A 90 90 LYS N N 90 114.834 117.390 -2.556 1
1 1240 . 12 1 1 A 91 91 ARG H H 91 7.468 7.925 -0.457 1
1 1241 . 12 1 1 A 91 91 ARG HA H 91 3.887 3.895 -0.008 1
1 1249 . 12 1 1 A 91 91 ARG C C 91 178.998 179.094 -0.096 1
1 1250 . 12 1 1 A 91 91 ARG CA C 91 59.164 59.157 0.007 1
1 1251 . 12 1 1 A 91 91 ARG CB C 91 29.274 29.671 -0.397 1
1 1254 . 12 1 1 A 91 91 ARG N N 91 119.029 119.165 -0.136 1
1 1256 . 12 1 1 A 92 92 TRP H H 92 8.136 8.161 -0.025 1
1 1257 . 12 1 1 A 92 92 TRP HA H 92 4.818 4.519 0.299 1
1 1266 . 12 1 1 A 92 92 TRP C C 92 179.566 179.024 0.542 1
1 1267 . 12 1 1 A 92 92 TRP CA C 92 58.663 59.295 -0.632 1
1 1268 . 12 1 1 A 92 92 TRP CB C 92 29.790 29.467 0.323 1
1 1274 . 12 1 1 A 92 92 TRP N N 92 118.100 120.215 -2.115 1
1 1276 . 12 1 1 A 93 93 ILE H H 93 8.363 8.495 -0.132 1
1 1277 . 12 1 1 A 93 93 ILE HA H 93 3.544 3.737 -0.193 1
1 1287 . 12 1 1 A 93 93 ILE C C 93 176.820 178.103 -1.283 1
1 1288 . 12 1 1 A 93 93 ILE CA C 93 66.225 65.461 0.764 1
1 1289 . 12 1 1 A 93 93 ILE CB C 93 37.571 37.872 -0.301 1
1 1293 . 12 1 1 A 93 93 ILE N N 93 120.588 120.473 0.115 1
1 1294 . 12 1 1 A 94 94 LYS H H 94 8.264 7.830 0.434 1
1 1295 . 12 1 1 A 94 94 LYS HA H 94 3.865 4.008 -0.143 1
1 1304 . 12 1 1 A 94 94 LYS C C 94 179.258 178.769 0.489 1
1 1305 . 12 1 1 A 94 94 LYS CA C 94 59.889 59.817 0.072 1
1 1306 . 12 1 1 A 94 94 LYS CB C 94 32.225 32.211 0.014 1
1 1310 . 12 1 1 A 94 94 LYS N N 94 121.687 120.344 1.343 1
1 1311 . 12 1 1 A 95 95 GLU H H 95 8.360 8.586 -0.226 1
1 1312 . 12 1 1 A 95 95 GLU HA H 95 4.023 4.059 -0.036 1
1 1317 . 12 1 1 A 95 95 GLU C C 95 178.884 179.208 -0.324 1
1 1318 . 12 1 1 A 95 95 GLU CA C 95 59.366 59.567 -0.201 1
1 1319 . 12 1 1 A 95 95 GLU CB C 95 29.508 29.516 -0.008 1
1 1321 . 12 1 1 A 95 95 GLU N N 95 118.505 117.905 0.600 1
1 1322 . 12 1 1 A 96 96 PHE H H 96 8.212 8.443 -0.231 1
1 1323 . 12 1 1 A 96 96 PHE HA H 96 4.512 4.337 0.175 1
1 1331 . 12 1 1 A 96 96 PHE C C 96 176.820 177.580 -0.760 1
1 1332 . 12 1 1 A 96 96 PHE CA C 96 59.608 61.260 -1.652 1
1 1333 . 12 1 1 A 96 96 PHE CB C 96 40.431 39.267 1.164 1
1 1339 . 12 1 1 A 96 96 PHE N N 96 120.369 122.352 -1.983 1
1 1340 . 12 1 1 A 97 97 SER H H 97 8.216 8.075 0.141 1
1 1341 . 12 1 1 A 97 97 SER HA H 97 3.816 3.998 -0.182 1
1 1344 . 12 1 1 A 97 97 SER C C 97 175.618 177.324 -1.706 1
1 1345 . 12 1 1 A 97 97 SER CA C 97 60.492 61.636 -1.144 1
1 1346 . 12 1 1 A 97 97 SER CB C 97 63.022 62.813 0.209 1
1 1347 . 12 1 1 A 97 97 SER N N 97 111.969 114.349 -2.380 1
1 1348 . 12 1 1 A 98 98 GLU H H 98 7.655 7.746 -0.091 1
1 1349 . 12 1 1 A 98 98 GLU HA H 98 4.187 4.058 0.129 1
1 1354 . 12 1 1 A 98 98 GLU C C 98 177.698 179.231 -1.533 1
1 1355 . 12 1 1 A 98 98 GLU CA C 98 57.069 59.260 -2.191 1
1 1356 . 12 1 1 A 98 98 GLU CB C 98 29.321 28.970 0.351 1
1 1358 . 12 1 1 A 98 98 GLU N N 98 120.588 121.646 -1.058 1
1 1359 . 12 1 1 A 99 99 GLU H H 99 7.794 7.803 -0.009 1
1 1360 . 12 1 1 A 99 99 GLU HA H 99 4.123 4.099 0.024 1
1 1365 . 12 1 1 A 99 99 GLU C C 99 177.665 176.639 1.026 1
1 1366 . 12 1 1 A 99 99 GLU CA C 99 57.304 58.355 -1.051 1
1 1367 . 12 1 1 A 99 99 GLU CB C 99 29.368 29.859 -0.491 1
1 1369 . 12 1 1 A 99 99 GLU N N 99 120.067 119.740 0.327 1
1 1370 . 12 1 1 A 100 100 GLY H H 100 8.138 8.744 -0.606 1
1 1371 . 12 1 1 A 100 100 GLY HA2 H 100 3.865 3.780 0.085 1
1 1372 . 12 1 1 A 100 100 GLY HA3 H 100 3.715 3.860 -0.145 1
1 1373 . 12 1 1 A 100 100 GLY C C 100 174.464 173.792 0.672 1
1 1374 . 12 1 1 A 100 100 GLY CA C 100 45.305 46.781 -1.476 1
1 1375 . 12 1 1 A 100 100 GLY N N 100 107.802 107.645 0.157 1
1 1376 . 12 1 1 A 101 101 GLY H H 101 8.023 7.418 0.605 1
1 1377 . 12 1 1 A 101 101 GLY HA2 H 101 3.865 4.001 -0.136 1
1 1378 . 12 1 1 A 101 101 GLY HA3 H 101 3.892 4.028 -0.136 1
1 1379 . 12 1 1 A 101 101 GLY C C 101 174.204 172.567 1.637 1
1 1380 . 12 1 1 A 101 101 GLY CA C 101 45.036 45.617 -0.581 1
1 1381 . 12 1 1 A 101 101 GLY N N 101 108.032 107.404 0.628 1
1 1382 . 12 1 1 A 102 102 SER H H 102 8.059 8.555 -0.496 1
1 1383 . 12 1 1 A 102 102 SER HA H 102 4.380 5.089 -0.709 1
1 1386 . 12 1 1 A 102 102 SER C C 102 174.627 174.325 0.302 1
1 1387 . 12 1 1 A 102 102 SER CA C 102 58.194 56.879 1.315 1
1 1388 . 12 1 1 A 102 102 SER CB C 102 63.538 64.267 -0.729 1
1 1389 . 12 1 1 A 102 102 SER N N 102 115.266 113.173 2.093 1
1 1390 . 12 1 1 A 103 103 LEU H H 103 8.287 8.314 -0.027 1
1 1391 . 12 1 1 A 103 103 LEU HA H 103 4.301 4.050 0.251 1
1 1401 . 12 1 1 A 103 103 LEU C C 103 177.292 176.833 0.459 1
1 1402 . 12 1 1 A 103 103 LEU CA C 103 55.007 55.563 -0.556 1
1 1403 . 12 1 1 A 103 103 LEU CB C 103 42.023 42.226 -0.203 1
1 1407 . 12 1 1 A 103 103 LEU N N 103 123.596 126.382 -2.786 1
1 1408 . 12 1 1 A 104 104 GLU H H 104 8.216 7.814 0.402 1
1 1409 . 12 1 1 A 104 104 GLU HA H 104 4.126 4.257 -0.131 1
1 1414 . 12 1 1 A 104 104 GLU CA C 104 56.518 56.334 0.184 1
1 1415 . 12 1 1 A 104 104 GLU CB C 104 29.837 28.609 1.228 1
1 1417 . 12 1 1 A 104 104 GLU N N 104 120.510 115.288 5.222 1
1 1418 . 12 1 1 A 105 105 HIS HA H 105 4.593 5.033 -0.440 1
1 1421 . 12 1 1 A 105 105 HIS C C 105 173.766 174.821 -1.055 1
1 1422 . 12 1 1 A 105 105 HIS CA C 105 55.536 54.854 0.682 1
1 1423 . 12 1 1 A 105 105 HIS CB C 105 30.001 30.693 -0.692 1
1 1424 . 12 1 1 A 106 106 HIS H H 106 8.154 8.936 -0.782 1
1 1425 . 12 1 1 A 106 106 HIS HA H 106 4.407 4.498 -0.091 1
1 1428 . 12 1 1 A 106 106 HIS CA C 106 56.920 57.621 -0.701 1
1 1429 . 12 1 1 A 106 106 HIS CB C 106 30.001 30.126 -0.125 1
1 14 . 13 1 1 A 2 2 LEU H H 2 8.509 8.580 -0.071 1
1 15 . 13 1 1 A 2 2 LEU HA H 2 4.463 4.543 -0.080 1
1 25 . 13 1 1 A 2 2 LEU C C 2 173.944 175.970 -2.026 1
1 26 . 13 1 1 A 2 2 LEU CA C 2 54.471 54.648 -0.177 1
1 27 . 13 1 1 A 2 2 LEU CB C 2 43.595 42.088 1.507 1
1 31 . 13 1 1 A 2 2 LEU N N 2 127.160 124.918 2.242 1
1 32 . 13 1 1 A 3 3 LEU H H 3 7.844 8.361 -0.517 1
1 33 . 13 1 1 A 3 3 LEU HA H 3 5.128 5.452 -0.324 1
1 43 . 13 1 1 A 3 3 LEU C C 3 175.423 175.054 0.369 1
1 44 . 13 1 1 A 3 3 LEU CA C 3 53.566 53.383 0.183 1
1 45 . 13 1 1 A 3 3 LEU CB C 3 44.039 44.970 -0.931 1
1 49 . 13 1 1 A 3 3 LEU N N 3 122.555 124.426 -1.871 1
1 50 . 13 1 1 A 4 4 TYR H H 4 8.360 9.157 -0.797 1
1 51 . 13 1 1 A 4 4 TYR HA H 4 5.143 5.216 -0.073 1
1 58 . 13 1 1 A 4 4 TYR C C 4 174.481 174.924 -0.443 1
1 59 . 13 1 1 A 4 4 TYR CA C 4 56.577 55.840 0.737 1
1 60 . 13 1 1 A 4 4 TYR CB C 4 43.840 42.326 1.514 1
1 65 . 13 1 1 A 4 4 TYR N N 4 119.315 123.398 -4.083 1
1 66 . 13 1 1 A 5 5 VAL H H 5 8.918 8.955 -0.037 1
1 67 . 13 1 1 A 5 5 VAL HA H 5 5.106 4.929 0.177 1
1 75 . 13 1 1 A 5 5 VAL C C 5 174.042 174.636 -0.594 1
1 76 . 13 1 1 A 5 5 VAL CA C 5 59.852 60.738 -0.886 1
1 77 . 13 1 1 A 5 5 VAL CB C 5 33.816 34.226 -0.410 1
1 80 . 13 1 1 A 5 5 VAL N N 5 119.952 120.420 -0.468 1
1 81 . 13 1 1 A 6 6 LEU H H 6 9.315 9.457 -0.142 1
1 82 . 13 1 1 A 6 6 LEU HA H 6 5.466 5.307 0.159 1
1 92 . 13 1 1 A 6 6 LEU C C 6 175.049 174.713 0.336 1
1 93 . 13 1 1 A 6 6 LEU CA C 6 52.090 52.905 -0.815 1
1 94 . 13 1 1 A 6 6 LEU CB C 6 44.103 43.762 0.341 1
1 98 . 13 1 1 A 6 6 LEU N N 6 126.917 125.980 0.937 1
1 99 . 13 1 1 A 7 7 ILE H H 7 8.458 8.905 -0.447 1
1 100 . 13 1 1 A 7 7 ILE HA H 7 5.131 5.093 0.038 1
1 110 . 13 1 1 A 7 7 ILE C C 7 173.213 173.632 -0.419 1
1 111 . 13 1 1 A 7 7 ILE CA C 7 58.463 59.642 -1.179 1
1 112 . 13 1 1 A 7 7 ILE CB C 7 41.020 40.853 0.167 1
1 116 . 13 1 1 A 7 7 ILE N N 7 119.778 126.227 -6.449 1
1 117 . 13 1 1 A 8 8 ILE H H 8 8.797 9.387 -0.590 1
1 118 . 13 1 1 A 8 8 ILE HA H 8 4.611 4.904 -0.293 1
1 128 . 13 1 1 A 8 8 ILE C C 8 174.611 174.715 -0.104 1
1 129 . 13 1 1 A 8 8 ILE CA C 8 60.227 60.173 0.054 1
1 130 . 13 1 1 A 8 8 ILE CB C 8 37.665 38.923 -1.258 1
1 134 . 13 1 1 A 8 8 ILE N N 8 128.919 130.943 -2.024 1
1 135 . 13 1 1 A 9 9 SER H H 9 7.811 8.793 -0.982 1
1 136 . 13 1 1 A 9 9 SER HA H 9 4.429 5.022 -0.593 1
1 140 . 13 1 1 A 9 9 SER C C 9 172.937 173.007 -0.070 1
1 141 . 13 1 1 A 9 9 SER CA C 9 58.241 56.977 1.264 1
1 142 . 13 1 1 A 9 9 SER CB C 9 64.261 64.655 -0.394 1
1 143 . 13 1 1 A 9 9 SER N N 9 116.365 121.723 -5.358 1
1 144 . 13 1 1 A 10 10 ASN H H 10 8.641 8.578 0.063 1
1 145 . 13 1 1 A 10 10 ASN HA H 10 4.938 4.874 0.064 1
1 150 . 13 1 1 A 10 10 ASN C C 10 174.497 174.730 -0.233 1
1 151 . 13 1 1 A 10 10 ASN CA C 10 52.221 53.813 -1.592 1
1 152 . 13 1 1 A 10 10 ASN CB C 10 39.128 38.997 0.131 1
1 153 . 13 1 1 A 10 10 ASN N N 10 122.612 121.467 1.145 1
1 155 . 13 1 1 A 11 11 ASP H H 11 8.673 7.767 0.906 1
1 156 . 13 1 1 A 11 11 ASP HA H 11 4.596 4.716 -0.120 1
1 159 . 13 1 1 A 11 11 ASP C C 11 175.342 176.749 -1.407 1
1 160 . 13 1 1 A 11 11 ASP CA C 11 53.233 53.541 -0.308 1
1 161 . 13 1 1 A 11 11 ASP CB C 11 40.965 42.125 -1.160 1
1 162 . 13 1 1 A 11 11 ASP N N 11 122.717 121.949 0.768 1
1 163 . 13 1 1 A 12 12 LYS H H 12 8.562 8.855 -0.293 1
1 164 . 13 1 1 A 12 12 LYS HA H 12 3.854 3.943 -0.089 1
1 173 . 13 1 1 A 12 12 LYS C C 12 178.754 178.294 0.460 1
1 174 . 13 1 1 A 12 12 LYS CA C 12 59.581 60.217 -0.636 1
1 175 . 13 1 1 A 12 12 LYS CB C 12 32.378 32.452 -0.074 1
1 179 . 13 1 1 A 12 12 LYS N N 12 125.737 126.116 -0.379 1
1 180 . 13 1 1 A 13 13 LYS H H 13 8.075 7.659 0.416 1
1 181 . 13 1 1 A 13 13 LYS HA H 13 4.154 4.066 0.088 1
1 190 . 13 1 1 A 13 13 LYS C C 13 178.315 179.040 -0.725 1
1 191 . 13 1 1 A 13 13 LYS CA C 13 58.532 59.116 -0.584 1
1 192 . 13 1 1 A 13 13 LYS CB C 13 31.452 32.129 -0.677 1
1 196 . 13 1 1 A 13 13 LYS N N 13 119.604 120.036 -0.432 1
1 197 . 13 1 1 A 14 14 LEU H H 14 7.552 8.274 -0.722 1
1 198 . 13 1 1 A 14 14 LEU HA H 14 3.682 4.043 -0.361 1
1 208 . 13 1 1 A 14 14 LEU C C 14 178.429 178.562 -0.133 1
1 209 . 13 1 1 A 14 14 LEU CA C 14 58.999 57.961 1.038 1
1 210 . 13 1 1 A 14 14 LEU CB C 14 41.228 41.756 -0.528 1
1 214 . 13 1 1 A 14 14 LEU N N 14 122.266 121.512 0.754 1
1 215 . 13 1 1 A 15 15 ILE H H 15 8.074 7.769 0.305 1
1 216 . 13 1 1 A 15 15 ILE HA H 15 3.264 3.495 -0.231 1
1 226 . 13 1 1 A 15 15 ILE C C 15 177.000 177.472 -0.472 1
1 227 . 13 1 1 A 15 15 ILE CA C 15 65.939 65.688 0.251 1
1 228 . 13 1 1 A 15 15 ILE CB C 15 37.983 37.536 0.447 1
1 232 . 13 1 1 A 15 15 ILE N N 15 118.214 119.300 -1.086 1
1 233 . 13 1 1 A 16 16 GLU H H 16 8.016 8.671 -0.655 1
1 234 . 13 1 1 A 16 16 GLU HA H 16 4.045 3.893 0.152 1
1 239 . 13 1 1 A 16 16 GLU C C 16 179.388 179.625 -0.237 1
1 240 . 13 1 1 A 16 16 GLU CA C 16 59.032 59.925 -0.893 1
1 241 . 13 1 1 A 16 16 GLU CB C 16 29.200 29.247 -0.047 1
1 243 . 13 1 1 A 16 16 GLU N N 16 118.484 118.747 -0.263 1
1 244 . 13 1 1 A 17 17 GLU H H 17 8.063 8.371 -0.308 1
1 245 . 13 1 1 A 17 17 GLU HA H 17 4.053 4.011 0.042 1
1 250 . 13 1 1 A 17 17 GLU C C 17 179.306 179.220 0.086 1
1 251 . 13 1 1 A 17 17 GLU CA C 17 58.636 59.267 -0.631 1
1 252 . 13 1 1 A 17 17 GLU CB C 17 29.011 29.518 -0.507 1
1 254 . 13 1 1 A 17 17 GLU N N 17 118.100 120.531 -2.431 1
1 255 . 13 1 1 A 18 18 ALA H H 18 8.655 8.006 0.649 1
1 256 . 13 1 1 A 18 18 ALA HA H 18 3.775 4.018 -0.243 1
1 260 . 13 1 1 A 18 18 ALA C C 18 178.559 179.742 -1.183 1
1 261 . 13 1 1 A 18 18 ALA CA C 18 54.960 55.372 -0.412 1
1 262 . 13 1 1 A 18 18 ALA CB C 18 17.960 18.168 -0.208 1
1 263 . 13 1 1 A 18 18 ALA N N 18 122.439 122.633 -0.194 1
1 264 . 13 1 1 A 19 19 ARG H H 19 8.900 8.142 0.758 1
1 265 . 13 1 1 A 19 19 ARG HA H 19 3.809 4.127 -0.318 1
1 273 . 13 1 1 A 19 19 ARG C C 19 178.721 178.906 -0.185 1
1 274 . 13 1 1 A 19 19 ARG CA C 19 59.976 59.789 0.187 1
1 275 . 13 1 1 A 19 19 ARG CB C 19 29.572 29.860 -0.288 1
1 278 . 13 1 1 A 19 19 ARG N N 19 118.563 117.685 0.878 1
1 280 . 13 1 1 A 20 20 LYS H H 20 7.792 8.068 -0.276 1
1 281 . 13 1 1 A 20 20 LYS HA H 20 4.052 4.005 0.047 1
1 290 . 13 1 1 A 20 20 LYS C C 20 179.648 179.847 -0.199 1
1 291 . 13 1 1 A 20 20 LYS CA C 20 59.296 59.365 -0.069 1
1 292 . 13 1 1 A 20 20 LYS CB C 20 32.216 32.357 -0.141 1
1 296 . 13 1 1 A 20 20 LYS N N 20 118.638 119.806 -1.168 1
1 297 . 13 1 1 A 21 21 MET H H 21 7.684 8.120 -0.436 1
1 298 . 13 1 1 A 21 21 MET HA H 21 4.411 4.148 0.263 1
1 306 . 13 1 1 A 21 21 MET C C 21 177.909 178.235 -0.326 1
1 307 . 13 1 1 A 21 21 MET CA C 21 57.009 59.438 -2.429 1
1 308 . 13 1 1 A 21 21 MET CB C 21 32.028 32.870 -0.842 1
1 311 . 13 1 1 A 21 21 MET N N 21 118.100 118.467 -0.367 1
1 312 . 13 1 1 A 22 22 ALA H H 22 8.815 8.367 0.448 1
1 313 . 13 1 1 A 22 22 ALA HA H 22 3.826 3.924 -0.098 1
1 317 . 13 1 1 A 22 22 ALA C C 22 178.835 179.924 -1.089 1
1 318 . 13 1 1 A 22 22 ALA CA C 22 55.427 55.589 -0.162 1
1 319 . 13 1 1 A 22 22 ALA CB C 22 18.059 18.589 -0.530 1
1 320 . 13 1 1 A 22 22 ALA N N 22 122.150 121.546 0.604 1
1 321 . 13 1 1 A 23 23 GLU H H 23 8.276 8.062 0.214 1
1 322 . 13 1 1 A 23 23 GLU HA H 23 4.146 3.949 0.197 1
1 327 . 13 1 1 A 23 23 GLU C C 23 180.151 179.204 0.947 1
1 328 . 13 1 1 A 23 23 GLU CA C 23 58.999 59.501 -0.502 1
1 329 . 13 1 1 A 23 23 GLU CB C 23 29.160 29.672 -0.512 1
1 331 . 13 1 1 A 23 23 GLU N N 23 117.001 117.893 -0.892 1
1 332 . 13 1 1 A 24 24 LYS H H 24 7.573 8.123 -0.550 1
1 333 . 13 1 1 A 24 24 LYS HA H 24 4.101 4.141 -0.040 1
1 342 . 13 1 1 A 24 24 LYS C C 24 177.145 177.266 -0.121 1
1 343 . 13 1 1 A 24 24 LYS CA C 24 58.261 58.293 -0.032 1
1 344 . 13 1 1 A 24 24 LYS CB C 24 32.079 32.292 -0.213 1
1 348 . 13 1 1 A 24 24 LYS N N 24 119.960 119.091 0.869 1
1 349 . 13 1 1 A 25 25 ALA H H 25 7.710 7.747 -0.037 1
1 350 . 13 1 1 A 25 25 ALA HA H 25 4.413 4.364 0.049 1
1 354 . 13 1 1 A 25 25 ALA C C 25 175.325 176.643 -1.318 1
1 355 . 13 1 1 A 25 25 ALA CA C 25 51.208 51.597 -0.389 1
1 356 . 13 1 1 A 25 25 ALA CB C 25 18.520 19.210 -0.690 1
1 357 . 13 1 1 A 25 25 ALA N N 25 119.257 118.788 0.469 1
1 358 . 13 1 1 A 26 26 ASN H H 26 7.840 7.915 -0.075 1
1 359 . 13 1 1 A 26 26 ASN HA H 26 4.357 4.336 0.021 1
1 364 . 13 1 1 A 26 26 ASN C C 26 173.587 173.819 -0.232 1
1 365 . 13 1 1 A 26 26 ASN CA C 26 54.307 54.495 -0.188 1
1 366 . 13 1 1 A 26 26 ASN CB C 26 36.972 36.939 0.033 1
1 367 . 13 1 1 A 26 26 ASN N N 26 115.266 113.585 1.681 1
1 369 . 13 1 1 A 27 27 LEU H H 27 8.241 7.869 0.372 1
1 370 . 13 1 1 A 27 27 LEU HA H 27 4.652 4.638 0.014 1
1 380 . 13 1 1 A 27 27 LEU C C 27 175.894 176.121 -0.227 1
1 381 . 13 1 1 A 27 27 LEU CA C 27 52.923 53.381 -0.458 1
1 382 . 13 1 1 A 27 27 LEU CB C 27 44.090 43.690 0.400 1
1 386 . 13 1 1 A 27 27 LEU N N 27 116.828 119.123 -2.295 1
1 387 . 13 1 1 A 28 28 GLU H H 28 7.798 8.414 -0.616 1
1 388 . 13 1 1 A 28 28 GLU HA H 28 4.310 4.732 -0.422 1
1 393 . 13 1 1 A 28 28 GLU C C 28 173.944 175.183 -1.239 1
1 394 . 13 1 1 A 28 28 GLU CA C 28 55.460 56.035 -0.575 1
1 395 . 13 1 1 A 28 28 GLU CB C 28 30.512 30.691 -0.179 1
1 397 . 13 1 1 A 28 28 GLU N N 28 121.340 122.471 -1.131 1
1 398 . 13 1 1 A 29 29 LEU H H 29 8.451 8.948 -0.497 1
1 399 . 13 1 1 A 29 29 LEU HA H 29 5.662 5.625 0.037 1
1 409 . 13 1 1 A 29 29 LEU C C 29 176.902 174.753 2.149 1
1 410 . 13 1 1 A 29 29 LEU CA C 29 53.186 53.475 -0.289 1
1 411 . 13 1 1 A 29 29 LEU CB C 29 44.914 45.510 -0.596 1
1 415 . 13 1 1 A 29 29 LEU N N 29 126.547 127.311 -0.764 1
1 416 . 13 1 1 A 30 30 ARG H H 30 9.094 9.054 0.040 1
1 417 . 13 1 1 A 30 30 ARG HA H 30 4.910 4.940 -0.030 1
1 425 . 13 1 1 A 30 30 ARG C C 30 175.147 175.519 -0.372 1
1 426 . 13 1 1 A 30 30 ARG CA C 30 53.417 54.396 -0.979 1
1 427 . 13 1 1 A 30 30 ARG CB C 30 32.555 32.884 -0.329 1
1 430 . 13 1 1 A 30 30 ARG N N 30 125.043 125.936 -0.893 1
1 432 . 13 1 1 A 31 31 THR H H 31 8.496 8.568 -0.072 1
1 433 . 13 1 1 A 31 31 THR HA H 31 4.888 4.714 0.174 1
1 438 . 13 1 1 A 31 31 THR C C 31 173.961 174.060 -0.099 1
1 439 . 13 1 1 A 31 31 THR CA C 31 60.445 61.065 -0.620 1
1 440 . 13 1 1 A 31 31 THR CB C 31 69.492 69.837 -0.345 1
1 442 . 13 1 1 A 31 31 THR N N 31 114.745 115.906 -1.161 1
1 443 . 13 1 1 A 32 32 VAL H H 32 8.480 9.057 -0.577 1
1 444 . 13 1 1 A 32 32 VAL HA H 32 4.411 4.651 -0.240 1
1 452 . 13 1 1 A 32 32 VAL C C 32 175.082 175.420 -0.338 1
1 453 . 13 1 1 A 32 32 VAL CA C 32 60.946 61.005 -0.059 1
1 454 . 13 1 1 A 32 32 VAL CB C 32 34.487 34.121 0.366 1
1 457 . 13 1 1 A 32 32 VAL N N 32 122.324 125.559 -3.235 1
1 458 . 13 1 1 A 33 33 LYS H H 33 9.304 8.621 0.683 1
1 459 . 13 1 1 A 33 33 LYS HA H 33 4.534 4.475 0.059 1
1 468 . 13 1 1 A 33 33 LYS C C 33 176.740 176.523 0.217 1
1 469 . 13 1 1 A 33 33 LYS CA C 33 56.846 57.376 -0.530 1
1 470 . 13 1 1 A 33 33 LYS CB C 33 34.355 33.463 0.892 1
1 474 . 13 1 1 A 33 33 LYS N N 33 123.654 126.404 -2.750 1
1 475 . 13 1 1 A 34 34 THR H H 34 7.245 7.684 -0.439 1
1 476 . 13 1 1 A 34 34 THR HA H 34 4.780 4.675 0.105 1
1 481 . 13 1 1 A 34 34 THR C C 34 174.529 175.393 -0.864 1
1 482 . 13 1 1 A 34 34 THR CA C 34 58.859 59.259 -0.400 1
1 483 . 13 1 1 A 34 34 THR CB C 34 73.023 71.840 1.183 1
1 485 . 13 1 1 A 34 34 THR N N 34 106.300 111.567 -5.267 1
1 486 . 13 1 1 A 35 35 GLU H H 35 9.174 9.034 0.140 1
1 487 . 13 1 1 A 35 35 GLU HA H 35 3.886 3.951 -0.065 1
1 492 . 13 1 1 A 35 35 GLU C C 35 177.714 177.702 0.012 1
1 493 . 13 1 1 A 35 35 GLU CA C 35 59.233 59.768 -0.535 1
1 494 . 13 1 1 A 35 35 GLU CB C 35 29.377 29.467 -0.090 1
1 496 . 13 1 1 A 35 35 GLU N N 35 121.919 122.112 -0.193 1
1 497 . 13 1 1 A 36 36 ASP H H 36 8.185 8.463 -0.278 1
1 498 . 13 1 1 A 36 36 ASP HA H 36 4.289 4.340 -0.051 1
1 501 . 13 1 1 A 36 36 ASP C C 36 178.348 178.522 -0.174 1
1 502 . 13 1 1 A 36 36 ASP CA C 36 56.962 57.839 -0.877 1
1 503 . 13 1 1 A 36 36 ASP CB C 36 40.214 42.259 -2.045 1
1 504 . 13 1 1 A 36 36 ASP N N 36 118.332 119.901 -1.569 1
1 505 . 13 1 1 A 37 37 GLU H H 37 7.741 7.431 0.310 1
1 506 . 13 1 1 A 37 37 GLU HA H 37 3.708 3.904 -0.196 1
1 511 . 13 1 1 A 37 37 GLU C C 37 177.324 178.751 -1.427 1
1 512 . 13 1 1 A 37 37 GLU CA C 37 58.698 59.147 -0.449 1
1 513 . 13 1 1 A 37 37 GLU CB C 37 30.199 29.605 0.594 1
1 515 . 13 1 1 A 37 37 GLU N N 37 120.704 119.024 1.680 1
1 516 . 13 1 1 A 38 38 LEU H H 38 7.531 8.193 -0.662 1
1 517 . 13 1 1 A 38 38 LEU HA H 38 3.873 4.245 -0.372 1
1 527 . 13 1 1 A 38 38 LEU C C 38 177.357 178.576 -1.219 1
1 528 . 13 1 1 A 38 38 LEU CA C 38 58.305 58.137 0.168 1
1 529 . 13 1 1 A 38 38 LEU CB C 38 40.837 41.595 -0.758 1
1 533 . 13 1 1 A 38 38 LEU N N 38 119.200 122.039 -2.839 1
1 534 . 13 1 1 A 39 39 LYS H H 39 8.083 8.458 -0.375 1
1 535 . 13 1 1 A 39 39 LYS HA H 39 3.608 3.945 -0.337 1
1 544 . 13 1 1 A 39 39 LYS C C 39 177.373 178.814 -1.441 1
1 545 . 13 1 1 A 39 39 LYS CA C 39 60.290 59.672 0.618 1
1 546 . 13 1 1 A 39 39 LYS CB C 39 32.178 32.376 -0.198 1
1 550 . 13 1 1 A 39 39 LYS N N 39 116.943 118.844 -1.901 1
1 551 . 13 1 1 A 40 40 LYS H H 40 7.632 7.748 -0.116 1
1 552 . 13 1 1 A 40 40 LYS HA H 40 3.864 3.882 -0.018 1
1 561 . 13 1 1 A 40 40 LYS C C 40 179.566 178.669 0.897 1
1 562 . 13 1 1 A 40 40 LYS CA C 40 58.993 59.086 -0.093 1
1 563 . 13 1 1 A 40 40 LYS CB C 40 31.758 31.923 -0.165 1
1 567 . 13 1 1 A 40 40 LYS N N 40 118.274 119.266 -0.992 1
1 568 . 13 1 1 A 41 41 TYR H H 41 7.823 7.927 -0.104 1
1 569 . 13 1 1 A 41 41 TYR HA H 41 3.926 3.997 -0.071 1
1 576 . 13 1 1 A 41 41 TYR C C 41 176.625 177.936 -1.311 1
1 577 . 13 1 1 A 41 41 TYR CA C 41 59.757 60.400 -0.643 1
1 578 . 13 1 1 A 41 41 TYR CB C 41 36.901 37.918 -1.017 1
1 583 . 13 1 1 A 41 41 TYR N N 41 117.811 119.254 -1.443 1
1 584 . 13 1 1 A 42 42 LEU H H 42 7.964 8.436 -0.472 1
1 585 . 13 1 1 A 42 42 LEU HA H 42 3.704 4.053 -0.349 1
1 595 . 13 1 1 A 42 42 LEU C C 42 178.396 179.488 -1.092 1
1 596 . 13 1 1 A 42 42 LEU CA C 42 58.237 57.985 0.252 1
1 597 . 13 1 1 A 42 42 LEU CB C 42 40.507 41.451 -0.944 1
1 601 . 13 1 1 A 42 42 LEU N N 42 115.960 120.016 -4.056 1
1 602 . 13 1 1 A 43 43 GLU H H 43 8.193 8.115 0.078 1
1 603 . 13 1 1 A 43 43 GLU HA H 43 3.882 3.958 -0.076 1
1 608 . 13 1 1 A 43 43 GLU C C 43 179.193 179.379 -0.186 1
1 609 . 13 1 1 A 43 43 GLU CA C 43 59.122 59.544 -0.422 1
1 610 . 13 1 1 A 43 43 GLU CB C 43 29.244 29.032 0.212 1
1 612 . 13 1 1 A 43 43 GLU N N 43 117.175 117.552 -0.377 1
1 613 . 13 1 1 A 44 44 GLU H H 44 7.601 7.786 -0.185 1
1 614 . 13 1 1 A 44 44 GLU HA H 44 3.936 3.977 -0.041 1
1 619 . 13 1 1 A 44 44 GLU C C 44 179.875 178.922 0.953 1
1 620 . 13 1 1 A 44 44 GLU CA C 44 58.867 59.169 -0.302 1
1 621 . 13 1 1 A 44 44 GLU CB C 44 28.648 29.165 -0.517 1
1 623 . 13 1 1 A 44 44 GLU N N 44 120.472 119.375 1.097 1
1 624 . 13 1 1 A 45 45 PHE H H 45 8.260 7.528 0.732 1
1 625 . 13 1 1 A 45 45 PHE HA H 45 4.520 4.226 0.294 1
1 633 . 13 1 1 A 45 45 PHE C C 45 177.942 178.320 -0.378 1
1 634 . 13 1 1 A 45 45 PHE CA C 45 55.945 61.685 -5.740 1
1 635 . 13 1 1 A 45 45 PHE CB C 45 36.680 38.078 -1.398 1
1 641 . 13 1 1 A 45 45 PHE N N 45 119.272 118.927 0.345 1
1 642 . 13 1 1 A 46 46 ARG H H 46 8.023 8.007 0.016 1
1 643 . 13 1 1 A 46 46 ARG HA H 46 4.074 4.297 -0.223 1
1 651 . 13 1 1 A 46 46 ARG C C 46 177.617 178.863 -1.246 1
1 652 . 13 1 1 A 46 46 ARG CA C 46 58.194 58.576 -0.382 1
1 653 . 13 1 1 A 46 46 ARG CB C 46 29.737 30.073 -0.336 1
1 656 . 13 1 1 A 46 46 ARG N N 46 118.136 120.781 -2.645 1
1 658 . 13 1 1 A 47 47 LYS H H 47 7.470 7.790 -0.320 1
1 659 . 13 1 1 A 47 47 LYS HA H 47 4.143 4.017 0.126 1
1 668 . 13 1 1 A 47 47 LYS C C 47 177.324 178.132 -0.808 1
1 669 . 13 1 1 A 47 47 LYS CA C 47 57.726 59.374 -1.648 1
1 670 . 13 1 1 A 47 47 LYS CB C 47 32.409 32.189 0.220 1
1 674 . 13 1 1 A 47 47 LYS N N 47 116.943 119.661 -2.718 1
1 675 . 13 1 1 A 48 48 GLU H H 48 7.615 7.935 -0.320 1
1 676 . 13 1 1 A 48 48 GLU HA H 48 4.428 4.544 -0.116 1
1 681 . 13 1 1 A 48 48 GLU C C 48 176.869 177.232 -0.363 1
1 682 . 13 1 1 A 48 48 GLU CA C 48 55.945 55.581 0.364 1
1 683 . 13 1 1 A 48 48 GLU CB C 48 29.696 27.929 1.767 1
1 685 . 13 1 1 A 48 48 GLU N N 48 118.852 117.571 1.281 1
1 686 . 13 1 1 A 49 49 SER H H 49 7.725 8.225 -0.500 1
1 687 . 13 1 1 A 49 49 SER HA H 49 4.244 4.393 -0.149 1
1 690 . 13 1 1 A 49 49 SER C C 49 174.838 173.666 1.172 1
1 691 . 13 1 1 A 49 49 SER CA C 49 59.366 58.511 0.855 1
1 692 . 13 1 1 A 49 49 SER CB C 49 63.116 62.560 0.556 1
1 693 . 13 1 1 A 49 49 SER N N 49 114.224 115.123 -0.899 1
1 694 . 13 1 1 A 50 50 GLN H H 50 8.548 8.226 0.322 1
1 695 . 13 1 1 A 50 50 GLN HA H 50 4.398 4.576 -0.178 1
1 702 . 13 1 1 A 50 50 GLN C C 50 175.732 176.988 -1.256 1
1 703 . 13 1 1 A 50 50 GLN CA C 50 56.272 56.846 -0.574 1
1 704 . 13 1 1 A 50 50 GLN CB C 50 28.946 31.102 -2.156 1
1 706 . 13 1 1 A 50 50 GLN N N 50 120.125 119.952 0.173 1
1 708 . 13 1 1 A 51 51 ASN H H 51 8.534 8.496 0.038 1
1 709 . 13 1 1 A 51 51 ASN HA H 51 4.980 4.961 0.019 1
1 714 . 13 1 1 A 51 51 ASN C C 51 173.717 173.941 -0.224 1
1 715 . 13 1 1 A 51 51 ASN CA C 51 52.804 52.897 -0.093 1
1 716 . 13 1 1 A 51 51 ASN CB C 51 39.583 39.204 0.379 1
1 717 . 13 1 1 A 51 51 ASN N N 51 118.158 115.512 2.646 1
1 719 . 13 1 1 A 52 52 ILE H H 52 7.492 7.489 0.003 1
1 720 . 13 1 1 A 52 52 ILE HA H 52 5.338 5.541 -0.203 1
1 730 . 13 1 1 A 52 52 ILE C C 52 175.049 174.368 0.681 1
1 731 . 13 1 1 A 52 52 ILE CA C 52 59.364 59.875 -0.511 1
1 732 . 13 1 1 A 52 52 ILE CB C 52 42.163 41.315 0.848 1
1 736 . 13 1 1 A 52 52 ILE N N 52 117.927 121.313 -3.386 1
1 737 . 13 1 1 A 53 53 LYS H H 53 8.467 9.252 -0.785 1
1 738 . 13 1 1 A 53 53 LYS HA H 53 5.044 5.268 -0.224 1
1 747 . 13 1 1 A 53 53 LYS C C 53 175.082 175.215 -0.133 1
1 748 . 13 1 1 A 53 53 LYS CA C 53 55.429 54.893 0.536 1
1 749 . 13 1 1 A 53 53 LYS CB C 53 36.446 36.740 -0.294 1
1 753 . 13 1 1 A 53 53 LYS N N 53 123.249 128.285 -5.036 1
1 754 . 13 1 1 A 54 54 VAL H H 54 8.490 8.679 -0.189 1
1 755 . 13 1 1 A 54 54 VAL HA H 54 5.159 5.156 0.003 1
1 763 . 13 1 1 A 54 54 VAL C C 54 173.473 173.317 0.156 1
1 764 . 13 1 1 A 54 54 VAL CA C 54 60.163 60.863 -0.700 1
1 765 . 13 1 1 A 54 54 VAL CB C 54 35.509 34.420 1.089 1
1 768 . 13 1 1 A 54 54 VAL N N 54 120.762 123.354 -2.592 1
1 769 . 13 1 1 A 55 55 LEU H H 55 8.636 8.766 -0.130 1
1 770 . 13 1 1 A 55 55 LEU HA H 55 4.670 4.804 -0.134 1
1 780 . 13 1 1 A 55 55 LEU C C 55 173.652 174.403 -0.751 1
1 781 . 13 1 1 A 55 55 LEU CA C 55 52.289 52.952 -0.663 1
1 782 . 13 1 1 A 55 55 LEU CB C 55 42.070 43.661 -1.591 1
1 786 . 13 1 1 A 55 55 LEU N N 55 131.898 129.281 2.617 1
1 787 . 13 1 1 A 56 56 ILE H H 56 9.188 9.014 0.174 1
1 788 . 13 1 1 A 56 56 ILE HA H 56 4.879 5.080 -0.201 1
1 798 . 13 1 1 A 56 56 ILE C C 56 174.172 174.295 -0.123 1
1 799 . 13 1 1 A 56 56 ILE CA C 56 59.976 59.806 0.170 1
1 800 . 13 1 1 A 56 56 ILE CB C 56 38.181 39.585 -1.404 1
1 804 . 13 1 1 A 56 56 ILE N N 56 126.373 127.611 -1.238 1
1 805 . 13 1 1 A 57 57 LEU H H 57 8.929 9.349 -0.420 1
1 806 . 13 1 1 A 57 57 LEU HA H 57 5.394 5.171 0.223 1
1 816 . 13 1 1 A 57 57 LEU C C 57 175.358 175.711 -0.353 1
1 817 . 13 1 1 A 57 57 LEU CA C 57 52.086 53.227 -1.141 1
1 818 . 13 1 1 A 57 57 LEU CB C 57 42.445 42.760 -0.315 1
1 822 . 13 1 1 A 57 57 LEU N N 57 126.547 128.353 -1.806 1
1 823 . 13 1 1 A 58 58 VAL H H 58 8.542 8.970 -0.428 1
1 824 . 13 1 1 A 58 58 VAL HA H 58 5.253 4.780 0.473 1
1 832 . 13 1 1 A 58 58 VAL C C 58 175.244 175.586 -0.342 1
1 833 . 13 1 1 A 58 58 VAL CA C 58 58.241 59.790 -1.549 1
1 834 . 13 1 1 A 58 58 VAL CB C 58 33.165 34.603 -1.438 1
1 837 . 13 1 1 A 58 58 VAL N N 58 114.398 120.820 -6.422 1
1 838 . 13 1 1 A 59 59 SER H H 59 8.797 8.340 0.457 1
1 839 . 13 1 1 A 59 59 SER HA H 59 5.063 4.726 0.337 1
1 842 . 13 1 1 A 59 59 SER C C 59 174.172 174.505 -0.333 1
1 843 . 13 1 1 A 59 59 SER CA C 59 59.320 60.212 -0.892 1
1 844 . 13 1 1 A 59 59 SER CB C 59 65.600 64.237 1.363 1
1 845 . 13 1 1 A 59 59 SER N N 59 115.497 119.112 -3.615 1
1 846 . 13 1 1 A 60 60 ASN H H 60 7.730 7.997 -0.267 1
1 847 . 13 1 1 A 60 60 ASN HA H 60 4.811 5.101 -0.290 1
1 852 . 13 1 1 A 60 60 ASN C C 60 174.464 175.224 -0.760 1
1 853 . 13 1 1 A 60 60 ASN CA C 60 52.007 52.198 -0.191 1
1 854 . 13 1 1 A 60 60 ASN CB C 60 40.336 41.297 -0.961 1
1 855 . 13 1 1 A 60 60 ASN N N 60 117.522 117.583 -0.061 1
1 857 . 13 1 1 A 61 61 ASP H H 61 8.577 8.933 -0.356 1
1 858 . 13 1 1 A 61 61 ASP HA H 61 4.365 4.263 0.102 1
1 861 . 13 1 1 A 61 61 ASP C C 61 177.357 177.827 -0.470 1
1 862 . 13 1 1 A 61 61 ASP CA C 61 57.351 57.514 -0.163 1
1 863 . 13 1 1 A 61 61 ASP CB C 61 40.383 40.499 -0.116 1
1 864 . 13 1 1 A 61 61 ASP N N 61 119.431 123.789 -4.358 1
1 865 . 13 1 1 A 62 62 GLU H H 62 8.405 8.394 0.011 1
1 866 . 13 1 1 A 62 62 GLU HA H 62 4.121 4.062 0.059 1
1 871 . 13 1 1 A 62 62 GLU C C 62 179.615 179.091 0.524 1
1 872 . 13 1 1 A 62 62 GLU CA C 62 59.593 59.513 0.080 1
1 873 . 13 1 1 A 62 62 GLU CB C 62 28.478 29.141 -0.663 1
1 875 . 13 1 1 A 62 62 GLU N N 62 122.150 119.088 3.062 1
1 876 . 13 1 1 A 63 63 GLU H H 63 8.384 8.201 0.183 1
1 877 . 13 1 1 A 63 63 GLU HA H 63 3.913 4.028 -0.115 1
1 882 . 13 1 1 A 63 63 GLU C C 63 178.478 178.912 -0.434 1
1 883 . 13 1 1 A 63 63 GLU CA C 63 58.273 59.180 -0.907 1
1 884 . 13 1 1 A 63 63 GLU CB C 63 29.931 29.413 0.518 1
1 886 . 13 1 1 A 63 63 GLU N N 63 119.084 120.360 -1.276 1
1 887 . 13 1 1 A 64 64 LEU H H 64 7.717 7.946 -0.229 1
1 888 . 13 1 1 A 64 64 LEU HA H 64 3.750 4.015 -0.265 1
1 898 . 13 1 1 A 64 64 LEU C C 64 177.535 178.038 -0.503 1
1 899 . 13 1 1 A 64 64 LEU CA C 64 58.944 58.346 0.598 1
1 900 . 13 1 1 A 64 64 LEU CB C 64 41.695 41.588 0.107 1
1 904 . 13 1 1 A 64 64 LEU N N 64 120.357 122.200 -1.843 1
1 905 . 13 1 1 A 65 65 ASP H H 65 7.922 8.069 -0.147 1
1 906 . 13 1 1 A 65 65 ASP HA H 65 4.313 4.315 -0.002 1
1 909 . 13 1 1 A 65 65 ASP C C 65 179.095 179.138 -0.043 1
1 910 . 13 1 1 A 65 65 ASP CA C 65 57.272 57.208 0.064 1
1 911 . 13 1 1 A 65 65 ASP CB C 65 40.196 40.508 -0.312 1
1 912 . 13 1 1 A 65 65 ASP N N 65 118.100 118.160 -0.060 1
1 913 . 13 1 1 A 66 66 LYS H H 66 7.802 8.063 -0.261 1
1 914 . 13 1 1 A 66 66 LYS HA H 66 4.078 3.927 0.151 1
1 923 . 13 1 1 A 66 66 LYS C C 66 178.624 179.088 -0.464 1
1 924 . 13 1 1 A 66 66 LYS CA C 66 58.429 59.731 -1.302 1
1 925 . 13 1 1 A 66 66 LYS CB C 66 31.727 32.344 -0.617 1
1 929 . 13 1 1 A 66 66 LYS N N 66 119.343 119.083 0.260 1
1 930 . 13 1 1 A 67 67 ALA H H 67 8.480 8.548 -0.068 1
1 931 . 13 1 1 A 67 67 ALA HA H 67 3.853 4.061 -0.208 1
1 935 . 13 1 1 A 67 67 ALA C C 67 178.591 179.574 -0.983 1
1 936 . 13 1 1 A 67 67 ALA CA C 67 55.403 55.093 0.310 1
1 937 . 13 1 1 A 67 67 ALA CB C 67 17.793 18.403 -0.610 1
1 938 . 13 1 1 A 67 67 ALA N N 67 121.562 122.379 -0.817 1
1 939 . 13 1 1 A 68 68 LYS H H 68 8.186 7.652 0.534 1
1 940 . 13 1 1 A 68 68 LYS HA H 68 3.805 4.057 -0.252 1
1 949 . 13 1 1 A 68 68 LYS C C 68 179.095 178.857 0.238 1
1 950 . 13 1 1 A 68 68 LYS CA C 68 59.952 59.263 0.689 1
1 951 . 13 1 1 A 68 68 LYS CB C 68 32.181 32.068 0.113 1
1 955 . 13 1 1 A 68 68 LYS N N 68 116.165 116.430 -0.265 1
1 956 . 13 1 1 A 69 69 GLU H H 69 7.904 8.155 -0.251 1
1 957 . 13 1 1 A 69 69 GLU HA H 69 3.995 4.056 -0.061 1
1 962 . 13 1 1 A 69 69 GLU C C 69 179.079 179.247 -0.168 1
1 963 . 13 1 1 A 69 69 GLU CA C 69 59.022 58.952 0.070 1
1 964 . 13 1 1 A 69 69 GLU CB C 69 29.274 29.694 -0.420 1
1 966 . 13 1 1 A 69 69 GLU N N 69 119.489 119.536 -0.047 1
1 967 . 13 1 1 A 70 70 LEU H H 70 7.962 7.886 0.076 1
1 968 . 13 1 1 A 70 70 LEU HA H 70 4.020 3.962 0.058 1
1 978 . 13 1 1 A 70 70 LEU C C 70 178.738 178.724 0.014 1
1 979 . 13 1 1 A 70 70 LEU CA C 70 57.486 57.910 -0.424 1
1 980 . 13 1 1 A 70 70 LEU CB C 70 41.695 41.805 -0.110 1
1 984 . 13 1 1 A 70 70 LEU N N 70 119.431 120.609 -1.178 1
1 985 . 13 1 1 A 71 71 ALA H H 71 8.260 8.073 0.187 1
1 986 . 13 1 1 A 71 71 ALA HA H 71 3.845 4.112 -0.267 1
1 990 . 13 1 1 A 71 71 ALA C C 71 179.518 180.326 -0.808 1
1 991 . 13 1 1 A 71 71 ALA CA C 71 55.139 55.408 -0.269 1
1 992 . 13 1 1 A 71 71 ALA CB C 71 18.487 18.891 -0.404 1
1 993 . 13 1 1 A 71 71 ALA N N 71 119.604 120.559 -0.955 1
1 994 . 13 1 1 A 72 72 GLN H H 72 7.910 8.075 -0.165 1
1 995 . 13 1 1 A 72 72 GLN HA H 72 4.154 4.026 0.128 1
1 1002 . 13 1 1 A 72 72 GLN C C 72 178.900 178.781 0.119 1
1 1003 . 13 1 1 A 72 72 GLN CA C 72 58.194 58.930 -0.736 1
1 1004 . 13 1 1 A 72 72 GLN CB C 72 28.056 28.298 -0.242 1
1 1006 . 13 1 1 A 72 72 GLN N N 72 115.960 117.596 -1.636 1
1 1008 . 13 1 1 A 73 73 LYS H H 73 7.841 7.745 0.096 1
1 1009 . 13 1 1 A 73 73 LYS HA H 73 4.171 4.097 0.074 1
1 1018 . 13 1 1 A 73 73 LYS C C 73 177.730 178.253 -0.523 1
1 1019 . 13 1 1 A 73 73 LYS CA C 73 57.867 58.555 -0.688 1
1 1020 . 13 1 1 A 73 73 LYS CB C 73 32.277 32.219 0.058 1
1 1024 . 13 1 1 A 73 73 LYS N N 73 119.027 119.348 -0.321 1
1 1025 . 13 1 1 A 74 74 MET H H 74 7.746 7.579 0.167 1
1 1026 . 13 1 1 A 74 74 MET HA H 74 4.403 4.579 -0.176 1
1 1034 . 13 1 1 A 74 74 MET C C 74 174.416 174.783 -0.367 1
1 1035 . 13 1 1 A 74 74 MET CA C 74 55.194 55.500 -0.306 1
1 1036 . 13 1 1 A 74 74 MET CB C 74 33.366 33.257 0.109 1
1 1039 . 13 1 1 A 74 74 MET N N 74 115.786 115.455 0.331 1
1 1040 . 13 1 1 A 75 75 GLU H H 75 8.076 7.820 0.256 1
1 1041 . 13 1 1 A 75 75 GLU HA H 75 4.001 3.967 0.034 1
1 1046 . 13 1 1 A 75 75 GLU C C 75 175.130 175.626 -0.496 1
1 1047 . 13 1 1 A 75 75 GLU CA C 75 56.722 57.566 -0.844 1
1 1048 . 13 1 1 A 75 75 GLU CB C 75 27.118 27.214 -0.096 1
1 1050 . 13 1 1 A 75 75 GLU N N 75 116.249 115.653 0.596 1
1 1051 . 13 1 1 A 76 76 ILE H H 76 7.560 8.029 -0.469 1
1 1052 . 13 1 1 A 76 76 ILE HA H 76 4.428 4.185 0.243 1
1 1062 . 13 1 1 A 76 76 ILE C C 76 174.529 175.068 -0.539 1
1 1063 . 13 1 1 A 76 76 ILE CA C 76 58.475 60.623 -2.148 1
1 1064 . 13 1 1 A 76 76 ILE CB C 76 40.337 38.165 2.172 1
1 1068 . 13 1 1 A 76 76 ILE N N 76 115.960 120.130 -4.170 1
1 1069 . 13 1 1 A 77 77 ASP H H 77 8.889 8.863 0.026 1
1 1070 . 13 1 1 A 77 77 ASP HA H 77 4.569 4.875 -0.306 1
1 1073 . 13 1 1 A 77 77 ASP C C 77 174.123 175.637 -1.514 1
1 1074 . 13 1 1 A 77 77 ASP CA C 77 54.069 53.600 0.469 1
1 1075 . 13 1 1 A 77 77 ASP CB C 77 40.233 40.665 -0.432 1
1 1076 . 13 1 1 A 77 77 ASP N N 77 126.142 129.054 -2.912 1
1 1077 . 13 1 1 A 78 78 VAL H H 78 7.754 8.473 -0.719 1
1 1078 . 13 1 1 A 78 78 VAL HA H 78 5.192 5.260 -0.068 1
1 1086 . 13 1 1 A 78 78 VAL C C 78 174.968 174.136 0.832 1
1 1087 . 13 1 1 A 78 78 VAL CA C 78 58.804 58.946 -0.142 1
1 1088 . 13 1 1 A 78 78 VAL CB C 78 35.293 34.883 0.410 1
1 1091 . 13 1 1 A 78 78 VAL N N 78 122.844 122.043 0.801 1
1 1092 . 13 1 1 A 79 79 ARG H H 79 8.499 9.014 -0.515 1
1 1093 . 13 1 1 A 79 79 ARG HA H 79 4.712 4.714 -0.002 1
1 1100 . 13 1 1 A 79 79 ARG C C 79 174.221 175.066 -0.845 1
1 1101 . 13 1 1 A 79 79 ARG CA C 79 54.117 54.956 -0.839 1
1 1102 . 13 1 1 A 79 79 ARG CB C 79 31.196 30.505 0.691 1
1 1105 . 13 1 1 A 79 79 ARG N N 79 125.637 122.032 3.605 1
1 1106 . 13 1 1 A 80 80 THR H H 80 8.416 8.909 -0.493 1
1 1107 . 13 1 1 A 80 80 THR HA H 80 5.332 4.828 0.504 1
1 1112 . 13 1 1 A 80 80 THR C C 80 174.497 174.119 0.378 1
1 1113 . 13 1 1 A 80 80 THR CA C 80 59.694 62.422 -2.728 1
1 1114 . 13 1 1 A 80 80 THR CB C 80 69.772 68.925 0.847 1
1 1116 . 13 1 1 A 80 80 THR N N 80 118.084 121.443 -3.359 1
1 1117 . 13 1 1 A 81 81 ARG H H 81 8.758 9.045 -0.287 1
1 1118 . 13 1 1 A 81 81 ARG HA H 81 4.362 4.716 -0.354 1
1 1126 . 13 1 1 A 81 81 ARG C C 81 173.733 174.027 -0.294 1
1 1127 . 13 1 1 A 81 81 ARG CA C 81 53.273 53.751 -0.478 1
1 1128 . 13 1 1 A 81 81 ARG CB C 81 33.915 33.052 0.863 1
1 1131 . 13 1 1 A 81 81 ARG N N 81 122.844 125.970 -3.126 1
1 1133 . 13 1 1 A 82 82 LYS H H 82 8.721 8.371 0.350 1
1 1134 . 13 1 1 A 82 82 LYS HA H 82 4.701 4.924 -0.223 1
1 1143 . 13 1 1 A 82 82 LYS C C 82 175.667 175.891 -0.224 1
1 1144 . 13 1 1 A 82 82 LYS CA C 82 54.960 55.706 -0.746 1
1 1145 . 13 1 1 A 82 82 LYS CB C 82 32.603 33.560 -0.957 1
1 1149 . 13 1 1 A 82 82 LYS N N 82 124.668 123.380 1.288 1
1 1150 . 13 1 1 A 83 83 VAL H H 83 9.112 9.024 0.088 1
1 1151 . 13 1 1 A 83 83 VAL HA H 83 4.796 4.850 -0.054 1
1 1159 . 13 1 1 A 83 83 VAL C C 83 174.594 175.625 -1.031 1
1 1160 . 13 1 1 A 83 83 VAL CA C 83 59.413 59.990 -0.577 1
1 1161 . 13 1 1 A 83 83 VAL CB C 83 35.298 34.217 1.081 1
1 1164 . 13 1 1 A 83 83 VAL N N 83 122.381 123.085 -0.704 1
1 1165 . 13 1 1 A 84 84 THR H H 84 9.200 8.842 0.358 1
1 1166 . 13 1 1 A 84 84 THR HA H 84 4.579 4.499 0.080 1
1 1171 . 13 1 1 A 84 84 THR C C 84 173.993 174.690 -0.697 1
1 1172 . 13 1 1 A 84 84 THR CA C 84 60.960 62.328 -1.368 1
1 1173 . 13 1 1 A 84 84 THR CB C 84 70.100 69.804 0.296 1
1 1175 . 13 1 1 A 84 84 THR N N 84 113.183 114.964 -1.781 1
1 1176 . 13 1 1 A 85 85 SER H H 85 7.688 8.193 -0.505 1
1 1177 . 13 1 1 A 85 85 SER HA H 85 5.136 4.710 0.426 1
1 1180 . 13 1 1 A 85 85 SER CA C 85 55.205 56.684 -1.479 1
1 1181 . 13 1 1 A 85 85 SER CB C 85 64.376 63.660 0.716 1
1 1182 . 13 1 1 A 85 85 SER N N 85 115.555 116.401 -0.846 1
1 1183 . 13 1 1 A 86 86 PRO HA H 86 4.090 4.222 -0.132 1
1 1190 . 13 1 1 A 86 86 PRO C C 86 177.227 177.432 -0.205 1
1 1191 . 13 1 1 A 86 86 PRO CA C 86 65.038 65.632 -0.594 1
1 1192 . 13 1 1 A 86 86 PRO CB C 86 31.711 31.706 0.005 1
1 1195 . 13 1 1 A 87 87 ASP H H 87 8.131 8.499 -0.368 1
1 1196 . 13 1 1 A 87 87 ASP HA H 87 4.223 4.382 -0.159 1
1 1199 . 13 1 1 A 87 87 ASP C C 87 178.721 178.513 0.208 1
1 1200 . 13 1 1 A 87 87 ASP CA C 87 57.311 57.071 0.240 1
1 1201 . 13 1 1 A 87 87 ASP CB C 87 40.102 41.806 -1.704 1
1 1202 . 13 1 1 A 87 87 ASP N N 87 115.381 117.516 -2.135 1
1 1203 . 13 1 1 A 88 88 GLU H H 88 7.571 7.947 -0.376 1
1 1204 . 13 1 1 A 88 88 GLU HA H 88 3.659 4.161 -0.502 1
1 1209 . 13 1 1 A 88 88 GLU C C 88 177.097 178.859 -1.762 1
1 1210 . 13 1 1 A 88 88 GLU CA C 88 58.729 59.002 -0.273 1
1 1211 . 13 1 1 A 88 88 GLU CB C 88 30.052 29.712 0.340 1
1 1213 . 13 1 1 A 88 88 GLU N N 88 120.009 119.124 0.885 1
1 1214 . 13 1 1 A 89 89 ALA H H 89 7.423 7.711 -0.288 1
1 1215 . 13 1 1 A 89 89 ALA HA H 89 3.900 4.196 -0.296 1
1 1219 . 13 1 1 A 89 89 ALA C C 89 178.267 180.003 -1.736 1
1 1220 . 13 1 1 A 89 89 ALA CA C 89 55.607 54.957 0.650 1
1 1221 . 13 1 1 A 89 89 ALA CB C 89 17.348 18.551 -1.203 1
1 1222 . 13 1 1 A 89 89 ALA N N 89 118.873 122.387 -3.514 1
1 1223 . 13 1 1 A 90 90 LYS H H 90 8.046 7.987 0.059 1
1 1224 . 13 1 1 A 90 90 LYS HA H 90 3.669 3.957 -0.288 1
1 1233 . 13 1 1 A 90 90 LYS C C 90 177.649 178.838 -1.189 1
1 1234 . 13 1 1 A 90 90 LYS CA C 90 60.351 59.508 0.843 1
1 1235 . 13 1 1 A 90 90 LYS CB C 90 32.087 32.304 -0.217 1
1 1239 . 13 1 1 A 90 90 LYS N N 90 114.834 117.253 -2.419 1
1 1240 . 13 1 1 A 91 91 ARG H H 91 7.468 8.084 -0.616 1
1 1241 . 13 1 1 A 91 91 ARG HA H 91 3.887 3.885 0.002 1
1 1249 . 13 1 1 A 91 91 ARG C C 91 178.998 179.081 -0.083 1
1 1250 . 13 1 1 A 91 91 ARG CA C 91 59.164 59.205 -0.041 1
1 1251 . 13 1 1 A 91 91 ARG CB C 91 29.274 29.983 -0.709 1
1 1254 . 13 1 1 A 91 91 ARG N N 91 119.029 119.451 -0.422 1
1 1256 . 13 1 1 A 92 92 TRP H H 92 8.136 8.294 -0.158 1
1 1257 . 13 1 1 A 92 92 TRP HA H 92 4.818 4.493 0.325 1
1 1266 . 13 1 1 A 92 92 TRP C C 92 179.566 179.179 0.387 1
1 1267 . 13 1 1 A 92 92 TRP CA C 92 58.663 59.508 -0.845 1
1 1268 . 13 1 1 A 92 92 TRP CB C 92 29.790 29.371 0.419 1
1 1274 . 13 1 1 A 92 92 TRP N N 92 118.100 120.036 -1.936 1
1 1276 . 13 1 1 A 93 93 ILE H H 93 8.363 8.139 0.224 1
1 1277 . 13 1 1 A 93 93 ILE HA H 93 3.544 3.766 -0.222 1
1 1287 . 13 1 1 A 93 93 ILE C C 93 176.820 178.104 -1.284 1
1 1288 . 13 1 1 A 93 93 ILE CA C 93 66.225 65.500 0.725 1
1 1289 . 13 1 1 A 93 93 ILE CB C 93 37.571 37.563 0.008 1
1 1293 . 13 1 1 A 93 93 ILE N N 93 120.588 120.416 0.172 1
1 1294 . 13 1 1 A 94 94 LYS H H 94 8.264 7.695 0.569 1
1 1295 . 13 1 1 A 94 94 LYS HA H 94 3.865 4.021 -0.156 1
1 1304 . 13 1 1 A 94 94 LYS C C 94 179.258 178.849 0.409 1
1 1305 . 13 1 1 A 94 94 LYS CA C 94 59.889 59.812 0.077 1
1 1306 . 13 1 1 A 94 94 LYS CB C 94 32.225 32.033 0.192 1
1 1310 . 13 1 1 A 94 94 LYS N N 94 121.687 121.142 0.545 1
1 1311 . 13 1 1 A 95 95 GLU H H 95 8.360 8.143 0.217 1
1 1312 . 13 1 1 A 95 95 GLU HA H 95 4.023 4.005 0.018 1
1 1317 . 13 1 1 A 95 95 GLU C C 95 178.884 179.144 -0.260 1
1 1318 . 13 1 1 A 95 95 GLU CA C 95 59.366 59.386 -0.020 1
1 1319 . 13 1 1 A 95 95 GLU CB C 95 29.508 29.580 -0.072 1
1 1321 . 13 1 1 A 95 95 GLU N N 95 118.505 117.592 0.913 1
1 1322 . 13 1 1 A 96 96 PHE H H 96 8.212 8.501 -0.289 1
1 1323 . 13 1 1 A 96 96 PHE HA H 96 4.512 4.269 0.243 1
1 1331 . 13 1 1 A 96 96 PHE C C 96 176.820 178.158 -1.338 1
1 1332 . 13 1 1 A 96 96 PHE CA C 96 59.608 61.429 -1.821 1
1 1333 . 13 1 1 A 96 96 PHE CB C 96 40.431 39.210 1.221 1
1 1339 . 13 1 1 A 96 96 PHE N N 96 120.369 122.333 -1.964 1
1 1340 . 13 1 1 A 97 97 SER H H 97 8.216 8.227 -0.011 1
1 1341 . 13 1 1 A 97 97 SER HA H 97 3.816 4.120 -0.304 1
1 1344 . 13 1 1 A 97 97 SER C C 97 175.618 177.146 -1.528 1
1 1345 . 13 1 1 A 97 97 SER CA C 97 60.492 60.941 -0.449 1
1 1346 . 13 1 1 A 97 97 SER CB C 97 63.022 62.666 0.356 1
1 1347 . 13 1 1 A 97 97 SER N N 97 111.969 113.737 -1.768 1
1 1348 . 13 1 1 A 98 98 GLU H H 98 7.655 7.290 0.365 1
1 1349 . 13 1 1 A 98 98 GLU HA H 98 4.187 4.170 0.017 1
1 1354 . 13 1 1 A 98 98 GLU C C 98 177.698 178.820 -1.122 1
1 1355 . 13 1 1 A 98 98 GLU CA C 98 57.069 58.973 -1.904 1
1 1356 . 13 1 1 A 98 98 GLU CB C 98 29.321 29.722 -0.401 1
1 1358 . 13 1 1 A 98 98 GLU N N 98 120.588 122.895 -2.307 1
1 1359 . 13 1 1 A 99 99 GLU H H 99 7.794 8.033 -0.239 1
1 1360 . 13 1 1 A 99 99 GLU HA H 99 4.123 3.909 0.214 1
1 1365 . 13 1 1 A 99 99 GLU C C 99 177.665 177.532 0.133 1
1 1366 . 13 1 1 A 99 99 GLU CA C 99 57.304 59.007 -1.703 1
1 1367 . 13 1 1 A 99 99 GLU CB C 99 29.368 29.546 -0.178 1
1 1369 . 13 1 1 A 99 99 GLU N N 99 120.067 119.609 0.458 1
1 1370 . 13 1 1 A 100 100 GLY H H 100 8.138 7.845 0.293 1
1 1371 . 13 1 1 A 100 100 GLY HA2 H 100 3.865 3.636 0.229 1
1 1372 . 13 1 1 A 100 100 GLY HA3 H 100 3.715 3.778 -0.063 1
1 1373 . 13 1 1 A 100 100 GLY C C 100 174.464 174.297 0.167 1
1 1374 . 13 1 1 A 100 100 GLY CA C 100 45.305 47.022 -1.717 1
1 1375 . 13 1 1 A 100 100 GLY N N 100 107.802 107.111 0.691 1
1 1376 . 13 1 1 A 101 101 GLY H H 101 8.023 8.405 -0.382 1
1 1377 . 13 1 1 A 101 101 GLY HA2 H 101 3.865 3.992 -0.127 1
1 1378 . 13 1 1 A 101 101 GLY HA3 H 101 3.892 4.011 -0.119 1
1 1379 . 13 1 1 A 101 101 GLY C C 101 174.204 173.622 0.582 1
1 1380 . 13 1 1 A 101 101 GLY CA C 101 45.036 44.896 0.140 1
1 1381 . 13 1 1 A 101 101 GLY N N 101 108.032 113.722 -5.690 1
1 1382 . 13 1 1 A 102 102 SER H H 102 8.059 8.723 -0.664 1
1 1383 . 13 1 1 A 102 102 SER HA H 102 4.380 4.809 -0.429 1
1 1386 . 13 1 1 A 102 102 SER C C 102 174.627 174.499 0.128 1
1 1387 . 13 1 1 A 102 102 SER CA C 102 58.194 57.437 0.757 1
1 1388 . 13 1 1 A 102 102 SER CB C 102 63.538 62.861 0.677 1
1 1389 . 13 1 1 A 102 102 SER N N 102 115.266 117.077 -1.811 1
1 1390 . 13 1 1 A 103 103 LEU H H 103 8.287 8.306 -0.019 1
1 1391 . 13 1 1 A 103 103 LEU HA H 103 4.301 3.901 0.400 1
1 1401 . 13 1 1 A 103 103 LEU C C 103 177.292 177.040 0.252 1
1 1402 . 13 1 1 A 103 103 LEU CA C 103 55.007 57.924 -2.917 1
1 1403 . 13 1 1 A 103 103 LEU CB C 103 42.023 41.617 0.406 1
1 1407 . 13 1 1 A 103 103 LEU N N 103 123.596 128.133 -4.537 1
1 1408 . 13 1 1 A 104 104 GLU H H 104 8.216 7.824 0.392 1
1 1409 . 13 1 1 A 104 104 GLU HA H 104 4.126 4.541 -0.415 1
1 1414 . 13 1 1 A 104 104 GLU CA C 104 56.518 55.181 1.337 1
1 1415 . 13 1 1 A 104 104 GLU CB C 104 29.837 31.108 -1.271 1
1 1417 . 13 1 1 A 104 104 GLU N N 104 120.510 116.872 3.638 1
1 1418 . 13 1 1 A 105 105 HIS HA H 105 4.593 5.055 -0.462 1
1 1421 . 13 1 1 A 105 105 HIS C C 105 173.766 174.791 -1.025 1
1 1422 . 13 1 1 A 105 105 HIS CA C 105 55.536 55.138 0.398 1
1 1423 . 13 1 1 A 105 105 HIS CB C 105 30.001 30.326 -0.325 1
1 1424 . 13 1 1 A 106 106 HIS H H 106 8.154 9.072 -0.918 1
1 1425 . 13 1 1 A 106 106 HIS HA H 106 4.407 4.711 -0.304 1
1 1428 . 13 1 1 A 106 106 HIS CA C 106 56.920 55.650 1.270 1
1 1429 . 13 1 1 A 106 106 HIS CB C 106 30.001 28.829 1.172 1
1 14 . 14 1 1 A 2 2 LEU H H 2 8.509 8.620 -0.111 1
1 15 . 14 1 1 A 2 2 LEU HA H 2 4.463 4.455 0.008 1
1 25 . 14 1 1 A 2 2 LEU C C 2 173.944 176.059 -2.115 1
1 26 . 14 1 1 A 2 2 LEU CA C 2 54.471 54.823 -0.352 1
1 27 . 14 1 1 A 2 2 LEU CB C 2 43.595 42.329 1.266 1
1 31 . 14 1 1 A 2 2 LEU N N 2 127.160 125.366 1.794 1
1 32 . 14 1 1 A 3 3 LEU H H 3 7.844 8.315 -0.471 1
1 33 . 14 1 1 A 3 3 LEU HA H 3 5.128 5.334 -0.206 1
1 43 . 14 1 1 A 3 3 LEU C C 3 175.423 175.018 0.405 1
1 44 . 14 1 1 A 3 3 LEU CA C 3 53.566 53.451 0.115 1
1 45 . 14 1 1 A 3 3 LEU CB C 3 44.039 45.085 -1.046 1
1 49 . 14 1 1 A 3 3 LEU N N 3 122.555 124.358 -1.803 1
1 50 . 14 1 1 A 4 4 TYR H H 4 8.360 8.908 -0.548 1
1 51 . 14 1 1 A 4 4 TYR HA H 4 5.143 5.144 -0.001 1
1 58 . 14 1 1 A 4 4 TYR C C 4 174.481 174.803 -0.322 1
1 59 . 14 1 1 A 4 4 TYR CA C 4 56.577 56.109 0.468 1
1 60 . 14 1 1 A 4 4 TYR CB C 4 43.840 42.982 0.858 1
1 65 . 14 1 1 A 4 4 TYR N N 4 119.315 122.528 -3.213 1
1 66 . 14 1 1 A 5 5 VAL H H 5 8.918 8.656 0.262 1
1 67 . 14 1 1 A 5 5 VAL HA H 5 5.106 4.845 0.261 1
1 75 . 14 1 1 A 5 5 VAL C C 5 174.042 174.628 -0.586 1
1 76 . 14 1 1 A 5 5 VAL CA C 5 59.852 60.747 -0.895 1
1 77 . 14 1 1 A 5 5 VAL CB C 5 33.816 34.365 -0.549 1
1 80 . 14 1 1 A 5 5 VAL N N 5 119.952 120.561 -0.609 1
1 81 . 14 1 1 A 6 6 LEU H H 6 9.315 9.591 -0.276 1
1 82 . 14 1 1 A 6 6 LEU HA H 6 5.466 5.374 0.092 1
1 92 . 14 1 1 A 6 6 LEU C C 6 175.049 174.896 0.153 1
1 93 . 14 1 1 A 6 6 LEU CA C 6 52.090 53.039 -0.949 1
1 94 . 14 1 1 A 6 6 LEU CB C 6 44.103 43.735 0.368 1
1 98 . 14 1 1 A 6 6 LEU N N 6 126.917 126.095 0.822 1
1 99 . 14 1 1 A 7 7 ILE H H 7 8.458 9.059 -0.601 1
1 100 . 14 1 1 A 7 7 ILE HA H 7 5.131 5.103 0.028 1
1 110 . 14 1 1 A 7 7 ILE C C 7 173.213 173.672 -0.459 1
1 111 . 14 1 1 A 7 7 ILE CA C 7 58.463 60.012 -1.549 1
1 112 . 14 1 1 A 7 7 ILE CB C 7 41.020 40.983 0.037 1
1 116 . 14 1 1 A 7 7 ILE N N 7 119.778 126.373 -6.595 1
1 117 . 14 1 1 A 8 8 ILE H H 8 8.797 9.509 -0.712 1
1 118 . 14 1 1 A 8 8 ILE HA H 8 4.611 4.858 -0.247 1
1 128 . 14 1 1 A 8 8 ILE C C 8 174.611 174.834 -0.223 1
1 129 . 14 1 1 A 8 8 ILE CA C 8 60.227 60.336 -0.109 1
1 130 . 14 1 1 A 8 8 ILE CB C 8 37.665 38.259 -0.594 1
1 134 . 14 1 1 A 8 8 ILE N N 8 128.919 131.759 -2.840 1
1 135 . 14 1 1 A 9 9 SER H H 9 7.811 8.829 -1.018 1
1 136 . 14 1 1 A 9 9 SER HA H 9 4.429 5.030 -0.601 1
1 140 . 14 1 1 A 9 9 SER C C 9 172.937 172.936 0.001 1
1 141 . 14 1 1 A 9 9 SER CA C 9 58.241 57.026 1.215 1
1 142 . 14 1 1 A 9 9 SER CB C 9 64.261 64.564 -0.303 1
1 143 . 14 1 1 A 9 9 SER N N 9 116.365 121.936 -5.571 1
1 144 . 14 1 1 A 10 10 ASN H H 10 8.641 8.633 0.008 1
1 145 . 14 1 1 A 10 10 ASN HA H 10 4.938 4.895 0.043 1
1 150 . 14 1 1 A 10 10 ASN C C 10 174.497 174.885 -0.388 1
1 151 . 14 1 1 A 10 10 ASN CA C 10 52.221 54.177 -1.956 1
1 152 . 14 1 1 A 10 10 ASN CB C 10 39.128 40.194 -1.066 1
1 153 . 14 1 1 A 10 10 ASN N N 10 122.612 121.260 1.352 1
1 155 . 14 1 1 A 11 11 ASP H H 11 8.673 7.434 1.239 1
1 156 . 14 1 1 A 11 11 ASP HA H 11 4.596 4.638 -0.042 1
1 159 . 14 1 1 A 11 11 ASP C C 11 175.342 176.856 -1.514 1
1 160 . 14 1 1 A 11 11 ASP CA C 11 53.233 53.781 -0.548 1
1 161 . 14 1 1 A 11 11 ASP CB C 11 40.965 42.047 -1.082 1
1 162 . 14 1 1 A 11 11 ASP N N 11 122.717 119.655 3.062 1
1 163 . 14 1 1 A 12 12 LYS H H 12 8.562 8.788 -0.226 1
1 164 . 14 1 1 A 12 12 LYS HA H 12 3.854 3.965 -0.111 1
1 173 . 14 1 1 A 12 12 LYS C C 12 178.754 178.179 0.575 1
1 174 . 14 1 1 A 12 12 LYS CA C 12 59.581 60.121 -0.540 1
1 175 . 14 1 1 A 12 12 LYS CB C 12 32.378 32.522 -0.144 1
1 179 . 14 1 1 A 12 12 LYS N N 12 125.737 126.674 -0.937 1
1 180 . 14 1 1 A 13 13 LYS H H 13 8.075 7.730 0.345 1
1 181 . 14 1 1 A 13 13 LYS HA H 13 4.154 4.055 0.099 1
1 190 . 14 1 1 A 13 13 LYS C C 13 178.315 179.150 -0.835 1
1 191 . 14 1 1 A 13 13 LYS CA C 13 58.532 58.983 -0.451 1
1 192 . 14 1 1 A 13 13 LYS CB C 13 31.452 32.568 -1.116 1
1 196 . 14 1 1 A 13 13 LYS N N 13 119.604 120.053 -0.449 1
1 197 . 14 1 1 A 14 14 LEU H H 14 7.552 7.983 -0.431 1
1 198 . 14 1 1 A 14 14 LEU HA H 14 3.682 4.065 -0.383 1
1 208 . 14 1 1 A 14 14 LEU C C 14 178.429 178.272 0.157 1
1 209 . 14 1 1 A 14 14 LEU CA C 14 58.999 58.187 0.812 1
1 210 . 14 1 1 A 14 14 LEU CB C 14 41.228 41.299 -0.071 1
1 214 . 14 1 1 A 14 14 LEU N N 14 122.266 121.190 1.076 1
1 215 . 14 1 1 A 15 15 ILE H H 15 8.074 7.896 0.178 1
1 216 . 14 1 1 A 15 15 ILE HA H 15 3.264 3.471 -0.207 1
1 226 . 14 1 1 A 15 15 ILE C C 15 177.000 178.028 -1.028 1
1 227 . 14 1 1 A 15 15 ILE CA C 15 65.939 65.590 0.349 1
1 228 . 14 1 1 A 15 15 ILE CB C 15 37.983 37.895 0.088 1
1 232 . 14 1 1 A 15 15 ILE N N 15 118.214 119.553 -1.339 1
1 233 . 14 1 1 A 16 16 GLU H H 16 8.016 8.585 -0.569 1
1 234 . 14 1 1 A 16 16 GLU HA H 16 4.045 3.964 0.081 1
1 239 . 14 1 1 A 16 16 GLU C C 16 179.388 179.568 -0.180 1
1 240 . 14 1 1 A 16 16 GLU CA C 16 59.032 59.904 -0.872 1
1 241 . 14 1 1 A 16 16 GLU CB C 16 29.200 29.346 -0.146 1
1 243 . 14 1 1 A 16 16 GLU N N 16 118.484 118.939 -0.455 1
1 244 . 14 1 1 A 17 17 GLU H H 17 8.063 8.258 -0.195 1
1 245 . 14 1 1 A 17 17 GLU HA H 17 4.053 4.033 0.020 1
1 250 . 14 1 1 A 17 17 GLU C C 17 179.306 179.055 0.251 1
1 251 . 14 1 1 A 17 17 GLU CA C 17 58.636 59.278 -0.642 1
1 252 . 14 1 1 A 17 17 GLU CB C 17 29.011 29.430 -0.419 1
1 254 . 14 1 1 A 17 17 GLU N N 17 118.100 120.531 -2.431 1
1 255 . 14 1 1 A 18 18 ALA H H 18 8.655 8.254 0.401 1
1 256 . 14 1 1 A 18 18 ALA HA H 18 3.775 4.074 -0.299 1
1 260 . 14 1 1 A 18 18 ALA C C 18 178.559 180.280 -1.721 1
1 261 . 14 1 1 A 18 18 ALA CA C 18 54.960 55.410 -0.450 1
1 262 . 14 1 1 A 18 18 ALA CB C 18 17.960 18.186 -0.226 1
1 263 . 14 1 1 A 18 18 ALA N N 18 122.439 122.970 -0.531 1
1 264 . 14 1 1 A 19 19 ARG H H 19 8.900 8.285 0.615 1
1 265 . 14 1 1 A 19 19 ARG HA H 19 3.809 4.106 -0.297 1
1 273 . 14 1 1 A 19 19 ARG C C 19 178.721 179.037 -0.316 1
1 274 . 14 1 1 A 19 19 ARG CA C 19 59.976 59.815 0.161 1
1 275 . 14 1 1 A 19 19 ARG CB C 19 29.572 29.799 -0.227 1
1 278 . 14 1 1 A 19 19 ARG N N 19 118.563 117.793 0.770 1
1 280 . 14 1 1 A 20 20 LYS H H 20 7.792 8.238 -0.446 1
1 281 . 14 1 1 A 20 20 LYS HA H 20 4.052 4.019 0.033 1
1 290 . 14 1 1 A 20 20 LYS C C 20 179.648 179.847 -0.199 1
1 291 . 14 1 1 A 20 20 LYS CA C 20 59.296 58.804 0.492 1
1 292 . 14 1 1 A 20 20 LYS CB C 20 32.216 31.875 0.341 1
1 296 . 14 1 1 A 20 20 LYS N N 20 118.638 119.438 -0.800 1
1 297 . 14 1 1 A 21 21 MET H H 21 7.684 8.089 -0.405 1
1 298 . 14 1 1 A 21 21 MET HA H 21 4.411 4.121 0.290 1
1 306 . 14 1 1 A 21 21 MET C C 21 177.909 178.301 -0.392 1
1 307 . 14 1 1 A 21 21 MET CA C 21 57.009 59.070 -2.061 1
1 308 . 14 1 1 A 21 21 MET CB C 21 32.028 33.007 -0.979 1
1 311 . 14 1 1 A 21 21 MET N N 21 118.100 118.869 -0.769 1
1 312 . 14 1 1 A 22 22 ALA H H 22 8.815 8.432 0.383 1
1 313 . 14 1 1 A 22 22 ALA HA H 22 3.826 3.920 -0.094 1
1 317 . 14 1 1 A 22 22 ALA C C 22 178.835 179.968 -1.133 1
1 318 . 14 1 1 A 22 22 ALA CA C 22 55.427 55.581 -0.154 1
1 319 . 14 1 1 A 22 22 ALA CB C 22 18.059 18.468 -0.409 1
1 320 . 14 1 1 A 22 22 ALA N N 22 122.150 121.224 0.926 1
1 321 . 14 1 1 A 23 23 GLU H H 23 8.276 8.229 0.047 1
1 322 . 14 1 1 A 23 23 GLU HA H 23 4.146 3.963 0.183 1
1 327 . 14 1 1 A 23 23 GLU C C 23 180.151 179.489 0.662 1
1 328 . 14 1 1 A 23 23 GLU CA C 23 58.999 59.574 -0.575 1
1 329 . 14 1 1 A 23 23 GLU CB C 23 29.160 29.062 0.098 1
1 331 . 14 1 1 A 23 23 GLU N N 23 117.001 118.026 -1.025 1
1 332 . 14 1 1 A 24 24 LYS H H 24 7.573 7.923 -0.350 1
1 333 . 14 1 1 A 24 24 LYS HA H 24 4.101 4.103 -0.002 1
1 342 . 14 1 1 A 24 24 LYS C C 24 177.145 178.509 -1.364 1
1 343 . 14 1 1 A 24 24 LYS CA C 24 58.261 58.950 -0.689 1
1 344 . 14 1 1 A 24 24 LYS CB C 24 32.079 31.942 0.137 1
1 348 . 14 1 1 A 24 24 LYS N N 24 119.960 118.991 0.969 1
1 349 . 14 1 1 A 25 25 ALA H H 25 7.710 7.738 -0.028 1
1 350 . 14 1 1 A 25 25 ALA HA H 25 4.413 4.324 0.089 1
1 354 . 14 1 1 A 25 25 ALA C C 25 175.325 176.684 -1.359 1
1 355 . 14 1 1 A 25 25 ALA CA C 25 51.208 52.536 -1.328 1
1 356 . 14 1 1 A 25 25 ALA CB C 25 18.520 19.494 -0.974 1
1 357 . 14 1 1 A 25 25 ALA N N 25 119.257 119.022 0.235 1
1 358 . 14 1 1 A 26 26 ASN H H 26 7.840 7.915 -0.075 1
1 359 . 14 1 1 A 26 26 ASN HA H 26 4.357 4.314 0.043 1
1 364 . 14 1 1 A 26 26 ASN C C 26 173.587 173.894 -0.307 1
1 365 . 14 1 1 A 26 26 ASN CA C 26 54.307 54.557 -0.250 1
1 366 . 14 1 1 A 26 26 ASN CB C 26 36.972 36.880 0.092 1
1 367 . 14 1 1 A 26 26 ASN N N 26 115.266 114.115 1.151 1
1 369 . 14 1 1 A 27 27 LEU H H 27 8.241 7.496 0.745 1
1 370 . 14 1 1 A 27 27 LEU HA H 27 4.652 4.572 0.080 1
1 380 . 14 1 1 A 27 27 LEU C C 27 175.894 176.081 -0.187 1
1 381 . 14 1 1 A 27 27 LEU CA C 27 52.923 53.208 -0.285 1
1 382 . 14 1 1 A 27 27 LEU CB C 27 44.090 43.283 0.807 1
1 386 . 14 1 1 A 27 27 LEU N N 27 116.828 119.392 -2.564 1
1 387 . 14 1 1 A 28 28 GLU H H 28 7.798 8.380 -0.582 1
1 388 . 14 1 1 A 28 28 GLU HA H 28 4.310 4.545 -0.235 1
1 393 . 14 1 1 A 28 28 GLU C C 28 173.944 175.721 -1.777 1
1 394 . 14 1 1 A 28 28 GLU CA C 28 55.460 56.779 -1.319 1
1 395 . 14 1 1 A 28 28 GLU CB C 28 30.512 30.205 0.307 1
1 397 . 14 1 1 A 28 28 GLU N N 28 121.340 124.034 -2.694 1
1 398 . 14 1 1 A 29 29 LEU H H 29 8.451 8.889 -0.438 1
1 399 . 14 1 1 A 29 29 LEU HA H 29 5.662 5.288 0.374 1
1 409 . 14 1 1 A 29 29 LEU C C 29 176.902 174.815 2.087 1
1 410 . 14 1 1 A 29 29 LEU CA C 29 53.186 54.384 -1.198 1
1 411 . 14 1 1 A 29 29 LEU CB C 29 44.914 44.061 0.853 1
1 415 . 14 1 1 A 29 29 LEU N N 29 126.547 127.844 -1.297 1
1 416 . 14 1 1 A 30 30 ARG H H 30 9.094 9.251 -0.157 1
1 417 . 14 1 1 A 30 30 ARG HA H 30 4.910 4.690 0.220 1
1 425 . 14 1 1 A 30 30 ARG C C 30 175.147 175.594 -0.447 1
1 426 . 14 1 1 A 30 30 ARG CA C 30 53.417 54.505 -1.088 1
1 427 . 14 1 1 A 30 30 ARG CB C 30 32.555 32.999 -0.444 1
1 430 . 14 1 1 A 30 30 ARG N N 30 125.043 126.374 -1.331 1
1 432 . 14 1 1 A 31 31 THR H H 31 8.496 8.581 -0.085 1
1 433 . 14 1 1 A 31 31 THR HA H 31 4.888 4.870 0.018 1
1 438 . 14 1 1 A 31 31 THR C C 31 173.961 173.937 0.024 1
1 439 . 14 1 1 A 31 31 THR CA C 31 60.445 61.175 -0.730 1
1 440 . 14 1 1 A 31 31 THR CB C 31 69.492 69.791 -0.299 1
1 442 . 14 1 1 A 31 31 THR N N 31 114.745 115.905 -1.160 1
1 443 . 14 1 1 A 32 32 VAL H H 32 8.480 9.265 -0.785 1
1 444 . 14 1 1 A 32 32 VAL HA H 32 4.411 4.351 0.060 1
1 452 . 14 1 1 A 32 32 VAL C C 32 175.082 175.620 -0.538 1
1 453 . 14 1 1 A 32 32 VAL CA C 32 60.946 62.386 -1.440 1
1 454 . 14 1 1 A 32 32 VAL CB C 32 34.487 32.197 2.290 1
1 457 . 14 1 1 A 32 32 VAL N N 32 122.324 127.280 -4.956 1
1 458 . 14 1 1 A 33 33 LYS H H 33 9.304 8.957 0.347 1
1 459 . 14 1 1 A 33 33 LYS HA H 33 4.534 4.626 -0.092 1
1 468 . 14 1 1 A 33 33 LYS C C 33 176.740 176.292 0.448 1
1 469 . 14 1 1 A 33 33 LYS CA C 33 56.846 56.295 0.551 1
1 470 . 14 1 1 A 33 33 LYS CB C 33 34.355 34.189 0.166 1
1 474 . 14 1 1 A 33 33 LYS N N 33 123.654 126.159 -2.505 1
1 475 . 14 1 1 A 34 34 THR H H 34 7.245 7.643 -0.398 1
1 476 . 14 1 1 A 34 34 THR HA H 34 4.780 4.569 0.211 1
1 481 . 14 1 1 A 34 34 THR C C 34 174.529 175.869 -1.340 1
1 482 . 14 1 1 A 34 34 THR CA C 34 58.859 60.031 -1.172 1
1 483 . 14 1 1 A 34 34 THR CB C 34 73.023 72.773 0.250 1
1 485 . 14 1 1 A 34 34 THR N N 34 106.300 111.556 -5.256 1
1 486 . 14 1 1 A 35 35 GLU H H 35 9.174 8.759 0.415 1
1 487 . 14 1 1 A 35 35 GLU HA H 35 3.886 3.898 -0.012 1
1 492 . 14 1 1 A 35 35 GLU C C 35 177.714 177.352 0.362 1
1 493 . 14 1 1 A 35 35 GLU CA C 35 59.233 59.613 -0.380 1
1 494 . 14 1 1 A 35 35 GLU CB C 35 29.377 29.341 0.036 1
1 496 . 14 1 1 A 35 35 GLU N N 35 121.919 122.452 -0.533 1
1 497 . 14 1 1 A 36 36 ASP H H 36 8.185 8.295 -0.110 1
1 498 . 14 1 1 A 36 36 ASP HA H 36 4.289 4.252 0.037 1
1 501 . 14 1 1 A 36 36 ASP C C 36 178.348 178.375 -0.027 1
1 502 . 14 1 1 A 36 36 ASP CA C 36 56.962 57.634 -0.672 1
1 503 . 14 1 1 A 36 36 ASP CB C 36 40.214 41.407 -1.193 1
1 504 . 14 1 1 A 36 36 ASP N N 36 118.332 119.646 -1.314 1
1 505 . 14 1 1 A 37 37 GLU H H 37 7.741 7.856 -0.115 1
1 506 . 14 1 1 A 37 37 GLU HA H 37 3.708 3.645 0.063 1
1 511 . 14 1 1 A 37 37 GLU C C 37 177.324 178.677 -1.353 1
1 512 . 14 1 1 A 37 37 GLU CA C 37 58.698 58.899 -0.201 1
1 513 . 14 1 1 A 37 37 GLU CB C 37 30.199 29.357 0.842 1
1 515 . 14 1 1 A 37 37 GLU N N 37 120.704 118.790 1.914 1
1 516 . 14 1 1 A 38 38 LEU H H 38 7.531 7.822 -0.291 1
1 517 . 14 1 1 A 38 38 LEU HA H 38 3.873 4.006 -0.133 1
1 527 . 14 1 1 A 38 38 LEU C C 38 177.357 178.293 -0.936 1
1 528 . 14 1 1 A 38 38 LEU CA C 38 58.305 58.047 0.258 1
1 529 . 14 1 1 A 38 38 LEU CB C 38 40.837 41.683 -0.846 1
1 533 . 14 1 1 A 38 38 LEU N N 38 119.200 121.114 -1.914 1
1 534 . 14 1 1 A 39 39 LYS H H 39 8.083 8.141 -0.058 1
1 535 . 14 1 1 A 39 39 LYS HA H 39 3.608 3.870 -0.262 1
1 544 . 14 1 1 A 39 39 LYS C C 39 177.373 178.608 -1.235 1
1 545 . 14 1 1 A 39 39 LYS CA C 39 60.290 59.712 0.578 1
1 546 . 14 1 1 A 39 39 LYS CB C 39 32.178 32.468 -0.290 1
1 550 . 14 1 1 A 39 39 LYS N N 39 116.943 118.612 -1.669 1
1 551 . 14 1 1 A 40 40 LYS H H 40 7.632 8.009 -0.377 1
1 552 . 14 1 1 A 40 40 LYS HA H 40 3.864 3.910 -0.046 1
1 561 . 14 1 1 A 40 40 LYS C C 40 179.566 178.504 1.062 1
1 562 . 14 1 1 A 40 40 LYS CA C 40 58.993 58.960 0.033 1
1 563 . 14 1 1 A 40 40 LYS CB C 40 31.758 32.024 -0.266 1
1 567 . 14 1 1 A 40 40 LYS N N 40 118.274 119.017 -0.743 1
1 568 . 14 1 1 A 41 41 TYR H H 41 7.823 7.710 0.113 1
1 569 . 14 1 1 A 41 41 TYR HA H 41 3.926 3.952 -0.026 1
1 576 . 14 1 1 A 41 41 TYR C C 41 176.625 177.892 -1.267 1
1 577 . 14 1 1 A 41 41 TYR CA C 41 59.757 60.725 -0.968 1
1 578 . 14 1 1 A 41 41 TYR CB C 41 36.901 37.778 -0.877 1
1 583 . 14 1 1 A 41 41 TYR N N 41 117.811 119.144 -1.333 1
1 584 . 14 1 1 A 42 42 LEU H H 42 7.964 8.263 -0.299 1
1 585 . 14 1 1 A 42 42 LEU HA H 42 3.704 3.997 -0.293 1
1 595 . 14 1 1 A 42 42 LEU C C 42 178.396 179.362 -0.966 1
1 596 . 14 1 1 A 42 42 LEU CA C 42 58.237 57.946 0.291 1
1 597 . 14 1 1 A 42 42 LEU CB C 42 40.507 41.512 -1.005 1
1 601 . 14 1 1 A 42 42 LEU N N 42 115.960 120.076 -4.116 1
1 602 . 14 1 1 A 43 43 GLU H H 43 8.193 8.203 -0.010 1
1 603 . 14 1 1 A 43 43 GLU HA H 43 3.882 3.962 -0.080 1
1 608 . 14 1 1 A 43 43 GLU C C 43 179.193 179.464 -0.271 1
1 609 . 14 1 1 A 43 43 GLU CA C 43 59.122 59.623 -0.501 1
1 610 . 14 1 1 A 43 43 GLU CB C 43 29.244 29.081 0.163 1
1 612 . 14 1 1 A 43 43 GLU N N 43 117.175 117.708 -0.533 1
1 613 . 14 1 1 A 44 44 GLU H H 44 7.601 7.876 -0.275 1
1 614 . 14 1 1 A 44 44 GLU HA H 44 3.936 4.022 -0.086 1
1 619 . 14 1 1 A 44 44 GLU C C 44 179.875 178.925 0.950 1
1 620 . 14 1 1 A 44 44 GLU CA C 44 58.867 59.216 -0.349 1
1 621 . 14 1 1 A 44 44 GLU CB C 44 28.648 29.200 -0.552 1
1 623 . 14 1 1 A 44 44 GLU N N 44 120.472 119.368 1.104 1
1 624 . 14 1 1 A 45 45 PHE H H 45 8.260 7.882 0.378 1
1 625 . 14 1 1 A 45 45 PHE HA H 45 4.520 4.228 0.292 1
1 633 . 14 1 1 A 45 45 PHE C C 45 177.942 178.460 -0.518 1
1 634 . 14 1 1 A 45 45 PHE CA C 45 55.945 61.462 -5.517 1
1 635 . 14 1 1 A 45 45 PHE CB C 45 36.680 38.038 -1.358 1
1 641 . 14 1 1 A 45 45 PHE N N 45 119.272 118.930 0.342 1
1 642 . 14 1 1 A 46 46 ARG H H 46 8.023 8.055 -0.032 1
1 643 . 14 1 1 A 46 46 ARG HA H 46 4.074 4.210 -0.136 1
1 651 . 14 1 1 A 46 46 ARG C C 46 177.617 179.190 -1.573 1
1 652 . 14 1 1 A 46 46 ARG CA C 46 58.194 58.983 -0.789 1
1 653 . 14 1 1 A 46 46 ARG CB C 46 29.737 29.998 -0.261 1
1 656 . 14 1 1 A 46 46 ARG N N 46 118.136 120.887 -2.751 1
1 658 . 14 1 1 A 47 47 LYS H H 47 7.470 7.860 -0.390 1
1 659 . 14 1 1 A 47 47 LYS HA H 47 4.143 4.088 0.055 1
1 668 . 14 1 1 A 47 47 LYS C C 47 177.324 178.089 -0.765 1
1 669 . 14 1 1 A 47 47 LYS CA C 47 57.726 59.607 -1.881 1
1 670 . 14 1 1 A 47 47 LYS CB C 47 32.409 32.148 0.261 1
1 674 . 14 1 1 A 47 47 LYS N N 47 116.943 119.546 -2.603 1
1 675 . 14 1 1 A 48 48 GLU H H 48 7.615 7.966 -0.351 1
1 676 . 14 1 1 A 48 48 GLU HA H 48 4.428 4.672 -0.244 1
1 681 . 14 1 1 A 48 48 GLU C C 48 176.869 177.091 -0.222 1
1 682 . 14 1 1 A 48 48 GLU CA C 48 55.945 56.005 -0.060 1
1 683 . 14 1 1 A 48 48 GLU CB C 48 29.696 30.324 -0.628 1
1 685 . 14 1 1 A 48 48 GLU N N 48 118.852 116.339 2.513 1
1 686 . 14 1 1 A 49 49 SER H H 49 7.725 8.217 -0.492 1
1 687 . 14 1 1 A 49 49 SER HA H 49 4.244 4.348 -0.104 1
1 690 . 14 1 1 A 49 49 SER C C 49 174.838 175.931 -1.093 1
1 691 . 14 1 1 A 49 49 SER CA C 49 59.366 60.286 -0.920 1
1 692 . 14 1 1 A 49 49 SER CB C 49 63.116 62.592 0.524 1
1 693 . 14 1 1 A 49 49 SER N N 49 114.224 115.088 -0.864 1
1 694 . 14 1 1 A 50 50 GLN H H 50 8.548 7.982 0.566 1
1 695 . 14 1 1 A 50 50 GLN HA H 50 4.398 4.270 0.128 1
1 702 . 14 1 1 A 50 50 GLN C C 50 175.732 176.367 -0.635 1
1 703 . 14 1 1 A 50 50 GLN CA C 50 56.272 57.903 -1.631 1
1 704 . 14 1 1 A 50 50 GLN CB C 50 28.946 29.456 -0.510 1
1 706 . 14 1 1 A 50 50 GLN N N 50 120.125 119.720 0.405 1
1 708 . 14 1 1 A 51 51 ASN H H 51 8.534 8.309 0.225 1
1 709 . 14 1 1 A 51 51 ASN HA H 51 4.980 4.961 0.019 1
1 714 . 14 1 1 A 51 51 ASN C C 51 173.717 173.755 -0.038 1
1 715 . 14 1 1 A 51 51 ASN CA C 51 52.804 52.269 0.535 1
1 716 . 14 1 1 A 51 51 ASN CB C 51 39.583 39.525 0.058 1
1 717 . 14 1 1 A 51 51 ASN N N 51 118.158 116.816 1.342 1
1 719 . 14 1 1 A 52 52 ILE H H 52 7.492 8.490 -0.998 1
1 720 . 14 1 1 A 52 52 ILE HA H 52 5.338 5.577 -0.239 1
1 730 . 14 1 1 A 52 52 ILE C C 52 175.049 173.155 1.894 1
1 731 . 14 1 1 A 52 52 ILE CA C 52 59.364 59.078 0.286 1
1 732 . 14 1 1 A 52 52 ILE CB C 52 42.163 42.349 -0.186 1
1 736 . 14 1 1 A 52 52 ILE N N 52 117.927 123.928 -6.001 1
1 737 . 14 1 1 A 53 53 LYS H H 53 8.467 8.731 -0.264 1
1 738 . 14 1 1 A 53 53 LYS HA H 53 5.044 5.391 -0.347 1
1 747 . 14 1 1 A 53 53 LYS C C 53 175.082 175.362 -0.280 1
1 748 . 14 1 1 A 53 53 LYS CA C 53 55.429 54.840 0.589 1
1 749 . 14 1 1 A 53 53 LYS CB C 53 36.446 36.865 -0.419 1
1 753 . 14 1 1 A 53 53 LYS N N 53 123.249 127.482 -4.233 1
1 754 . 14 1 1 A 54 54 VAL H H 54 8.490 8.660 -0.170 1
1 755 . 14 1 1 A 54 54 VAL HA H 54 5.159 4.611 0.548 1
1 763 . 14 1 1 A 54 54 VAL C C 54 173.473 173.979 -0.506 1
1 764 . 14 1 1 A 54 54 VAL CA C 54 60.163 61.288 -1.125 1
1 765 . 14 1 1 A 54 54 VAL CB C 54 35.509 32.900 2.609 1
1 768 . 14 1 1 A 54 54 VAL N N 54 120.762 123.976 -3.214 1
1 769 . 14 1 1 A 55 55 LEU H H 55 8.636 8.731 -0.095 1
1 770 . 14 1 1 A 55 55 LEU HA H 55 4.670 4.695 -0.025 1
1 780 . 14 1 1 A 55 55 LEU C C 55 173.652 174.165 -0.513 1
1 781 . 14 1 1 A 55 55 LEU CA C 55 52.289 53.556 -1.267 1
1 782 . 14 1 1 A 55 55 LEU CB C 55 42.070 42.297 -0.227 1
1 786 . 14 1 1 A 55 55 LEU N N 55 131.898 129.474 2.424 1
1 787 . 14 1 1 A 56 56 ILE H H 56 9.188 9.017 0.171 1
1 788 . 14 1 1 A 56 56 ILE HA H 56 4.879 4.970 -0.091 1
1 798 . 14 1 1 A 56 56 ILE C C 56 174.172 174.506 -0.334 1
1 799 . 14 1 1 A 56 56 ILE CA C 56 59.976 60.445 -0.469 1
1 800 . 14 1 1 A 56 56 ILE CB C 56 38.181 38.637 -0.456 1
1 804 . 14 1 1 A 56 56 ILE N N 56 126.373 129.762 -3.389 1
1 805 . 14 1 1 A 57 57 LEU H H 57 8.929 9.347 -0.418 1
1 806 . 14 1 1 A 57 57 LEU HA H 57 5.394 5.113 0.281 1
1 816 . 14 1 1 A 57 57 LEU C C 57 175.358 176.291 -0.933 1
1 817 . 14 1 1 A 57 57 LEU CA C 57 52.086 53.288 -1.202 1
1 818 . 14 1 1 A 57 57 LEU CB C 57 42.445 42.307 0.138 1
1 822 . 14 1 1 A 57 57 LEU N N 57 126.547 128.723 -2.176 1
1 823 . 14 1 1 A 58 58 VAL H H 58 8.542 9.041 -0.499 1
1 824 . 14 1 1 A 58 58 VAL HA H 58 5.253 4.807 0.446 1
1 832 . 14 1 1 A 58 58 VAL C C 58 175.244 175.765 -0.521 1
1 833 . 14 1 1 A 58 58 VAL CA C 58 58.241 59.718 -1.477 1
1 834 . 14 1 1 A 58 58 VAL CB C 58 33.165 33.904 -0.739 1
1 837 . 14 1 1 A 58 58 VAL N N 58 114.398 123.014 -8.616 1
1 838 . 14 1 1 A 59 59 SER H H 59 8.797 8.599 0.198 1
1 839 . 14 1 1 A 59 59 SER HA H 59 5.063 4.617 0.446 1
1 842 . 14 1 1 A 59 59 SER C C 59 174.172 173.679 0.493 1
1 843 . 14 1 1 A 59 59 SER CA C 59 59.320 59.807 -0.487 1
1 844 . 14 1 1 A 59 59 SER CB C 59 65.600 64.301 1.299 1
1 845 . 14 1 1 A 59 59 SER N N 59 115.497 116.637 -1.140 1
1 846 . 14 1 1 A 60 60 ASN H H 60 7.730 7.734 -0.004 1
1 847 . 14 1 1 A 60 60 ASN HA H 60 4.811 5.171 -0.360 1
1 852 . 14 1 1 A 60 60 ASN C C 60 174.464 175.317 -0.853 1
1 853 . 14 1 1 A 60 60 ASN CA C 60 52.007 51.780 0.227 1
1 854 . 14 1 1 A 60 60 ASN CB C 60 40.336 42.084 -1.748 1
1 855 . 14 1 1 A 60 60 ASN N N 60 117.522 116.229 1.293 1
1 857 . 14 1 1 A 61 61 ASP H H 61 8.577 8.992 -0.415 1
1 858 . 14 1 1 A 61 61 ASP HA H 61 4.365 4.342 0.023 1
1 861 . 14 1 1 A 61 61 ASP C C 61 177.357 178.348 -0.991 1
1 862 . 14 1 1 A 61 61 ASP CA C 61 57.351 57.079 0.272 1
1 863 . 14 1 1 A 61 61 ASP CB C 61 40.383 39.667 0.716 1
1 864 . 14 1 1 A 61 61 ASP N N 61 119.431 121.116 -1.685 1
1 865 . 14 1 1 A 62 62 GLU H H 62 8.405 8.482 -0.077 1
1 866 . 14 1 1 A 62 62 GLU HA H 62 4.121 4.004 0.117 1
1 871 . 14 1 1 A 62 62 GLU C C 62 179.615 178.926 0.689 1
1 872 . 14 1 1 A 62 62 GLU CA C 62 59.593 59.761 -0.168 1
1 873 . 14 1 1 A 62 62 GLU CB C 62 28.478 29.124 -0.646 1
1 875 . 14 1 1 A 62 62 GLU N N 62 122.150 119.647 2.503 1
1 876 . 14 1 1 A 63 63 GLU H H 63 8.384 8.190 0.194 1
1 877 . 14 1 1 A 63 63 GLU HA H 63 3.913 4.003 -0.090 1
1 882 . 14 1 1 A 63 63 GLU C C 63 178.478 178.969 -0.491 1
1 883 . 14 1 1 A 63 63 GLU CA C 63 58.273 59.134 -0.861 1
1 884 . 14 1 1 A 63 63 GLU CB C 63 29.931 29.409 0.522 1
1 886 . 14 1 1 A 63 63 GLU N N 63 119.084 118.790 0.294 1
1 887 . 14 1 1 A 64 64 LEU H H 64 7.717 8.155 -0.438 1
1 888 . 14 1 1 A 64 64 LEU HA H 64 3.750 4.002 -0.252 1
1 898 . 14 1 1 A 64 64 LEU C C 64 177.535 178.109 -0.574 1
1 899 . 14 1 1 A 64 64 LEU CA C 64 58.944 58.561 0.383 1
1 900 . 14 1 1 A 64 64 LEU CB C 64 41.695 41.632 0.063 1
1 904 . 14 1 1 A 64 64 LEU N N 64 120.357 122.074 -1.717 1
1 905 . 14 1 1 A 65 65 ASP H H 65 7.922 8.176 -0.254 1
1 906 . 14 1 1 A 65 65 ASP HA H 65 4.313 4.256 0.057 1
1 909 . 14 1 1 A 65 65 ASP C C 65 179.095 178.947 0.148 1
1 910 . 14 1 1 A 65 65 ASP CA C 65 57.272 58.248 -0.976 1
1 911 . 14 1 1 A 65 65 ASP CB C 65 40.196 41.450 -1.254 1
1 912 . 14 1 1 A 65 65 ASP N N 65 118.100 118.642 -0.542 1
1 913 . 14 1 1 A 66 66 LYS H H 66 7.802 7.850 -0.048 1
1 914 . 14 1 1 A 66 66 LYS HA H 66 4.078 3.993 0.085 1
1 923 . 14 1 1 A 66 66 LYS C C 66 178.624 179.025 -0.401 1
1 924 . 14 1 1 A 66 66 LYS CA C 66 58.429 58.520 -0.091 1
1 925 . 14 1 1 A 66 66 LYS CB C 66 31.727 31.936 -0.209 1
1 929 . 14 1 1 A 66 66 LYS N N 66 119.343 118.522 0.821 1
1 930 . 14 1 1 A 67 67 ALA H H 67 8.480 8.018 0.462 1
1 931 . 14 1 1 A 67 67 ALA HA H 67 3.853 4.024 -0.171 1
1 935 . 14 1 1 A 67 67 ALA C C 67 178.591 179.428 -0.837 1
1 936 . 14 1 1 A 67 67 ALA CA C 67 55.403 55.471 -0.068 1
1 937 . 14 1 1 A 67 67 ALA CB C 67 17.793 18.631 -0.838 1
1 938 . 14 1 1 A 67 67 ALA N N 67 121.562 122.030 -0.468 1
1 939 . 14 1 1 A 68 68 LYS H H 68 8.186 7.894 0.292 1
1 940 . 14 1 1 A 68 68 LYS HA H 68 3.805 4.010 -0.205 1
1 949 . 14 1 1 A 68 68 LYS C C 68 179.095 178.589 0.506 1
1 950 . 14 1 1 A 68 68 LYS CA C 68 59.952 59.093 0.859 1
1 951 . 14 1 1 A 68 68 LYS CB C 68 32.181 31.880 0.301 1
1 955 . 14 1 1 A 68 68 LYS N N 68 116.165 116.848 -0.683 1
1 956 . 14 1 1 A 69 69 GLU H H 69 7.904 8.181 -0.277 1
1 957 . 14 1 1 A 69 69 GLU HA H 69 3.995 4.077 -0.082 1
1 962 . 14 1 1 A 69 69 GLU C C 69 179.079 179.414 -0.335 1
1 963 . 14 1 1 A 69 69 GLU CA C 69 59.022 58.902 0.120 1
1 964 . 14 1 1 A 69 69 GLU CB C 69 29.274 29.361 -0.087 1
1 966 . 14 1 1 A 69 69 GLU N N 69 119.489 119.638 -0.149 1
1 967 . 14 1 1 A 70 70 LEU H H 70 7.962 8.022 -0.060 1
1 968 . 14 1 1 A 70 70 LEU HA H 70 4.020 3.945 0.075 1
1 978 . 14 1 1 A 70 70 LEU C C 70 178.738 179.071 -0.333 1
1 979 . 14 1 1 A 70 70 LEU CA C 70 57.486 57.877 -0.391 1
1 980 . 14 1 1 A 70 70 LEU CB C 70 41.695 41.524 0.171 1
1 984 . 14 1 1 A 70 70 LEU N N 70 119.431 120.325 -0.894 1
1 985 . 14 1 1 A 71 71 ALA H H 71 8.260 8.472 -0.212 1
1 986 . 14 1 1 A 71 71 ALA HA H 71 3.845 4.088 -0.243 1
1 990 . 14 1 1 A 71 71 ALA C C 71 179.518 180.257 -0.739 1
1 991 . 14 1 1 A 71 71 ALA CA C 71 55.139 55.710 -0.571 1
1 992 . 14 1 1 A 71 71 ALA CB C 71 18.487 18.199 0.288 1
1 993 . 14 1 1 A 71 71 ALA N N 71 119.604 121.535 -1.931 1
1 994 . 14 1 1 A 72 72 GLN H H 72 7.910 8.569 -0.659 1
1 995 . 14 1 1 A 72 72 GLN HA H 72 4.154 4.029 0.125 1
1 1002 . 14 1 1 A 72 72 GLN C C 72 178.900 178.748 0.152 1
1 1003 . 14 1 1 A 72 72 GLN CA C 72 58.194 58.712 -0.518 1
1 1004 . 14 1 1 A 72 72 GLN CB C 72 28.056 28.439 -0.383 1
1 1006 . 14 1 1 A 72 72 GLN N N 72 115.960 117.191 -1.231 1
1 1008 . 14 1 1 A 73 73 LYS H H 73 7.841 8.146 -0.305 1
1 1009 . 14 1 1 A 73 73 LYS HA H 73 4.171 4.187 -0.016 1
1 1018 . 14 1 1 A 73 73 LYS C C 73 177.730 177.878 -0.148 1
1 1019 . 14 1 1 A 73 73 LYS CA C 73 57.867 58.526 -0.659 1
1 1020 . 14 1 1 A 73 73 LYS CB C 73 32.277 32.505 -0.228 1
1 1024 . 14 1 1 A 73 73 LYS N N 73 119.027 118.917 0.110 1
1 1025 . 14 1 1 A 74 74 MET H H 74 7.746 7.612 0.134 1
1 1026 . 14 1 1 A 74 74 MET HA H 74 4.403 4.521 -0.118 1
1 1034 . 14 1 1 A 74 74 MET C C 74 174.416 174.951 -0.535 1
1 1035 . 14 1 1 A 74 74 MET CA C 74 55.194 55.129 0.065 1
1 1036 . 14 1 1 A 74 74 MET CB C 74 33.366 33.530 -0.164 1
1 1039 . 14 1 1 A 74 74 MET N N 74 115.786 115.956 -0.170 1
1 1040 . 14 1 1 A 75 75 GLU H H 75 8.076 7.817 0.259 1
1 1041 . 14 1 1 A 75 75 GLU HA H 75 4.001 3.844 0.157 1
1 1046 . 14 1 1 A 75 75 GLU C C 75 175.130 175.484 -0.354 1
1 1047 . 14 1 1 A 75 75 GLU CA C 75 56.722 57.611 -0.889 1
1 1048 . 14 1 1 A 75 75 GLU CB C 75 27.118 27.106 0.012 1
1 1050 . 14 1 1 A 75 75 GLU N N 75 116.249 115.999 0.250 1
1 1051 . 14 1 1 A 76 76 ILE H H 76 7.560 8.035 -0.475 1
1 1052 . 14 1 1 A 76 76 ILE HA H 76 4.428 4.162 0.266 1
1 1062 . 14 1 1 A 76 76 ILE C C 76 174.529 174.926 -0.397 1
1 1063 . 14 1 1 A 76 76 ILE CA C 76 58.475 60.956 -2.481 1
1 1064 . 14 1 1 A 76 76 ILE CB C 76 40.337 38.045 2.292 1
1 1068 . 14 1 1 A 76 76 ILE N N 76 115.960 120.375 -4.415 1
1 1069 . 14 1 1 A 77 77 ASP H H 77 8.889 8.701 0.188 1
1 1070 . 14 1 1 A 77 77 ASP HA H 77 4.569 5.007 -0.438 1
1 1073 . 14 1 1 A 77 77 ASP C C 77 174.123 175.809 -1.686 1
1 1074 . 14 1 1 A 77 77 ASP CA C 77 54.069 54.260 -0.191 1
1 1075 . 14 1 1 A 77 77 ASP CB C 77 40.233 39.900 0.333 1
1 1076 . 14 1 1 A 77 77 ASP N N 77 126.142 128.031 -1.889 1
1 1077 . 14 1 1 A 78 78 VAL H H 78 7.754 8.427 -0.673 1
1 1078 . 14 1 1 A 78 78 VAL HA H 78 5.192 5.124 0.068 1
1 1086 . 14 1 1 A 78 78 VAL C C 78 174.968 173.981 0.987 1
1 1087 . 14 1 1 A 78 78 VAL CA C 78 58.804 59.428 -0.624 1
1 1088 . 14 1 1 A 78 78 VAL CB C 78 35.293 34.891 0.402 1
1 1091 . 14 1 1 A 78 78 VAL N N 78 122.844 117.186 5.658 1
1 1092 . 14 1 1 A 79 79 ARG H H 79 8.499 9.028 -0.529 1
1 1093 . 14 1 1 A 79 79 ARG HA H 79 4.712 4.826 -0.114 1
1 1100 . 14 1 1 A 79 79 ARG C C 79 174.221 174.598 -0.377 1
1 1101 . 14 1 1 A 79 79 ARG CA C 79 54.117 55.046 -0.929 1
1 1102 . 14 1 1 A 79 79 ARG CB C 79 31.196 32.142 -0.946 1
1 1105 . 14 1 1 A 79 79 ARG N N 79 125.637 122.104 3.533 1
1 1106 . 14 1 1 A 80 80 THR H H 80 8.416 8.894 -0.478 1
1 1107 . 14 1 1 A 80 80 THR HA H 80 5.332 5.019 0.313 1
1 1112 . 14 1 1 A 80 80 THR C C 80 174.497 173.941 0.556 1
1 1113 . 14 1 1 A 80 80 THR CA C 80 59.694 61.992 -2.298 1
1 1114 . 14 1 1 A 80 80 THR CB C 80 69.772 69.322 0.450 1
1 1116 . 14 1 1 A 80 80 THR N N 80 118.084 120.778 -2.694 1
1 1117 . 14 1 1 A 81 81 ARG H H 81 8.758 9.047 -0.289 1
1 1118 . 14 1 1 A 81 81 ARG HA H 81 4.362 4.751 -0.389 1
1 1126 . 14 1 1 A 81 81 ARG C C 81 173.733 174.111 -0.378 1
1 1127 . 14 1 1 A 81 81 ARG CA C 81 53.273 53.834 -0.561 1
1 1128 . 14 1 1 A 81 81 ARG CB C 81 33.915 33.027 0.888 1
1 1131 . 14 1 1 A 81 81 ARG N N 81 122.844 125.455 -2.611 1
1 1133 . 14 1 1 A 82 82 LYS H H 82 8.721 8.496 0.225 1
1 1134 . 14 1 1 A 82 82 LYS HA H 82 4.701 5.008 -0.307 1
1 1143 . 14 1 1 A 82 82 LYS C C 82 175.667 175.626 0.041 1
1 1144 . 14 1 1 A 82 82 LYS CA C 82 54.960 54.878 0.082 1
1 1145 . 14 1 1 A 82 82 LYS CB C 82 32.603 34.564 -1.961 1
1 1149 . 14 1 1 A 82 82 LYS N N 82 124.668 123.266 1.402 1
1 1150 . 14 1 1 A 83 83 VAL H H 83 9.112 8.839 0.273 1
1 1151 . 14 1 1 A 83 83 VAL HA H 83 4.796 4.836 -0.040 1
1 1159 . 14 1 1 A 83 83 VAL C C 83 174.594 174.938 -0.344 1
1 1160 . 14 1 1 A 83 83 VAL CA C 83 59.413 59.743 -0.330 1
1 1161 . 14 1 1 A 83 83 VAL CB C 83 35.298 35.682 -0.384 1
1 1164 . 14 1 1 A 83 83 VAL N N 83 122.381 120.207 2.174 1
1 1165 . 14 1 1 A 84 84 THR H H 84 9.200 8.601 0.599 1
1 1166 . 14 1 1 A 84 84 THR HA H 84 4.579 4.624 -0.045 1
1 1171 . 14 1 1 A 84 84 THR C C 84 173.993 174.722 -0.729 1
1 1172 . 14 1 1 A 84 84 THR CA C 84 60.960 61.716 -0.756 1
1 1173 . 14 1 1 A 84 84 THR CB C 84 70.100 70.550 -0.450 1
1 1175 . 14 1 1 A 84 84 THR N N 84 113.183 115.090 -1.907 1
1 1176 . 14 1 1 A 85 85 SER H H 85 7.688 7.841 -0.153 1
1 1177 . 14 1 1 A 85 85 SER HA H 85 5.136 4.616 0.520 1
1 1180 . 14 1 1 A 85 85 SER CA C 85 55.205 56.725 -1.520 1
1 1181 . 14 1 1 A 85 85 SER CB C 85 64.376 63.435 0.941 1
1 1182 . 14 1 1 A 85 85 SER N N 85 115.555 118.022 -2.467 1
1 1183 . 14 1 1 A 86 86 PRO HA H 86 4.090 4.331 -0.241 1
1 1190 . 14 1 1 A 86 86 PRO C C 86 177.227 178.438 -1.211 1
1 1191 . 14 1 1 A 86 86 PRO CA C 86 65.038 65.711 -0.673 1
1 1192 . 14 1 1 A 86 86 PRO CB C 86 31.711 31.896 -0.185 1
1 1195 . 14 1 1 A 87 87 ASP H H 87 8.131 8.476 -0.345 1
1 1196 . 14 1 1 A 87 87 ASP HA H 87 4.223 4.353 -0.130 1
1 1199 . 14 1 1 A 87 87 ASP C C 87 178.721 179.121 -0.400 1
1 1200 . 14 1 1 A 87 87 ASP CA C 87 57.311 56.787 0.524 1
1 1201 . 14 1 1 A 87 87 ASP CB C 87 40.102 40.130 -0.028 1
1 1202 . 14 1 1 A 87 87 ASP N N 87 115.381 116.941 -1.560 1
1 1203 . 14 1 1 A 88 88 GLU H H 88 7.571 8.107 -0.536 1
1 1204 . 14 1 1 A 88 88 GLU HA H 88 3.659 4.033 -0.374 1
1 1209 . 14 1 1 A 88 88 GLU C C 88 177.097 178.832 -1.735 1
1 1210 . 14 1 1 A 88 88 GLU CA C 88 58.729 58.794 -0.065 1
1 1211 . 14 1 1 A 88 88 GLU CB C 88 30.052 29.774 0.278 1
1 1213 . 14 1 1 A 88 88 GLU N N 88 120.009 121.422 -1.413 1
1 1214 . 14 1 1 A 89 89 ALA H H 89 7.423 7.842 -0.419 1
1 1215 . 14 1 1 A 89 89 ALA HA H 89 3.900 4.274 -0.374 1
1 1219 . 14 1 1 A 89 89 ALA C C 89 178.267 180.069 -1.802 1
1 1220 . 14 1 1 A 89 89 ALA CA C 89 55.607 55.334 0.273 1
1 1221 . 14 1 1 A 89 89 ALA CB C 89 17.348 18.503 -1.155 1
1 1222 . 14 1 1 A 89 89 ALA N N 89 118.873 122.177 -3.304 1
1 1223 . 14 1 1 A 90 90 LYS H H 90 8.046 8.243 -0.197 1
1 1224 . 14 1 1 A 90 90 LYS HA H 90 3.669 3.995 -0.326 1
1 1233 . 14 1 1 A 90 90 LYS C C 90 177.649 179.081 -1.432 1
1 1234 . 14 1 1 A 90 90 LYS CA C 90 60.351 59.902 0.449 1
1 1235 . 14 1 1 A 90 90 LYS CB C 90 32.087 32.357 -0.270 1
1 1239 . 14 1 1 A 90 90 LYS N N 90 114.834 117.338 -2.504 1
1 1240 . 14 1 1 A 91 91 ARG H H 91 7.468 7.955 -0.487 1
1 1241 . 14 1 1 A 91 91 ARG HA H 91 3.887 3.879 0.008 1
1 1249 . 14 1 1 A 91 91 ARG C C 91 178.998 179.093 -0.095 1
1 1250 . 14 1 1 A 91 91 ARG CA C 91 59.164 59.061 0.103 1
1 1251 . 14 1 1 A 91 91 ARG CB C 91 29.274 29.685 -0.411 1
1 1254 . 14 1 1 A 91 91 ARG N N 91 119.029 119.056 -0.027 1
1 1256 . 14 1 1 A 92 92 TRP H H 92 8.136 8.223 -0.087 1
1 1257 . 14 1 1 A 92 92 TRP HA H 92 4.818 4.546 0.272 1
1 1266 . 14 1 1 A 92 92 TRP C C 92 179.566 179.182 0.384 1
1 1267 . 14 1 1 A 92 92 TRP CA C 92 58.663 59.429 -0.766 1
1 1268 . 14 1 1 A 92 92 TRP CB C 92 29.790 29.144 0.646 1
1 1274 . 14 1 1 A 92 92 TRP N N 92 118.100 120.231 -2.131 1
1 1276 . 14 1 1 A 93 93 ILE H H 93 8.363 8.593 -0.230 1
1 1277 . 14 1 1 A 93 93 ILE HA H 93 3.544 3.763 -0.219 1
1 1287 . 14 1 1 A 93 93 ILE C C 93 176.820 178.398 -1.578 1
1 1288 . 14 1 1 A 93 93 ILE CA C 93 66.225 65.579 0.646 1
1 1289 . 14 1 1 A 93 93 ILE CB C 93 37.571 37.903 -0.332 1
1 1293 . 14 1 1 A 93 93 ILE N N 93 120.588 120.416 0.172 1
1 1294 . 14 1 1 A 94 94 LYS H H 94 8.264 7.817 0.447 1
1 1295 . 14 1 1 A 94 94 LYS HA H 94 3.865 4.241 -0.376 1
1 1304 . 14 1 1 A 94 94 LYS C C 94 179.258 178.657 0.601 1
1 1305 . 14 1 1 A 94 94 LYS CA C 94 59.889 59.249 0.640 1
1 1306 . 14 1 1 A 94 94 LYS CB C 94 32.225 32.075 0.150 1
1 1310 . 14 1 1 A 94 94 LYS N N 94 121.687 120.585 1.102 1
1 1311 . 14 1 1 A 95 95 GLU H H 95 8.360 8.405 -0.045 1
1 1312 . 14 1 1 A 95 95 GLU HA H 95 4.023 4.078 -0.055 1
1 1317 . 14 1 1 A 95 95 GLU C C 95 178.884 179.287 -0.403 1
1 1318 . 14 1 1 A 95 95 GLU CA C 95 59.366 59.622 -0.256 1
1 1319 . 14 1 1 A 95 95 GLU CB C 95 29.508 29.601 -0.093 1
1 1321 . 14 1 1 A 95 95 GLU N N 95 118.505 118.470 0.035 1
1 1322 . 14 1 1 A 96 96 PHE H H 96 8.212 8.415 -0.203 1
1 1323 . 14 1 1 A 96 96 PHE HA H 96 4.512 4.331 0.181 1
1 1331 . 14 1 1 A 96 96 PHE C C 96 176.820 178.040 -1.220 1
1 1332 . 14 1 1 A 96 96 PHE CA C 96 59.608 61.109 -1.501 1
1 1333 . 14 1 1 A 96 96 PHE CB C 96 40.431 39.215 1.216 1
1 1339 . 14 1 1 A 96 96 PHE N N 96 120.369 122.021 -1.652 1
1 1340 . 14 1 1 A 97 97 SER H H 97 8.216 8.471 -0.255 1
1 1341 . 14 1 1 A 97 97 SER HA H 97 3.816 4.068 -0.252 1
1 1344 . 14 1 1 A 97 97 SER C C 97 175.618 176.762 -1.144 1
1 1345 . 14 1 1 A 97 97 SER CA C 97 60.492 61.060 -0.568 1
1 1346 . 14 1 1 A 97 97 SER CB C 97 63.022 62.676 0.346 1
1 1347 . 14 1 1 A 97 97 SER N N 97 111.969 113.386 -1.417 1
1 1348 . 14 1 1 A 98 98 GLU H H 98 7.655 7.788 -0.133 1
1 1349 . 14 1 1 A 98 98 GLU HA H 98 4.187 4.156 0.031 1
1 1354 . 14 1 1 A 98 98 GLU C C 98 177.698 179.127 -1.429 1
1 1355 . 14 1 1 A 98 98 GLU CA C 98 57.069 58.838 -1.769 1
1 1356 . 14 1 1 A 98 98 GLU CB C 98 29.321 29.135 0.186 1
1 1358 . 14 1 1 A 98 98 GLU N N 98 120.588 122.398 -1.810 1
1 1359 . 14 1 1 A 99 99 GLU H H 99 7.794 7.939 -0.145 1
1 1360 . 14 1 1 A 99 99 GLU HA H 99 4.123 4.315 -0.192 1
1 1365 . 14 1 1 A 99 99 GLU C C 99 177.665 177.336 0.329 1
1 1366 . 14 1 1 A 99 99 GLU CA C 99 57.304 59.064 -1.760 1
1 1367 . 14 1 1 A 99 99 GLU CB C 99 29.368 29.617 -0.249 1
1 1369 . 14 1 1 A 99 99 GLU N N 99 120.067 119.694 0.373 1
1 1370 . 14 1 1 A 100 100 GLY H H 100 8.138 8.507 -0.369 1
1 1371 . 14 1 1 A 100 100 GLY HA2 H 100 3.865 3.756 0.109 1
1 1372 . 14 1 1 A 100 100 GLY HA3 H 100 3.715 3.852 -0.137 1
1 1373 . 14 1 1 A 100 100 GLY C C 100 174.464 173.938 0.526 1
1 1374 . 14 1 1 A 100 100 GLY CA C 100 45.305 45.382 -0.077 1
1 1375 . 14 1 1 A 100 100 GLY N N 100 107.802 108.208 -0.406 1
1 1376 . 14 1 1 A 101 101 GLY H H 101 8.023 8.413 -0.390 1
1 1377 . 14 1 1 A 101 101 GLY HA2 H 101 3.865 4.072 -0.207 1
1 1378 . 14 1 1 A 101 101 GLY HA3 H 101 3.892 4.078 -0.186 1
1 1379 . 14 1 1 A 101 101 GLY C C 101 174.204 175.149 -0.945 1
1 1380 . 14 1 1 A 101 101 GLY CA C 101 45.036 44.879 0.157 1
1 1381 . 14 1 1 A 101 101 GLY N N 101 108.032 106.927 1.105 1
1 1382 . 14 1 1 A 102 102 SER H H 102 8.059 8.115 -0.056 1
1 1383 . 14 1 1 A 102 102 SER HA H 102 4.380 4.644 -0.264 1
1 1386 . 14 1 1 A 102 102 SER C C 102 174.627 175.206 -0.579 1
1 1387 . 14 1 1 A 102 102 SER CA C 102 58.194 58.489 -0.295 1
1 1388 . 14 1 1 A 102 102 SER CB C 102 63.538 63.273 0.265 1
1 1389 . 14 1 1 A 102 102 SER N N 102 115.266 121.990 -6.724 1
1 1390 . 14 1 1 A 103 103 LEU H H 103 8.287 7.718 0.569 1
1 1391 . 14 1 1 A 103 103 LEU HA H 103 4.301 4.024 0.277 1
1 1401 . 14 1 1 A 103 103 LEU C C 103 177.292 178.234 -0.942 1
1 1402 . 14 1 1 A 103 103 LEU CA C 103 55.007 57.616 -2.609 1
1 1403 . 14 1 1 A 103 103 LEU CB C 103 42.023 41.792 0.231 1
1 1407 . 14 1 1 A 103 103 LEU N N 103 123.596 122.669 0.927 1
1 1408 . 14 1 1 A 104 104 GLU H H 104 8.216 8.217 -0.001 1
1 1409 . 14 1 1 A 104 104 GLU HA H 104 4.126 4.032 0.094 1
1 1414 . 14 1 1 A 104 104 GLU CA C 104 56.518 58.510 -1.992 1
1 1415 . 14 1 1 A 104 104 GLU CB C 104 29.837 29.591 0.246 1
1 1417 . 14 1 1 A 104 104 GLU N N 104 120.510 117.313 3.197 1
1 1418 . 14 1 1 A 105 105 HIS HA H 105 4.593 4.685 -0.092 1
1 1421 . 14 1 1 A 105 105 HIS C C 105 173.766 174.685 -0.919 1
1 1422 . 14 1 1 A 105 105 HIS CA C 105 55.536 54.810 0.726 1
1 1423 . 14 1 1 A 105 105 HIS CB C 105 30.001 30.676 -0.675 1
1 1424 . 14 1 1 A 106 106 HIS H H 106 8.154 8.709 -0.555 1
1 1425 . 14 1 1 A 106 106 HIS HA H 106 4.407 4.727 -0.320 1
1 1428 . 14 1 1 A 106 106 HIS CA C 106 56.920 55.069 1.851 1
1 1429 . 14 1 1 A 106 106 HIS CB C 106 30.001 27.890 2.111 1
1 14 . 15 1 1 A 2 2 LEU H H 2 8.509 9.089 -0.580 1
1 15 . 15 1 1 A 2 2 LEU HA H 2 4.463 4.379 0.084 1
1 25 . 15 1 1 A 2 2 LEU C C 2 173.944 176.265 -2.321 1
1 26 . 15 1 1 A 2 2 LEU CA C 2 54.471 54.979 -0.508 1
1 27 . 15 1 1 A 2 2 LEU CB C 2 43.595 42.544 1.051 1
1 31 . 15 1 1 A 2 2 LEU N N 2 127.160 127.401 -0.241 1
1 32 . 15 1 1 A 3 3 LEU H H 3 7.844 8.314 -0.470 1
1 33 . 15 1 1 A 3 3 LEU HA H 3 5.128 5.450 -0.322 1
1 43 . 15 1 1 A 3 3 LEU C C 3 175.423 175.146 0.277 1
1 44 . 15 1 1 A 3 3 LEU CA C 3 53.566 53.504 0.062 1
1 45 . 15 1 1 A 3 3 LEU CB C 3 44.039 45.099 -1.060 1
1 49 . 15 1 1 A 3 3 LEU N N 3 122.555 122.090 0.465 1
1 50 . 15 1 1 A 4 4 TYR H H 4 8.360 8.992 -0.632 1
1 51 . 15 1 1 A 4 4 TYR HA H 4 5.143 5.194 -0.051 1
1 58 . 15 1 1 A 4 4 TYR C C 4 174.481 174.869 -0.388 1
1 59 . 15 1 1 A 4 4 TYR CA C 4 56.577 56.079 0.498 1
1 60 . 15 1 1 A 4 4 TYR CB C 4 43.840 43.069 0.771 1
1 65 . 15 1 1 A 4 4 TYR N N 4 119.315 122.261 -2.946 1
1 66 . 15 1 1 A 5 5 VAL H H 5 8.918 8.806 0.112 1
1 67 . 15 1 1 A 5 5 VAL HA H 5 5.106 4.912 0.194 1
1 75 . 15 1 1 A 5 5 VAL C C 5 174.042 174.666 -0.624 1
1 76 . 15 1 1 A 5 5 VAL CA C 5 59.852 60.779 -0.927 1
1 77 . 15 1 1 A 5 5 VAL CB C 5 33.816 35.088 -1.272 1
1 80 . 15 1 1 A 5 5 VAL N N 5 119.952 120.367 -0.415 1
1 81 . 15 1 1 A 6 6 LEU H H 6 9.315 9.417 -0.102 1
1 82 . 15 1 1 A 6 6 LEU HA H 6 5.466 5.375 0.091 1
1 92 . 15 1 1 A 6 6 LEU C C 6 175.049 174.782 0.267 1
1 93 . 15 1 1 A 6 6 LEU CA C 6 52.090 52.889 -0.799 1
1 94 . 15 1 1 A 6 6 LEU CB C 6 44.103 43.680 0.423 1
1 98 . 15 1 1 A 6 6 LEU N N 6 126.917 125.951 0.966 1
1 99 . 15 1 1 A 7 7 ILE H H 7 8.458 9.073 -0.615 1
1 100 . 15 1 1 A 7 7 ILE HA H 7 5.131 5.027 0.104 1
1 110 . 15 1 1 A 7 7 ILE C C 7 173.213 173.626 -0.413 1
1 111 . 15 1 1 A 7 7 ILE CA C 7 58.463 59.660 -1.197 1
1 112 . 15 1 1 A 7 7 ILE CB C 7 41.020 40.801 0.219 1
1 116 . 15 1 1 A 7 7 ILE N N 7 119.778 126.332 -6.554 1
1 117 . 15 1 1 A 8 8 ILE H H 8 8.797 9.366 -0.569 1
1 118 . 15 1 1 A 8 8 ILE HA H 8 4.611 5.114 -0.503 1
1 128 . 15 1 1 A 8 8 ILE C C 8 174.611 174.735 -0.124 1
1 129 . 15 1 1 A 8 8 ILE CA C 8 60.227 60.269 -0.042 1
1 130 . 15 1 1 A 8 8 ILE CB C 8 37.665 39.030 -1.365 1
1 134 . 15 1 1 A 8 8 ILE N N 8 128.919 130.053 -1.134 1
1 135 . 15 1 1 A 9 9 SER H H 9 7.811 8.763 -0.952 1
1 136 . 15 1 1 A 9 9 SER HA H 9 4.429 5.005 -0.576 1
1 140 . 15 1 1 A 9 9 SER C C 9 172.937 172.828 0.109 1
1 141 . 15 1 1 A 9 9 SER CA C 9 58.241 57.009 1.232 1
1 142 . 15 1 1 A 9 9 SER CB C 9 64.261 64.327 -0.066 1
1 143 . 15 1 1 A 9 9 SER N N 9 116.365 121.604 -5.239 1
1 144 . 15 1 1 A 10 10 ASN H H 10 8.641 8.635 0.006 1
1 145 . 15 1 1 A 10 10 ASN HA H 10 4.938 5.009 -0.071 1
1 150 . 15 1 1 A 10 10 ASN C C 10 174.497 174.736 -0.239 1
1 151 . 15 1 1 A 10 10 ASN CA C 10 52.221 53.329 -1.108 1
1 152 . 15 1 1 A 10 10 ASN CB C 10 39.128 39.239 -0.111 1
1 153 . 15 1 1 A 10 10 ASN N N 10 122.612 120.859 1.753 1
1 155 . 15 1 1 A 11 11 ASP H H 11 8.673 7.778 0.895 1
1 156 . 15 1 1 A 11 11 ASP HA H 11 4.596 4.653 -0.057 1
1 159 . 15 1 1 A 11 11 ASP C C 11 175.342 176.714 -1.372 1
1 160 . 15 1 1 A 11 11 ASP CA C 11 53.233 53.490 -0.257 1
1 161 . 15 1 1 A 11 11 ASP CB C 11 40.965 40.820 0.145 1
1 162 . 15 1 1 A 11 11 ASP N N 11 122.717 122.170 0.547 1
1 163 . 15 1 1 A 12 12 LYS H H 12 8.562 8.700 -0.138 1
1 164 . 15 1 1 A 12 12 LYS HA H 12 3.854 4.102 -0.248 1
1 173 . 15 1 1 A 12 12 LYS C C 12 178.754 178.480 0.274 1
1 174 . 15 1 1 A 12 12 LYS CA C 12 59.581 59.485 0.096 1
1 175 . 15 1 1 A 12 12 LYS CB C 12 32.378 32.090 0.288 1
1 179 . 15 1 1 A 12 12 LYS N N 12 125.737 126.022 -0.285 1
1 180 . 15 1 1 A 13 13 LYS H H 13 8.075 7.411 0.664 1
1 181 . 15 1 1 A 13 13 LYS HA H 13 4.154 4.054 0.100 1
1 190 . 15 1 1 A 13 13 LYS C C 13 178.315 179.081 -0.766 1
1 191 . 15 1 1 A 13 13 LYS CA C 13 58.532 59.275 -0.743 1
1 192 . 15 1 1 A 13 13 LYS CB C 13 31.452 32.171 -0.719 1
1 196 . 15 1 1 A 13 13 LYS N N 13 119.604 119.886 -0.282 1
1 197 . 15 1 1 A 14 14 LEU H H 14 7.552 8.047 -0.495 1
1 198 . 15 1 1 A 14 14 LEU HA H 14 3.682 4.078 -0.396 1
1 208 . 15 1 1 A 14 14 LEU C C 14 178.429 178.146 0.283 1
1 209 . 15 1 1 A 14 14 LEU CA C 14 58.999 58.236 0.763 1
1 210 . 15 1 1 A 14 14 LEU CB C 14 41.228 41.184 0.044 1
1 214 . 15 1 1 A 14 14 LEU N N 14 122.266 121.357 0.909 1
1 215 . 15 1 1 A 15 15 ILE H H 15 8.074 8.248 -0.174 1
1 216 . 15 1 1 A 15 15 ILE HA H 15 3.264 3.459 -0.195 1
1 226 . 15 1 1 A 15 15 ILE C C 15 177.000 178.071 -1.071 1
1 227 . 15 1 1 A 15 15 ILE CA C 15 65.939 65.629 0.310 1
1 228 . 15 1 1 A 15 15 ILE CB C 15 37.983 37.958 0.025 1
1 232 . 15 1 1 A 15 15 ILE N N 15 118.214 119.724 -1.510 1
1 233 . 15 1 1 A 16 16 GLU H H 16 8.016 8.309 -0.293 1
1 234 . 15 1 1 A 16 16 GLU HA H 16 4.045 3.945 0.100 1
1 239 . 15 1 1 A 16 16 GLU C C 16 179.388 179.693 -0.305 1
1 240 . 15 1 1 A 16 16 GLU CA C 16 59.032 59.958 -0.926 1
1 241 . 15 1 1 A 16 16 GLU CB C 16 29.200 29.168 0.032 1
1 243 . 15 1 1 A 16 16 GLU N N 16 118.484 118.912 -0.428 1
1 244 . 15 1 1 A 17 17 GLU H H 17 8.063 8.427 -0.364 1
1 245 . 15 1 1 A 17 17 GLU HA H 17 4.053 4.028 0.025 1
1 250 . 15 1 1 A 17 17 GLU C C 17 179.306 179.267 0.039 1
1 251 . 15 1 1 A 17 17 GLU CA C 17 58.636 59.419 -0.783 1
1 252 . 15 1 1 A 17 17 GLU CB C 17 29.011 29.219 -0.208 1
1 254 . 15 1 1 A 17 17 GLU N N 17 118.100 120.433 -2.333 1
1 255 . 15 1 1 A 18 18 ALA H H 18 8.655 8.187 0.468 1
1 256 . 15 1 1 A 18 18 ALA HA H 18 3.775 4.027 -0.252 1
1 260 . 15 1 1 A 18 18 ALA C C 18 178.559 179.585 -1.026 1
1 261 . 15 1 1 A 18 18 ALA CA C 18 54.960 55.306 -0.346 1
1 262 . 15 1 1 A 18 18 ALA CB C 18 17.960 18.123 -0.163 1
1 263 . 15 1 1 A 18 18 ALA N N 18 122.439 122.950 -0.511 1
1 264 . 15 1 1 A 19 19 ARG H H 19 8.900 7.784 1.116 1
1 265 . 15 1 1 A 19 19 ARG HA H 19 3.809 4.040 -0.231 1
1 273 . 15 1 1 A 19 19 ARG C C 19 178.721 178.944 -0.223 1
1 274 . 15 1 1 A 19 19 ARG CA C 19 59.976 59.862 0.114 1
1 275 . 15 1 1 A 19 19 ARG CB C 19 29.572 29.992 -0.420 1
1 278 . 15 1 1 A 19 19 ARG N N 19 118.563 117.695 0.868 1
1 280 . 15 1 1 A 20 20 LYS H H 20 7.792 7.882 -0.090 1
1 281 . 15 1 1 A 20 20 LYS HA H 20 4.052 4.027 0.025 1
1 290 . 15 1 1 A 20 20 LYS C C 20 179.648 179.795 -0.147 1
1 291 . 15 1 1 A 20 20 LYS CA C 20 59.296 59.426 -0.130 1
1 292 . 15 1 1 A 20 20 LYS CB C 20 32.216 32.237 -0.021 1
1 296 . 15 1 1 A 20 20 LYS N N 20 118.638 119.448 -0.810 1
1 297 . 15 1 1 A 21 21 MET H H 21 7.684 7.951 -0.267 1
1 298 . 15 1 1 A 21 21 MET HA H 21 4.411 4.126 0.285 1
1 306 . 15 1 1 A 21 21 MET C C 21 177.909 178.201 -0.292 1
1 307 . 15 1 1 A 21 21 MET CA C 21 57.009 59.558 -2.549 1
1 308 . 15 1 1 A 21 21 MET CB C 21 32.028 32.948 -0.920 1
1 311 . 15 1 1 A 21 21 MET N N 21 118.100 118.375 -0.275 1
1 312 . 15 1 1 A 22 22 ALA H H 22 8.815 8.266 0.549 1
1 313 . 15 1 1 A 22 22 ALA HA H 22 3.826 3.959 -0.133 1
1 317 . 15 1 1 A 22 22 ALA C C 22 178.835 179.927 -1.092 1
1 318 . 15 1 1 A 22 22 ALA CA C 22 55.427 55.558 -0.131 1
1 319 . 15 1 1 A 22 22 ALA CB C 22 18.059 18.305 -0.246 1
1 320 . 15 1 1 A 22 22 ALA N N 22 122.150 121.110 1.040 1
1 321 . 15 1 1 A 23 23 GLU H H 23 8.276 7.752 0.524 1
1 322 . 15 1 1 A 23 23 GLU HA H 23 4.146 4.144 0.002 1
1 327 . 15 1 1 A 23 23 GLU C C 23 180.151 179.511 0.640 1
1 328 . 15 1 1 A 23 23 GLU CA C 23 58.999 59.007 -0.008 1
1 329 . 15 1 1 A 23 23 GLU CB C 23 29.160 29.975 -0.815 1
1 331 . 15 1 1 A 23 23 GLU N N 23 117.001 117.960 -0.959 1
1 332 . 15 1 1 A 24 24 LYS H H 24 7.573 8.110 -0.537 1
1 333 . 15 1 1 A 24 24 LYS HA H 24 4.101 4.088 0.013 1
1 342 . 15 1 1 A 24 24 LYS C C 24 177.145 177.678 -0.533 1
1 343 . 15 1 1 A 24 24 LYS CA C 24 58.261 58.764 -0.503 1
1 344 . 15 1 1 A 24 24 LYS CB C 24 32.079 32.206 -0.127 1
1 348 . 15 1 1 A 24 24 LYS N N 24 119.960 119.316 0.644 1
1 349 . 15 1 1 A 25 25 ALA H H 25 7.710 7.771 -0.061 1
1 350 . 15 1 1 A 25 25 ALA HA H 25 4.413 4.391 0.022 1
1 354 . 15 1 1 A 25 25 ALA C C 25 175.325 177.004 -1.679 1
1 355 . 15 1 1 A 25 25 ALA CA C 25 51.208 51.867 -0.659 1
1 356 . 15 1 1 A 25 25 ALA CB C 25 18.520 19.393 -0.873 1
1 357 . 15 1 1 A 25 25 ALA N N 25 119.257 118.906 0.351 1
1 358 . 15 1 1 A 26 26 ASN H H 26 7.840 8.038 -0.198 1
1 359 . 15 1 1 A 26 26 ASN HA H 26 4.357 4.363 -0.006 1
1 364 . 15 1 1 A 26 26 ASN C C 26 173.587 174.321 -0.734 1
1 365 . 15 1 1 A 26 26 ASN CA C 26 54.307 54.492 -0.185 1
1 366 . 15 1 1 A 26 26 ASN CB C 26 36.972 37.353 -0.381 1
1 367 . 15 1 1 A 26 26 ASN N N 26 115.266 113.763 1.503 1
1 369 . 15 1 1 A 27 27 LEU H H 27 8.241 7.820 0.421 1
1 370 . 15 1 1 A 27 27 LEU HA H 27 4.652 4.329 0.323 1
1 380 . 15 1 1 A 27 27 LEU C C 27 175.894 176.639 -0.745 1
1 381 . 15 1 1 A 27 27 LEU CA C 27 52.923 54.313 -1.390 1
1 382 . 15 1 1 A 27 27 LEU CB C 27 44.090 42.645 1.445 1
1 386 . 15 1 1 A 27 27 LEU N N 27 116.828 119.408 -2.580 1
1 387 . 15 1 1 A 28 28 GLU H H 28 7.798 8.443 -0.645 1
1 388 . 15 1 1 A 28 28 GLU HA H 28 4.310 4.699 -0.389 1
1 393 . 15 1 1 A 28 28 GLU C C 28 173.944 175.314 -1.370 1
1 394 . 15 1 1 A 28 28 GLU CA C 28 55.460 56.290 -0.830 1
1 395 . 15 1 1 A 28 28 GLU CB C 28 30.512 30.589 -0.077 1
1 397 . 15 1 1 A 28 28 GLU N N 28 121.340 122.337 -0.997 1
1 398 . 15 1 1 A 29 29 LEU H H 29 8.451 9.041 -0.590 1
1 399 . 15 1 1 A 29 29 LEU HA H 29 5.662 5.473 0.189 1
1 409 . 15 1 1 A 29 29 LEU C C 29 176.902 174.891 2.011 1
1 410 . 15 1 1 A 29 29 LEU CA C 29 53.186 53.518 -0.332 1
1 411 . 15 1 1 A 29 29 LEU CB C 29 44.914 45.453 -0.539 1
1 415 . 15 1 1 A 29 29 LEU N N 29 126.547 127.569 -1.022 1
1 416 . 15 1 1 A 30 30 ARG H H 30 9.094 9.208 -0.114 1
1 417 . 15 1 1 A 30 30 ARG HA H 30 4.910 5.078 -0.168 1
1 425 . 15 1 1 A 30 30 ARG C C 30 175.147 174.978 0.169 1
1 426 . 15 1 1 A 30 30 ARG CA C 30 53.417 53.998 -0.581 1
1 427 . 15 1 1 A 30 30 ARG CB C 30 32.555 33.676 -1.121 1
1 430 . 15 1 1 A 30 30 ARG N N 30 125.043 126.087 -1.044 1
1 432 . 15 1 1 A 31 31 THR H H 31 8.496 8.585 -0.089 1
1 433 . 15 1 1 A 31 31 THR HA H 31 4.888 5.065 -0.177 1
1 438 . 15 1 1 A 31 31 THR C C 31 173.961 173.815 0.146 1
1 439 . 15 1 1 A 31 31 THR CA C 31 60.445 60.198 0.247 1
1 440 . 15 1 1 A 31 31 THR CB C 31 69.492 70.468 -0.976 1
1 442 . 15 1 1 A 31 31 THR N N 31 114.745 113.206 1.539 1
1 443 . 15 1 1 A 32 32 VAL H H 32 8.480 8.948 -0.468 1
1 444 . 15 1 1 A 32 32 VAL HA H 32 4.411 4.912 -0.501 1
1 452 . 15 1 1 A 32 32 VAL C C 32 175.082 175.305 -0.223 1
1 453 . 15 1 1 A 32 32 VAL CA C 32 60.946 60.384 0.562 1
1 454 . 15 1 1 A 32 32 VAL CB C 32 34.487 35.180 -0.693 1
1 457 . 15 1 1 A 32 32 VAL N N 32 122.324 122.073 0.251 1
1 458 . 15 1 1 A 33 33 LYS H H 33 9.304 8.888 0.416 1
1 459 . 15 1 1 A 33 33 LYS HA H 33 4.534 4.532 0.002 1
1 468 . 15 1 1 A 33 33 LYS C C 33 176.740 176.335 0.405 1
1 469 . 15 1 1 A 33 33 LYS CA C 33 56.846 57.178 -0.332 1
1 470 . 15 1 1 A 33 33 LYS CB C 33 34.355 34.361 -0.006 1
1 474 . 15 1 1 A 33 33 LYS N N 33 123.654 124.869 -1.215 1
1 475 . 15 1 1 A 34 34 THR H H 34 7.245 7.874 -0.629 1
1 476 . 15 1 1 A 34 34 THR HA H 34 4.780 4.576 0.204 1
1 481 . 15 1 1 A 34 34 THR C C 34 174.529 175.458 -0.929 1
1 482 . 15 1 1 A 34 34 THR CA C 34 58.859 60.658 -1.799 1
1 483 . 15 1 1 A 34 34 THR CB C 34 73.023 71.858 1.165 1
1 485 . 15 1 1 A 34 34 THR N N 34 106.300 111.844 -5.544 1
1 486 . 15 1 1 A 35 35 GLU H H 35 9.174 9.091 0.083 1
1 487 . 15 1 1 A 35 35 GLU HA H 35 3.886 3.941 -0.055 1
1 492 . 15 1 1 A 35 35 GLU C C 35 177.714 177.650 0.064 1
1 493 . 15 1 1 A 35 35 GLU CA C 35 59.233 59.663 -0.430 1
1 494 . 15 1 1 A 35 35 GLU CB C 35 29.377 29.530 -0.153 1
1 496 . 15 1 1 A 35 35 GLU N N 35 121.919 122.255 -0.336 1
1 497 . 15 1 1 A 36 36 ASP H H 36 8.185 8.490 -0.305 1
1 498 . 15 1 1 A 36 36 ASP HA H 36 4.289 4.319 -0.030 1
1 501 . 15 1 1 A 36 36 ASP C C 36 178.348 178.589 -0.241 1
1 502 . 15 1 1 A 36 36 ASP CA C 36 56.962 57.904 -0.942 1
1 503 . 15 1 1 A 36 36 ASP CB C 36 40.214 42.554 -2.340 1
1 504 . 15 1 1 A 36 36 ASP N N 36 118.332 120.256 -1.924 1
1 505 . 15 1 1 A 37 37 GLU H H 37 7.741 7.602 0.139 1
1 506 . 15 1 1 A 37 37 GLU HA H 37 3.708 4.056 -0.348 1
1 511 . 15 1 1 A 37 37 GLU C C 37 177.324 179.001 -1.677 1
1 512 . 15 1 1 A 37 37 GLU CA C 37 58.698 59.410 -0.712 1
1 513 . 15 1 1 A 37 37 GLU CB C 37 30.199 29.491 0.708 1
1 515 . 15 1 1 A 37 37 GLU N N 37 120.704 119.062 1.642 1
1 516 . 15 1 1 A 38 38 LEU H H 38 7.531 8.064 -0.533 1
1 517 . 15 1 1 A 38 38 LEU HA H 38 3.873 4.147 -0.274 1
1 527 . 15 1 1 A 38 38 LEU C C 38 177.357 178.702 -1.345 1
1 528 . 15 1 1 A 38 38 LEU CA C 38 58.305 58.426 -0.121 1
1 529 . 15 1 1 A 38 38 LEU CB C 38 40.837 41.672 -0.835 1
1 533 . 15 1 1 A 38 38 LEU N N 38 119.200 121.989 -2.789 1
1 534 . 15 1 1 A 39 39 LYS H H 39 8.083 8.153 -0.070 1
1 535 . 15 1 1 A 39 39 LYS HA H 39 3.608 3.919 -0.311 1
1 544 . 15 1 1 A 39 39 LYS C C 39 177.373 178.760 -1.387 1
1 545 . 15 1 1 A 39 39 LYS CA C 39 60.290 59.208 1.082 1
1 546 . 15 1 1 A 39 39 LYS CB C 39 32.178 31.968 0.210 1
1 550 . 15 1 1 A 39 39 LYS N N 39 116.943 118.802 -1.859 1
1 551 . 15 1 1 A 40 40 LYS H H 40 7.632 8.118 -0.486 1
1 552 . 15 1 1 A 40 40 LYS HA H 40 3.864 3.910 -0.046 1
1 561 . 15 1 1 A 40 40 LYS C C 40 179.566 178.476 1.090 1
1 562 . 15 1 1 A 40 40 LYS CA C 40 58.993 58.869 0.124 1
1 563 . 15 1 1 A 40 40 LYS CB C 40 31.758 31.952 -0.194 1
1 567 . 15 1 1 A 40 40 LYS N N 40 118.274 118.932 -0.658 1
1 568 . 15 1 1 A 41 41 TYR H H 41 7.823 8.060 -0.237 1
1 569 . 15 1 1 A 41 41 TYR HA H 41 3.926 4.053 -0.127 1
1 576 . 15 1 1 A 41 41 TYR C C 41 176.625 177.947 -1.322 1
1 577 . 15 1 1 A 41 41 TYR CA C 41 59.757 60.663 -0.906 1
1 578 . 15 1 1 A 41 41 TYR CB C 41 36.901 37.964 -1.063 1
1 583 . 15 1 1 A 41 41 TYR N N 41 117.811 119.328 -1.517 1
1 584 . 15 1 1 A 42 42 LEU H H 42 7.964 8.490 -0.526 1
1 585 . 15 1 1 A 42 42 LEU HA H 42 3.704 4.096 -0.392 1
1 595 . 15 1 1 A 42 42 LEU C C 42 178.396 179.208 -0.812 1
1 596 . 15 1 1 A 42 42 LEU CA C 42 58.237 57.787 0.450 1
1 597 . 15 1 1 A 42 42 LEU CB C 42 40.507 40.941 -0.434 1
1 601 . 15 1 1 A 42 42 LEU N N 42 115.960 120.248 -4.288 1
1 602 . 15 1 1 A 43 43 GLU H H 43 8.193 8.540 -0.347 1
1 603 . 15 1 1 A 43 43 GLU HA H 43 3.882 3.892 -0.010 1
1 608 . 15 1 1 A 43 43 GLU C C 43 179.193 178.698 0.495 1
1 609 . 15 1 1 A 43 43 GLU CA C 43 59.122 59.882 -0.760 1
1 610 . 15 1 1 A 43 43 GLU CB C 43 29.244 29.203 0.041 1
1 612 . 15 1 1 A 43 43 GLU N N 43 117.175 119.932 -2.757 1
1 613 . 15 1 1 A 44 44 GLU H H 44 7.601 7.486 0.115 1
1 614 . 15 1 1 A 44 44 GLU HA H 44 3.936 3.922 0.014 1
1 619 . 15 1 1 A 44 44 GLU C C 44 179.875 179.027 0.848 1
1 620 . 15 1 1 A 44 44 GLU CA C 44 58.867 59.296 -0.429 1
1 621 . 15 1 1 A 44 44 GLU CB C 44 28.648 29.113 -0.465 1
1 623 . 15 1 1 A 44 44 GLU N N 44 120.472 119.349 1.123 1
1 624 . 15 1 1 A 45 45 PHE H H 45 8.260 7.439 0.821 1
1 625 . 15 1 1 A 45 45 PHE HA H 45 4.520 4.092 0.428 1
1 633 . 15 1 1 A 45 45 PHE C C 45 177.942 177.881 0.061 1
1 634 . 15 1 1 A 45 45 PHE CA C 45 55.945 61.027 -5.082 1
1 635 . 15 1 1 A 45 45 PHE CB C 45 36.680 38.058 -1.378 1
1 641 . 15 1 1 A 45 45 PHE N N 45 119.272 119.274 -0.002 1
1 642 . 15 1 1 A 46 46 ARG H H 46 8.023 8.780 -0.757 1
1 643 . 15 1 1 A 46 46 ARG HA H 46 4.074 3.954 0.120 1
1 651 . 15 1 1 A 46 46 ARG C C 46 177.617 178.727 -1.110 1
1 652 . 15 1 1 A 46 46 ARG CA C 46 58.194 59.593 -1.399 1
1 653 . 15 1 1 A 46 46 ARG CB C 46 29.737 29.546 0.191 1
1 656 . 15 1 1 A 46 46 ARG N N 46 118.136 120.912 -2.776 1
1 658 . 15 1 1 A 47 47 LYS H H 47 7.470 7.604 -0.134 1
1 659 . 15 1 1 A 47 47 LYS HA H 47 4.143 4.123 0.020 1
1 668 . 15 1 1 A 47 47 LYS C C 47 177.324 178.221 -0.897 1
1 669 . 15 1 1 A 47 47 LYS CA C 47 57.726 59.417 -1.691 1
1 670 . 15 1 1 A 47 47 LYS CB C 47 32.409 32.324 0.085 1
1 674 . 15 1 1 A 47 47 LYS N N 47 116.943 118.848 -1.905 1
1 675 . 15 1 1 A 48 48 GLU H H 48 7.615 7.503 0.112 1
1 676 . 15 1 1 A 48 48 GLU HA H 48 4.428 4.593 -0.165 1
1 681 . 15 1 1 A 48 48 GLU C C 48 176.869 176.858 0.011 1
1 682 . 15 1 1 A 48 48 GLU CA C 48 55.945 56.345 -0.400 1
1 683 . 15 1 1 A 48 48 GLU CB C 48 29.696 30.302 -0.606 1
1 685 . 15 1 1 A 48 48 GLU N N 48 118.852 116.670 2.182 1
1 686 . 15 1 1 A 49 49 SER H H 49 7.725 7.952 -0.227 1
1 687 . 15 1 1 A 49 49 SER HA H 49 4.244 4.149 0.095 1
1 690 . 15 1 1 A 49 49 SER C C 49 174.838 176.843 -2.005 1
1 691 . 15 1 1 A 49 49 SER CA C 49 59.366 60.917 -1.551 1
1 692 . 15 1 1 A 49 49 SER CB C 49 63.116 63.094 0.022 1
1 693 . 15 1 1 A 49 49 SER N N 49 114.224 116.718 -2.494 1
1 694 . 15 1 1 A 50 50 GLN H H 50 8.548 7.934 0.614 1
1 695 . 15 1 1 A 50 50 GLN HA H 50 4.398 4.144 0.254 1
1 702 . 15 1 1 A 50 50 GLN C C 50 175.732 176.263 -0.531 1
1 703 . 15 1 1 A 50 50 GLN CA C 50 56.272 58.296 -2.024 1
1 704 . 15 1 1 A 50 50 GLN CB C 50 28.946 29.001 -0.055 1
1 706 . 15 1 1 A 50 50 GLN N N 50 120.125 119.299 0.826 1
1 708 . 15 1 1 A 51 51 ASN H H 51 8.534 7.914 0.620 1
1 709 . 15 1 1 A 51 51 ASN HA H 51 4.980 4.856 0.124 1
1 714 . 15 1 1 A 51 51 ASN C C 51 173.717 173.639 0.078 1
1 715 . 15 1 1 A 51 51 ASN CA C 51 52.804 52.372 0.432 1
1 716 . 15 1 1 A 51 51 ASN CB C 51 39.583 39.152 0.431 1
1 717 . 15 1 1 A 51 51 ASN N N 51 118.158 115.822 2.336 1
1 719 . 15 1 1 A 52 52 ILE H H 52 7.492 7.565 -0.073 1
1 720 . 15 1 1 A 52 52 ILE HA H 52 5.338 5.413 -0.075 1
1 730 . 15 1 1 A 52 52 ILE C C 52 175.049 173.829 1.220 1
1 731 . 15 1 1 A 52 52 ILE CA C 52 59.364 59.329 0.035 1
1 732 . 15 1 1 A 52 52 ILE CB C 52 42.163 42.310 -0.147 1
1 736 . 15 1 1 A 52 52 ILE N N 52 117.927 121.107 -3.180 1
1 737 . 15 1 1 A 53 53 LYS H H 53 8.467 9.065 -0.598 1
1 738 . 15 1 1 A 53 53 LYS HA H 53 5.044 5.194 -0.150 1
1 747 . 15 1 1 A 53 53 LYS C C 53 175.082 175.555 -0.473 1
1 748 . 15 1 1 A 53 53 LYS CA C 53 55.429 55.087 0.342 1
1 749 . 15 1 1 A 53 53 LYS CB C 53 36.446 35.258 1.188 1
1 753 . 15 1 1 A 53 53 LYS N N 53 123.249 127.469 -4.220 1
1 754 . 15 1 1 A 54 54 VAL H H 54 8.490 8.772 -0.282 1
1 755 . 15 1 1 A 54 54 VAL HA H 54 5.159 4.853 0.306 1
1 763 . 15 1 1 A 54 54 VAL C C 54 173.473 173.820 -0.347 1
1 764 . 15 1 1 A 54 54 VAL CA C 54 60.163 61.188 -1.025 1
1 765 . 15 1 1 A 54 54 VAL CB C 54 35.509 32.808 2.701 1
1 768 . 15 1 1 A 54 54 VAL N N 54 120.762 125.380 -4.618 1
1 769 . 15 1 1 A 55 55 LEU H H 55 8.636 8.758 -0.122 1
1 770 . 15 1 1 A 55 55 LEU HA H 55 4.670 4.575 0.095 1
1 780 . 15 1 1 A 55 55 LEU C C 55 173.652 174.137 -0.485 1
1 781 . 15 1 1 A 55 55 LEU CA C 55 52.289 53.464 -1.175 1
1 782 . 15 1 1 A 55 55 LEU CB C 55 42.070 42.410 -0.340 1
1 786 . 15 1 1 A 55 55 LEU N N 55 131.898 129.411 2.487 1
1 787 . 15 1 1 A 56 56 ILE H H 56 9.188 9.110 0.078 1
1 788 . 15 1 1 A 56 56 ILE HA H 56 4.879 5.136 -0.257 1
1 798 . 15 1 1 A 56 56 ILE C C 56 174.172 174.358 -0.186 1
1 799 . 15 1 1 A 56 56 ILE CA C 56 59.976 59.805 0.171 1
1 800 . 15 1 1 A 56 56 ILE CB C 56 38.181 39.048 -0.867 1
1 804 . 15 1 1 A 56 56 ILE N N 56 126.373 128.928 -2.555 1
1 805 . 15 1 1 A 57 57 LEU H H 57 8.929 9.305 -0.376 1
1 806 . 15 1 1 A 57 57 LEU HA H 57 5.394 5.240 0.154 1
1 816 . 15 1 1 A 57 57 LEU C C 57 175.358 175.992 -0.634 1
1 817 . 15 1 1 A 57 57 LEU CA C 57 52.086 52.941 -0.855 1
1 818 . 15 1 1 A 57 57 LEU CB C 57 42.445 42.631 -0.186 1
1 822 . 15 1 1 A 57 57 LEU N N 57 126.547 128.490 -1.943 1
1 823 . 15 1 1 A 58 58 VAL H H 58 8.542 8.984 -0.442 1
1 824 . 15 1 1 A 58 58 VAL HA H 58 5.253 4.763 0.490 1
1 832 . 15 1 1 A 58 58 VAL C C 58 175.244 175.927 -0.683 1
1 833 . 15 1 1 A 58 58 VAL CA C 58 58.241 59.003 -0.762 1
1 834 . 15 1 1 A 58 58 VAL CB C 58 33.165 34.487 -1.322 1
1 837 . 15 1 1 A 58 58 VAL N N 58 114.398 120.768 -6.370 1
1 838 . 15 1 1 A 59 59 SER H H 59 8.797 8.847 -0.050 1
1 839 . 15 1 1 A 59 59 SER HA H 59 5.063 4.434 0.629 1
1 842 . 15 1 1 A 59 59 SER C C 59 174.172 174.107 0.065 1
1 843 . 15 1 1 A 59 59 SER CA C 59 59.320 60.279 -0.959 1
1 844 . 15 1 1 A 59 59 SER CB C 59 65.600 63.182 2.418 1
1 845 . 15 1 1 A 59 59 SER N N 59 115.497 116.318 -0.821 1
1 846 . 15 1 1 A 60 60 ASN H H 60 7.730 7.971 -0.241 1
1 847 . 15 1 1 A 60 60 ASN HA H 60 4.811 5.086 -0.275 1
1 852 . 15 1 1 A 60 60 ASN C C 60 174.464 174.982 -0.518 1
1 853 . 15 1 1 A 60 60 ASN CA C 60 52.007 52.161 -0.154 1
1 854 . 15 1 1 A 60 60 ASN CB C 60 40.336 41.117 -0.781 1
1 855 . 15 1 1 A 60 60 ASN N N 60 117.522 117.782 -0.260 1
1 857 . 15 1 1 A 61 61 ASP H H 61 8.577 8.814 -0.237 1
1 858 . 15 1 1 A 61 61 ASP HA H 61 4.365 4.322 0.043 1
1 861 . 15 1 1 A 61 61 ASP C C 61 177.357 178.032 -0.675 1
1 862 . 15 1 1 A 61 61 ASP CA C 61 57.351 56.742 0.609 1
1 863 . 15 1 1 A 61 61 ASP CB C 61 40.383 40.394 -0.011 1
1 864 . 15 1 1 A 61 61 ASP N N 61 119.431 121.506 -2.075 1
1 865 . 15 1 1 A 62 62 GLU H H 62 8.405 8.383 0.022 1
1 866 . 15 1 1 A 62 62 GLU HA H 62 4.121 4.021 0.100 1
1 871 . 15 1 1 A 62 62 GLU C C 62 179.615 178.888 0.727 1
1 872 . 15 1 1 A 62 62 GLU CA C 62 59.593 59.389 0.204 1
1 873 . 15 1 1 A 62 62 GLU CB C 62 28.478 29.298 -0.820 1
1 875 . 15 1 1 A 62 62 GLU N N 62 122.150 120.171 1.979 1
1 876 . 15 1 1 A 63 63 GLU H H 63 8.384 8.251 0.133 1
1 877 . 15 1 1 A 63 63 GLU HA H 63 3.913 4.087 -0.174 1
1 882 . 15 1 1 A 63 63 GLU C C 63 178.478 178.971 -0.493 1
1 883 . 15 1 1 A 63 63 GLU CA C 63 58.273 59.001 -0.728 1
1 884 . 15 1 1 A 63 63 GLU CB C 63 29.931 28.449 1.482 1
1 886 . 15 1 1 A 63 63 GLU N N 63 119.084 117.915 1.169 1
1 887 . 15 1 1 A 64 64 LEU H H 64 7.717 7.961 -0.244 1
1 888 . 15 1 1 A 64 64 LEU HA H 64 3.750 4.039 -0.289 1
1 898 . 15 1 1 A 64 64 LEU C C 64 177.535 177.957 -0.422 1
1 899 . 15 1 1 A 64 64 LEU CA C 64 58.944 58.196 0.748 1
1 900 . 15 1 1 A 64 64 LEU CB C 64 41.695 41.443 0.252 1
1 904 . 15 1 1 A 64 64 LEU N N 64 120.357 123.007 -2.650 1
1 905 . 15 1 1 A 65 65 ASP H H 65 7.922 8.453 -0.531 1
1 906 . 15 1 1 A 65 65 ASP HA H 65 4.313 4.234 0.079 1
1 909 . 15 1 1 A 65 65 ASP C C 65 179.095 178.713 0.382 1
1 910 . 15 1 1 A 65 65 ASP CA C 65 57.272 57.633 -0.361 1
1 911 . 15 1 1 A 65 65 ASP CB C 65 40.196 41.752 -1.556 1
1 912 . 15 1 1 A 65 65 ASP N N 65 118.100 118.748 -0.648 1
1 913 . 15 1 1 A 66 66 LYS H H 66 7.802 8.275 -0.473 1
1 914 . 15 1 1 A 66 66 LYS HA H 66 4.078 3.904 0.174 1
1 923 . 15 1 1 A 66 66 LYS C C 66 178.624 178.847 -0.223 1
1 924 . 15 1 1 A 66 66 LYS CA C 66 58.429 59.676 -1.247 1
1 925 . 15 1 1 A 66 66 LYS CB C 66 31.727 32.311 -0.584 1
1 929 . 15 1 1 A 66 66 LYS N N 66 119.343 117.669 1.674 1
1 930 . 15 1 1 A 67 67 ALA H H 67 8.480 8.275 0.205 1
1 931 . 15 1 1 A 67 67 ALA HA H 67 3.853 4.119 -0.266 1
1 935 . 15 1 1 A 67 67 ALA C C 67 178.591 179.489 -0.898 1
1 936 . 15 1 1 A 67 67 ALA CA C 67 55.403 55.145 0.258 1
1 937 . 15 1 1 A 67 67 ALA CB C 67 17.793 18.462 -0.669 1
1 938 . 15 1 1 A 67 67 ALA N N 67 121.562 122.367 -0.805 1
1 939 . 15 1 1 A 68 68 LYS H H 68 8.186 7.736 0.450 1
1 940 . 15 1 1 A 68 68 LYS HA H 68 3.805 4.046 -0.241 1
1 949 . 15 1 1 A 68 68 LYS C C 68 179.095 178.830 0.265 1
1 950 . 15 1 1 A 68 68 LYS CA C 68 59.952 59.270 0.682 1
1 951 . 15 1 1 A 68 68 LYS CB C 68 32.181 32.047 0.134 1
1 955 . 15 1 1 A 68 68 LYS N N 68 116.165 116.498 -0.333 1
1 956 . 15 1 1 A 69 69 GLU H H 69 7.904 8.298 -0.394 1
1 957 . 15 1 1 A 69 69 GLU HA H 69 3.995 4.000 -0.005 1
1 962 . 15 1 1 A 69 69 GLU C C 69 179.079 179.303 -0.224 1
1 963 . 15 1 1 A 69 69 GLU CA C 69 59.022 59.041 -0.019 1
1 964 . 15 1 1 A 69 69 GLU CB C 69 29.274 29.312 -0.038 1
1 966 . 15 1 1 A 69 69 GLU N N 69 119.489 119.491 -0.002 1
1 967 . 15 1 1 A 70 70 LEU H H 70 7.962 8.038 -0.076 1
1 968 . 15 1 1 A 70 70 LEU HA H 70 4.020 4.008 0.012 1
1 978 . 15 1 1 A 70 70 LEU C C 70 178.738 178.873 -0.135 1
1 979 . 15 1 1 A 70 70 LEU CA C 70 57.486 57.957 -0.471 1
1 980 . 15 1 1 A 70 70 LEU CB C 70 41.695 41.647 0.048 1
1 984 . 15 1 1 A 70 70 LEU N N 70 119.431 120.473 -1.042 1
1 985 . 15 1 1 A 71 71 ALA H H 71 8.260 8.184 0.076 1
1 986 . 15 1 1 A 71 71 ALA HA H 71 3.845 4.042 -0.197 1
1 990 . 15 1 1 A 71 71 ALA C C 71 179.518 180.074 -0.556 1
1 991 . 15 1 1 A 71 71 ALA CA C 71 55.139 55.009 0.130 1
1 992 . 15 1 1 A 71 71 ALA CB C 71 18.487 18.649 -0.162 1
1 993 . 15 1 1 A 71 71 ALA N N 71 119.604 120.939 -1.335 1
1 994 . 15 1 1 A 72 72 GLN H H 72 7.910 8.349 -0.439 1
1 995 . 15 1 1 A 72 72 GLN HA H 72 4.154 4.004 0.150 1
1 1002 . 15 1 1 A 72 72 GLN C C 72 178.900 178.604 0.296 1
1 1003 . 15 1 1 A 72 72 GLN CA C 72 58.194 58.893 -0.699 1
1 1004 . 15 1 1 A 72 72 GLN CB C 72 28.056 28.468 -0.412 1
1 1006 . 15 1 1 A 72 72 GLN N N 72 115.960 117.771 -1.811 1
1 1008 . 15 1 1 A 73 73 LYS H H 73 7.841 8.045 -0.204 1
1 1009 . 15 1 1 A 73 73 LYS HA H 73 4.171 4.079 0.092 1
1 1018 . 15 1 1 A 73 73 LYS C C 73 177.730 178.665 -0.935 1
1 1019 . 15 1 1 A 73 73 LYS CA C 73 57.867 59.098 -1.231 1
1 1020 . 15 1 1 A 73 73 LYS CB C 73 32.277 32.110 0.167 1
1 1024 . 15 1 1 A 73 73 LYS N N 73 119.027 119.531 -0.504 1
1 1025 . 15 1 1 A 74 74 MET H H 74 7.746 8.002 -0.256 1
1 1026 . 15 1 1 A 74 74 MET HA H 74 4.403 4.532 -0.129 1
1 1034 . 15 1 1 A 74 74 MET C C 74 174.416 174.918 -0.502 1
1 1035 . 15 1 1 A 74 74 MET CA C 74 55.194 55.354 -0.160 1
1 1036 . 15 1 1 A 74 74 MET CB C 74 33.366 33.036 0.330 1
1 1039 . 15 1 1 A 74 74 MET N N 74 115.786 115.300 0.486 1
1 1040 . 15 1 1 A 75 75 GLU H H 75 8.076 7.781 0.295 1
1 1041 . 15 1 1 A 75 75 GLU HA H 75 4.001 3.906 0.095 1
1 1046 . 15 1 1 A 75 75 GLU C C 75 175.130 175.198 -0.068 1
1 1047 . 15 1 1 A 75 75 GLU CA C 75 56.722 57.730 -1.008 1
1 1048 . 15 1 1 A 75 75 GLU CB C 75 27.118 27.175 -0.057 1
1 1050 . 15 1 1 A 75 75 GLU N N 75 116.249 115.870 0.379 1
1 1051 . 15 1 1 A 76 76 ILE H H 76 7.560 7.722 -0.162 1
1 1052 . 15 1 1 A 76 76 ILE HA H 76 4.428 4.307 0.121 1
1 1062 . 15 1 1 A 76 76 ILE C C 76 174.529 175.192 -0.663 1
1 1063 . 15 1 1 A 76 76 ILE CA C 76 58.475 60.242 -1.767 1
1 1064 . 15 1 1 A 76 76 ILE CB C 76 40.337 38.655 1.682 1
1 1068 . 15 1 1 A 76 76 ILE N N 76 115.960 120.258 -4.298 1
1 1069 . 15 1 1 A 77 77 ASP H H 77 8.889 8.691 0.198 1
1 1070 . 15 1 1 A 77 77 ASP HA H 77 4.569 4.830 -0.261 1
1 1073 . 15 1 1 A 77 77 ASP C C 77 174.123 175.969 -1.846 1
1 1074 . 15 1 1 A 77 77 ASP CA C 77 54.069 54.275 -0.206 1
1 1075 . 15 1 1 A 77 77 ASP CB C 77 40.233 39.927 0.306 1
1 1076 . 15 1 1 A 77 77 ASP N N 77 126.142 128.357 -2.215 1
1 1077 . 15 1 1 A 78 78 VAL H H 78 7.754 8.481 -0.727 1
1 1078 . 15 1 1 A 78 78 VAL HA H 78 5.192 5.112 0.080 1
1 1086 . 15 1 1 A 78 78 VAL C C 78 174.968 173.826 1.142 1
1 1087 . 15 1 1 A 78 78 VAL CA C 78 58.804 59.183 -0.379 1
1 1088 . 15 1 1 A 78 78 VAL CB C 78 35.293 35.330 -0.037 1
1 1091 . 15 1 1 A 78 78 VAL N N 78 122.844 116.865 5.979 1
1 1092 . 15 1 1 A 79 79 ARG H H 79 8.499 9.058 -0.559 1
1 1093 . 15 1 1 A 79 79 ARG HA H 79 4.712 4.811 -0.099 1
1 1100 . 15 1 1 A 79 79 ARG C C 79 174.221 174.573 -0.352 1
1 1101 . 15 1 1 A 79 79 ARG CA C 79 54.117 54.920 -0.803 1
1 1102 . 15 1 1 A 79 79 ARG CB C 79 31.196 32.090 -0.894 1
1 1105 . 15 1 1 A 79 79 ARG N N 79 125.637 122.102 3.535 1
1 1106 . 15 1 1 A 80 80 THR H H 80 8.416 8.803 -0.387 1
1 1107 . 15 1 1 A 80 80 THR HA H 80 5.332 4.838 0.494 1
1 1112 . 15 1 1 A 80 80 THR C C 80 174.497 174.127 0.370 1
1 1113 . 15 1 1 A 80 80 THR CA C 80 59.694 62.275 -2.581 1
1 1114 . 15 1 1 A 80 80 THR CB C 80 69.772 69.029 0.743 1
1 1116 . 15 1 1 A 80 80 THR N N 80 118.084 120.231 -2.147 1
1 1117 . 15 1 1 A 81 81 ARG H H 81 8.758 9.094 -0.336 1
1 1118 . 15 1 1 A 81 81 ARG HA H 81 4.362 4.700 -0.338 1
1 1126 . 15 1 1 A 81 81 ARG C C 81 173.733 173.977 -0.244 1
1 1127 . 15 1 1 A 81 81 ARG CA C 81 53.273 53.687 -0.414 1
1 1128 . 15 1 1 A 81 81 ARG CB C 81 33.915 32.692 1.223 1
1 1131 . 15 1 1 A 81 81 ARG N N 81 122.844 126.215 -3.371 1
1 1133 . 15 1 1 A 82 82 LYS H H 82 8.721 8.408 0.313 1
1 1134 . 15 1 1 A 82 82 LYS HA H 82 4.701 5.165 -0.464 1
1 1143 . 15 1 1 A 82 82 LYS C C 82 175.667 175.551 0.116 1
1 1144 . 15 1 1 A 82 82 LYS CA C 82 54.960 54.871 0.089 1
1 1145 . 15 1 1 A 82 82 LYS CB C 82 32.603 34.447 -1.844 1
1 1149 . 15 1 1 A 82 82 LYS N N 82 124.668 122.958 1.710 1
1 1150 . 15 1 1 A 83 83 VAL H H 83 9.112 9.092 0.020 1
1 1151 . 15 1 1 A 83 83 VAL HA H 83 4.796 4.898 -0.102 1
1 1159 . 15 1 1 A 83 83 VAL C C 83 174.594 174.902 -0.308 1
1 1160 . 15 1 1 A 83 83 VAL CA C 83 59.413 59.683 -0.270 1
1 1161 . 15 1 1 A 83 83 VAL CB C 83 35.298 35.411 -0.113 1
1 1164 . 15 1 1 A 83 83 VAL N N 83 122.381 120.092 2.289 1
1 1165 . 15 1 1 A 84 84 THR H H 84 9.200 8.711 0.489 1
1 1166 . 15 1 1 A 84 84 THR HA H 84 4.579 4.529 0.050 1
1 1171 . 15 1 1 A 84 84 THR C C 84 173.993 174.557 -0.564 1
1 1172 . 15 1 1 A 84 84 THR CA C 84 60.960 62.323 -1.363 1
1 1173 . 15 1 1 A 84 84 THR CB C 84 70.100 69.767 0.333 1
1 1175 . 15 1 1 A 84 84 THR N N 84 113.183 115.306 -2.123 1
1 1176 . 15 1 1 A 85 85 SER H H 85 7.688 8.232 -0.544 1
1 1177 . 15 1 1 A 85 85 SER HA H 85 5.136 4.743 0.393 1
1 1180 . 15 1 1 A 85 85 SER CA C 85 55.205 55.798 -0.593 1
1 1181 . 15 1 1 A 85 85 SER CB C 85 64.376 64.003 0.373 1
1 1182 . 15 1 1 A 85 85 SER N N 85 115.555 116.107 -0.552 1
1 1183 . 15 1 1 A 86 86 PRO HA H 86 4.090 4.197 -0.107 1
1 1190 . 15 1 1 A 86 86 PRO C C 86 177.227 177.567 -0.340 1
1 1191 . 15 1 1 A 86 86 PRO CA C 86 65.038 65.678 -0.640 1
1 1192 . 15 1 1 A 86 86 PRO CB C 86 31.711 31.881 -0.170 1
1 1195 . 15 1 1 A 87 87 ASP H H 87 8.131 8.513 -0.382 1
1 1196 . 15 1 1 A 87 87 ASP HA H 87 4.223 4.374 -0.151 1
1 1199 . 15 1 1 A 87 87 ASP C C 87 178.721 178.568 0.153 1
1 1200 . 15 1 1 A 87 87 ASP CA C 87 57.311 57.046 0.265 1
1 1201 . 15 1 1 A 87 87 ASP CB C 87 40.102 41.665 -1.563 1
1 1202 . 15 1 1 A 87 87 ASP N N 87 115.381 117.423 -2.042 1
1 1203 . 15 1 1 A 88 88 GLU H H 88 7.571 8.017 -0.446 1
1 1204 . 15 1 1 A 88 88 GLU HA H 88 3.659 4.028 -0.369 1
1 1209 . 15 1 1 A 88 88 GLU C C 88 177.097 178.753 -1.656 1
1 1210 . 15 1 1 A 88 88 GLU CA C 88 58.729 58.913 -0.184 1
1 1211 . 15 1 1 A 88 88 GLU CB C 88 30.052 29.731 0.321 1
1 1213 . 15 1 1 A 88 88 GLU N N 88 120.009 119.276 0.733 1
1 1214 . 15 1 1 A 89 89 ALA H H 89 7.423 7.693 -0.270 1
1 1215 . 15 1 1 A 89 89 ALA HA H 89 3.900 4.316 -0.416 1
1 1219 . 15 1 1 A 89 89 ALA C C 89 178.267 180.023 -1.756 1
1 1220 . 15 1 1 A 89 89 ALA CA C 89 55.607 55.169 0.438 1
1 1221 . 15 1 1 A 89 89 ALA CB C 89 17.348 18.470 -1.122 1
1 1222 . 15 1 1 A 89 89 ALA N N 89 118.873 122.278 -3.405 1
1 1223 . 15 1 1 A 90 90 LYS H H 90 8.046 7.922 0.124 1
1 1224 . 15 1 1 A 90 90 LYS HA H 90 3.669 3.999 -0.330 1
1 1233 . 15 1 1 A 90 90 LYS C C 90 177.649 178.971 -1.322 1
1 1234 . 15 1 1 A 90 90 LYS CA C 90 60.351 59.845 0.506 1
1 1235 . 15 1 1 A 90 90 LYS CB C 90 32.087 32.237 -0.150 1
1 1239 . 15 1 1 A 90 90 LYS N N 90 114.834 117.349 -2.515 1
1 1240 . 15 1 1 A 91 91 ARG H H 91 7.468 7.807 -0.339 1
1 1241 . 15 1 1 A 91 91 ARG HA H 91 3.887 3.907 -0.020 1
1 1249 . 15 1 1 A 91 91 ARG C C 91 178.998 179.100 -0.102 1
1 1250 . 15 1 1 A 91 91 ARG CA C 91 59.164 59.024 0.140 1
1 1251 . 15 1 1 A 91 91 ARG CB C 91 29.274 29.653 -0.379 1
1 1254 . 15 1 1 A 91 91 ARG N N 91 119.029 119.684 -0.655 1
1 1256 . 15 1 1 A 92 92 TRP H H 92 8.136 8.102 0.034 1
1 1257 . 15 1 1 A 92 92 TRP HA H 92 4.818 4.487 0.331 1
1 1266 . 15 1 1 A 92 92 TRP C C 92 179.566 179.192 0.374 1
1 1267 . 15 1 1 A 92 92 TRP CA C 92 58.663 59.668 -1.005 1
1 1268 . 15 1 1 A 92 92 TRP CB C 92 29.790 29.655 0.135 1
1 1274 . 15 1 1 A 92 92 TRP N N 92 118.100 120.369 -2.269 1
1 1276 . 15 1 1 A 93 93 ILE H H 93 8.363 8.450 -0.087 1
1 1277 . 15 1 1 A 93 93 ILE HA H 93 3.544 3.808 -0.264 1
1 1287 . 15 1 1 A 93 93 ILE C C 93 176.820 178.289 -1.469 1
1 1288 . 15 1 1 A 93 93 ILE CA C 93 66.225 65.210 1.015 1
1 1289 . 15 1 1 A 93 93 ILE CB C 93 37.571 37.593 -0.022 1
1 1293 . 15 1 1 A 93 93 ILE N N 93 120.588 120.245 0.343 1
1 1294 . 15 1 1 A 94 94 LYS H H 94 8.264 7.721 0.543 1
1 1295 . 15 1 1 A 94 94 LYS HA H 94 3.865 4.009 -0.144 1
1 1304 . 15 1 1 A 94 94 LYS C C 94 179.258 179.252 0.006 1
1 1305 . 15 1 1 A 94 94 LYS CA C 94 59.889 59.857 0.032 1
1 1306 . 15 1 1 A 94 94 LYS CB C 94 32.225 32.378 -0.153 1
1 1310 . 15 1 1 A 94 94 LYS N N 94 121.687 121.764 -0.077 1
1 1311 . 15 1 1 A 95 95 GLU H H 95 8.360 8.277 0.083 1
1 1312 . 15 1 1 A 95 95 GLU HA H 95 4.023 4.160 -0.137 1
1 1317 . 15 1 1 A 95 95 GLU C C 95 178.884 178.924 -0.040 1
1 1318 . 15 1 1 A 95 95 GLU CA C 95 59.366 59.166 0.200 1
1 1319 . 15 1 1 A 95 95 GLU CB C 95 29.508 28.927 0.581 1
1 1321 . 15 1 1 A 95 95 GLU N N 95 118.505 117.527 0.978 1
1 1322 . 15 1 1 A 96 96 PHE H H 96 8.212 8.313 -0.101 1
1 1323 . 15 1 1 A 96 96 PHE HA H 96 4.512 4.271 0.241 1
1 1331 . 15 1 1 A 96 96 PHE C C 96 176.820 177.381 -0.561 1
1 1332 . 15 1 1 A 96 96 PHE CA C 96 59.608 60.884 -1.276 1
1 1333 . 15 1 1 A 96 96 PHE CB C 96 40.431 39.199 1.232 1
1 1339 . 15 1 1 A 96 96 PHE N N 96 120.369 122.347 -1.978 1
1 1340 . 15 1 1 A 97 97 SER H H 97 8.216 8.406 -0.190 1
1 1341 . 15 1 1 A 97 97 SER HA H 97 3.816 3.946 -0.130 1
1 1344 . 15 1 1 A 97 97 SER C C 97 175.618 177.233 -1.615 1
1 1345 . 15 1 1 A 97 97 SER CA C 97 60.492 61.615 -1.123 1
1 1346 . 15 1 1 A 97 97 SER CB C 97 63.022 62.982 0.040 1
1 1347 . 15 1 1 A 97 97 SER N N 97 111.969 114.344 -2.375 1
1 1348 . 15 1 1 A 98 98 GLU H H 98 7.655 7.598 0.057 1
1 1349 . 15 1 1 A 98 98 GLU HA H 98 4.187 4.054 0.133 1
1 1354 . 15 1 1 A 98 98 GLU C C 98 177.698 179.643 -1.945 1
1 1355 . 15 1 1 A 98 98 GLU CA C 98 57.069 59.254 -2.185 1
1 1356 . 15 1 1 A 98 98 GLU CB C 98 29.321 29.201 0.120 1
1 1358 . 15 1 1 A 98 98 GLU N N 98 120.588 121.755 -1.167 1
1 1359 . 15 1 1 A 99 99 GLU H H 99 7.794 7.673 0.121 1
1 1360 . 15 1 1 A 99 99 GLU HA H 99 4.123 4.049 0.074 1
1 1365 . 15 1 1 A 99 99 GLU C C 99 177.665 177.412 0.253 1
1 1366 . 15 1 1 A 99 99 GLU CA C 99 57.304 57.736 -0.432 1
1 1367 . 15 1 1 A 99 99 GLU CB C 99 29.368 29.759 -0.391 1
1 1369 . 15 1 1 A 99 99 GLU N N 99 120.067 118.237 1.830 1
1 1370 . 15 1 1 A 100 100 GLY H H 100 8.138 8.654 -0.516 1
1 1371 . 15 1 1 A 100 100 GLY HA2 H 100 3.865 3.804 0.061 1
1 1372 . 15 1 1 A 100 100 GLY HA3 H 100 3.715 3.850 -0.135 1
1 1373 . 15 1 1 A 100 100 GLY C C 100 174.464 175.245 -0.781 1
1 1374 . 15 1 1 A 100 100 GLY CA C 100 45.305 45.375 -0.070 1
1 1375 . 15 1 1 A 100 100 GLY N N 100 107.802 108.275 -0.473 1
1 1376 . 15 1 1 A 101 101 GLY H H 101 8.023 8.497 -0.474 1
1 1377 . 15 1 1 A 101 101 GLY HA2 H 101 3.865 3.851 0.014 1
1 1378 . 15 1 1 A 101 101 GLY HA3 H 101 3.892 3.858 0.034 1
1 1379 . 15 1 1 A 101 101 GLY C C 101 174.204 174.772 -0.568 1
1 1380 . 15 1 1 A 101 101 GLY CA C 101 45.036 45.400 -0.364 1
1 1381 . 15 1 1 A 101 101 GLY N N 101 108.032 108.768 -0.736 1
1 1382 . 15 1 1 A 102 102 SER H H 102 8.059 7.232 0.827 1
1 1383 . 15 1 1 A 102 102 SER HA H 102 4.380 4.781 -0.401 1
1 1386 . 15 1 1 A 102 102 SER C C 102 174.627 175.116 -0.489 1
1 1387 . 15 1 1 A 102 102 SER CA C 102 58.194 57.482 0.712 1
1 1388 . 15 1 1 A 102 102 SER CB C 102 63.538 63.287 0.251 1
1 1389 . 15 1 1 A 102 102 SER N N 102 115.266 112.362 2.904 1
1 1390 . 15 1 1 A 103 103 LEU H H 103 8.287 7.931 0.356 1
1 1391 . 15 1 1 A 103 103 LEU HA H 103 4.301 3.889 0.412 1
1 1401 . 15 1 1 A 103 103 LEU C C 103 177.292 178.188 -0.896 1
1 1402 . 15 1 1 A 103 103 LEU CA C 103 55.007 58.102 -3.095 1
1 1403 . 15 1 1 A 103 103 LEU CB C 103 42.023 41.735 0.288 1
1 1407 . 15 1 1 A 103 103 LEU N N 103 123.596 123.965 -0.369 1
1 1408 . 15 1 1 A 104 104 GLU H H 104 8.216 8.479 -0.263 1
1 1409 . 15 1 1 A 104 104 GLU HA H 104 4.126 4.070 0.056 1
1 1414 . 15 1 1 A 104 104 GLU CA C 104 56.518 59.586 -3.068 1
1 1415 . 15 1 1 A 104 104 GLU CB C 104 29.837 29.352 0.485 1
1 1417 . 15 1 1 A 104 104 GLU N N 104 120.510 117.066 3.444 1
1 1418 . 15 1 1 A 105 105 HIS HA H 105 4.593 4.818 -0.225 1
1 1421 . 15 1 1 A 105 105 HIS C C 105 173.766 174.362 -0.596 1
1 1422 . 15 1 1 A 105 105 HIS CA C 105 55.536 54.993 0.543 1
1 1423 . 15 1 1 A 105 105 HIS CB C 105 30.001 28.574 1.427 1
1 1424 . 15 1 1 A 106 106 HIS H H 106 8.154 9.162 -1.008 1
1 1425 . 15 1 1 A 106 106 HIS HA H 106 4.407 4.738 -0.331 1
1 1428 . 15 1 1 A 106 106 HIS CA C 106 56.920 55.959 0.961 1
1 1429 . 15 1 1 A 106 106 HIS CB C 106 30.001 29.508 0.493 1
1 14 . 16 1 1 A 2 2 LEU H H 2 8.509 8.855 -0.346 1
1 15 . 16 1 1 A 2 2 LEU HA H 2 4.463 4.676 -0.213 1
1 25 . 16 1 1 A 2 2 LEU C C 2 173.944 176.332 -2.388 1
1 26 . 16 1 1 A 2 2 LEU CA C 2 54.471 54.758 -0.287 1
1 27 . 16 1 1 A 2 2 LEU CB C 2 43.595 41.934 1.661 1
1 31 . 16 1 1 A 2 2 LEU N N 2 127.160 127.317 -0.157 1
1 32 . 16 1 1 A 3 3 LEU H H 3 7.844 8.848 -1.004 1
1 33 . 16 1 1 A 3 3 LEU HA H 3 5.128 5.366 -0.238 1
1 43 . 16 1 1 A 3 3 LEU C C 3 175.423 175.426 -0.003 1
1 44 . 16 1 1 A 3 3 LEU CA C 3 53.566 53.029 0.537 1
1 45 . 16 1 1 A 3 3 LEU CB C 3 44.039 43.322 0.717 1
1 49 . 16 1 1 A 3 3 LEU N N 3 122.555 125.089 -2.534 1
1 50 . 16 1 1 A 4 4 TYR H H 4 8.360 9.467 -1.107 1
1 51 . 16 1 1 A 4 4 TYR HA H 4 5.143 5.231 -0.088 1
1 58 . 16 1 1 A 4 4 TYR C C 4 174.481 174.955 -0.474 1
1 59 . 16 1 1 A 4 4 TYR CA C 4 56.577 55.780 0.797 1
1 60 . 16 1 1 A 4 4 TYR CB C 4 43.840 42.560 1.280 1
1 65 . 16 1 1 A 4 4 TYR N N 4 119.315 123.585 -4.270 1
1 66 . 16 1 1 A 5 5 VAL H H 5 8.918 8.247 0.671 1
1 67 . 16 1 1 A 5 5 VAL HA H 5 5.106 4.863 0.243 1
1 75 . 16 1 1 A 5 5 VAL C C 5 174.042 174.716 -0.674 1
1 76 . 16 1 1 A 5 5 VAL CA C 5 59.852 60.811 -0.959 1
1 77 . 16 1 1 A 5 5 VAL CB C 5 33.816 35.231 -1.415 1
1 80 . 16 1 1 A 5 5 VAL N N 5 119.952 120.203 -0.251 1
1 81 . 16 1 1 A 6 6 LEU H H 6 9.315 9.334 -0.019 1
1 82 . 16 1 1 A 6 6 LEU HA H 6 5.466 5.140 0.326 1
1 92 . 16 1 1 A 6 6 LEU C C 6 175.049 174.778 0.271 1
1 93 . 16 1 1 A 6 6 LEU CA C 6 52.090 53.496 -1.406 1
1 94 . 16 1 1 A 6 6 LEU CB C 6 44.103 43.149 0.954 1
1 98 . 16 1 1 A 6 6 LEU N N 6 126.917 126.983 -0.066 1
1 99 . 16 1 1 A 7 7 ILE H H 7 8.458 8.956 -0.498 1
1 100 . 16 1 1 A 7 7 ILE HA H 7 5.131 4.905 0.226 1
1 110 . 16 1 1 A 7 7 ILE C C 7 173.213 173.675 -0.462 1
1 111 . 16 1 1 A 7 7 ILE CA C 7 58.463 59.889 -1.426 1
1 112 . 16 1 1 A 7 7 ILE CB C 7 41.020 40.523 0.497 1
1 116 . 16 1 1 A 7 7 ILE N N 7 119.778 126.224 -6.446 1
1 117 . 16 1 1 A 8 8 ILE H H 8 8.797 9.236 -0.439 1
1 118 . 16 1 1 A 8 8 ILE HA H 8 4.611 4.840 -0.229 1
1 128 . 16 1 1 A 8 8 ILE C C 8 174.611 174.686 -0.075 1
1 129 . 16 1 1 A 8 8 ILE CA C 8 60.227 60.408 -0.181 1
1 130 . 16 1 1 A 8 8 ILE CB C 8 37.665 39.161 -1.496 1
1 134 . 16 1 1 A 8 8 ILE N N 8 128.919 130.342 -1.423 1
1 135 . 16 1 1 A 9 9 SER H H 9 7.811 8.792 -0.981 1
1 136 . 16 1 1 A 9 9 SER HA H 9 4.429 4.944 -0.515 1
1 140 . 16 1 1 A 9 9 SER C C 9 172.937 173.704 -0.767 1
1 141 . 16 1 1 A 9 9 SER CA C 9 58.241 56.961 1.280 1
1 142 . 16 1 1 A 9 9 SER CB C 9 64.261 64.711 -0.450 1
1 143 . 16 1 1 A 9 9 SER N N 9 116.365 121.699 -5.334 1
1 144 . 16 1 1 A 10 10 ASN H H 10 8.641 8.934 -0.293 1
1 145 . 16 1 1 A 10 10 ASN HA H 10 4.938 4.850 0.088 1
1 150 . 16 1 1 A 10 10 ASN C C 10 174.497 175.010 -0.513 1
1 151 . 16 1 1 A 10 10 ASN CA C 10 52.221 54.025 -1.804 1
1 152 . 16 1 1 A 10 10 ASN CB C 10 39.128 40.740 -1.612 1
1 153 . 16 1 1 A 10 10 ASN N N 10 122.612 122.265 0.347 1
1 155 . 16 1 1 A 11 11 ASP H H 11 8.673 7.003 1.670 1
1 156 . 16 1 1 A 11 11 ASP HA H 11 4.596 4.691 -0.095 1
1 159 . 16 1 1 A 11 11 ASP C C 11 175.342 176.547 -1.205 1
1 160 . 16 1 1 A 11 11 ASP CA C 11 53.233 54.026 -0.793 1
1 161 . 16 1 1 A 11 11 ASP CB C 11 40.965 41.125 -0.160 1
1 162 . 16 1 1 A 11 11 ASP N N 11 122.717 119.065 3.652 1
1 163 . 16 1 1 A 12 12 LYS H H 12 8.562 8.708 -0.146 1
1 164 . 16 1 1 A 12 12 LYS HA H 12 3.854 4.069 -0.215 1
1 173 . 16 1 1 A 12 12 LYS C C 12 178.754 178.441 0.313 1
1 174 . 16 1 1 A 12 12 LYS CA C 12 59.581 59.364 0.217 1
1 175 . 16 1 1 A 12 12 LYS CB C 12 32.378 32.079 0.299 1
1 179 . 16 1 1 A 12 12 LYS N N 12 125.737 124.821 0.916 1
1 180 . 16 1 1 A 13 13 LYS H H 13 8.075 7.958 0.117 1
1 181 . 16 1 1 A 13 13 LYS HA H 13 4.154 4.069 0.085 1
1 190 . 16 1 1 A 13 13 LYS C C 13 178.315 179.065 -0.750 1
1 191 . 16 1 1 A 13 13 LYS CA C 13 58.532 59.022 -0.490 1
1 192 . 16 1 1 A 13 13 LYS CB C 13 31.452 32.324 -0.872 1
1 196 . 16 1 1 A 13 13 LYS N N 13 119.604 120.230 -0.626 1
1 197 . 16 1 1 A 14 14 LEU H H 14 7.552 7.550 0.002 1
1 198 . 16 1 1 A 14 14 LEU HA H 14 3.682 4.014 -0.332 1
1 208 . 16 1 1 A 14 14 LEU C C 14 178.429 178.321 0.108 1
1 209 . 16 1 1 A 14 14 LEU CA C 14 58.999 58.232 0.767 1
1 210 . 16 1 1 A 14 14 LEU CB C 14 41.228 41.594 -0.366 1
1 214 . 16 1 1 A 14 14 LEU N N 14 122.266 121.227 1.039 1
1 215 . 16 1 1 A 15 15 ILE H H 15 8.074 7.934 0.140 1
1 216 . 16 1 1 A 15 15 ILE HA H 15 3.264 3.447 -0.183 1
1 226 . 16 1 1 A 15 15 ILE C C 15 177.000 177.919 -0.919 1
1 227 . 16 1 1 A 15 15 ILE CA C 15 65.939 65.669 0.270 1
1 228 . 16 1 1 A 15 15 ILE CB C 15 37.983 38.136 -0.153 1
1 232 . 16 1 1 A 15 15 ILE N N 15 118.214 119.504 -1.290 1
1 233 . 16 1 1 A 16 16 GLU H H 16 8.016 8.288 -0.272 1
1 234 . 16 1 1 A 16 16 GLU HA H 16 4.045 3.991 0.054 1
1 239 . 16 1 1 A 16 16 GLU C C 16 179.388 179.476 -0.088 1
1 240 . 16 1 1 A 16 16 GLU CA C 16 59.032 59.669 -0.637 1
1 241 . 16 1 1 A 16 16 GLU CB C 16 29.200 29.306 -0.106 1
1 243 . 16 1 1 A 16 16 GLU N N 16 118.484 118.757 -0.273 1
1 244 . 16 1 1 A 17 17 GLU H H 17 8.063 7.966 0.097 1
1 245 . 16 1 1 A 17 17 GLU HA H 17 4.053 3.979 0.074 1
1 250 . 16 1 1 A 17 17 GLU C C 17 179.306 179.350 -0.044 1
1 251 . 16 1 1 A 17 17 GLU CA C 17 58.636 59.028 -0.392 1
1 252 . 16 1 1 A 17 17 GLU CB C 17 29.011 29.844 -0.833 1
1 254 . 16 1 1 A 17 17 GLU N N 17 118.100 120.714 -2.614 1
1 255 . 16 1 1 A 18 18 ALA H H 18 8.655 8.425 0.230 1
1 256 . 16 1 1 A 18 18 ALA HA H 18 3.775 4.051 -0.276 1
1 260 . 16 1 1 A 18 18 ALA C C 18 178.559 179.655 -1.096 1
1 261 . 16 1 1 A 18 18 ALA CA C 18 54.960 55.166 -0.206 1
1 262 . 16 1 1 A 18 18 ALA CB C 18 17.960 18.197 -0.237 1
1 263 . 16 1 1 A 18 18 ALA N N 18 122.439 122.730 -0.291 1
1 264 . 16 1 1 A 19 19 ARG H H 19 8.900 8.167 0.733 1
1 265 . 16 1 1 A 19 19 ARG HA H 19 3.809 3.990 -0.181 1
1 273 . 16 1 1 A 19 19 ARG C C 19 178.721 178.966 -0.245 1
1 274 . 16 1 1 A 19 19 ARG CA C 19 59.976 59.776 0.200 1
1 275 . 16 1 1 A 19 19 ARG CB C 19 29.572 30.176 -0.604 1
1 278 . 16 1 1 A 19 19 ARG N N 19 118.563 117.678 0.885 1
1 280 . 16 1 1 A 20 20 LYS H H 20 7.792 8.259 -0.467 1
1 281 . 16 1 1 A 20 20 LYS HA H 20 4.052 3.967 0.085 1
1 290 . 16 1 1 A 20 20 LYS C C 20 179.648 179.669 -0.021 1
1 291 . 16 1 1 A 20 20 LYS CA C 20 59.296 59.211 0.085 1
1 292 . 16 1 1 A 20 20 LYS CB C 20 32.216 32.292 -0.076 1
1 296 . 16 1 1 A 20 20 LYS N N 20 118.638 119.348 -0.710 1
1 297 . 16 1 1 A 21 21 MET H H 21 7.684 8.159 -0.475 1
1 298 . 16 1 1 A 21 21 MET HA H 21 4.411 4.206 0.205 1
1 306 . 16 1 1 A 21 21 MET C C 21 177.909 178.136 -0.227 1
1 307 . 16 1 1 A 21 21 MET CA C 21 57.009 59.026 -2.017 1
1 308 . 16 1 1 A 21 21 MET CB C 21 32.028 32.464 -0.436 1
1 311 . 16 1 1 A 21 21 MET N N 21 118.100 118.386 -0.286 1
1 312 . 16 1 1 A 22 22 ALA H H 22 8.815 8.403 0.412 1
1 313 . 16 1 1 A 22 22 ALA HA H 22 3.826 3.916 -0.090 1
1 317 . 16 1 1 A 22 22 ALA C C 22 178.835 179.994 -1.159 1
1 318 . 16 1 1 A 22 22 ALA CA C 22 55.427 55.573 -0.146 1
1 319 . 16 1 1 A 22 22 ALA CB C 22 18.059 18.346 -0.287 1
1 320 . 16 1 1 A 22 22 ALA N N 22 122.150 121.024 1.126 1
1 321 . 16 1 1 A 23 23 GLU H H 23 8.276 8.137 0.139 1
1 322 . 16 1 1 A 23 23 GLU HA H 23 4.146 3.943 0.203 1
1 327 . 16 1 1 A 23 23 GLU C C 23 180.151 179.309 0.842 1
1 328 . 16 1 1 A 23 23 GLU CA C 23 58.999 59.571 -0.572 1
1 329 . 16 1 1 A 23 23 GLU CB C 23 29.160 29.737 -0.577 1
1 331 . 16 1 1 A 23 23 GLU N N 23 117.001 117.824 -0.823 1
1 332 . 16 1 1 A 24 24 LYS H H 24 7.573 7.714 -0.141 1
1 333 . 16 1 1 A 24 24 LYS HA H 24 4.101 4.115 -0.014 1
1 342 . 16 1 1 A 24 24 LYS C C 24 177.145 177.718 -0.573 1
1 343 . 16 1 1 A 24 24 LYS CA C 24 58.261 58.775 -0.514 1
1 344 . 16 1 1 A 24 24 LYS CB C 24 32.079 32.197 -0.118 1
1 348 . 16 1 1 A 24 24 LYS N N 24 119.960 119.477 0.483 1
1 349 . 16 1 1 A 25 25 ALA H H 25 7.710 7.673 0.037 1
1 350 . 16 1 1 A 25 25 ALA HA H 25 4.413 4.358 0.055 1
1 354 . 16 1 1 A 25 25 ALA C C 25 175.325 177.248 -1.923 1
1 355 . 16 1 1 A 25 25 ALA CA C 25 51.208 51.670 -0.462 1
1 356 . 16 1 1 A 25 25 ALA CB C 25 18.520 19.114 -0.594 1
1 357 . 16 1 1 A 25 25 ALA N N 25 119.257 118.927 0.330 1
1 358 . 16 1 1 A 26 26 ASN H H 26 7.840 8.002 -0.162 1
1 359 . 16 1 1 A 26 26 ASN HA H 26 4.357 4.317 0.040 1
1 364 . 16 1 1 A 26 26 ASN C C 26 173.587 173.840 -0.253 1
1 365 . 16 1 1 A 26 26 ASN CA C 26 54.307 54.431 -0.124 1
1 366 . 16 1 1 A 26 26 ASN CB C 26 36.972 37.548 -0.576 1
1 367 . 16 1 1 A 26 26 ASN N N 26 115.266 115.918 -0.652 1
1 369 . 16 1 1 A 27 27 LEU H H 27 8.241 8.054 0.187 1
1 370 . 16 1 1 A 27 27 LEU HA H 27 4.652 4.331 0.321 1
1 380 . 16 1 1 A 27 27 LEU C C 27 175.894 175.906 -0.012 1
1 381 . 16 1 1 A 27 27 LEU CA C 27 52.923 53.859 -0.936 1
1 382 . 16 1 1 A 27 27 LEU CB C 27 44.090 42.427 1.663 1
1 386 . 16 1 1 A 27 27 LEU N N 27 116.828 120.087 -3.259 1
1 387 . 16 1 1 A 28 28 GLU H H 28 7.798 8.555 -0.757 1
1 388 . 16 1 1 A 28 28 GLU HA H 28 4.310 4.525 -0.215 1
1 393 . 16 1 1 A 28 28 GLU C C 28 173.944 175.720 -1.776 1
1 394 . 16 1 1 A 28 28 GLU CA C 28 55.460 55.999 -0.539 1
1 395 . 16 1 1 A 28 28 GLU CB C 28 30.512 29.996 0.516 1
1 397 . 16 1 1 A 28 28 GLU N N 28 121.340 125.169 -3.829 1
1 398 . 16 1 1 A 29 29 LEU H H 29 8.451 8.750 -0.299 1
1 399 . 16 1 1 A 29 29 LEU HA H 29 5.662 4.796 0.866 1
1 409 . 16 1 1 A 29 29 LEU C C 29 176.902 174.888 2.014 1
1 410 . 16 1 1 A 29 29 LEU CA C 29 53.186 54.715 -1.529 1
1 411 . 16 1 1 A 29 29 LEU CB C 29 44.914 43.475 1.439 1
1 415 . 16 1 1 A 29 29 LEU N N 29 126.547 129.786 -3.239 1
1 416 . 16 1 1 A 30 30 ARG H H 30 9.094 9.168 -0.074 1
1 417 . 16 1 1 A 30 30 ARG HA H 30 4.910 4.855 0.055 1
1 425 . 16 1 1 A 30 30 ARG C C 30 175.147 175.096 0.051 1
1 426 . 16 1 1 A 30 30 ARG CA C 30 53.417 54.460 -1.043 1
1 427 . 16 1 1 A 30 30 ARG CB C 30 32.555 32.769 -0.214 1
1 430 . 16 1 1 A 30 30 ARG N N 30 125.043 126.391 -1.348 1
1 432 . 16 1 1 A 31 31 THR H H 31 8.496 8.567 -0.071 1
1 433 . 16 1 1 A 31 31 THR HA H 31 4.888 4.847 0.041 1
1 438 . 16 1 1 A 31 31 THR C C 31 173.961 174.017 -0.056 1
1 439 . 16 1 1 A 31 31 THR CA C 31 60.445 60.886 -0.441 1
1 440 . 16 1 1 A 31 31 THR CB C 31 69.492 69.929 -0.437 1
1 442 . 16 1 1 A 31 31 THR N N 31 114.745 116.879 -2.134 1
1 443 . 16 1 1 A 32 32 VAL H H 32 8.480 8.842 -0.362 1
1 444 . 16 1 1 A 32 32 VAL HA H 32 4.411 4.351 0.060 1
1 452 . 16 1 1 A 32 32 VAL C C 32 175.082 175.566 -0.484 1
1 453 . 16 1 1 A 32 32 VAL CA C 32 60.946 61.552 -0.606 1
1 454 . 16 1 1 A 32 32 VAL CB C 32 34.487 32.711 1.776 1
1 457 . 16 1 1 A 32 32 VAL N N 32 122.324 126.805 -4.481 1
1 458 . 16 1 1 A 33 33 LYS H H 33 9.304 8.948 0.356 1
1 459 . 16 1 1 A 33 33 LYS HA H 33 4.534 4.503 0.031 1
1 468 . 16 1 1 A 33 33 LYS C C 33 176.740 176.446 0.294 1
1 469 . 16 1 1 A 33 33 LYS CA C 33 56.846 57.387 -0.541 1
1 470 . 16 1 1 A 33 33 LYS CB C 33 34.355 33.763 0.592 1
1 474 . 16 1 1 A 33 33 LYS N N 33 123.654 126.256 -2.602 1
1 475 . 16 1 1 A 34 34 THR H H 34 7.245 7.801 -0.556 1
1 476 . 16 1 1 A 34 34 THR HA H 34 4.780 4.749 0.031 1
1 481 . 16 1 1 A 34 34 THR C C 34 174.529 175.671 -1.142 1
1 482 . 16 1 1 A 34 34 THR CA C 34 58.859 59.636 -0.777 1
1 483 . 16 1 1 A 34 34 THR CB C 34 73.023 72.137 0.886 1
1 485 . 16 1 1 A 34 34 THR N N 34 106.300 111.515 -5.215 1
1 486 . 16 1 1 A 35 35 GLU H H 35 9.174 9.154 0.020 1
1 487 . 16 1 1 A 35 35 GLU HA H 35 3.886 3.971 -0.085 1
1 492 . 16 1 1 A 35 35 GLU C C 35 177.714 177.663 0.051 1
1 493 . 16 1 1 A 35 35 GLU CA C 35 59.233 59.633 -0.400 1
1 494 . 16 1 1 A 35 35 GLU CB C 35 29.377 29.487 -0.110 1
1 496 . 16 1 1 A 35 35 GLU N N 35 121.919 122.204 -0.285 1
1 497 . 16 1 1 A 36 36 ASP H H 36 8.185 8.504 -0.319 1
1 498 . 16 1 1 A 36 36 ASP HA H 36 4.289 4.345 -0.056 1
1 501 . 16 1 1 A 36 36 ASP C C 36 178.348 178.552 -0.204 1
1 502 . 16 1 1 A 36 36 ASP CA C 36 56.962 57.830 -0.868 1
1 503 . 16 1 1 A 36 36 ASP CB C 36 40.214 42.289 -2.075 1
1 504 . 16 1 1 A 36 36 ASP N N 36 118.332 119.822 -1.490 1
1 505 . 16 1 1 A 37 37 GLU H H 37 7.741 7.895 -0.154 1
1 506 . 16 1 1 A 37 37 GLU HA H 37 3.708 4.096 -0.388 1
1 511 . 16 1 1 A 37 37 GLU C C 37 177.324 179.074 -1.750 1
1 512 . 16 1 1 A 37 37 GLU CA C 37 58.698 59.318 -0.620 1
1 513 . 16 1 1 A 37 37 GLU CB C 37 30.199 29.663 0.536 1
1 515 . 16 1 1 A 37 37 GLU N N 37 120.704 119.086 1.618 1
1 516 . 16 1 1 A 38 38 LEU H H 38 7.531 8.157 -0.626 1
1 517 . 16 1 1 A 38 38 LEU HA H 38 3.873 4.100 -0.227 1
1 527 . 16 1 1 A 38 38 LEU C C 38 177.357 178.577 -1.220 1
1 528 . 16 1 1 A 38 38 LEU CA C 38 58.305 58.412 -0.107 1
1 529 . 16 1 1 A 38 38 LEU CB C 38 40.837 41.745 -0.908 1
1 533 . 16 1 1 A 38 38 LEU N N 38 119.200 121.518 -2.318 1
1 534 . 16 1 1 A 39 39 LYS H H 39 8.083 8.144 -0.061 1
1 535 . 16 1 1 A 39 39 LYS HA H 39 3.608 3.926 -0.318 1
1 544 . 16 1 1 A 39 39 LYS C C 39 177.373 178.830 -1.457 1
1 545 . 16 1 1 A 39 39 LYS CA C 39 60.290 59.685 0.605 1
1 546 . 16 1 1 A 39 39 LYS CB C 39 32.178 32.393 -0.215 1
1 550 . 16 1 1 A 39 39 LYS N N 39 116.943 118.903 -1.960 1
1 551 . 16 1 1 A 40 40 LYS H H 40 7.632 8.208 -0.576 1
1 552 . 16 1 1 A 40 40 LYS HA H 40 3.864 3.863 0.001 1
1 561 . 16 1 1 A 40 40 LYS C C 40 179.566 178.362 1.204 1
1 562 . 16 1 1 A 40 40 LYS CA C 40 58.993 58.929 0.064 1
1 563 . 16 1 1 A 40 40 LYS CB C 40 31.758 32.048 -0.290 1
1 567 . 16 1 1 A 40 40 LYS N N 40 118.274 119.115 -0.841 1
1 568 . 16 1 1 A 41 41 TYR H H 41 7.823 8.141 -0.318 1
1 569 . 16 1 1 A 41 41 TYR HA H 41 3.926 3.988 -0.062 1
1 576 . 16 1 1 A 41 41 TYR C C 41 176.625 177.719 -1.094 1
1 577 . 16 1 1 A 41 41 TYR CA C 41 59.757 61.070 -1.313 1
1 578 . 16 1 1 A 41 41 TYR CB C 41 36.901 38.022 -1.121 1
1 583 . 16 1 1 A 41 41 TYR N N 41 117.811 118.999 -1.188 1
1 584 . 16 1 1 A 42 42 LEU H H 42 7.964 8.305 -0.341 1
1 585 . 16 1 1 A 42 42 LEU HA H 42 3.704 4.036 -0.332 1
1 595 . 16 1 1 A 42 42 LEU C C 42 178.396 179.271 -0.875 1
1 596 . 16 1 1 A 42 42 LEU CA C 42 58.237 58.156 0.081 1
1 597 . 16 1 1 A 42 42 LEU CB C 42 40.507 41.606 -1.099 1
1 601 . 16 1 1 A 42 42 LEU N N 42 115.960 120.329 -4.369 1
1 602 . 16 1 1 A 43 43 GLU H H 43 8.193 7.942 0.251 1
1 603 . 16 1 1 A 43 43 GLU HA H 43 3.882 3.868 0.014 1
1 608 . 16 1 1 A 43 43 GLU C C 43 179.193 179.136 0.057 1
1 609 . 16 1 1 A 43 43 GLU CA C 43 59.122 59.821 -0.699 1
1 610 . 16 1 1 A 43 43 GLU CB C 43 29.244 29.090 0.154 1
1 612 . 16 1 1 A 43 43 GLU N N 43 117.175 117.696 -0.521 1
1 613 . 16 1 1 A 44 44 GLU H H 44 7.601 7.484 0.117 1
1 614 . 16 1 1 A 44 44 GLU HA H 44 3.936 3.988 -0.052 1
1 619 . 16 1 1 A 44 44 GLU C C 44 179.875 178.764 1.111 1
1 620 . 16 1 1 A 44 44 GLU CA C 44 58.867 59.108 -0.241 1
1 621 . 16 1 1 A 44 44 GLU CB C 44 28.648 29.028 -0.380 1
1 623 . 16 1 1 A 44 44 GLU N N 44 120.472 119.314 1.158 1
1 624 . 16 1 1 A 45 45 PHE H H 45 8.260 7.403 0.857 1
1 625 . 16 1 1 A 45 45 PHE HA H 45 4.520 4.235 0.285 1
1 633 . 16 1 1 A 45 45 PHE C C 45 177.942 178.202 -0.260 1
1 634 . 16 1 1 A 45 45 PHE CA C 45 55.945 60.673 -4.728 1
1 635 . 16 1 1 A 45 45 PHE CB C 45 36.680 38.385 -1.705 1
1 641 . 16 1 1 A 45 45 PHE N N 45 119.272 118.563 0.709 1
1 642 . 16 1 1 A 46 46 ARG H H 46 8.023 8.230 -0.207 1
1 643 . 16 1 1 A 46 46 ARG HA H 46 4.074 3.983 0.091 1
1 651 . 16 1 1 A 46 46 ARG C C 46 177.617 178.983 -1.366 1
1 652 . 16 1 1 A 46 46 ARG CA C 46 58.194 59.558 -1.364 1
1 653 . 16 1 1 A 46 46 ARG CB C 46 29.737 29.924 -0.187 1
1 656 . 16 1 1 A 46 46 ARG N N 46 118.136 119.791 -1.655 1
1 658 . 16 1 1 A 47 47 LYS H H 47 7.470 7.756 -0.286 1
1 659 . 16 1 1 A 47 47 LYS HA H 47 4.143 4.078 0.065 1
1 668 . 16 1 1 A 47 47 LYS C C 47 177.324 177.614 -0.290 1
1 669 . 16 1 1 A 47 47 LYS CA C 47 57.726 59.522 -1.796 1
1 670 . 16 1 1 A 47 47 LYS CB C 47 32.409 32.447 -0.038 1
1 674 . 16 1 1 A 47 47 LYS N N 47 116.943 120.137 -3.194 1
1 675 . 16 1 1 A 48 48 GLU H H 48 7.615 7.775 -0.160 1
1 676 . 16 1 1 A 48 48 GLU HA H 48 4.428 4.729 -0.301 1
1 681 . 16 1 1 A 48 48 GLU C C 48 176.869 176.824 0.045 1
1 682 . 16 1 1 A 48 48 GLU CA C 48 55.945 55.369 0.576 1
1 683 . 16 1 1 A 48 48 GLU CB C 48 29.696 30.396 -0.700 1
1 685 . 16 1 1 A 48 48 GLU N N 48 118.852 116.250 2.602 1
1 686 . 16 1 1 A 49 49 SER H H 49 7.725 7.618 0.107 1
1 687 . 16 1 1 A 49 49 SER HA H 49 4.244 4.116 0.128 1
1 690 . 16 1 1 A 49 49 SER C C 49 174.838 176.654 -1.816 1
1 691 . 16 1 1 A 49 49 SER CA C 49 59.366 60.830 -1.464 1
1 692 . 16 1 1 A 49 49 SER CB C 49 63.116 63.099 0.017 1
1 693 . 16 1 1 A 49 49 SER N N 49 114.224 116.871 -2.647 1
1 694 . 16 1 1 A 50 50 GLN H H 50 8.548 8.076 0.472 1
1 695 . 16 1 1 A 50 50 GLN HA H 50 4.398 4.066 0.332 1
1 702 . 16 1 1 A 50 50 GLN C C 50 175.732 176.977 -1.245 1
1 703 . 16 1 1 A 50 50 GLN CA C 50 56.272 58.912 -2.640 1
1 704 . 16 1 1 A 50 50 GLN CB C 50 28.946 28.155 0.791 1
1 706 . 16 1 1 A 50 50 GLN N N 50 120.125 119.682 0.443 1
1 708 . 16 1 1 A 51 51 ASN H H 51 8.534 7.747 0.787 1
1 709 . 16 1 1 A 51 51 ASN HA H 51 4.980 4.965 0.015 1
1 714 . 16 1 1 A 51 51 ASN C C 51 173.717 174.270 -0.553 1
1 715 . 16 1 1 A 51 51 ASN CA C 51 52.804 52.993 -0.189 1
1 716 . 16 1 1 A 51 51 ASN CB C 51 39.583 40.100 -0.517 1
1 717 . 16 1 1 A 51 51 ASN N N 51 118.158 114.344 3.814 1
1 719 . 16 1 1 A 52 52 ILE H H 52 7.492 7.036 0.456 1
1 720 . 16 1 1 A 52 52 ILE HA H 52 5.338 4.939 0.399 1
1 730 . 16 1 1 A 52 52 ILE C C 52 175.049 174.289 0.760 1
1 731 . 16 1 1 A 52 52 ILE CA C 52 59.364 60.169 -0.805 1
1 732 . 16 1 1 A 52 52 ILE CB C 52 42.163 40.818 1.345 1
1 736 . 16 1 1 A 52 52 ILE N N 52 117.927 121.963 -4.036 1
1 737 . 16 1 1 A 53 53 LYS H H 53 8.467 9.272 -0.805 1
1 738 . 16 1 1 A 53 53 LYS HA H 53 5.044 5.151 -0.107 1
1 747 . 16 1 1 A 53 53 LYS C C 53 175.082 175.558 -0.476 1
1 748 . 16 1 1 A 53 53 LYS CA C 53 55.429 54.942 0.487 1
1 749 . 16 1 1 A 53 53 LYS CB C 53 36.446 35.199 1.247 1
1 753 . 16 1 1 A 53 53 LYS N N 53 123.249 128.359 -5.110 1
1 754 . 16 1 1 A 54 54 VAL H H 54 8.490 8.784 -0.294 1
1 755 . 16 1 1 A 54 54 VAL HA H 54 5.159 4.946 0.213 1
1 763 . 16 1 1 A 54 54 VAL C C 54 173.473 173.848 -0.375 1
1 764 . 16 1 1 A 54 54 VAL CA C 54 60.163 60.826 -0.663 1
1 765 . 16 1 1 A 54 54 VAL CB C 54 35.509 33.554 1.955 1
1 768 . 16 1 1 A 54 54 VAL N N 54 120.762 124.779 -4.017 1
1 769 . 16 1 1 A 55 55 LEU H H 55 8.636 8.612 0.024 1
1 770 . 16 1 1 A 55 55 LEU HA H 55 4.670 4.629 0.041 1
1 780 . 16 1 1 A 55 55 LEU C C 55 173.652 174.251 -0.599 1
1 781 . 16 1 1 A 55 55 LEU CA C 55 52.289 53.198 -0.909 1
1 782 . 16 1 1 A 55 55 LEU CB C 55 42.070 42.726 -0.656 1
1 786 . 16 1 1 A 55 55 LEU N N 55 131.898 129.138 2.760 1
1 787 . 16 1 1 A 56 56 ILE H H 56 9.188 9.311 -0.123 1
1 788 . 16 1 1 A 56 56 ILE HA H 56 4.879 4.911 -0.032 1
1 798 . 16 1 1 A 56 56 ILE C C 56 174.172 174.576 -0.404 1
1 799 . 16 1 1 A 56 56 ILE CA C 56 59.976 59.972 0.004 1
1 800 . 16 1 1 A 56 56 ILE CB C 56 38.181 38.620 -0.439 1
1 804 . 16 1 1 A 56 56 ILE N N 56 126.373 128.826 -2.453 1
1 805 . 16 1 1 A 57 57 LEU H H 57 8.929 9.430 -0.501 1
1 806 . 16 1 1 A 57 57 LEU HA H 57 5.394 5.292 0.102 1
1 816 . 16 1 1 A 57 57 LEU C C 57 175.358 175.844 -0.486 1
1 817 . 16 1 1 A 57 57 LEU CA C 57 52.086 53.200 -1.114 1
1 818 . 16 1 1 A 57 57 LEU CB C 57 42.445 42.940 -0.495 1
1 822 . 16 1 1 A 57 57 LEU N N 57 126.547 128.669 -2.122 1
1 823 . 16 1 1 A 58 58 VAL H H 58 8.542 9.049 -0.507 1
1 824 . 16 1 1 A 58 58 VAL HA H 58 5.253 4.698 0.555 1
1 832 . 16 1 1 A 58 58 VAL C C 58 175.244 175.818 -0.574 1
1 833 . 16 1 1 A 58 58 VAL CA C 58 58.241 59.421 -1.180 1
1 834 . 16 1 1 A 58 58 VAL CB C 58 33.165 34.053 -0.888 1
1 837 . 16 1 1 A 58 58 VAL N N 58 114.398 121.587 -7.189 1
1 838 . 16 1 1 A 59 59 SER H H 59 8.797 8.902 -0.105 1
1 839 . 16 1 1 A 59 59 SER HA H 59 5.063 4.478 0.585 1
1 842 . 16 1 1 A 59 59 SER C C 59 174.172 173.789 0.383 1
1 843 . 16 1 1 A 59 59 SER CA C 59 59.320 59.936 -0.616 1
1 844 . 16 1 1 A 59 59 SER CB C 59 65.600 64.203 1.397 1
1 845 . 16 1 1 A 59 59 SER N N 59 115.497 116.505 -1.008 1
1 846 . 16 1 1 A 60 60 ASN H H 60 7.730 7.803 -0.073 1
1 847 . 16 1 1 A 60 60 ASN HA H 60 4.811 5.166 -0.355 1
1 852 . 16 1 1 A 60 60 ASN C C 60 174.464 174.756 -0.292 1
1 853 . 16 1 1 A 60 60 ASN CA C 60 52.007 51.937 0.070 1
1 854 . 16 1 1 A 60 60 ASN CB C 60 40.336 42.057 -1.721 1
1 855 . 16 1 1 A 60 60 ASN N N 60 117.522 116.212 1.310 1
1 857 . 16 1 1 A 61 61 ASP H H 61 8.577 9.088 -0.511 1
1 858 . 16 1 1 A 61 61 ASP HA H 61 4.365 4.248 0.117 1
1 861 . 16 1 1 A 61 61 ASP C C 61 177.357 178.125 -0.768 1
1 862 . 16 1 1 A 61 61 ASP CA C 61 57.351 57.404 -0.053 1
1 863 . 16 1 1 A 61 61 ASP CB C 61 40.383 40.541 -0.158 1
1 864 . 16 1 1 A 61 61 ASP N N 61 119.431 121.969 -2.538 1
1 865 . 16 1 1 A 62 62 GLU H H 62 8.405 8.408 -0.003 1
1 866 . 16 1 1 A 62 62 GLU HA H 62 4.121 3.993 0.128 1
1 871 . 16 1 1 A 62 62 GLU C C 62 179.615 179.217 0.398 1
1 872 . 16 1 1 A 62 62 GLU CA C 62 59.593 59.826 -0.233 1
1 873 . 16 1 1 A 62 62 GLU CB C 62 28.478 29.136 -0.658 1
1 875 . 16 1 1 A 62 62 GLU N N 62 122.150 119.429 2.721 1
1 876 . 16 1 1 A 63 63 GLU H H 63 8.384 8.099 0.285 1
1 877 . 16 1 1 A 63 63 GLU HA H 63 3.913 4.005 -0.092 1
1 882 . 16 1 1 A 63 63 GLU C C 63 178.478 179.027 -0.549 1
1 883 . 16 1 1 A 63 63 GLU CA C 63 58.273 58.989 -0.716 1
1 884 . 16 1 1 A 63 63 GLU CB C 63 29.931 29.425 0.506 1
1 886 . 16 1 1 A 63 63 GLU N N 63 119.084 118.972 0.112 1
1 887 . 16 1 1 A 64 64 LEU H H 64 7.717 8.117 -0.400 1
1 888 . 16 1 1 A 64 64 LEU HA H 64 3.750 4.030 -0.280 1
1 898 . 16 1 1 A 64 64 LEU C C 64 177.535 178.193 -0.658 1
1 899 . 16 1 1 A 64 64 LEU CA C 64 58.944 58.324 0.620 1
1 900 . 16 1 1 A 64 64 LEU CB C 64 41.695 41.395 0.300 1
1 904 . 16 1 1 A 64 64 LEU N N 64 120.357 122.055 -1.698 1
1 905 . 16 1 1 A 65 65 ASP H H 65 7.922 8.306 -0.384 1
1 906 . 16 1 1 A 65 65 ASP HA H 65 4.313 4.292 0.021 1
1 909 . 16 1 1 A 65 65 ASP C C 65 179.095 179.173 -0.078 1
1 910 . 16 1 1 A 65 65 ASP CA C 65 57.272 57.148 0.124 1
1 911 . 16 1 1 A 65 65 ASP CB C 65 40.196 40.564 -0.368 1
1 912 . 16 1 1 A 65 65 ASP N N 65 118.100 118.160 -0.060 1
1 913 . 16 1 1 A 66 66 LYS H H 66 7.802 7.992 -0.190 1
1 914 . 16 1 1 A 66 66 LYS HA H 66 4.078 3.917 0.161 1
1 923 . 16 1 1 A 66 66 LYS C C 66 178.624 178.785 -0.161 1
1 924 . 16 1 1 A 66 66 LYS CA C 66 58.429 59.583 -1.154 1
1 925 . 16 1 1 A 66 66 LYS CB C 66 31.727 32.188 -0.461 1
1 929 . 16 1 1 A 66 66 LYS N N 66 119.343 119.119 0.224 1
1 930 . 16 1 1 A 67 67 ALA H H 67 8.480 8.326 0.154 1
1 931 . 16 1 1 A 67 67 ALA HA H 67 3.853 4.137 -0.284 1
1 935 . 16 1 1 A 67 67 ALA C C 67 178.591 179.577 -0.986 1
1 936 . 16 1 1 A 67 67 ALA CA C 67 55.403 55.284 0.119 1
1 937 . 16 1 1 A 67 67 ALA CB C 67 17.793 18.603 -0.810 1
1 938 . 16 1 1 A 67 67 ALA N N 67 121.562 122.338 -0.776 1
1 939 . 16 1 1 A 68 68 LYS H H 68 8.186 7.697 0.489 1
1 940 . 16 1 1 A 68 68 LYS HA H 68 3.805 4.060 -0.255 1
1 949 . 16 1 1 A 68 68 LYS C C 68 179.095 178.854 0.241 1
1 950 . 16 1 1 A 68 68 LYS CA C 68 59.952 59.210 0.742 1
1 951 . 16 1 1 A 68 68 LYS CB C 68 32.181 32.076 0.105 1
1 955 . 16 1 1 A 68 68 LYS N N 68 116.165 116.744 -0.579 1
1 956 . 16 1 1 A 69 69 GLU H H 69 7.904 8.344 -0.440 1
1 957 . 16 1 1 A 69 69 GLU HA H 69 3.995 4.082 -0.087 1
1 962 . 16 1 1 A 69 69 GLU C C 69 179.079 179.243 -0.164 1
1 963 . 16 1 1 A 69 69 GLU CA C 69 59.022 59.114 -0.092 1
1 964 . 16 1 1 A 69 69 GLU CB C 69 29.274 29.397 -0.123 1
1 966 . 16 1 1 A 69 69 GLU N N 69 119.489 119.513 -0.024 1
1 967 . 16 1 1 A 70 70 LEU H H 70 7.962 8.050 -0.088 1
1 968 . 16 1 1 A 70 70 LEU HA H 70 4.020 3.948 0.072 1
1 978 . 16 1 1 A 70 70 LEU C C 70 178.738 178.846 -0.108 1
1 979 . 16 1 1 A 70 70 LEU CA C 70 57.486 57.874 -0.388 1
1 980 . 16 1 1 A 70 70 LEU CB C 70 41.695 41.916 -0.221 1
1 984 . 16 1 1 A 70 70 LEU N N 70 119.431 120.272 -0.841 1
1 985 . 16 1 1 A 71 71 ALA H H 71 8.260 8.284 -0.024 1
1 986 . 16 1 1 A 71 71 ALA HA H 71 3.845 4.037 -0.192 1
1 990 . 16 1 1 A 71 71 ALA C C 71 179.518 180.189 -0.671 1
1 991 . 16 1 1 A 71 71 ALA CA C 71 55.139 55.648 -0.509 1
1 992 . 16 1 1 A 71 71 ALA CB C 71 18.487 18.252 0.235 1
1 993 . 16 1 1 A 71 71 ALA N N 71 119.604 120.230 -0.626 1
1 994 . 16 1 1 A 72 72 GLN H H 72 7.910 8.326 -0.416 1
1 995 . 16 1 1 A 72 72 GLN HA H 72 4.154 3.982 0.172 1
1 1002 . 16 1 1 A 72 72 GLN C C 72 178.900 178.693 0.207 1
1 1003 . 16 1 1 A 72 72 GLN CA C 72 58.194 58.951 -0.757 1
1 1004 . 16 1 1 A 72 72 GLN CB C 72 28.056 28.349 -0.293 1
1 1006 . 16 1 1 A 72 72 GLN N N 72 115.960 117.459 -1.499 1
1 1008 . 16 1 1 A 73 73 LYS H H 73 7.841 7.898 -0.057 1
1 1009 . 16 1 1 A 73 73 LYS HA H 73 4.171 4.144 0.027 1
1 1018 . 16 1 1 A 73 73 LYS C C 73 177.730 178.238 -0.508 1
1 1019 . 16 1 1 A 73 73 LYS CA C 73 57.867 58.734 -0.867 1
1 1020 . 16 1 1 A 73 73 LYS CB C 73 32.277 32.416 -0.139 1
1 1024 . 16 1 1 A 73 73 LYS N N 73 119.027 118.447 0.580 1
1 1025 . 16 1 1 A 74 74 MET H H 74 7.746 8.045 -0.299 1
1 1026 . 16 1 1 A 74 74 MET HA H 74 4.403 4.568 -0.165 1
1 1034 . 16 1 1 A 74 74 MET C C 74 174.416 174.655 -0.239 1
1 1035 . 16 1 1 A 74 74 MET CA C 74 55.194 55.455 -0.261 1
1 1036 . 16 1 1 A 74 74 MET CB C 74 33.366 33.258 0.108 1
1 1039 . 16 1 1 A 74 74 MET N N 74 115.786 116.013 -0.227 1
1 1040 . 16 1 1 A 75 75 GLU H H 75 8.076 7.698 0.378 1
1 1041 . 16 1 1 A 75 75 GLU HA H 75 4.001 3.985 0.016 1
1 1046 . 16 1 1 A 75 75 GLU C C 75 175.130 174.974 0.156 1
1 1047 . 16 1 1 A 75 75 GLU CA C 75 56.722 57.584 -0.862 1
1 1048 . 16 1 1 A 75 75 GLU CB C 75 27.118 26.894 0.224 1
1 1050 . 16 1 1 A 75 75 GLU N N 75 116.249 115.605 0.644 1
1 1051 . 16 1 1 A 76 76 ILE H H 76 7.560 7.704 -0.144 1
1 1052 . 16 1 1 A 76 76 ILE HA H 76 4.428 4.471 -0.043 1
1 1062 . 16 1 1 A 76 76 ILE C C 76 174.529 174.975 -0.446 1
1 1063 . 16 1 1 A 76 76 ILE CA C 76 58.475 60.018 -1.543 1
1 1064 . 16 1 1 A 76 76 ILE CB C 76 40.337 40.161 0.176 1
1 1068 . 16 1 1 A 76 76 ILE N N 76 115.960 119.362 -3.402 1
1 1069 . 16 1 1 A 77 77 ASP H H 77 8.889 8.680 0.209 1
1 1070 . 16 1 1 A 77 77 ASP HA H 77 4.569 4.966 -0.397 1
1 1073 . 16 1 1 A 77 77 ASP C C 77 174.123 176.168 -2.045 1
1 1074 . 16 1 1 A 77 77 ASP CA C 77 54.069 54.309 -0.240 1
1 1075 . 16 1 1 A 77 77 ASP CB C 77 40.233 41.442 -1.209 1
1 1076 . 16 1 1 A 77 77 ASP N N 77 126.142 128.415 -2.273 1
1 1077 . 16 1 1 A 78 78 VAL H H 78 7.754 8.960 -1.206 1
1 1078 . 16 1 1 A 78 78 VAL HA H 78 5.192 5.332 -0.140 1
1 1086 . 16 1 1 A 78 78 VAL C C 78 174.968 174.382 0.586 1
1 1087 . 16 1 1 A 78 78 VAL CA C 78 58.804 58.651 0.153 1
1 1088 . 16 1 1 A 78 78 VAL CB C 78 35.293 35.500 -0.207 1
1 1091 . 16 1 1 A 78 78 VAL N N 78 122.844 117.612 5.232 1
1 1092 . 16 1 1 A 79 79 ARG H H 79 8.499 8.985 -0.486 1
1 1093 . 16 1 1 A 79 79 ARG HA H 79 4.712 4.959 -0.247 1
1 1100 . 16 1 1 A 79 79 ARG C C 79 174.221 175.206 -0.985 1
1 1101 . 16 1 1 A 79 79 ARG CA C 79 54.117 54.718 -0.601 1
1 1102 . 16 1 1 A 79 79 ARG CB C 79 31.196 31.697 -0.501 1
1 1105 . 16 1 1 A 79 79 ARG N N 79 125.637 121.473 4.164 1
1 1106 . 16 1 1 A 80 80 THR H H 80 8.416 8.484 -0.068 1
1 1107 . 16 1 1 A 80 80 THR HA H 80 5.332 4.973 0.359 1
1 1112 . 16 1 1 A 80 80 THR C C 80 174.497 173.862 0.635 1
1 1113 . 16 1 1 A 80 80 THR CA C 80 59.694 60.915 -1.221 1
1 1114 . 16 1 1 A 80 80 THR CB C 80 69.772 69.973 -0.201 1
1 1116 . 16 1 1 A 80 80 THR N N 80 118.084 117.231 0.853 1
1 1117 . 16 1 1 A 81 81 ARG H H 81 8.758 9.022 -0.264 1
1 1118 . 16 1 1 A 81 81 ARG HA H 81 4.362 4.787 -0.425 1
1 1126 . 16 1 1 A 81 81 ARG C C 81 173.733 174.027 -0.294 1
1 1127 . 16 1 1 A 81 81 ARG CA C 81 53.273 53.882 -0.609 1
1 1128 . 16 1 1 A 81 81 ARG CB C 81 33.915 33.196 0.719 1
1 1131 . 16 1 1 A 81 81 ARG N N 81 122.844 123.156 -0.312 1
1 1133 . 16 1 1 A 82 82 LYS H H 82 8.721 8.533 0.188 1
1 1134 . 16 1 1 A 82 82 LYS HA H 82 4.701 4.885 -0.184 1
1 1143 . 16 1 1 A 82 82 LYS C C 82 175.667 176.165 -0.498 1
1 1144 . 16 1 1 A 82 82 LYS CA C 82 54.960 56.020 -1.060 1
1 1145 . 16 1 1 A 82 82 LYS CB C 82 32.603 33.296 -0.693 1
1 1149 . 16 1 1 A 82 82 LYS N N 82 124.668 123.788 0.880 1
1 1150 . 16 1 1 A 83 83 VAL H H 83 9.112 9.094 0.018 1
1 1151 . 16 1 1 A 83 83 VAL HA H 83 4.796 4.878 -0.082 1
1 1159 . 16 1 1 A 83 83 VAL C C 83 174.594 175.297 -0.703 1
1 1160 . 16 1 1 A 83 83 VAL CA C 83 59.413 60.032 -0.619 1
1 1161 . 16 1 1 A 83 83 VAL CB C 83 35.298 34.583 0.715 1
1 1164 . 16 1 1 A 83 83 VAL N N 83 122.381 122.385 -0.004 1
1 1165 . 16 1 1 A 84 84 THR H H 84 9.200 8.630 0.570 1
1 1166 . 16 1 1 A 84 84 THR HA H 84 4.579 4.582 -0.003 1
1 1171 . 16 1 1 A 84 84 THR C C 84 173.993 174.616 -0.623 1
1 1172 . 16 1 1 A 84 84 THR CA C 84 60.960 61.764 -0.804 1
1 1173 . 16 1 1 A 84 84 THR CB C 84 70.100 70.152 -0.052 1
1 1175 . 16 1 1 A 84 84 THR N N 84 113.183 115.483 -2.300 1
1 1176 . 16 1 1 A 85 85 SER H H 85 7.688 7.808 -0.120 1
1 1177 . 16 1 1 A 85 85 SER HA H 85 5.136 4.660 0.476 1
1 1180 . 16 1 1 A 85 85 SER CA C 85 55.205 56.239 -1.034 1
1 1181 . 16 1 1 A 85 85 SER CB C 85 64.376 63.993 0.383 1
1 1182 . 16 1 1 A 85 85 SER N N 85 115.555 117.906 -2.351 1
1 1183 . 16 1 1 A 86 86 PRO HA H 86 4.090 4.276 -0.186 1
1 1190 . 16 1 1 A 86 86 PRO C C 86 177.227 177.674 -0.447 1
1 1191 . 16 1 1 A 86 86 PRO CA C 86 65.038 65.667 -0.629 1
1 1192 . 16 1 1 A 86 86 PRO CB C 86 31.711 32.003 -0.292 1
1 1195 . 16 1 1 A 87 87 ASP H H 87 8.131 8.540 -0.409 1
1 1196 . 16 1 1 A 87 87 ASP HA H 87 4.223 4.400 -0.177 1
1 1199 . 16 1 1 A 87 87 ASP C C 87 178.721 178.530 0.191 1
1 1200 . 16 1 1 A 87 87 ASP CA C 87 57.311 56.937 0.374 1
1 1201 . 16 1 1 A 87 87 ASP CB C 87 40.102 41.082 -0.980 1
1 1202 . 16 1 1 A 87 87 ASP N N 87 115.381 117.389 -2.008 1
1 1203 . 16 1 1 A 88 88 GLU H H 88 7.571 8.039 -0.468 1
1 1204 . 16 1 1 A 88 88 GLU HA H 88 3.659 4.072 -0.413 1
1 1209 . 16 1 1 A 88 88 GLU C C 88 177.097 178.870 -1.773 1
1 1210 . 16 1 1 A 88 88 GLU CA C 88 58.729 58.831 -0.102 1
1 1211 . 16 1 1 A 88 88 GLU CB C 88 30.052 29.750 0.302 1
1 1213 . 16 1 1 A 88 88 GLU N N 88 120.009 119.279 0.730 1
1 1214 . 16 1 1 A 89 89 ALA H H 89 7.423 7.736 -0.313 1
1 1215 . 16 1 1 A 89 89 ALA HA H 89 3.900 4.270 -0.370 1
1 1219 . 16 1 1 A 89 89 ALA C C 89 178.267 180.061 -1.794 1
1 1220 . 16 1 1 A 89 89 ALA CA C 89 55.607 55.099 0.508 1
1 1221 . 16 1 1 A 89 89 ALA CB C 89 17.348 18.388 -1.040 1
1 1222 . 16 1 1 A 89 89 ALA N N 89 118.873 122.263 -3.390 1
1 1223 . 16 1 1 A 90 90 LYS H H 90 8.046 8.139 -0.093 1
1 1224 . 16 1 1 A 90 90 LYS HA H 90 3.669 3.928 -0.259 1
1 1233 . 16 1 1 A 90 90 LYS C C 90 177.649 179.092 -1.443 1
1 1234 . 16 1 1 A 90 90 LYS CA C 90 60.351 59.911 0.440 1
1 1235 . 16 1 1 A 90 90 LYS CB C 90 32.087 32.246 -0.159 1
1 1239 . 16 1 1 A 90 90 LYS N N 90 114.834 117.334 -2.500 1
1 1240 . 16 1 1 A 91 91 ARG H H 91 7.468 7.906 -0.438 1
1 1241 . 16 1 1 A 91 91 ARG HA H 91 3.887 3.902 -0.015 1
1 1249 . 16 1 1 A 91 91 ARG C C 91 178.998 179.116 -0.118 1
1 1250 . 16 1 1 A 91 91 ARG CA C 91 59.164 59.154 0.010 1
1 1251 . 16 1 1 A 91 91 ARG CB C 91 29.274 29.729 -0.455 1
1 1254 . 16 1 1 A 91 91 ARG N N 91 119.029 119.158 -0.129 1
1 1256 . 16 1 1 A 92 92 TRP H H 92 8.136 8.251 -0.115 1
1 1257 . 16 1 1 A 92 92 TRP HA H 92 4.818 4.556 0.262 1
1 1266 . 16 1 1 A 92 92 TRP C C 92 179.566 178.994 0.572 1
1 1267 . 16 1 1 A 92 92 TRP CA C 92 58.663 59.352 -0.689 1
1 1268 . 16 1 1 A 92 92 TRP CB C 92 29.790 29.367 0.423 1
1 1274 . 16 1 1 A 92 92 TRP N N 92 118.100 120.194 -2.094 1
1 1276 . 16 1 1 A 93 93 ILE H H 93 8.363 8.360 0.003 1
1 1277 . 16 1 1 A 93 93 ILE HA H 93 3.544 3.747 -0.203 1
1 1287 . 16 1 1 A 93 93 ILE C C 93 176.820 177.934 -1.114 1
1 1288 . 16 1 1 A 93 93 ILE CA C 93 66.225 65.566 0.659 1
1 1289 . 16 1 1 A 93 93 ILE CB C 93 37.571 38.019 -0.448 1
1 1293 . 16 1 1 A 93 93 ILE N N 93 120.588 120.353 0.235 1
1 1294 . 16 1 1 A 94 94 LYS H H 94 8.264 7.853 0.411 1
1 1295 . 16 1 1 A 94 94 LYS HA H 94 3.865 4.009 -0.144 1
1 1304 . 16 1 1 A 94 94 LYS C C 94 179.258 178.785 0.473 1
1 1305 . 16 1 1 A 94 94 LYS CA C 94 59.889 59.816 0.073 1
1 1306 . 16 1 1 A 94 94 LYS CB C 94 32.225 32.370 -0.145 1
1 1310 . 16 1 1 A 94 94 LYS N N 94 121.687 120.309 1.378 1
1 1311 . 16 1 1 A 95 95 GLU H H 95 8.360 8.570 -0.210 1
1 1312 . 16 1 1 A 95 95 GLU HA H 95 4.023 4.033 -0.010 1
1 1317 . 16 1 1 A 95 95 GLU C C 95 178.884 179.246 -0.362 1
1 1318 . 16 1 1 A 95 95 GLU CA C 95 59.366 59.443 -0.077 1
1 1319 . 16 1 1 A 95 95 GLU CB C 95 29.508 29.586 -0.078 1
1 1321 . 16 1 1 A 95 95 GLU N N 95 118.505 117.909 0.596 1
1 1322 . 16 1 1 A 96 96 PHE H H 96 8.212 8.561 -0.349 1
1 1323 . 16 1 1 A 96 96 PHE HA H 96 4.512 4.319 0.193 1
1 1331 . 16 1 1 A 96 96 PHE C C 96 176.820 177.979 -1.159 1
1 1332 . 16 1 1 A 96 96 PHE CA C 96 59.608 61.395 -1.787 1
1 1333 . 16 1 1 A 96 96 PHE CB C 96 40.431 39.257 1.174 1
1 1339 . 16 1 1 A 96 96 PHE N N 96 120.369 122.140 -1.771 1
1 1340 . 16 1 1 A 97 97 SER H H 97 8.216 8.436 -0.220 1
1 1341 . 16 1 1 A 97 97 SER HA H 97 3.816 4.201 -0.385 1
1 1344 . 16 1 1 A 97 97 SER C C 97 175.618 176.498 -0.880 1
1 1345 . 16 1 1 A 97 97 SER CA C 97 60.492 61.186 -0.694 1
1 1346 . 16 1 1 A 97 97 SER CB C 97 63.022 62.599 0.423 1
1 1347 . 16 1 1 A 97 97 SER N N 97 111.969 113.086 -1.117 1
1 1348 . 16 1 1 A 98 98 GLU H H 98 7.655 7.581 0.074 1
1 1349 . 16 1 1 A 98 98 GLU HA H 98 4.187 4.213 -0.026 1
1 1354 . 16 1 1 A 98 98 GLU C C 98 177.698 179.366 -1.668 1
1 1355 . 16 1 1 A 98 98 GLU CA C 98 57.069 58.193 -1.124 1
1 1356 . 16 1 1 A 98 98 GLU CB C 98 29.321 29.619 -0.298 1
1 1358 . 16 1 1 A 98 98 GLU N N 98 120.588 122.340 -1.752 1
1 1359 . 16 1 1 A 99 99 GLU H H 99 7.794 7.600 0.194 1
1 1360 . 16 1 1 A 99 99 GLU HA H 99 4.123 3.978 0.145 1
1 1365 . 16 1 1 A 99 99 GLU C C 99 177.665 177.508 0.157 1
1 1366 . 16 1 1 A 99 99 GLU CA C 99 57.304 59.084 -1.780 1
1 1367 . 16 1 1 A 99 99 GLU CB C 99 29.368 29.499 -0.131 1
1 1369 . 16 1 1 A 99 99 GLU N N 99 120.067 118.888 1.179 1
1 1370 . 16 1 1 A 100 100 GLY H H 100 8.138 7.557 0.581 1
1 1371 . 16 1 1 A 100 100 GLY HA2 H 100 3.865 3.746 0.119 1
1 1372 . 16 1 1 A 100 100 GLY HA3 H 100 3.715 3.811 -0.096 1
1 1373 . 16 1 1 A 100 100 GLY C C 100 174.464 174.781 -0.317 1
1 1374 . 16 1 1 A 100 100 GLY CA C 100 45.305 46.197 -0.892 1
1 1375 . 16 1 1 A 100 100 GLY N N 100 107.802 107.970 -0.168 1
1 1376 . 16 1 1 A 101 101 GLY H H 101 8.023 8.594 -0.571 1
1 1377 . 16 1 1 A 101 101 GLY HA2 H 101 3.865 3.845 0.020 1
1 1378 . 16 1 1 A 101 101 GLY HA3 H 101 3.892 3.847 0.045 1
1 1379 . 16 1 1 A 101 101 GLY C C 101 174.204 173.292 0.912 1
1 1380 . 16 1 1 A 101 101 GLY CA C 101 45.036 47.249 -2.213 1
1 1381 . 16 1 1 A 101 101 GLY N N 101 108.032 107.913 0.119 1
1 1382 . 16 1 1 A 102 102 SER H H 102 8.059 8.174 -0.115 1
1 1383 . 16 1 1 A 102 102 SER HA H 102 4.380 4.822 -0.442 1
1 1386 . 16 1 1 A 102 102 SER C C 102 174.627 174.172 0.455 1
1 1387 . 16 1 1 A 102 102 SER CA C 102 58.194 57.550 0.644 1
1 1388 . 16 1 1 A 102 102 SER CB C 102 63.538 65.849 -2.311 1
1 1389 . 16 1 1 A 102 102 SER N N 102 115.266 115.309 -0.043 1
1 1390 . 16 1 1 A 103 103 LEU H H 103 8.287 8.803 -0.516 1
1 1391 . 16 1 1 A 103 103 LEU HA H 103 4.301 4.091 0.210 1
1 1401 . 16 1 1 A 103 103 LEU C C 103 177.292 177.630 -0.338 1
1 1402 . 16 1 1 A 103 103 LEU CA C 103 55.007 58.049 -3.042 1
1 1403 . 16 1 1 A 103 103 LEU CB C 103 42.023 41.813 0.210 1
1 1407 . 16 1 1 A 103 103 LEU N N 103 123.596 125.076 -1.480 1
1 1408 . 16 1 1 A 104 104 GLU H H 104 8.216 7.979 0.237 1
1 1409 . 16 1 1 A 104 104 GLU HA H 104 4.126 4.715 -0.589 1
1 1414 . 16 1 1 A 104 104 GLU CA C 104 56.518 55.551 0.967 1
1 1415 . 16 1 1 A 104 104 GLU CB C 104 29.837 27.920 1.917 1
1 1417 . 16 1 1 A 104 104 GLU N N 104 120.510 116.472 4.038 1
1 1418 . 16 1 1 A 105 105 HIS HA H 105 4.593 4.446 0.147 1
1 1421 . 16 1 1 A 105 105 HIS C C 105 173.766 176.613 -2.847 1
1 1422 . 16 1 1 A 105 105 HIS CA C 105 55.536 58.187 -2.651 1
1 1423 . 16 1 1 A 105 105 HIS CB C 105 30.001 30.773 -0.772 1
1 1424 . 16 1 1 A 106 106 HIS H H 106 8.154 7.926 0.228 1
1 1425 . 16 1 1 A 106 106 HIS HA H 106 4.407 4.283 0.124 1
1 1428 . 16 1 1 A 106 106 HIS CA C 106 56.920 58.294 -1.374 1
1 1429 . 16 1 1 A 106 106 HIS CB C 106 30.001 30.355 -0.354 1
1 14 . 17 1 1 A 2 2 LEU H H 2 8.509 8.901 -0.392 1
1 15 . 17 1 1 A 2 2 LEU HA H 2 4.463 5.147 -0.684 1
1 25 . 17 1 1 A 2 2 LEU C C 2 173.944 176.115 -2.171 1
1 26 . 17 1 1 A 2 2 LEU CA C 2 54.471 53.462 1.009 1
1 27 . 17 1 1 A 2 2 LEU CB C 2 43.595 43.722 -0.127 1
1 31 . 17 1 1 A 2 2 LEU N N 2 127.160 126.698 0.462 1
1 32 . 17 1 1 A 3 3 LEU H H 3 7.844 8.725 -0.881 1
1 33 . 17 1 1 A 3 3 LEU HA H 3 5.128 5.534 -0.406 1
1 43 . 17 1 1 A 3 3 LEU C C 3 175.423 175.186 0.237 1
1 44 . 17 1 1 A 3 3 LEU CA C 3 53.566 53.017 0.549 1
1 45 . 17 1 1 A 3 3 LEU CB C 3 44.039 44.654 -0.615 1
1 49 . 17 1 1 A 3 3 LEU N N 3 122.555 122.880 -0.325 1
1 50 . 17 1 1 A 4 4 TYR H H 4 8.360 9.354 -0.994 1
1 51 . 17 1 1 A 4 4 TYR HA H 4 5.143 5.260 -0.117 1
1 58 . 17 1 1 A 4 4 TYR C C 4 174.481 175.038 -0.557 1
1 59 . 17 1 1 A 4 4 TYR CA C 4 56.577 56.025 0.552 1
1 60 . 17 1 1 A 4 4 TYR CB C 4 43.840 43.064 0.776 1
1 65 . 17 1 1 A 4 4 TYR N N 4 119.315 122.797 -3.482 1
1 66 . 17 1 1 A 5 5 VAL H H 5 8.918 8.954 -0.036 1
1 67 . 17 1 1 A 5 5 VAL HA H 5 5.106 5.011 0.095 1
1 75 . 17 1 1 A 5 5 VAL C C 5 174.042 174.937 -0.895 1
1 76 . 17 1 1 A 5 5 VAL CA C 5 59.852 60.651 -0.799 1
1 77 . 17 1 1 A 5 5 VAL CB C 5 33.816 35.712 -1.896 1
1 80 . 17 1 1 A 5 5 VAL N N 5 119.952 120.285 -0.333 1
1 81 . 17 1 1 A 6 6 LEU H H 6 9.315 9.282 0.033 1
1 82 . 17 1 1 A 6 6 LEU HA H 6 5.466 5.236 0.230 1
1 92 . 17 1 1 A 6 6 LEU C C 6 175.049 174.727 0.322 1
1 93 . 17 1 1 A 6 6 LEU CA C 6 52.090 53.207 -1.117 1
1 94 . 17 1 1 A 6 6 LEU CB C 6 44.103 44.415 -0.312 1
1 98 . 17 1 1 A 6 6 LEU N N 6 126.917 125.922 0.995 1
1 99 . 17 1 1 A 7 7 ILE H H 7 8.458 8.896 -0.438 1
1 100 . 17 1 1 A 7 7 ILE HA H 7 5.131 5.156 -0.025 1
1 110 . 17 1 1 A 7 7 ILE C C 7 173.213 173.502 -0.289 1
1 111 . 17 1 1 A 7 7 ILE CA C 7 58.463 59.650 -1.187 1
1 112 . 17 1 1 A 7 7 ILE CB C 7 41.020 41.016 0.004 1
1 116 . 17 1 1 A 7 7 ILE N N 7 119.778 126.185 -6.407 1
1 117 . 17 1 1 A 8 8 ILE H H 8 8.797 9.418 -0.621 1
1 118 . 17 1 1 A 8 8 ILE HA H 8 4.611 4.923 -0.312 1
1 128 . 17 1 1 A 8 8 ILE C C 8 174.611 174.827 -0.216 1
1 129 . 17 1 1 A 8 8 ILE CA C 8 60.227 60.345 -0.118 1
1 130 . 17 1 1 A 8 8 ILE CB C 8 37.665 37.903 -0.238 1
1 134 . 17 1 1 A 8 8 ILE N N 8 128.919 131.578 -2.659 1
1 135 . 17 1 1 A 9 9 SER H H 9 7.811 8.781 -0.970 1
1 136 . 17 1 1 A 9 9 SER HA H 9 4.429 4.979 -0.550 1
1 140 . 17 1 1 A 9 9 SER C C 9 172.937 172.881 0.056 1
1 141 . 17 1 1 A 9 9 SER CA C 9 58.241 56.971 1.270 1
1 142 . 17 1 1 A 9 9 SER CB C 9 64.261 64.201 0.060 1
1 143 . 17 1 1 A 9 9 SER N N 9 116.365 121.870 -5.505 1
1 144 . 17 1 1 A 10 10 ASN H H 10 8.641 8.604 0.037 1
1 145 . 17 1 1 A 10 10 ASN HA H 10 4.938 4.899 0.039 1
1 150 . 17 1 1 A 10 10 ASN C C 10 174.497 175.242 -0.745 1
1 151 . 17 1 1 A 10 10 ASN CA C 10 52.221 53.334 -1.113 1
1 152 . 17 1 1 A 10 10 ASN CB C 10 39.128 39.209 -0.081 1
1 153 . 17 1 1 A 10 10 ASN N N 10 122.612 120.991 1.621 1
1 155 . 17 1 1 A 11 11 ASP H H 11 8.673 7.518 1.155 1
1 156 . 17 1 1 A 11 11 ASP HA H 11 4.596 4.809 -0.213 1
1 159 . 17 1 1 A 11 11 ASP C C 11 175.342 176.131 -0.789 1
1 160 . 17 1 1 A 11 11 ASP CA C 11 53.233 53.847 -0.614 1
1 161 . 17 1 1 A 11 11 ASP CB C 11 40.965 40.149 0.816 1
1 162 . 17 1 1 A 11 11 ASP N N 11 122.717 120.471 2.246 1
1 163 . 17 1 1 A 12 12 LYS H H 12 8.562 8.606 -0.044 1
1 164 . 17 1 1 A 12 12 LYS HA H 12 3.854 3.975 -0.121 1
1 173 . 17 1 1 A 12 12 LYS C C 12 178.754 178.253 0.501 1
1 174 . 17 1 1 A 12 12 LYS CA C 12 59.581 60.258 -0.677 1
1 175 . 17 1 1 A 12 12 LYS CB C 12 32.378 32.514 -0.136 1
1 179 . 17 1 1 A 12 12 LYS N N 12 125.737 125.631 0.106 1
1 180 . 17 1 1 A 13 13 LYS H H 13 8.075 7.667 0.408 1
1 181 . 17 1 1 A 13 13 LYS HA H 13 4.154 4.016 0.138 1
1 190 . 17 1 1 A 13 13 LYS C C 13 178.315 179.262 -0.947 1
1 191 . 17 1 1 A 13 13 LYS CA C 13 58.532 59.417 -0.885 1
1 192 . 17 1 1 A 13 13 LYS CB C 13 31.452 32.255 -0.803 1
1 196 . 17 1 1 A 13 13 LYS N N 13 119.604 119.462 0.142 1
1 197 . 17 1 1 A 14 14 LEU H H 14 7.552 7.681 -0.129 1
1 198 . 17 1 1 A 14 14 LEU HA H 14 3.682 4.034 -0.352 1
1 208 . 17 1 1 A 14 14 LEU C C 14 178.429 178.342 0.087 1
1 209 . 17 1 1 A 14 14 LEU CA C 14 58.999 57.987 1.012 1
1 210 . 17 1 1 A 14 14 LEU CB C 14 41.228 41.587 -0.359 1
1 214 . 17 1 1 A 14 14 LEU N N 14 122.266 121.421 0.845 1
1 215 . 17 1 1 A 15 15 ILE H H 15 8.074 8.093 -0.019 1
1 216 . 17 1 1 A 15 15 ILE HA H 15 3.264 3.481 -0.217 1
1 226 . 17 1 1 A 15 15 ILE C C 15 177.000 177.814 -0.814 1
1 227 . 17 1 1 A 15 15 ILE CA C 15 65.939 65.213 0.726 1
1 228 . 17 1 1 A 15 15 ILE CB C 15 37.983 37.431 0.552 1
1 232 . 17 1 1 A 15 15 ILE N N 15 118.214 119.558 -1.344 1
1 233 . 17 1 1 A 16 16 GLU H H 16 8.016 8.688 -0.672 1
1 234 . 17 1 1 A 16 16 GLU HA H 16 4.045 3.902 0.143 1
1 239 . 17 1 1 A 16 16 GLU C C 16 179.388 179.748 -0.360 1
1 240 . 17 1 1 A 16 16 GLU CA C 16 59.032 59.950 -0.918 1
1 241 . 17 1 1 A 16 16 GLU CB C 16 29.200 29.211 -0.011 1
1 243 . 17 1 1 A 16 16 GLU N N 16 118.484 118.987 -0.503 1
1 244 . 17 1 1 A 17 17 GLU H H 17 8.063 8.161 -0.098 1
1 245 . 17 1 1 A 17 17 GLU HA H 17 4.053 4.031 0.022 1
1 250 . 17 1 1 A 17 17 GLU C C 17 179.306 179.150 0.156 1
1 251 . 17 1 1 A 17 17 GLU CA C 17 58.636 59.407 -0.771 1
1 252 . 17 1 1 A 17 17 GLU CB C 17 29.011 29.332 -0.321 1
1 254 . 17 1 1 A 17 17 GLU N N 17 118.100 120.579 -2.479 1
1 255 . 17 1 1 A 18 18 ALA H H 18 8.655 8.009 0.646 1
1 256 . 17 1 1 A 18 18 ALA HA H 18 3.775 4.043 -0.268 1
1 260 . 17 1 1 A 18 18 ALA C C 18 178.559 179.682 -1.123 1
1 261 . 17 1 1 A 18 18 ALA CA C 18 54.960 55.280 -0.320 1
1 262 . 17 1 1 A 18 18 ALA CB C 18 17.960 18.130 -0.170 1
1 263 . 17 1 1 A 18 18 ALA N N 18 122.439 122.768 -0.329 1
1 264 . 17 1 1 A 19 19 ARG H H 19 8.900 8.054 0.846 1
1 265 . 17 1 1 A 19 19 ARG HA H 19 3.809 4.055 -0.246 1
1 273 . 17 1 1 A 19 19 ARG C C 19 178.721 178.773 -0.052 1
1 274 . 17 1 1 A 19 19 ARG CA C 19 59.976 59.798 0.178 1
1 275 . 17 1 1 A 19 19 ARG CB C 19 29.572 29.952 -0.380 1
1 278 . 17 1 1 A 19 19 ARG N N 19 118.563 117.713 0.850 1
1 280 . 17 1 1 A 20 20 LYS H H 20 7.792 8.205 -0.413 1
1 281 . 17 1 1 A 20 20 LYS HA H 20 4.052 4.003 0.049 1
1 290 . 17 1 1 A 20 20 LYS C C 20 179.648 179.657 -0.009 1
1 291 . 17 1 1 A 20 20 LYS CA C 20 59.296 59.151 0.145 1
1 292 . 17 1 1 A 20 20 LYS CB C 20 32.216 32.224 -0.008 1
1 296 . 17 1 1 A 20 20 LYS N N 20 118.638 119.219 -0.581 1
1 297 . 17 1 1 A 21 21 MET H H 21 7.684 8.227 -0.543 1
1 298 . 17 1 1 A 21 21 MET HA H 21 4.411 4.188 0.223 1
1 306 . 17 1 1 A 21 21 MET C C 21 177.909 178.156 -0.247 1
1 307 . 17 1 1 A 21 21 MET CA C 21 57.009 59.104 -2.095 1
1 308 . 17 1 1 A 21 21 MET CB C 21 32.028 32.045 -0.017 1
1 311 . 17 1 1 A 21 21 MET N N 21 118.100 118.259 -0.159 1
1 312 . 17 1 1 A 22 22 ALA H H 22 8.815 8.236 0.579 1
1 313 . 17 1 1 A 22 22 ALA HA H 22 3.826 3.995 -0.169 1
1 317 . 17 1 1 A 22 22 ALA C C 22 178.835 179.747 -0.912 1
1 318 . 17 1 1 A 22 22 ALA CA C 22 55.427 55.396 0.031 1
1 319 . 17 1 1 A 22 22 ALA CB C 22 18.059 18.280 -0.221 1
1 320 . 17 1 1 A 22 22 ALA N N 22 122.150 121.328 0.822 1
1 321 . 17 1 1 A 23 23 GLU H H 23 8.276 8.022 0.254 1
1 322 . 17 1 1 A 23 23 GLU HA H 23 4.146 4.010 0.136 1
1 327 . 17 1 1 A 23 23 GLU C C 23 180.151 179.570 0.581 1
1 328 . 17 1 1 A 23 23 GLU CA C 23 58.999 59.088 -0.089 1
1 329 . 17 1 1 A 23 23 GLU CB C 23 29.160 29.273 -0.113 1
1 331 . 17 1 1 A 23 23 GLU N N 23 117.001 117.942 -0.941 1
1 332 . 17 1 1 A 24 24 LYS H H 24 7.573 8.281 -0.708 1
1 333 . 17 1 1 A 24 24 LYS HA H 24 4.101 4.054 0.047 1
1 342 . 17 1 1 A 24 24 LYS C C 24 177.145 177.727 -0.582 1
1 343 . 17 1 1 A 24 24 LYS CA C 24 58.261 59.069 -0.808 1
1 344 . 17 1 1 A 24 24 LYS CB C 24 32.079 32.222 -0.143 1
1 348 . 17 1 1 A 24 24 LYS N N 24 119.960 120.126 -0.166 1
1 349 . 17 1 1 A 25 25 ALA H H 25 7.710 7.810 -0.100 1
1 350 . 17 1 1 A 25 25 ALA HA H 25 4.413 4.371 0.042 1
1 354 . 17 1 1 A 25 25 ALA C C 25 175.325 176.485 -1.160 1
1 355 . 17 1 1 A 25 25 ALA CA C 25 51.208 51.706 -0.498 1
1 356 . 17 1 1 A 25 25 ALA CB C 25 18.520 19.061 -0.541 1
1 357 . 17 1 1 A 25 25 ALA N N 25 119.257 118.930 0.327 1
1 358 . 17 1 1 A 26 26 ASN H H 26 7.840 7.768 0.072 1
1 359 . 17 1 1 A 26 26 ASN HA H 26 4.357 4.354 0.003 1
1 364 . 17 1 1 A 26 26 ASN C C 26 173.587 173.925 -0.338 1
1 365 . 17 1 1 A 26 26 ASN CA C 26 54.307 54.485 -0.178 1
1 366 . 17 1 1 A 26 26 ASN CB C 26 36.972 37.024 -0.052 1
1 367 . 17 1 1 A 26 26 ASN N N 26 115.266 113.544 1.722 1
1 369 . 17 1 1 A 27 27 LEU H H 27 8.241 7.960 0.281 1
1 370 . 17 1 1 A 27 27 LEU HA H 27 4.652 4.597 0.055 1
1 380 . 17 1 1 A 27 27 LEU C C 27 175.894 175.962 -0.068 1
1 381 . 17 1 1 A 27 27 LEU CA C 27 52.923 53.527 -0.604 1
1 382 . 17 1 1 A 27 27 LEU CB C 27 44.090 43.585 0.505 1
1 386 . 17 1 1 A 27 27 LEU N N 27 116.828 119.251 -2.423 1
1 387 . 17 1 1 A 28 28 GLU H H 28 7.798 8.540 -0.742 1
1 388 . 17 1 1 A 28 28 GLU HA H 28 4.310 4.645 -0.335 1
1 393 . 17 1 1 A 28 28 GLU C C 28 173.944 175.414 -1.470 1
1 394 . 17 1 1 A 28 28 GLU CA C 28 55.460 56.203 -0.743 1
1 395 . 17 1 1 A 28 28 GLU CB C 28 30.512 30.558 -0.046 1
1 397 . 17 1 1 A 28 28 GLU N N 28 121.340 122.866 -1.526 1
1 398 . 17 1 1 A 29 29 LEU H H 29 8.451 8.685 -0.234 1
1 399 . 17 1 1 A 29 29 LEU HA H 29 5.662 5.550 0.112 1
1 409 . 17 1 1 A 29 29 LEU C C 29 176.902 174.143 2.759 1
1 410 . 17 1 1 A 29 29 LEU CA C 29 53.186 54.088 -0.902 1
1 411 . 17 1 1 A 29 29 LEU CB C 29 44.914 46.032 -1.118 1
1 415 . 17 1 1 A 29 29 LEU N N 29 126.547 127.431 -0.884 1
1 416 . 17 1 1 A 30 30 ARG H H 30 9.094 8.862 0.232 1
1 417 . 17 1 1 A 30 30 ARG HA H 30 4.910 5.063 -0.153 1
1 425 . 17 1 1 A 30 30 ARG C C 30 175.147 175.194 -0.047 1
1 426 . 17 1 1 A 30 30 ARG CA C 30 53.417 53.834 -0.417 1
1 427 . 17 1 1 A 30 30 ARG CB C 30 32.555 33.602 -1.047 1
1 430 . 17 1 1 A 30 30 ARG N N 30 125.043 125.392 -0.349 1
1 432 . 17 1 1 A 31 31 THR H H 31 8.496 8.350 0.146 1
1 433 . 17 1 1 A 31 31 THR HA H 31 4.888 4.756 0.132 1
1 438 . 17 1 1 A 31 31 THR C C 31 173.961 173.893 0.068 1
1 439 . 17 1 1 A 31 31 THR CA C 31 60.445 60.981 -0.536 1
1 440 . 17 1 1 A 31 31 THR CB C 31 69.492 69.862 -0.370 1
1 442 . 17 1 1 A 31 31 THR N N 31 114.745 113.785 0.960 1
1 443 . 17 1 1 A 32 32 VAL H H 32 8.480 9.143 -0.663 1
1 444 . 17 1 1 A 32 32 VAL HA H 32 4.411 4.578 -0.167 1
1 452 . 17 1 1 A 32 32 VAL C C 32 175.082 175.514 -0.432 1
1 453 . 17 1 1 A 32 32 VAL CA C 32 60.946 61.266 -0.320 1
1 454 . 17 1 1 A 32 32 VAL CB C 32 34.487 33.302 1.185 1
1 457 . 17 1 1 A 32 32 VAL N N 32 122.324 126.060 -3.736 1
1 458 . 17 1 1 A 33 33 LYS H H 33 9.304 8.951 0.353 1
1 459 . 17 1 1 A 33 33 LYS HA H 33 4.534 4.458 0.076 1
1 468 . 17 1 1 A 33 33 LYS C C 33 176.740 176.815 -0.075 1
1 469 . 17 1 1 A 33 33 LYS CA C 33 56.846 57.332 -0.486 1
1 470 . 17 1 1 A 33 33 LYS CB C 33 34.355 33.224 1.131 1
1 474 . 17 1 1 A 33 33 LYS N N 33 123.654 126.210 -2.556 1
1 475 . 17 1 1 A 34 34 THR H H 34 7.245 7.709 -0.464 1
1 476 . 17 1 1 A 34 34 THR HA H 34 4.780 4.685 0.095 1
1 481 . 17 1 1 A 34 34 THR C C 34 174.529 175.253 -0.724 1
1 482 . 17 1 1 A 34 34 THR CA C 34 58.859 59.809 -0.950 1
1 483 . 17 1 1 A 34 34 THR CB C 34 73.023 71.931 1.092 1
1 485 . 17 1 1 A 34 34 THR N N 34 106.300 111.729 -5.429 1
1 486 . 17 1 1 A 35 35 GLU H H 35 9.174 8.876 0.298 1
1 487 . 17 1 1 A 35 35 GLU HA H 35 3.886 3.979 -0.093 1
1 492 . 17 1 1 A 35 35 GLU C C 35 177.714 177.572 0.142 1
1 493 . 17 1 1 A 35 35 GLU CA C 35 59.233 59.772 -0.539 1
1 494 . 17 1 1 A 35 35 GLU CB C 35 29.377 29.399 -0.022 1
1 496 . 17 1 1 A 35 35 GLU N N 35 121.919 121.851 0.068 1
1 497 . 17 1 1 A 36 36 ASP H H 36 8.185 8.371 -0.186 1
1 498 . 17 1 1 A 36 36 ASP HA H 36 4.289 4.316 -0.027 1
1 501 . 17 1 1 A 36 36 ASP C C 36 178.348 178.553 -0.205 1
1 502 . 17 1 1 A 36 36 ASP CA C 36 56.962 57.651 -0.689 1
1 503 . 17 1 1 A 36 36 ASP CB C 36 40.214 41.844 -1.630 1
1 504 . 17 1 1 A 36 36 ASP N N 36 118.332 119.988 -1.656 1
1 505 . 17 1 1 A 37 37 GLU H H 37 7.741 7.663 0.078 1
1 506 . 17 1 1 A 37 37 GLU HA H 37 3.708 3.963 -0.255 1
1 511 . 17 1 1 A 37 37 GLU C C 37 177.324 179.083 -1.759 1
1 512 . 17 1 1 A 37 37 GLU CA C 37 58.698 59.297 -0.599 1
1 513 . 17 1 1 A 37 37 GLU CB C 37 30.199 29.412 0.787 1
1 515 . 17 1 1 A 37 37 GLU N N 37 120.704 118.983 1.721 1
1 516 . 17 1 1 A 38 38 LEU H H 38 7.531 8.160 -0.629 1
1 517 . 17 1 1 A 38 38 LEU HA H 38 3.873 4.132 -0.259 1
1 527 . 17 1 1 A 38 38 LEU C C 38 177.357 178.586 -1.229 1
1 528 . 17 1 1 A 38 38 LEU CA C 38 58.305 58.281 0.024 1
1 529 . 17 1 1 A 38 38 LEU CB C 38 40.837 41.763 -0.926 1
1 533 . 17 1 1 A 38 38 LEU N N 38 119.200 121.669 -2.469 1
1 534 . 17 1 1 A 39 39 LYS H H 39 8.083 8.075 0.008 1
1 535 . 17 1 1 A 39 39 LYS HA H 39 3.608 3.887 -0.279 1
1 544 . 17 1 1 A 39 39 LYS C C 39 177.373 178.957 -1.584 1
1 545 . 17 1 1 A 39 39 LYS CA C 39 60.290 59.522 0.768 1
1 546 . 17 1 1 A 39 39 LYS CB C 39 32.178 32.171 0.007 1
1 550 . 17 1 1 A 39 39 LYS N N 39 116.943 118.900 -1.957 1
1 551 . 17 1 1 A 40 40 LYS H H 40 7.632 8.281 -0.649 1
1 552 . 17 1 1 A 40 40 LYS HA H 40 3.864 4.141 -0.277 1
1 561 . 17 1 1 A 40 40 LYS C C 40 179.566 178.245 1.321 1
1 562 . 17 1 1 A 40 40 LYS CA C 40 58.993 58.839 0.154 1
1 563 . 17 1 1 A 40 40 LYS CB C 40 31.758 32.038 -0.280 1
1 567 . 17 1 1 A 40 40 LYS N N 40 118.274 119.075 -0.801 1
1 568 . 17 1 1 A 41 41 TYR H H 41 7.823 7.585 0.238 1
1 569 . 17 1 1 A 41 41 TYR HA H 41 3.926 4.108 -0.182 1
1 576 . 17 1 1 A 41 41 TYR C C 41 176.625 177.675 -1.050 1
1 577 . 17 1 1 A 41 41 TYR CA C 41 59.757 60.981 -1.224 1
1 578 . 17 1 1 A 41 41 TYR CB C 41 36.901 38.294 -1.393 1
1 583 . 17 1 1 A 41 41 TYR N N 41 117.811 118.178 -0.367 1
1 584 . 17 1 1 A 42 42 LEU H H 42 7.964 7.909 0.055 1
1 585 . 17 1 1 A 42 42 LEU HA H 42 3.704 3.767 -0.063 1
1 595 . 17 1 1 A 42 42 LEU C C 42 178.396 179.131 -0.735 1
1 596 . 17 1 1 A 42 42 LEU CA C 42 58.237 57.422 0.815 1
1 597 . 17 1 1 A 42 42 LEU CB C 42 40.507 40.973 -0.466 1
1 601 . 17 1 1 A 42 42 LEU N N 42 115.960 120.553 -4.593 1
1 602 . 17 1 1 A 43 43 GLU H H 43 8.193 8.283 -0.090 1
1 603 . 17 1 1 A 43 43 GLU HA H 43 3.882 3.848 0.034 1
1 608 . 17 1 1 A 43 43 GLU C C 43 179.193 179.504 -0.311 1
1 609 . 17 1 1 A 43 43 GLU CA C 43 59.122 59.893 -0.771 1
1 610 . 17 1 1 A 43 43 GLU CB C 43 29.244 29.168 0.076 1
1 612 . 17 1 1 A 43 43 GLU N N 43 117.175 119.609 -2.434 1
1 613 . 17 1 1 A 44 44 GLU H H 44 7.601 7.693 -0.092 1
1 614 . 17 1 1 A 44 44 GLU HA H 44 3.936 3.945 -0.009 1
1 619 . 17 1 1 A 44 44 GLU C C 44 179.875 179.123 0.752 1
1 620 . 17 1 1 A 44 44 GLU CA C 44 58.867 58.918 -0.051 1
1 621 . 17 1 1 A 44 44 GLU CB C 44 28.648 29.387 -0.739 1
1 623 . 17 1 1 A 44 44 GLU N N 44 120.472 119.468 1.004 1
1 624 . 17 1 1 A 45 45 PHE H H 45 8.260 7.491 0.769 1
1 625 . 17 1 1 A 45 45 PHE HA H 45 4.520 4.064 0.456 1
1 633 . 17 1 1 A 45 45 PHE C C 45 177.942 178.400 -0.458 1
1 634 . 17 1 1 A 45 45 PHE CA C 45 55.945 61.142 -5.197 1
1 635 . 17 1 1 A 45 45 PHE CB C 45 36.680 38.160 -1.480 1
1 641 . 17 1 1 A 45 45 PHE N N 45 119.272 119.290 -0.018 1
1 642 . 17 1 1 A 46 46 ARG H H 46 8.023 8.081 -0.058 1
1 643 . 17 1 1 A 46 46 ARG HA H 46 4.074 4.169 -0.095 1
1 651 . 17 1 1 A 46 46 ARG C C 46 177.617 178.907 -1.290 1
1 652 . 17 1 1 A 46 46 ARG CA C 46 58.194 58.955 -0.761 1
1 653 . 17 1 1 A 46 46 ARG CB C 46 29.737 30.073 -0.336 1
1 656 . 17 1 1 A 46 46 ARG N N 46 118.136 120.395 -2.259 1
1 658 . 17 1 1 A 47 47 LYS H H 47 7.470 8.047 -0.577 1
1 659 . 17 1 1 A 47 47 LYS HA H 47 4.143 4.070 0.073 1
1 668 . 17 1 1 A 47 47 LYS C C 47 177.324 178.112 -0.788 1
1 669 . 17 1 1 A 47 47 LYS CA C 47 57.726 59.643 -1.917 1
1 670 . 17 1 1 A 47 47 LYS CB C 47 32.409 32.142 0.267 1
1 674 . 17 1 1 A 47 47 LYS N N 47 116.943 120.011 -3.068 1
1 675 . 17 1 1 A 48 48 GLU H H 48 7.615 8.046 -0.431 1
1 676 . 17 1 1 A 48 48 GLU HA H 48 4.428 4.850 -0.422 1
1 681 . 17 1 1 A 48 48 GLU C C 48 176.869 176.564 0.305 1
1 682 . 17 1 1 A 48 48 GLU CA C 48 55.945 55.916 0.029 1
1 683 . 17 1 1 A 48 48 GLU CB C 48 29.696 30.335 -0.639 1
1 685 . 17 1 1 A 48 48 GLU N N 48 118.852 116.525 2.327 1
1 686 . 17 1 1 A 49 49 SER H H 49 7.725 7.946 -0.221 1
1 687 . 17 1 1 A 49 49 SER HA H 49 4.244 4.410 -0.166 1
1 690 . 17 1 1 A 49 49 SER C C 49 174.838 175.896 -1.058 1
1 691 . 17 1 1 A 49 49 SER CA C 49 59.366 59.729 -0.363 1
1 692 . 17 1 1 A 49 49 SER CB C 49 63.116 62.775 0.341 1
1 693 . 17 1 1 A 49 49 SER N N 49 114.224 116.593 -2.369 1
1 694 . 17 1 1 A 50 50 GLN H H 50 8.548 7.989 0.559 1
1 695 . 17 1 1 A 50 50 GLN HA H 50 4.398 4.266 0.132 1
1 702 . 17 1 1 A 50 50 GLN C C 50 175.732 177.193 -1.461 1
1 703 . 17 1 1 A 50 50 GLN CA C 50 56.272 58.054 -1.782 1
1 704 . 17 1 1 A 50 50 GLN CB C 50 28.946 29.494 -0.548 1
1 706 . 17 1 1 A 50 50 GLN N N 50 120.125 120.333 -0.208 1
1 708 . 17 1 1 A 51 51 ASN H H 51 8.534 7.957 0.577 1
1 709 . 17 1 1 A 51 51 ASN HA H 51 4.980 4.934 0.046 1
1 714 . 17 1 1 A 51 51 ASN C C 51 173.717 174.472 -0.755 1
1 715 . 17 1 1 A 51 51 ASN CA C 51 52.804 52.811 -0.007 1
1 716 . 17 1 1 A 51 51 ASN CB C 51 39.583 39.367 0.216 1
1 717 . 17 1 1 A 51 51 ASN N N 51 118.158 114.708 3.450 1
1 719 . 17 1 1 A 52 52 ILE H H 52 7.492 7.517 -0.025 1
1 720 . 17 1 1 A 52 52 ILE HA H 52 5.338 4.713 0.625 1
1 730 . 17 1 1 A 52 52 ILE C C 52 175.049 174.309 0.740 1
1 731 . 17 1 1 A 52 52 ILE CA C 52 59.364 60.472 -1.108 1
1 732 . 17 1 1 A 52 52 ILE CB C 52 42.163 40.444 1.719 1
1 736 . 17 1 1 A 52 52 ILE N N 52 117.927 121.653 -3.726 1
1 737 . 17 1 1 A 53 53 LYS H H 53 8.467 9.193 -0.726 1
1 738 . 17 1 1 A 53 53 LYS HA H 53 5.044 5.195 -0.151 1
1 747 . 17 1 1 A 53 53 LYS C C 53 175.082 175.548 -0.466 1
1 748 . 17 1 1 A 53 53 LYS CA C 53 55.429 54.987 0.442 1
1 749 . 17 1 1 A 53 53 LYS CB C 53 36.446 35.133 1.313 1
1 753 . 17 1 1 A 53 53 LYS N N 53 123.249 128.404 -5.155 1
1 754 . 17 1 1 A 54 54 VAL H H 54 8.490 9.030 -0.540 1
1 755 . 17 1 1 A 54 54 VAL HA H 54 5.159 4.923 0.236 1
1 763 . 17 1 1 A 54 54 VAL C C 54 173.473 173.877 -0.404 1
1 764 . 17 1 1 A 54 54 VAL CA C 54 60.163 60.681 -0.518 1
1 765 . 17 1 1 A 54 54 VAL CB C 54 35.509 33.754 1.755 1
1 768 . 17 1 1 A 54 54 VAL N N 54 120.762 125.312 -4.550 1
1 769 . 17 1 1 A 55 55 LEU H H 55 8.636 8.848 -0.212 1
1 770 . 17 1 1 A 55 55 LEU HA H 55 4.670 4.719 -0.049 1
1 780 . 17 1 1 A 55 55 LEU C C 55 173.652 174.424 -0.772 1
1 781 . 17 1 1 A 55 55 LEU CA C 55 52.289 53.081 -0.792 1
1 782 . 17 1 1 A 55 55 LEU CB C 55 42.070 43.576 -1.506 1
1 786 . 17 1 1 A 55 55 LEU N N 55 131.898 129.358 2.540 1
1 787 . 17 1 1 A 56 56 ILE H H 56 9.188 9.076 0.112 1
1 788 . 17 1 1 A 56 56 ILE HA H 56 4.879 5.316 -0.437 1
1 798 . 17 1 1 A 56 56 ILE C C 56 174.172 174.319 -0.147 1
1 799 . 17 1 1 A 56 56 ILE CA C 56 59.976 59.268 0.708 1
1 800 . 17 1 1 A 56 56 ILE CB C 56 38.181 40.691 -2.510 1
1 804 . 17 1 1 A 56 56 ILE N N 56 126.373 127.571 -1.198 1
1 805 . 17 1 1 A 57 57 LEU H H 57 8.929 9.239 -0.310 1
1 806 . 17 1 1 A 57 57 LEU HA H 57 5.394 5.180 0.214 1
1 816 . 17 1 1 A 57 57 LEU C C 57 175.358 175.528 -0.170 1
1 817 . 17 1 1 A 57 57 LEU CA C 57 52.086 53.492 -1.406 1
1 818 . 17 1 1 A 57 57 LEU CB C 57 42.445 43.135 -0.690 1
1 822 . 17 1 1 A 57 57 LEU N N 57 126.547 128.012 -1.465 1
1 823 . 17 1 1 A 58 58 VAL H H 58 8.542 9.072 -0.530 1
1 824 . 17 1 1 A 58 58 VAL HA H 58 5.253 4.857 0.396 1
1 832 . 17 1 1 A 58 58 VAL C C 58 175.244 175.960 -0.716 1
1 833 . 17 1 1 A 58 58 VAL CA C 58 58.241 59.258 -1.017 1
1 834 . 17 1 1 A 58 58 VAL CB C 58 33.165 34.237 -1.072 1
1 837 . 17 1 1 A 58 58 VAL N N 58 114.398 121.864 -7.466 1
1 838 . 17 1 1 A 59 59 SER H H 59 8.797 8.724 0.073 1
1 839 . 17 1 1 A 59 59 SER HA H 59 5.063 4.651 0.412 1
1 842 . 17 1 1 A 59 59 SER C C 59 174.172 174.572 -0.400 1
1 843 . 17 1 1 A 59 59 SER CA C 59 59.320 59.114 0.206 1
1 844 . 17 1 1 A 59 59 SER CB C 59 65.600 63.496 2.104 1
1 845 . 17 1 1 A 59 59 SER N N 59 115.497 116.223 -0.726 1
1 846 . 17 1 1 A 60 60 ASN H H 60 7.730 7.928 -0.198 1
1 847 . 17 1 1 A 60 60 ASN HA H 60 4.811 5.139 -0.328 1
1 852 . 17 1 1 A 60 60 ASN C C 60 174.464 175.619 -1.155 1
1 853 . 17 1 1 A 60 60 ASN CA C 60 52.007 52.334 -0.327 1
1 854 . 17 1 1 A 60 60 ASN CB C 60 40.336 41.536 -1.200 1
1 855 . 17 1 1 A 60 60 ASN N N 60 117.522 118.728 -1.206 1
1 857 . 17 1 1 A 61 61 ASP H H 61 8.577 8.973 -0.396 1
1 858 . 17 1 1 A 61 61 ASP HA H 61 4.365 4.341 0.024 1
1 861 . 17 1 1 A 61 61 ASP C C 61 177.357 178.422 -1.065 1
1 862 . 17 1 1 A 61 61 ASP CA C 61 57.351 57.044 0.307 1
1 863 . 17 1 1 A 61 61 ASP CB C 61 40.383 39.673 0.710 1
1 864 . 17 1 1 A 61 61 ASP N N 61 119.431 121.933 -2.502 1
1 865 . 17 1 1 A 62 62 GLU H H 62 8.405 8.382 0.023 1
1 866 . 17 1 1 A 62 62 GLU HA H 62 4.121 4.008 0.113 1
1 871 . 17 1 1 A 62 62 GLU C C 62 179.615 178.980 0.635 1
1 872 . 17 1 1 A 62 62 GLU CA C 62 59.593 59.700 -0.107 1
1 873 . 17 1 1 A 62 62 GLU CB C 62 28.478 29.113 -0.635 1
1 875 . 17 1 1 A 62 62 GLU N N 62 122.150 120.333 1.817 1
1 876 . 17 1 1 A 63 63 GLU H H 63 8.384 8.216 0.168 1
1 877 . 17 1 1 A 63 63 GLU HA H 63 3.913 3.981 -0.068 1
1 882 . 17 1 1 A 63 63 GLU C C 63 178.478 179.057 -0.579 1
1 883 . 17 1 1 A 63 63 GLU CA C 63 58.273 59.140 -0.867 1
1 884 . 17 1 1 A 63 63 GLU CB C 63 29.931 28.942 0.989 1
1 886 . 17 1 1 A 63 63 GLU N N 63 119.084 118.947 0.137 1
1 887 . 17 1 1 A 64 64 LEU H H 64 7.717 8.004 -0.287 1
1 888 . 17 1 1 A 64 64 LEU HA H 64 3.750 4.010 -0.260 1
1 898 . 17 1 1 A 64 64 LEU C C 64 177.535 178.146 -0.611 1
1 899 . 17 1 1 A 64 64 LEU CA C 64 58.944 58.437 0.507 1
1 900 . 17 1 1 A 64 64 LEU CB C 64 41.695 41.715 -0.020 1
1 904 . 17 1 1 A 64 64 LEU N N 64 120.357 122.044 -1.687 1
1 905 . 17 1 1 A 65 65 ASP H H 65 7.922 8.274 -0.352 1
1 906 . 17 1 1 A 65 65 ASP HA H 65 4.313 4.214 0.099 1
1 909 . 17 1 1 A 65 65 ASP C C 65 179.095 178.716 0.379 1
1 910 . 17 1 1 A 65 65 ASP CA C 65 57.272 57.910 -0.638 1
1 911 . 17 1 1 A 65 65 ASP CB C 65 40.196 41.852 -1.656 1
1 912 . 17 1 1 A 65 65 ASP N N 65 118.100 118.629 -0.529 1
1 913 . 17 1 1 A 66 66 LYS H H 66 7.802 8.084 -0.282 1
1 914 . 17 1 1 A 66 66 LYS HA H 66 4.078 3.990 0.088 1
1 923 . 17 1 1 A 66 66 LYS C C 66 178.624 179.012 -0.388 1
1 924 . 17 1 1 A 66 66 LYS CA C 66 58.429 59.180 -0.751 1
1 925 . 17 1 1 A 66 66 LYS CB C 66 31.727 32.135 -0.408 1
1 929 . 17 1 1 A 66 66 LYS N N 66 119.343 118.206 1.137 1
1 930 . 17 1 1 A 67 67 ALA H H 67 8.480 8.435 0.045 1
1 931 . 17 1 1 A 67 67 ALA HA H 67 3.853 4.141 -0.288 1
1 935 . 17 1 1 A 67 67 ALA C C 67 178.591 179.509 -0.918 1
1 936 . 17 1 1 A 67 67 ALA CA C 67 55.403 55.390 0.013 1
1 937 . 17 1 1 A 67 67 ALA CB C 67 17.793 18.432 -0.639 1
1 938 . 17 1 1 A 67 67 ALA N N 67 121.562 122.062 -0.500 1
1 939 . 17 1 1 A 68 68 LYS H H 68 8.186 7.641 0.545 1
1 940 . 17 1 1 A 68 68 LYS HA H 68 3.805 4.049 -0.244 1
1 949 . 17 1 1 A 68 68 LYS C C 68 179.095 178.888 0.207 1
1 950 . 17 1 1 A 68 68 LYS CA C 68 59.952 59.246 0.706 1
1 951 . 17 1 1 A 68 68 LYS CB C 68 32.181 32.034 0.147 1
1 955 . 17 1 1 A 68 68 LYS N N 68 116.165 116.800 -0.635 1
1 956 . 17 1 1 A 69 69 GLU H H 69 7.904 8.056 -0.152 1
1 957 . 17 1 1 A 69 69 GLU HA H 69 3.995 4.039 -0.044 1
1 962 . 17 1 1 A 69 69 GLU C C 69 179.079 179.142 -0.063 1
1 963 . 17 1 1 A 69 69 GLU CA C 69 59.022 59.259 -0.237 1
1 964 . 17 1 1 A 69 69 GLU CB C 69 29.274 29.478 -0.204 1
1 966 . 17 1 1 A 69 69 GLU N N 69 119.489 119.391 0.098 1
1 967 . 17 1 1 A 70 70 LEU H H 70 7.962 8.276 -0.314 1
1 968 . 17 1 1 A 70 70 LEU HA H 70 4.020 3.944 0.076 1
1 978 . 17 1 1 A 70 70 LEU C C 70 178.738 178.767 -0.029 1
1 979 . 17 1 1 A 70 70 LEU CA C 70 57.486 57.842 -0.356 1
1 980 . 17 1 1 A 70 70 LEU CB C 70 41.695 41.610 0.085 1
1 984 . 17 1 1 A 70 70 LEU N N 70 119.431 120.003 -0.572 1
1 985 . 17 1 1 A 71 71 ALA H H 71 8.260 8.292 -0.032 1
1 986 . 17 1 1 A 71 71 ALA HA H 71 3.845 3.985 -0.140 1
1 990 . 17 1 1 A 71 71 ALA C C 71 179.518 180.046 -0.528 1
1 991 . 17 1 1 A 71 71 ALA CA C 71 55.139 55.261 -0.122 1
1 992 . 17 1 1 A 71 71 ALA CB C 71 18.487 18.157 0.330 1
1 993 . 17 1 1 A 71 71 ALA N N 71 119.604 121.201 -1.597 1
1 994 . 17 1 1 A 72 72 GLN H H 72 7.910 8.165 -0.255 1
1 995 . 17 1 1 A 72 72 GLN HA H 72 4.154 4.049 0.105 1
1 1002 . 17 1 1 A 72 72 GLN C C 72 178.900 178.940 -0.040 1
1 1003 . 17 1 1 A 72 72 GLN CA C 72 58.194 58.699 -0.505 1
1 1004 . 17 1 1 A 72 72 GLN CB C 72 28.056 28.448 -0.392 1
1 1006 . 17 1 1 A 72 72 GLN N N 72 115.960 117.838 -1.878 1
1 1008 . 17 1 1 A 73 73 LYS H H 73 7.841 7.759 0.082 1
1 1009 . 17 1 1 A 73 73 LYS HA H 73 4.171 4.087 0.084 1
1 1018 . 17 1 1 A 73 73 LYS C C 73 177.730 178.537 -0.807 1
1 1019 . 17 1 1 A 73 73 LYS CA C 73 57.867 58.922 -1.055 1
1 1020 . 17 1 1 A 73 73 LYS CB C 73 32.277 32.321 -0.044 1
1 1024 . 17 1 1 A 73 73 LYS N N 73 119.027 119.537 -0.510 1
1 1025 . 17 1 1 A 74 74 MET H H 74 7.746 8.147 -0.401 1
1 1026 . 17 1 1 A 74 74 MET HA H 74 4.403 4.524 -0.121 1
1 1034 . 17 1 1 A 74 74 MET C C 74 174.416 175.314 -0.898 1
1 1035 . 17 1 1 A 74 74 MET CA C 74 55.194 55.578 -0.384 1
1 1036 . 17 1 1 A 74 74 MET CB C 74 33.366 32.767 0.599 1
1 1039 . 17 1 1 A 74 74 MET N N 74 115.786 115.888 -0.102 1
1 1040 . 17 1 1 A 75 75 GLU H H 75 8.076 7.679 0.397 1
1 1041 . 17 1 1 A 75 75 GLU HA H 75 4.001 3.844 0.157 1
1 1046 . 17 1 1 A 75 75 GLU C C 75 175.130 174.841 0.289 1
1 1047 . 17 1 1 A 75 75 GLU CA C 75 56.722 57.571 -0.849 1
1 1048 . 17 1 1 A 75 75 GLU CB C 75 27.118 27.283 -0.165 1
1 1050 . 17 1 1 A 75 75 GLU N N 75 116.249 116.688 -0.439 1
1 1051 . 17 1 1 A 76 76 ILE H H 76 7.560 7.579 -0.019 1
1 1052 . 17 1 1 A 76 76 ILE HA H 76 4.428 4.639 -0.211 1
1 1062 . 17 1 1 A 76 76 ILE C C 76 174.529 174.653 -0.124 1
1 1063 . 17 1 1 A 76 76 ILE CA C 76 58.475 59.545 -1.070 1
1 1064 . 17 1 1 A 76 76 ILE CB C 76 40.337 41.568 -1.231 1
1 1068 . 17 1 1 A 76 76 ILE N N 76 115.960 119.070 -3.110 1
1 1069 . 17 1 1 A 77 77 ASP H H 77 8.889 8.572 0.317 1
1 1070 . 17 1 1 A 77 77 ASP HA H 77 4.569 4.990 -0.421 1
1 1073 . 17 1 1 A 77 77 ASP C C 77 174.123 176.039 -1.916 1
1 1074 . 17 1 1 A 77 77 ASP CA C 77 54.069 54.213 -0.144 1
1 1075 . 17 1 1 A 77 77 ASP CB C 77 40.233 41.608 -1.375 1
1 1076 . 17 1 1 A 77 77 ASP N N 77 126.142 126.363 -0.221 1
1 1077 . 17 1 1 A 78 78 VAL H H 78 7.754 8.978 -1.224 1
1 1078 . 17 1 1 A 78 78 VAL HA H 78 5.192 5.377 -0.185 1
1 1086 . 17 1 1 A 78 78 VAL C C 78 174.968 174.338 0.630 1
1 1087 . 17 1 1 A 78 78 VAL CA C 78 58.804 58.697 0.107 1
1 1088 . 17 1 1 A 78 78 VAL CB C 78 35.293 35.304 -0.011 1
1 1091 . 17 1 1 A 78 78 VAL N N 78 122.844 117.432 5.412 1
1 1092 . 17 1 1 A 79 79 ARG H H 79 8.499 9.118 -0.619 1
1 1093 . 17 1 1 A 79 79 ARG HA H 79 4.712 4.780 -0.068 1
1 1100 . 17 1 1 A 79 79 ARG C C 79 174.221 175.030 -0.809 1
1 1101 . 17 1 1 A 79 79 ARG CA C 79 54.117 54.858 -0.741 1
1 1102 . 17 1 1 A 79 79 ARG CB C 79 31.196 30.977 0.219 1
1 1105 . 17 1 1 A 79 79 ARG N N 79 125.637 121.835 3.802 1
1 1106 . 17 1 1 A 80 80 THR H H 80 8.416 8.818 -0.402 1
1 1107 . 17 1 1 A 80 80 THR HA H 80 5.332 4.963 0.369 1
1 1112 . 17 1 1 A 80 80 THR C C 80 174.497 174.142 0.355 1
1 1113 . 17 1 1 A 80 80 THR CA C 80 59.694 61.967 -2.273 1
1 1114 . 17 1 1 A 80 80 THR CB C 80 69.772 69.251 0.521 1
1 1116 . 17 1 1 A 80 80 THR N N 80 118.084 122.001 -3.917 1
1 1117 . 17 1 1 A 81 81 ARG H H 81 8.758 8.882 -0.124 1
1 1118 . 17 1 1 A 81 81 ARG HA H 81 4.362 4.786 -0.424 1
1 1126 . 17 1 1 A 81 81 ARG C C 81 173.733 174.013 -0.280 1
1 1127 . 17 1 1 A 81 81 ARG CA C 81 53.273 53.774 -0.501 1
1 1128 . 17 1 1 A 81 81 ARG CB C 81 33.915 32.728 1.187 1
1 1131 . 17 1 1 A 81 81 ARG N N 81 122.844 126.132 -3.288 1
1 1133 . 17 1 1 A 82 82 LYS H H 82 8.721 8.361 0.360 1
1 1134 . 17 1 1 A 82 82 LYS HA H 82 4.701 5.046 -0.345 1
1 1143 . 17 1 1 A 82 82 LYS C C 82 175.667 176.076 -0.409 1
1 1144 . 17 1 1 A 82 82 LYS CA C 82 54.960 55.310 -0.350 1
1 1145 . 17 1 1 A 82 82 LYS CB C 82 32.603 33.907 -1.304 1
1 1149 . 17 1 1 A 82 82 LYS N N 82 124.668 123.154 1.514 1
1 1150 . 17 1 1 A 83 83 VAL H H 83 9.112 9.395 -0.283 1
1 1151 . 17 1 1 A 83 83 VAL HA H 83 4.796 4.971 -0.175 1
1 1159 . 17 1 1 A 83 83 VAL C C 83 174.594 175.351 -0.757 1
1 1160 . 17 1 1 A 83 83 VAL CA C 83 59.413 60.050 -0.637 1
1 1161 . 17 1 1 A 83 83 VAL CB C 83 35.298 34.505 0.793 1
1 1164 . 17 1 1 A 83 83 VAL N N 83 122.381 121.620 0.761 1
1 1165 . 17 1 1 A 84 84 THR H H 84 9.200 8.850 0.350 1
1 1166 . 17 1 1 A 84 84 THR HA H 84 4.579 4.667 -0.088 1
1 1171 . 17 1 1 A 84 84 THR C C 84 173.993 174.847 -0.854 1
1 1172 . 17 1 1 A 84 84 THR CA C 84 60.960 61.061 -0.101 1
1 1173 . 17 1 1 A 84 84 THR CB C 84 70.100 69.895 0.205 1
1 1175 . 17 1 1 A 84 84 THR N N 84 113.183 115.780 -2.597 1
1 1176 . 17 1 1 A 85 85 SER H H 85 7.688 7.838 -0.150 1
1 1177 . 17 1 1 A 85 85 SER HA H 85 5.136 4.975 0.161 1
1 1180 . 17 1 1 A 85 85 SER CA C 85 55.205 55.697 -0.492 1
1 1181 . 17 1 1 A 85 85 SER CB C 85 64.376 65.850 -1.474 1
1 1182 . 17 1 1 A 85 85 SER N N 85 115.555 116.302 -0.747 1
1 1183 . 17 1 1 A 86 86 PRO HA H 86 4.090 4.247 -0.157 1
1 1190 . 17 1 1 A 86 86 PRO C C 86 177.227 177.851 -0.624 1
1 1191 . 17 1 1 A 86 86 PRO CA C 86 65.038 65.498 -0.460 1
1 1192 . 17 1 1 A 86 86 PRO CB C 86 31.711 31.725 -0.014 1
1 1195 . 17 1 1 A 87 87 ASP H H 87 8.131 8.400 -0.269 1
1 1196 . 17 1 1 A 87 87 ASP HA H 87 4.223 4.319 -0.096 1
1 1199 . 17 1 1 A 87 87 ASP C C 87 178.721 179.396 -0.675 1
1 1200 . 17 1 1 A 87 87 ASP CA C 87 57.311 56.884 0.427 1
1 1201 . 17 1 1 A 87 87 ASP CB C 87 40.102 40.300 -0.198 1
1 1202 . 17 1 1 A 87 87 ASP N N 87 115.381 116.985 -1.604 1
1 1203 . 17 1 1 A 88 88 GLU H H 88 7.571 7.811 -0.240 1
1 1204 . 17 1 1 A 88 88 GLU HA H 88 3.659 4.137 -0.478 1
1 1209 . 17 1 1 A 88 88 GLU C C 88 177.097 178.860 -1.763 1
1 1210 . 17 1 1 A 88 88 GLU CA C 88 58.729 58.869 -0.140 1
1 1211 . 17 1 1 A 88 88 GLU CB C 88 30.052 29.669 0.383 1
1 1213 . 17 1 1 A 88 88 GLU N N 88 120.009 121.070 -1.061 1
1 1214 . 17 1 1 A 89 89 ALA H H 89 7.423 7.767 -0.344 1
1 1215 . 17 1 1 A 89 89 ALA HA H 89 3.900 4.245 -0.345 1
1 1219 . 17 1 1 A 89 89 ALA C C 89 178.267 180.042 -1.775 1
1 1220 . 17 1 1 A 89 89 ALA CA C 89 55.607 55.102 0.505 1
1 1221 . 17 1 1 A 89 89 ALA CB C 89 17.348 18.425 -1.077 1
1 1222 . 17 1 1 A 89 89 ALA N N 89 118.873 122.424 -3.551 1
1 1223 . 17 1 1 A 90 90 LYS H H 90 8.046 8.319 -0.273 1
1 1224 . 17 1 1 A 90 90 LYS HA H 90 3.669 3.901 -0.232 1
1 1233 . 17 1 1 A 90 90 LYS C C 90 177.649 179.029 -1.380 1
1 1234 . 17 1 1 A 90 90 LYS CA C 90 60.351 59.894 0.457 1
1 1235 . 17 1 1 A 90 90 LYS CB C 90 32.087 32.258 -0.171 1
1 1239 . 17 1 1 A 90 90 LYS N N 90 114.834 117.315 -2.481 1
1 1240 . 17 1 1 A 91 91 ARG H H 91 7.468 7.714 -0.246 1
1 1241 . 17 1 1 A 91 91 ARG HA H 91 3.887 3.900 -0.013 1
1 1249 . 17 1 1 A 91 91 ARG C C 91 178.998 179.116 -0.118 1
1 1250 . 17 1 1 A 91 91 ARG CA C 91 59.164 59.289 -0.125 1
1 1251 . 17 1 1 A 91 91 ARG CB C 91 29.274 29.797 -0.523 1
1 1254 . 17 1 1 A 91 91 ARG N N 91 119.029 119.180 -0.151 1
1 1256 . 17 1 1 A 92 92 TRP H H 92 8.136 8.261 -0.125 1
1 1257 . 17 1 1 A 92 92 TRP HA H 92 4.818 4.502 0.316 1
1 1266 . 17 1 1 A 92 92 TRP C C 92 179.566 179.088 0.478 1
1 1267 . 17 1 1 A 92 92 TRP CA C 92 58.663 59.494 -0.831 1
1 1268 . 17 1 1 A 92 92 TRP CB C 92 29.790 29.260 0.530 1
1 1274 . 17 1 1 A 92 92 TRP N N 92 118.100 120.186 -2.086 1
1 1276 . 17 1 1 A 93 93 ILE H H 93 8.363 8.312 0.051 1
1 1277 . 17 1 1 A 93 93 ILE HA H 93 3.544 3.772 -0.228 1
1 1287 . 17 1 1 A 93 93 ILE C C 93 176.820 177.975 -1.155 1
1 1288 . 17 1 1 A 93 93 ILE CA C 93 66.225 65.461 0.764 1
1 1289 . 17 1 1 A 93 93 ILE CB C 93 37.571 37.965 -0.394 1
1 1293 . 17 1 1 A 93 93 ILE N N 93 120.588 120.430 0.158 1
1 1294 . 17 1 1 A 94 94 LYS H H 94 8.264 7.818 0.446 1
1 1295 . 17 1 1 A 94 94 LYS HA H 94 3.865 3.998 -0.133 1
1 1304 . 17 1 1 A 94 94 LYS C C 94 179.258 178.647 0.611 1
1 1305 . 17 1 1 A 94 94 LYS CA C 94 59.889 59.818 0.071 1
1 1306 . 17 1 1 A 94 94 LYS CB C 94 32.225 32.235 -0.010 1
1 1310 . 17 1 1 A 94 94 LYS N N 94 121.687 120.516 1.171 1
1 1311 . 17 1 1 A 95 95 GLU H H 95 8.360 8.520 -0.160 1
1 1312 . 17 1 1 A 95 95 GLU HA H 95 4.023 4.020 0.003 1
1 1317 . 17 1 1 A 95 95 GLU C C 95 178.884 179.177 -0.293 1
1 1318 . 17 1 1 A 95 95 GLU CA C 95 59.366 59.519 -0.153 1
1 1319 . 17 1 1 A 95 95 GLU CB C 95 29.508 29.423 0.085 1
1 1321 . 17 1 1 A 95 95 GLU N N 95 118.505 117.793 0.712 1
1 1322 . 17 1 1 A 96 96 PHE H H 96 8.212 8.476 -0.264 1
1 1323 . 17 1 1 A 96 96 PHE HA H 96 4.512 4.325 0.187 1
1 1331 . 17 1 1 A 96 96 PHE C C 96 176.820 178.273 -1.453 1
1 1332 . 17 1 1 A 96 96 PHE CA C 96 59.608 61.247 -1.639 1
1 1333 . 17 1 1 A 96 96 PHE CB C 96 40.431 39.297 1.134 1
1 1339 . 17 1 1 A 96 96 PHE N N 96 120.369 122.030 -1.661 1
1 1340 . 17 1 1 A 97 97 SER H H 97 8.216 8.239 -0.023 1
1 1341 . 17 1 1 A 97 97 SER HA H 97 3.816 4.058 -0.242 1
1 1344 . 17 1 1 A 97 97 SER C C 97 175.618 176.777 -1.159 1
1 1345 . 17 1 1 A 97 97 SER CA C 97 60.492 61.119 -0.627 1
1 1346 . 17 1 1 A 97 97 SER CB C 97 63.022 63.205 -0.183 1
1 1347 . 17 1 1 A 97 97 SER N N 97 111.969 114.146 -2.177 1
1 1348 . 17 1 1 A 98 98 GLU H H 98 7.655 7.798 -0.143 1
1 1349 . 17 1 1 A 98 98 GLU HA H 98 4.187 4.128 0.059 1
1 1354 . 17 1 1 A 98 98 GLU C C 98 177.698 179.097 -1.399 1
1 1355 . 17 1 1 A 98 98 GLU CA C 98 57.069 59.078 -2.009 1
1 1356 . 17 1 1 A 98 98 GLU CB C 98 29.321 29.165 0.156 1
1 1358 . 17 1 1 A 98 98 GLU N N 98 120.588 121.566 -0.978 1
1 1359 . 17 1 1 A 99 99 GLU H H 99 7.794 7.654 0.140 1
1 1360 . 17 1 1 A 99 99 GLU HA H 99 4.123 4.122 0.001 1
1 1365 . 17 1 1 A 99 99 GLU C C 99 177.665 177.538 0.127 1
1 1366 . 17 1 1 A 99 99 GLU CA C 99 57.304 58.536 -1.232 1
1 1367 . 17 1 1 A 99 99 GLU CB C 99 29.368 29.914 -0.546 1
1 1369 . 17 1 1 A 99 99 GLU N N 99 120.067 118.042 2.025 1
1 1370 . 17 1 1 A 100 100 GLY H H 100 8.138 8.011 0.127 1
1 1371 . 17 1 1 A 100 100 GLY HA2 H 100 3.865 3.566 0.299 1
1 1372 . 17 1 1 A 100 100 GLY HA3 H 100 3.715 3.714 0.001 1
1 1373 . 17 1 1 A 100 100 GLY C C 100 174.464 175.112 -0.648 1
1 1374 . 17 1 1 A 100 100 GLY CA C 100 45.305 45.625 -0.320 1
1 1375 . 17 1 1 A 100 100 GLY N N 100 107.802 107.623 0.179 1
1 1376 . 17 1 1 A 101 101 GLY H H 101 8.023 8.558 -0.535 1
1 1377 . 17 1 1 A 101 101 GLY HA2 H 101 3.865 3.898 -0.033 1
1 1378 . 17 1 1 A 101 101 GLY HA3 H 101 3.892 3.915 -0.023 1
1 1379 . 17 1 1 A 101 101 GLY C C 101 174.204 173.303 0.901 1
1 1380 . 17 1 1 A 101 101 GLY CA C 101 45.036 45.794 -0.758 1
1 1381 . 17 1 1 A 101 101 GLY N N 101 108.032 108.197 -0.165 1
1 1382 . 17 1 1 A 102 102 SER H H 102 8.059 7.942 0.117 1
1 1383 . 17 1 1 A 102 102 SER HA H 102 4.380 4.663 -0.283 1
1 1386 . 17 1 1 A 102 102 SER C C 102 174.627 172.857 1.770 1
1 1387 . 17 1 1 A 102 102 SER CA C 102 58.194 57.373 0.821 1
1 1388 . 17 1 1 A 102 102 SER CB C 102 63.538 64.636 -1.098 1
1 1389 . 17 1 1 A 102 102 SER N N 102 115.266 115.263 0.003 1
1 1390 . 17 1 1 A 103 103 LEU H H 103 8.287 8.485 -0.198 1
1 1391 . 17 1 1 A 103 103 LEU HA H 103 4.301 4.494 -0.193 1
1 1401 . 17 1 1 A 103 103 LEU C C 103 177.292 176.933 0.359 1
1 1402 . 17 1 1 A 103 103 LEU CA C 103 55.007 55.214 -0.207 1
1 1403 . 17 1 1 A 103 103 LEU CB C 103 42.023 43.018 -0.995 1
1 1407 . 17 1 1 A 103 103 LEU N N 103 123.596 128.410 -4.814 1
1 1408 . 17 1 1 A 104 104 GLU H H 104 8.216 7.773 0.443 1
1 1409 . 17 1 1 A 104 104 GLU HA H 104 4.126 4.250 -0.124 1
1 1414 . 17 1 1 A 104 104 GLU CA C 104 56.518 56.760 -0.242 1
1 1415 . 17 1 1 A 104 104 GLU CB C 104 29.837 30.302 -0.465 1
1 1417 . 17 1 1 A 104 104 GLU N N 104 120.510 118.316 2.194 1
1 1418 . 17 1 1 A 105 105 HIS HA H 105 4.593 4.575 0.018 1
1 1421 . 17 1 1 A 105 105 HIS C C 105 173.766 175.110 -1.344 1
1 1422 . 17 1 1 A 105 105 HIS CA C 105 55.536 56.146 -0.610 1
1 1423 . 17 1 1 A 105 105 HIS CB C 105 30.001 30.250 -0.249 1
1 1424 . 17 1 1 A 106 106 HIS H H 106 8.154 8.827 -0.673 1
1 1425 . 17 1 1 A 106 106 HIS HA H 106 4.407 4.517 -0.110 1
1 1428 . 17 1 1 A 106 106 HIS CA C 106 56.920 56.340 0.580 1
1 1429 . 17 1 1 A 106 106 HIS CB C 106 30.001 30.507 -0.506 1
1 14 . 18 1 1 A 2 2 LEU H H 2 8.509 8.212 0.297 1
1 15 . 18 1 1 A 2 2 LEU HA H 2 4.463 4.765 -0.302 1
1 25 . 18 1 1 A 2 2 LEU C C 2 173.944 175.924 -1.980 1
1 26 . 18 1 1 A 2 2 LEU CA C 2 54.471 54.391 0.080 1
1 27 . 18 1 1 A 2 2 LEU CB C 2 43.595 41.673 1.922 1
1 31 . 18 1 1 A 2 2 LEU N N 2 127.160 126.011 1.149 1
1 32 . 18 1 1 A 3 3 LEU H H 3 7.844 8.665 -0.821 1
1 33 . 18 1 1 A 3 3 LEU HA H 3 5.128 5.599 -0.471 1
1 43 . 18 1 1 A 3 3 LEU C C 3 175.423 175.272 0.151 1
1 44 . 18 1 1 A 3 3 LEU CA C 3 53.566 53.245 0.321 1
1 45 . 18 1 1 A 3 3 LEU CB C 3 44.039 45.147 -1.108 1
1 49 . 18 1 1 A 3 3 LEU N N 3 122.555 124.495 -1.940 1
1 50 . 18 1 1 A 4 4 TYR H H 4 8.360 9.172 -0.812 1
1 51 . 18 1 1 A 4 4 TYR HA H 4 5.143 5.213 -0.070 1
1 58 . 18 1 1 A 4 4 TYR C C 4 174.481 174.925 -0.444 1
1 59 . 18 1 1 A 4 4 TYR CA C 4 56.577 55.982 0.595 1
1 60 . 18 1 1 A 4 4 TYR CB C 4 43.840 43.106 0.734 1
1 65 . 18 1 1 A 4 4 TYR N N 4 119.315 122.846 -3.531 1
1 66 . 18 1 1 A 5 5 VAL H H 5 8.918 8.597 0.321 1
1 67 . 18 1 1 A 5 5 VAL HA H 5 5.106 4.952 0.154 1
1 75 . 18 1 1 A 5 5 VAL C C 5 174.042 174.532 -0.490 1
1 76 . 18 1 1 A 5 5 VAL CA C 5 59.852 61.013 -1.161 1
1 77 . 18 1 1 A 5 5 VAL CB C 5 33.816 34.525 -0.709 1
1 80 . 18 1 1 A 5 5 VAL N N 5 119.952 120.386 -0.434 1
1 81 . 18 1 1 A 6 6 LEU H H 6 9.315 9.427 -0.112 1
1 82 . 18 1 1 A 6 6 LEU HA H 6 5.466 5.223 0.243 1
1 92 . 18 1 1 A 6 6 LEU C C 6 175.049 175.054 -0.005 1
1 93 . 18 1 1 A 6 6 LEU CA C 6 52.090 53.204 -1.114 1
1 94 . 18 1 1 A 6 6 LEU CB C 6 44.103 42.898 1.205 1
1 98 . 18 1 1 A 6 6 LEU N N 6 126.917 126.859 0.058 1
1 99 . 18 1 1 A 7 7 ILE H H 7 8.458 8.930 -0.472 1
1 100 . 18 1 1 A 7 7 ILE HA H 7 5.131 5.072 0.059 1
1 110 . 18 1 1 A 7 7 ILE C C 7 173.213 173.772 -0.559 1
1 111 . 18 1 1 A 7 7 ILE CA C 7 58.463 59.780 -1.317 1
1 112 . 18 1 1 A 7 7 ILE CB C 7 41.020 40.876 0.144 1
1 116 . 18 1 1 A 7 7 ILE N N 7 119.778 126.175 -6.397 1
1 117 . 18 1 1 A 8 8 ILE H H 8 8.797 9.174 -0.377 1
1 118 . 18 1 1 A 8 8 ILE HA H 8 4.611 4.973 -0.362 1
1 128 . 18 1 1 A 8 8 ILE C C 8 174.611 174.838 -0.227 1
1 129 . 18 1 1 A 8 8 ILE CA C 8 60.227 60.197 0.030 1
1 130 . 18 1 1 A 8 8 ILE CB C 8 37.665 39.438 -1.773 1
1 134 . 18 1 1 A 8 8 ILE N N 8 128.919 129.178 -0.259 1
1 135 . 18 1 1 A 9 9 SER H H 9 7.811 8.740 -0.929 1
1 136 . 18 1 1 A 9 9 SER HA H 9 4.429 4.940 -0.511 1
1 140 . 18 1 1 A 9 9 SER C C 9 172.937 172.830 0.107 1
1 141 . 18 1 1 A 9 9 SER CA C 9 58.241 56.883 1.358 1
1 142 . 18 1 1 A 9 9 SER CB C 9 64.261 64.549 -0.288 1
1 143 . 18 1 1 A 9 9 SER N N 9 116.365 121.180 -4.815 1
1 144 . 18 1 1 A 10 10 ASN H H 10 8.641 8.567 0.074 1
1 145 . 18 1 1 A 10 10 ASN HA H 10 4.938 4.924 0.014 1
1 150 . 18 1 1 A 10 10 ASN C C 10 174.497 175.182 -0.685 1
1 151 . 18 1 1 A 10 10 ASN CA C 10 52.221 54.298 -2.077 1
1 152 . 18 1 1 A 10 10 ASN CB C 10 39.128 40.630 -1.502 1
1 153 . 18 1 1 A 10 10 ASN N N 10 122.612 120.655 1.957 1
1 155 . 18 1 1 A 11 11 ASP H H 11 8.673 6.993 1.680 1
1 156 . 18 1 1 A 11 11 ASP HA H 11 4.596 4.799 -0.203 1
1 159 . 18 1 1 A 11 11 ASP C C 11 175.342 176.704 -1.362 1
1 160 . 18 1 1 A 11 11 ASP CA C 11 53.233 53.686 -0.453 1
1 161 . 18 1 1 A 11 11 ASP CB C 11 40.965 41.489 -0.524 1
1 162 . 18 1 1 A 11 11 ASP N N 11 122.717 118.884 3.833 1
1 163 . 18 1 1 A 12 12 LYS H H 12 8.562 8.948 -0.386 1
1 164 . 18 1 1 A 12 12 LYS HA H 12 3.854 4.187 -0.333 1
1 173 . 18 1 1 A 12 12 LYS C C 12 178.754 178.571 0.183 1
1 174 . 18 1 1 A 12 12 LYS CA C 12 59.581 58.693 0.888 1
1 175 . 18 1 1 A 12 12 LYS CB C 12 32.378 32.254 0.124 1
1 179 . 18 1 1 A 12 12 LYS N N 12 125.737 124.111 1.626 1
1 180 . 18 1 1 A 13 13 LYS H H 13 8.075 7.916 0.159 1
1 181 . 18 1 1 A 13 13 LYS HA H 13 4.154 4.051 0.103 1
1 190 . 18 1 1 A 13 13 LYS C C 13 178.315 179.081 -0.766 1
1 191 . 18 1 1 A 13 13 LYS CA C 13 58.532 59.243 -0.711 1
1 192 . 18 1 1 A 13 13 LYS CB C 13 31.452 32.155 -0.703 1
1 196 . 18 1 1 A 13 13 LYS N N 13 119.604 119.776 -0.172 1
1 197 . 18 1 1 A 14 14 LEU H H 14 7.552 7.950 -0.398 1
1 198 . 18 1 1 A 14 14 LEU HA H 14 3.682 4.035 -0.353 1
1 208 . 18 1 1 A 14 14 LEU C C 14 178.429 178.236 0.193 1
1 209 . 18 1 1 A 14 14 LEU CA C 14 58.999 58.111 0.888 1
1 210 . 18 1 1 A 14 14 LEU CB C 14 41.228 41.653 -0.425 1
1 214 . 18 1 1 A 14 14 LEU N N 14 122.266 121.248 1.018 1
1 215 . 18 1 1 A 15 15 ILE H H 15 8.074 7.880 0.194 1
1 216 . 18 1 1 A 15 15 ILE HA H 15 3.264 3.478 -0.214 1
1 226 . 18 1 1 A 15 15 ILE C C 15 177.000 177.544 -0.544 1
1 227 . 18 1 1 A 15 15 ILE CA C 15 65.939 65.703 0.236 1
1 228 . 18 1 1 A 15 15 ILE CB C 15 37.983 38.174 -0.191 1
1 232 . 18 1 1 A 15 15 ILE N N 15 118.214 120.220 -2.006 1
1 233 . 18 1 1 A 16 16 GLU H H 16 8.016 8.332 -0.316 1
1 234 . 18 1 1 A 16 16 GLU HA H 16 4.045 3.957 0.088 1
1 239 . 18 1 1 A 16 16 GLU C C 16 179.388 179.490 -0.102 1
1 240 . 18 1 1 A 16 16 GLU CA C 16 59.032 59.630 -0.598 1
1 241 . 18 1 1 A 16 16 GLU CB C 16 29.200 29.171 0.029 1
1 243 . 18 1 1 A 16 16 GLU N N 16 118.484 118.706 -0.222 1
1 244 . 18 1 1 A 17 17 GLU H H 17 8.063 8.266 -0.203 1
1 245 . 18 1 1 A 17 17 GLU HA H 17 4.053 4.006 0.047 1
1 250 . 18 1 1 A 17 17 GLU C C 17 179.306 179.464 -0.158 1
1 251 . 18 1 1 A 17 17 GLU CA C 17 58.636 58.981 -0.345 1
1 252 . 18 1 1 A 17 17 GLU CB C 17 29.011 29.417 -0.406 1
1 254 . 18 1 1 A 17 17 GLU N N 17 118.100 121.268 -3.168 1
1 255 . 18 1 1 A 18 18 ALA H H 18 8.655 8.077 0.578 1
1 256 . 18 1 1 A 18 18 ALA HA H 18 3.775 4.027 -0.252 1
1 260 . 18 1 1 A 18 18 ALA C C 18 178.559 179.627 -1.068 1
1 261 . 18 1 1 A 18 18 ALA CA C 18 54.960 55.404 -0.444 1
1 262 . 18 1 1 A 18 18 ALA CB C 18 17.960 18.114 -0.154 1
1 263 . 18 1 1 A 18 18 ALA N N 18 122.439 122.529 -0.090 1
1 264 . 18 1 1 A 19 19 ARG H H 19 8.900 8.222 0.678 1
1 265 . 18 1 1 A 19 19 ARG HA H 19 3.809 4.043 -0.234 1
1 273 . 18 1 1 A 19 19 ARG C C 19 178.721 179.080 -0.359 1
1 274 . 18 1 1 A 19 19 ARG CA C 19 59.976 59.867 0.109 1
1 275 . 18 1 1 A 19 19 ARG CB C 19 29.572 29.987 -0.415 1
1 278 . 18 1 1 A 19 19 ARG N N 19 118.563 117.733 0.830 1
1 280 . 18 1 1 A 20 20 LYS H H 20 7.792 7.947 -0.155 1
1 281 . 18 1 1 A 20 20 LYS HA H 20 4.052 4.040 0.012 1
1 290 . 18 1 1 A 20 20 LYS C C 20 179.648 179.599 0.049 1
1 291 . 18 1 1 A 20 20 LYS CA C 20 59.296 59.006 0.290 1
1 292 . 18 1 1 A 20 20 LYS CB C 20 32.216 32.222 -0.006 1
1 296 . 18 1 1 A 20 20 LYS N N 20 118.638 119.395 -0.757 1
1 297 . 18 1 1 A 21 21 MET H H 21 7.684 8.050 -0.366 1
1 298 . 18 1 1 A 21 21 MET HA H 21 4.411 4.096 0.315 1
1 306 . 18 1 1 A 21 21 MET C C 21 177.909 178.157 -0.248 1
1 307 . 18 1 1 A 21 21 MET CA C 21 57.009 59.565 -2.556 1
1 308 . 18 1 1 A 21 21 MET CB C 21 32.028 32.564 -0.536 1
1 311 . 18 1 1 A 21 21 MET N N 21 118.100 118.637 -0.537 1
1 312 . 18 1 1 A 22 22 ALA H H 22 8.815 8.471 0.344 1
1 313 . 18 1 1 A 22 22 ALA HA H 22 3.826 3.944 -0.118 1
1 317 . 18 1 1 A 22 22 ALA C C 22 178.835 180.050 -1.215 1
1 318 . 18 1 1 A 22 22 ALA CA C 22 55.427 55.569 -0.142 1
1 319 . 18 1 1 A 22 22 ALA CB C 22 18.059 18.307 -0.248 1
1 320 . 18 1 1 A 22 22 ALA N N 22 122.150 121.050 1.100 1
1 321 . 18 1 1 A 23 23 GLU H H 23 8.276 7.870 0.406 1
1 322 . 18 1 1 A 23 23 GLU HA H 23 4.146 4.036 0.110 1
1 327 . 18 1 1 A 23 23 GLU C C 23 180.151 179.417 0.734 1
1 328 . 18 1 1 A 23 23 GLU CA C 23 58.999 59.416 -0.417 1
1 329 . 18 1 1 A 23 23 GLU CB C 23 29.160 29.636 -0.476 1
1 331 . 18 1 1 A 23 23 GLU N N 23 117.001 117.801 -0.800 1
1 332 . 18 1 1 A 24 24 LYS H H 24 7.573 7.624 -0.051 1
1 333 . 18 1 1 A 24 24 LYS HA H 24 4.101 4.014 0.087 1
1 342 . 18 1 1 A 24 24 LYS C C 24 177.145 179.189 -2.044 1
1 343 . 18 1 1 A 24 24 LYS CA C 24 58.261 59.466 -1.205 1
1 344 . 18 1 1 A 24 24 LYS CB C 24 32.079 32.224 -0.145 1
1 348 . 18 1 1 A 24 24 LYS N N 24 119.960 119.606 0.354 1
1 349 . 18 1 1 A 25 25 ALA H H 25 7.710 7.826 -0.116 1
1 350 . 18 1 1 A 25 25 ALA HA H 25 4.413 4.321 0.092 1
1 354 . 18 1 1 A 25 25 ALA C C 25 175.325 176.766 -1.441 1
1 355 . 18 1 1 A 25 25 ALA CA C 25 51.208 52.420 -1.212 1
1 356 . 18 1 1 A 25 25 ALA CB C 25 18.520 19.443 -0.923 1
1 357 . 18 1 1 A 25 25 ALA N N 25 119.257 118.323 0.934 1
1 358 . 18 1 1 A 26 26 ASN H H 26 7.840 7.745 0.095 1
1 359 . 18 1 1 A 26 26 ASN HA H 26 4.357 4.353 0.004 1
1 364 . 18 1 1 A 26 26 ASN C C 26 173.587 174.238 -0.651 1
1 365 . 18 1 1 A 26 26 ASN CA C 26 54.307 54.520 -0.213 1
1 366 . 18 1 1 A 26 26 ASN CB C 26 36.972 37.161 -0.189 1
1 367 . 18 1 1 A 26 26 ASN N N 26 115.266 114.154 1.112 1
1 369 . 18 1 1 A 27 27 LEU H H 27 8.241 7.769 0.472 1
1 370 . 18 1 1 A 27 27 LEU HA H 27 4.652 4.405 0.247 1
1 380 . 18 1 1 A 27 27 LEU C C 27 175.894 176.037 -0.143 1
1 381 . 18 1 1 A 27 27 LEU CA C 27 52.923 53.580 -0.657 1
1 382 . 18 1 1 A 27 27 LEU CB C 27 44.090 42.672 1.418 1
1 386 . 18 1 1 A 27 27 LEU N N 27 116.828 119.267 -2.439 1
1 387 . 18 1 1 A 28 28 GLU H H 28 7.798 8.301 -0.503 1
1 388 . 18 1 1 A 28 28 GLU HA H 28 4.310 4.558 -0.248 1
1 393 . 18 1 1 A 28 28 GLU C C 28 173.944 175.536 -1.592 1
1 394 . 18 1 1 A 28 28 GLU CA C 28 55.460 56.592 -1.132 1
1 395 . 18 1 1 A 28 28 GLU CB C 28 30.512 30.209 0.303 1
1 397 . 18 1 1 A 28 28 GLU N N 28 121.340 123.342 -2.002 1
1 398 . 18 1 1 A 29 29 LEU H H 29 8.451 8.960 -0.509 1
1 399 . 18 1 1 A 29 29 LEU HA H 29 5.662 5.180 0.482 1
1 409 . 18 1 1 A 29 29 LEU C C 29 176.902 174.882 2.020 1
1 410 . 18 1 1 A 29 29 LEU CA C 29 53.186 54.251 -1.065 1
1 411 . 18 1 1 A 29 29 LEU CB C 29 44.914 44.032 0.882 1
1 415 . 18 1 1 A 29 29 LEU N N 29 126.547 127.812 -1.265 1
1 416 . 18 1 1 A 30 30 ARG H H 30 9.094 9.344 -0.250 1
1 417 . 18 1 1 A 30 30 ARG HA H 30 4.910 4.798 0.112 1
1 425 . 18 1 1 A 30 30 ARG C C 30 175.147 175.473 -0.326 1
1 426 . 18 1 1 A 30 30 ARG CA C 30 53.417 54.472 -1.055 1
1 427 . 18 1 1 A 30 30 ARG CB C 30 32.555 33.078 -0.523 1
1 430 . 18 1 1 A 30 30 ARG N N 30 125.043 126.509 -1.466 1
1 432 . 18 1 1 A 31 31 THR H H 31 8.496 8.577 -0.081 1
1 433 . 18 1 1 A 31 31 THR HA H 31 4.888 4.955 -0.067 1
1 438 . 18 1 1 A 31 31 THR C C 31 173.961 173.783 0.178 1
1 439 . 18 1 1 A 31 31 THR CA C 31 60.445 60.826 -0.381 1
1 440 . 18 1 1 A 31 31 THR CB C 31 69.492 69.991 -0.499 1
1 442 . 18 1 1 A 31 31 THR N N 31 114.745 115.127 -0.382 1
1 443 . 18 1 1 A 32 32 VAL H H 32 8.480 8.978 -0.498 1
1 444 . 18 1 1 A 32 32 VAL HA H 32 4.411 4.419 -0.008 1
1 452 . 18 1 1 A 32 32 VAL C C 32 175.082 175.551 -0.469 1
1 453 . 18 1 1 A 32 32 VAL CA C 32 60.946 61.474 -0.528 1
1 454 . 18 1 1 A 32 32 VAL CB C 32 34.487 33.333 1.154 1
1 457 . 18 1 1 A 32 32 VAL N N 32 122.324 126.319 -3.995 1
1 458 . 18 1 1 A 33 33 LYS H H 33 9.304 8.969 0.335 1
1 459 . 18 1 1 A 33 33 LYS HA H 33 4.534 4.537 -0.003 1
1 468 . 18 1 1 A 33 33 LYS C C 33 176.740 176.484 0.256 1
1 469 . 18 1 1 A 33 33 LYS CA C 33 56.846 57.250 -0.404 1
1 470 . 18 1 1 A 33 33 LYS CB C 33 34.355 33.938 0.417 1
1 474 . 18 1 1 A 33 33 LYS N N 33 123.654 126.230 -2.576 1
1 475 . 18 1 1 A 34 34 THR H H 34 7.245 7.626 -0.381 1
1 476 . 18 1 1 A 34 34 THR HA H 34 4.780 4.560 0.220 1
1 481 . 18 1 1 A 34 34 THR C C 34 174.529 175.682 -1.153 1
1 482 . 18 1 1 A 34 34 THR CA C 34 58.859 61.939 -3.080 1
1 483 . 18 1 1 A 34 34 THR CB C 34 73.023 72.790 0.233 1
1 485 . 18 1 1 A 34 34 THR N N 34 106.300 111.099 -4.799 1
1 486 . 18 1 1 A 35 35 GLU H H 35 9.174 8.837 0.337 1
1 487 . 18 1 1 A 35 35 GLU HA H 35 3.886 3.964 -0.078 1
1 492 . 18 1 1 A 35 35 GLU C C 35 177.714 177.342 0.372 1
1 493 . 18 1 1 A 35 35 GLU CA C 35 59.233 59.655 -0.422 1
1 494 . 18 1 1 A 35 35 GLU CB C 35 29.377 29.236 0.141 1
1 496 . 18 1 1 A 35 35 GLU N N 35 121.919 122.071 -0.152 1
1 497 . 18 1 1 A 36 36 ASP H H 36 8.185 8.217 -0.032 1
1 498 . 18 1 1 A 36 36 ASP HA H 36 4.289 4.304 -0.015 1
1 501 . 18 1 1 A 36 36 ASP C C 36 178.348 178.620 -0.272 1
1 502 . 18 1 1 A 36 36 ASP CA C 36 56.962 57.288 -0.326 1
1 503 . 18 1 1 A 36 36 ASP CB C 36 40.214 41.017 -0.803 1
1 504 . 18 1 1 A 36 36 ASP N N 36 118.332 119.844 -1.512 1
1 505 . 18 1 1 A 37 37 GLU H H 37 7.741 8.196 -0.455 1
1 506 . 18 1 1 A 37 37 GLU HA H 37 3.708 3.994 -0.286 1
1 511 . 18 1 1 A 37 37 GLU C C 37 177.324 178.938 -1.614 1
1 512 . 18 1 1 A 37 37 GLU CA C 37 58.698 59.247 -0.549 1
1 513 . 18 1 1 A 37 37 GLU CB C 37 30.199 29.431 0.768 1
1 515 . 18 1 1 A 37 37 GLU N N 37 120.704 119.115 1.589 1
1 516 . 18 1 1 A 38 38 LEU H H 38 7.531 8.400 -0.869 1
1 517 . 18 1 1 A 38 38 LEU HA H 38 3.873 4.209 -0.336 1
1 527 . 18 1 1 A 38 38 LEU C C 38 177.357 178.521 -1.164 1
1 528 . 18 1 1 A 38 38 LEU CA C 38 58.305 58.189 0.116 1
1 529 . 18 1 1 A 38 38 LEU CB C 38 40.837 41.594 -0.757 1
1 533 . 18 1 1 A 38 38 LEU N N 38 119.200 121.921 -2.721 1
1 534 . 18 1 1 A 39 39 LYS H H 39 8.083 7.826 0.257 1
1 535 . 18 1 1 A 39 39 LYS HA H 39 3.608 3.909 -0.301 1
1 544 . 18 1 1 A 39 39 LYS C C 39 177.373 178.664 -1.291 1
1 545 . 18 1 1 A 39 39 LYS CA C 39 60.290 59.827 0.463 1
1 546 . 18 1 1 A 39 39 LYS CB C 39 32.178 32.666 -0.488 1
1 550 . 18 1 1 A 39 39 LYS N N 39 116.943 118.751 -1.808 1
1 551 . 18 1 1 A 40 40 LYS H H 40 7.632 7.847 -0.215 1
1 552 . 18 1 1 A 40 40 LYS HA H 40 3.864 4.067 -0.203 1
1 561 . 18 1 1 A 40 40 LYS C C 40 179.566 178.274 1.292 1
1 562 . 18 1 1 A 40 40 LYS CA C 40 58.993 58.899 0.094 1
1 563 . 18 1 1 A 40 40 LYS CB C 40 31.758 31.913 -0.155 1
1 567 . 18 1 1 A 40 40 LYS N N 40 118.274 119.067 -0.793 1
1 568 . 18 1 1 A 41 41 TYR H H 41 7.823 7.905 -0.082 1
1 569 . 18 1 1 A 41 41 TYR HA H 41 3.926 3.993 -0.067 1
1 576 . 18 1 1 A 41 41 TYR C C 41 176.625 177.830 -1.205 1
1 577 . 18 1 1 A 41 41 TYR CA C 41 59.757 60.787 -1.030 1
1 578 . 18 1 1 A 41 41 TYR CB C 41 36.901 37.974 -1.073 1
1 583 . 18 1 1 A 41 41 TYR N N 41 117.811 119.114 -1.303 1
1 584 . 18 1 1 A 42 42 LEU H H 42 7.964 8.245 -0.281 1
1 585 . 18 1 1 A 42 42 LEU HA H 42 3.704 3.996 -0.292 1
1 595 . 18 1 1 A 42 42 LEU C C 42 178.396 179.125 -0.729 1
1 596 . 18 1 1 A 42 42 LEU CA C 42 58.237 57.830 0.407 1
1 597 . 18 1 1 A 42 42 LEU CB C 42 40.507 41.351 -0.844 1
1 601 . 18 1 1 A 42 42 LEU N N 42 115.960 119.954 -3.994 1
1 602 . 18 1 1 A 43 43 GLU H H 43 8.193 8.233 -0.040 1
1 603 . 18 1 1 A 43 43 GLU HA H 43 3.882 3.924 -0.042 1
1 608 . 18 1 1 A 43 43 GLU C C 43 179.193 179.377 -0.184 1
1 609 . 18 1 1 A 43 43 GLU CA C 43 59.122 59.621 -0.499 1
1 610 . 18 1 1 A 43 43 GLU CB C 43 29.244 29.063 0.181 1
1 612 . 18 1 1 A 43 43 GLU N N 43 117.175 118.562 -1.387 1
1 613 . 18 1 1 A 44 44 GLU H H 44 7.601 7.323 0.278 1
1 614 . 18 1 1 A 44 44 GLU HA H 44 3.936 3.968 -0.032 1
1 619 . 18 1 1 A 44 44 GLU C C 44 179.875 178.762 1.113 1
1 620 . 18 1 1 A 44 44 GLU CA C 44 58.867 58.927 -0.060 1
1 621 . 18 1 1 A 44 44 GLU CB C 44 28.648 28.869 -0.221 1
1 623 . 18 1 1 A 44 44 GLU N N 44 120.472 119.272 1.200 1
1 624 . 18 1 1 A 45 45 PHE H H 45 8.260 7.240 1.020 1
1 625 . 18 1 1 A 45 45 PHE HA H 45 4.520 4.204 0.316 1
1 633 . 18 1 1 A 45 45 PHE C C 45 177.942 178.108 -0.166 1
1 634 . 18 1 1 A 45 45 PHE CA C 45 55.945 60.597 -4.652 1
1 635 . 18 1 1 A 45 45 PHE CB C 45 36.680 38.299 -1.619 1
1 641 . 18 1 1 A 45 45 PHE N N 45 119.272 118.545 0.727 1
1 642 . 18 1 1 A 46 46 ARG H H 46 8.023 8.132 -0.109 1
1 643 . 18 1 1 A 46 46 ARG HA H 46 4.074 4.325 -0.251 1
1 651 . 18 1 1 A 46 46 ARG C C 46 177.617 179.093 -1.476 1
1 652 . 18 1 1 A 46 46 ARG CA C 46 58.194 59.514 -1.320 1
1 653 . 18 1 1 A 46 46 ARG CB C 46 29.737 29.933 -0.196 1
1 656 . 18 1 1 A 46 46 ARG N N 46 118.136 119.836 -1.700 1
1 658 . 18 1 1 A 47 47 LYS H H 47 7.470 7.750 -0.280 1
1 659 . 18 1 1 A 47 47 LYS HA H 47 4.143 4.044 0.099 1
1 668 . 18 1 1 A 47 47 LYS C C 47 177.324 177.397 -0.073 1
1 669 . 18 1 1 A 47 47 LYS CA C 47 57.726 59.333 -1.607 1
1 670 . 18 1 1 A 47 47 LYS CB C 47 32.409 32.500 -0.091 1
1 674 . 18 1 1 A 47 47 LYS N N 47 116.943 119.713 -2.770 1
1 675 . 18 1 1 A 48 48 GLU H H 48 7.615 7.732 -0.117 1
1 676 . 18 1 1 A 48 48 GLU HA H 48 4.428 4.726 -0.298 1
1 681 . 18 1 1 A 48 48 GLU C C 48 176.869 176.766 0.103 1
1 682 . 18 1 1 A 48 48 GLU CA C 48 55.945 55.473 0.472 1
1 683 . 18 1 1 A 48 48 GLU CB C 48 29.696 30.743 -1.047 1
1 685 . 18 1 1 A 48 48 GLU N N 48 118.852 116.630 2.222 1
1 686 . 18 1 1 A 49 49 SER H H 49 7.725 7.944 -0.219 1
1 687 . 18 1 1 A 49 49 SER HA H 49 4.244 4.171 0.073 1
1 690 . 18 1 1 A 49 49 SER C C 49 174.838 176.457 -1.619 1
1 691 . 18 1 1 A 49 49 SER CA C 49 59.366 61.608 -2.242 1
1 692 . 18 1 1 A 49 49 SER CB C 49 63.116 62.899 0.217 1
1 693 . 18 1 1 A 49 49 SER N N 49 114.224 116.299 -2.075 1
1 694 . 18 1 1 A 50 50 GLN H H 50 8.548 8.103 0.445 1
1 695 . 18 1 1 A 50 50 GLN HA H 50 4.398 4.072 0.326 1
1 702 . 18 1 1 A 50 50 GLN C C 50 175.732 176.898 -1.166 1
1 703 . 18 1 1 A 50 50 GLN CA C 50 56.272 59.043 -2.771 1
1 704 . 18 1 1 A 50 50 GLN CB C 50 28.946 28.274 0.672 1
1 706 . 18 1 1 A 50 50 GLN N N 50 120.125 119.911 0.214 1
1 708 . 18 1 1 A 51 51 ASN H H 51 8.534 7.912 0.622 1
1 709 . 18 1 1 A 51 51 ASN HA H 51 4.980 4.924 0.056 1
1 714 . 18 1 1 A 51 51 ASN C C 51 173.717 174.106 -0.389 1
1 715 . 18 1 1 A 51 51 ASN CA C 51 52.804 52.699 0.105 1
1 716 . 18 1 1 A 51 51 ASN CB C 51 39.583 39.684 -0.101 1
1 717 . 18 1 1 A 51 51 ASN N N 51 118.158 114.644 3.514 1
1 719 . 18 1 1 A 52 52 ILE H H 52 7.492 7.520 -0.028 1
1 720 . 18 1 1 A 52 52 ILE HA H 52 5.338 5.050 0.288 1
1 730 . 18 1 1 A 52 52 ILE C C 52 175.049 174.358 0.691 1
1 731 . 18 1 1 A 52 52 ILE CA C 52 59.364 59.992 -0.628 1
1 732 . 18 1 1 A 52 52 ILE CB C 52 42.163 41.096 1.067 1
1 736 . 18 1 1 A 52 52 ILE N N 52 117.927 121.463 -3.536 1
1 737 . 18 1 1 A 53 53 LYS H H 53 8.467 9.200 -0.733 1
1 738 . 18 1 1 A 53 53 LYS HA H 53 5.044 5.616 -0.572 1
1 747 . 18 1 1 A 53 53 LYS C C 53 175.082 175.405 -0.323 1
1 748 . 18 1 1 A 53 53 LYS CA C 53 55.429 54.977 0.452 1
1 749 . 18 1 1 A 53 53 LYS CB C 53 36.446 35.968 0.478 1
1 753 . 18 1 1 A 53 53 LYS N N 53 123.249 128.470 -5.221 1
1 754 . 18 1 1 A 54 54 VAL H H 54 8.490 9.002 -0.512 1
1 755 . 18 1 1 A 54 54 VAL HA H 54 5.159 5.058 0.101 1
1 763 . 18 1 1 A 54 54 VAL C C 54 173.473 173.856 -0.383 1
1 764 . 18 1 1 A 54 54 VAL CA C 54 60.163 60.766 -0.603 1
1 765 . 18 1 1 A 54 54 VAL CB C 54 35.509 34.098 1.411 1
1 768 . 18 1 1 A 54 54 VAL N N 54 120.762 124.003 -3.241 1
1 769 . 18 1 1 A 55 55 LEU H H 55 8.636 8.646 -0.010 1
1 770 . 18 1 1 A 55 55 LEU HA H 55 4.670 4.552 0.118 1
1 780 . 18 1 1 A 55 55 LEU C C 55 173.652 174.274 -0.622 1
1 781 . 18 1 1 A 55 55 LEU CA C 55 52.289 53.327 -1.038 1
1 782 . 18 1 1 A 55 55 LEU CB C 55 42.070 42.648 -0.578 1
1 786 . 18 1 1 A 55 55 LEU N N 55 131.898 129.170 2.728 1
1 787 . 18 1 1 A 56 56 ILE H H 56 9.188 9.205 -0.017 1
1 788 . 18 1 1 A 56 56 ILE HA H 56 4.879 5.030 -0.151 1
1 798 . 18 1 1 A 56 56 ILE C C 56 174.172 174.355 -0.183 1
1 799 . 18 1 1 A 56 56 ILE CA C 56 59.976 60.166 -0.190 1
1 800 . 18 1 1 A 56 56 ILE CB C 56 38.181 39.272 -1.091 1
1 804 . 18 1 1 A 56 56 ILE N N 56 126.373 128.759 -2.386 1
1 805 . 18 1 1 A 57 57 LEU H H 57 8.929 9.271 -0.342 1
1 806 . 18 1 1 A 57 57 LEU HA H 57 5.394 5.340 0.054 1
1 816 . 18 1 1 A 57 57 LEU C C 57 175.358 176.211 -0.853 1
1 817 . 18 1 1 A 57 57 LEU CA C 57 52.086 53.271 -1.185 1
1 818 . 18 1 1 A 57 57 LEU CB C 57 42.445 42.797 -0.352 1
1 822 . 18 1 1 A 57 57 LEU N N 57 126.547 128.755 -2.208 1
1 823 . 18 1 1 A 58 58 VAL H H 58 8.542 8.822 -0.280 1
1 824 . 18 1 1 A 58 58 VAL HA H 58 5.253 4.750 0.503 1
1 832 . 18 1 1 A 58 58 VAL C C 58 175.244 175.880 -0.636 1
1 833 . 18 1 1 A 58 58 VAL CA C 58 58.241 59.287 -1.046 1
1 834 . 18 1 1 A 58 58 VAL CB C 58 33.165 34.806 -1.641 1
1 837 . 18 1 1 A 58 58 VAL N N 58 114.398 122.274 -7.876 1
1 838 . 18 1 1 A 59 59 SER H H 59 8.797 8.831 -0.034 1
1 839 . 18 1 1 A 59 59 SER HA H 59 5.063 4.464 0.599 1
1 842 . 18 1 1 A 59 59 SER C C 59 174.172 174.238 -0.066 1
1 843 . 18 1 1 A 59 59 SER CA C 59 59.320 60.259 -0.939 1
1 844 . 18 1 1 A 59 59 SER CB C 59 65.600 63.425 2.175 1
1 845 . 18 1 1 A 59 59 SER N N 59 115.497 116.096 -0.599 1
1 846 . 18 1 1 A 60 60 ASN H H 60 7.730 7.985 -0.255 1
1 847 . 18 1 1 A 60 60 ASN HA H 60 4.811 5.086 -0.275 1
1 852 . 18 1 1 A 60 60 ASN C C 60 174.464 175.889 -1.425 1
1 853 . 18 1 1 A 60 60 ASN CA C 60 52.007 52.255 -0.248 1
1 854 . 18 1 1 A 60 60 ASN CB C 60 40.336 41.214 -0.878 1
1 855 . 18 1 1 A 60 60 ASN N N 60 117.522 117.835 -0.313 1
1 857 . 18 1 1 A 61 61 ASP H H 61 8.577 8.976 -0.399 1
1 858 . 18 1 1 A 61 61 ASP HA H 61 4.365 4.384 -0.019 1
1 861 . 18 1 1 A 61 61 ASP C C 61 177.357 178.397 -1.040 1
1 862 . 18 1 1 A 61 61 ASP CA C 61 57.351 56.420 0.931 1
1 863 . 18 1 1 A 61 61 ASP CB C 61 40.383 40.063 0.320 1
1 864 . 18 1 1 A 61 61 ASP N N 61 119.431 121.533 -2.102 1
1 865 . 18 1 1 A 62 62 GLU H H 62 8.405 8.426 -0.021 1
1 866 . 18 1 1 A 62 62 GLU HA H 62 4.121 4.045 0.076 1
1 871 . 18 1 1 A 62 62 GLU C C 62 179.615 178.721 0.894 1
1 872 . 18 1 1 A 62 62 GLU CA C 62 59.593 59.707 -0.114 1
1 873 . 18 1 1 A 62 62 GLU CB C 62 28.478 29.026 -0.548 1
1 875 . 18 1 1 A 62 62 GLU N N 62 122.150 120.357 1.793 1
1 876 . 18 1 1 A 63 63 GLU H H 63 8.384 8.183 0.201 1
1 877 . 18 1 1 A 63 63 GLU HA H 63 3.913 4.108 -0.195 1
1 882 . 18 1 1 A 63 63 GLU C C 63 178.478 179.046 -0.568 1
1 883 . 18 1 1 A 63 63 GLU CA C 63 58.273 59.021 -0.748 1
1 884 . 18 1 1 A 63 63 GLU CB C 63 29.931 28.631 1.300 1
1 886 . 18 1 1 A 63 63 GLU N N 63 119.084 117.973 1.111 1
1 887 . 18 1 1 A 64 64 LEU H H 64 7.717 7.895 -0.178 1
1 888 . 18 1 1 A 64 64 LEU HA H 64 3.750 4.040 -0.290 1
1 898 . 18 1 1 A 64 64 LEU C C 64 177.535 178.059 -0.524 1
1 899 . 18 1 1 A 64 64 LEU CA C 64 58.944 58.291 0.653 1
1 900 . 18 1 1 A 64 64 LEU CB C 64 41.695 41.381 0.314 1
1 904 . 18 1 1 A 64 64 LEU N N 64 120.357 122.666 -2.309 1
1 905 . 18 1 1 A 65 65 ASP H H 65 7.922 8.415 -0.493 1
1 906 . 18 1 1 A 65 65 ASP HA H 65 4.313 4.228 0.085 1
1 909 . 18 1 1 A 65 65 ASP C C 65 179.095 178.886 0.209 1
1 910 . 18 1 1 A 65 65 ASP CA C 65 57.272 57.570 -0.298 1
1 911 . 18 1 1 A 65 65 ASP CB C 65 40.196 41.875 -1.679 1
1 912 . 18 1 1 A 65 65 ASP N N 65 118.100 118.552 -0.452 1
1 913 . 18 1 1 A 66 66 LYS H H 66 7.802 7.792 0.010 1
1 914 . 18 1 1 A 66 66 LYS HA H 66 4.078 4.019 0.059 1
1 923 . 18 1 1 A 66 66 LYS C C 66 178.624 179.120 -0.496 1
1 924 . 18 1 1 A 66 66 LYS CA C 66 58.429 58.875 -0.446 1
1 925 . 18 1 1 A 66 66 LYS CB C 66 31.727 32.103 -0.376 1
1 929 . 18 1 1 A 66 66 LYS N N 66 119.343 117.518 1.825 1
1 930 . 18 1 1 A 67 67 ALA H H 67 8.480 8.343 0.137 1
1 931 . 18 1 1 A 67 67 ALA HA H 67 3.853 4.131 -0.278 1
1 935 . 18 1 1 A 67 67 ALA C C 67 178.591 179.554 -0.963 1
1 936 . 18 1 1 A 67 67 ALA CA C 67 55.403 55.417 -0.014 1
1 937 . 18 1 1 A 67 67 ALA CB C 67 17.793 18.247 -0.454 1
1 938 . 18 1 1 A 67 67 ALA N N 67 121.562 122.094 -0.532 1
1 939 . 18 1 1 A 68 68 LYS H H 68 8.186 7.713 0.473 1
1 940 . 18 1 1 A 68 68 LYS HA H 68 3.805 4.048 -0.243 1
1 949 . 18 1 1 A 68 68 LYS C C 68 179.095 178.896 0.199 1
1 950 . 18 1 1 A 68 68 LYS CA C 68 59.952 59.233 0.719 1
1 951 . 18 1 1 A 68 68 LYS CB C 68 32.181 31.906 0.275 1
1 955 . 18 1 1 A 68 68 LYS N N 68 116.165 116.992 -0.827 1
1 956 . 18 1 1 A 69 69 GLU H H 69 7.904 7.905 -0.001 1
1 957 . 18 1 1 A 69 69 GLU HA H 69 3.995 4.048 -0.053 1
1 962 . 18 1 1 A 69 69 GLU C C 69 179.079 179.445 -0.366 1
1 963 . 18 1 1 A 69 69 GLU CA C 69 59.022 59.109 -0.087 1
1 964 . 18 1 1 A 69 69 GLU CB C 69 29.274 29.455 -0.181 1
1 966 . 18 1 1 A 69 69 GLU N N 69 119.489 119.326 0.163 1
1 967 . 18 1 1 A 70 70 LEU H H 70 7.962 8.440 -0.478 1
1 968 . 18 1 1 A 70 70 LEU HA H 70 4.020 3.862 0.158 1
1 978 . 18 1 1 A 70 70 LEU C C 70 178.738 178.815 -0.077 1
1 979 . 18 1 1 A 70 70 LEU CA C 70 57.486 57.934 -0.448 1
1 980 . 18 1 1 A 70 70 LEU CB C 70 41.695 41.374 0.321 1
1 984 . 18 1 1 A 70 70 LEU N N 70 119.431 119.861 -0.430 1
1 985 . 18 1 1 A 71 71 ALA H H 71 8.260 8.179 0.081 1
1 986 . 18 1 1 A 71 71 ALA HA H 71 3.845 4.007 -0.162 1
1 990 . 18 1 1 A 71 71 ALA C C 71 179.518 180.208 -0.690 1
1 991 . 18 1 1 A 71 71 ALA CA C 71 55.139 55.220 -0.081 1
1 992 . 18 1 1 A 71 71 ALA CB C 71 18.487 18.176 0.311 1
1 993 . 18 1 1 A 71 71 ALA N N 71 119.604 122.007 -2.403 1
1 994 . 18 1 1 A 72 72 GLN H H 72 7.910 7.902 0.008 1
1 995 . 18 1 1 A 72 72 GLN HA H 72 4.154 4.056 0.098 1
1 1002 . 18 1 1 A 72 72 GLN C C 72 178.900 179.031 -0.131 1
1 1003 . 18 1 1 A 72 72 GLN CA C 72 58.194 58.463 -0.269 1
1 1004 . 18 1 1 A 72 72 GLN CB C 72 28.056 28.353 -0.297 1
1 1006 . 18 1 1 A 72 72 GLN N N 72 115.960 117.862 -1.902 1
1 1008 . 18 1 1 A 73 73 LYS H H 73 7.841 7.778 0.063 1
1 1009 . 18 1 1 A 73 73 LYS HA H 73 4.171 4.079 0.092 1
1 1018 . 18 1 1 A 73 73 LYS C C 73 177.730 177.723 0.007 1
1 1019 . 18 1 1 A 73 73 LYS CA C 73 57.867 58.590 -0.723 1
1 1020 . 18 1 1 A 73 73 LYS CB C 73 32.277 32.452 -0.175 1
1 1024 . 18 1 1 A 73 73 LYS N N 73 119.027 120.065 -1.038 1
1 1025 . 18 1 1 A 74 74 MET H H 74 7.746 7.592 0.154 1
1 1026 . 18 1 1 A 74 74 MET HA H 74 4.403 4.633 -0.230 1
1 1034 . 18 1 1 A 74 74 MET C C 74 174.416 174.889 -0.473 1
1 1035 . 18 1 1 A 74 74 MET CA C 74 55.194 54.774 0.420 1
1 1036 . 18 1 1 A 74 74 MET CB C 74 33.366 32.769 0.597 1
1 1039 . 18 1 1 A 74 74 MET N N 74 115.786 115.346 0.440 1
1 1040 . 18 1 1 A 75 75 GLU H H 75 8.076 7.968 0.108 1
1 1041 . 18 1 1 A 75 75 GLU HA H 75 4.001 3.879 0.122 1
1 1046 . 18 1 1 A 75 75 GLU C C 75 175.130 175.047 0.083 1
1 1047 . 18 1 1 A 75 75 GLU CA C 75 56.722 57.395 -0.673 1
1 1048 . 18 1 1 A 75 75 GLU CB C 75 27.118 27.857 -0.739 1
1 1050 . 18 1 1 A 75 75 GLU N N 75 116.249 116.301 -0.052 1
1 1051 . 18 1 1 A 76 76 ILE H H 76 7.560 7.773 -0.213 1
1 1052 . 18 1 1 A 76 76 ILE HA H 76 4.428 4.594 -0.166 1
1 1062 . 18 1 1 A 76 76 ILE C C 76 174.529 174.714 -0.185 1
1 1063 . 18 1 1 A 76 76 ILE CA C 76 58.475 59.969 -1.494 1
1 1064 . 18 1 1 A 76 76 ILE CB C 76 40.337 41.675 -1.338 1
1 1068 . 18 1 1 A 76 76 ILE N N 76 115.960 119.569 -3.609 1
1 1069 . 18 1 1 A 77 77 ASP H H 77 8.889 8.837 0.052 1
1 1070 . 18 1 1 A 77 77 ASP HA H 77 4.569 4.866 -0.297 1
1 1073 . 18 1 1 A 77 77 ASP C C 77 174.123 175.885 -1.762 1
1 1074 . 18 1 1 A 77 77 ASP CA C 77 54.069 53.543 0.526 1
1 1075 . 18 1 1 A 77 77 ASP CB C 77 40.233 40.987 -0.754 1
1 1076 . 18 1 1 A 77 77 ASP N N 77 126.142 128.414 -2.272 1
1 1077 . 18 1 1 A 78 78 VAL H H 78 7.754 8.944 -1.190 1
1 1078 . 18 1 1 A 78 78 VAL HA H 78 5.192 5.298 -0.106 1
1 1086 . 18 1 1 A 78 78 VAL C C 78 174.968 174.314 0.654 1
1 1087 . 18 1 1 A 78 78 VAL CA C 78 58.804 58.933 -0.129 1
1 1088 . 18 1 1 A 78 78 VAL CB C 78 35.293 34.819 0.474 1
1 1091 . 18 1 1 A 78 78 VAL N N 78 122.844 121.313 1.531 1
1 1092 . 18 1 1 A 79 79 ARG H H 79 8.499 8.997 -0.498 1
1 1093 . 18 1 1 A 79 79 ARG HA H 79 4.712 4.869 -0.157 1
1 1100 . 18 1 1 A 79 79 ARG C C 79 174.221 175.059 -0.838 1
1 1101 . 18 1 1 A 79 79 ARG CA C 79 54.117 54.889 -0.772 1
1 1102 . 18 1 1 A 79 79 ARG CB C 79 31.196 31.043 0.153 1
1 1105 . 18 1 1 A 79 79 ARG N N 79 125.637 121.954 3.683 1
1 1106 . 18 1 1 A 80 80 THR H H 80 8.416 8.941 -0.525 1
1 1107 . 18 1 1 A 80 80 THR HA H 80 5.332 5.009 0.323 1
1 1112 . 18 1 1 A 80 80 THR C C 80 174.497 174.264 0.233 1
1 1113 . 18 1 1 A 80 80 THR CA C 80 59.694 62.002 -2.308 1
1 1114 . 18 1 1 A 80 80 THR CB C 80 69.772 69.326 0.446 1
1 1116 . 18 1 1 A 80 80 THR N N 80 118.084 121.563 -3.479 1
1 1117 . 18 1 1 A 81 81 ARG H H 81 8.758 8.978 -0.220 1
1 1118 . 18 1 1 A 81 81 ARG HA H 81 4.362 4.713 -0.351 1
1 1126 . 18 1 1 A 81 81 ARG C C 81 173.733 174.102 -0.369 1
1 1127 . 18 1 1 A 81 81 ARG CA C 81 53.273 54.005 -0.732 1
1 1128 . 18 1 1 A 81 81 ARG CB C 81 33.915 33.457 0.458 1
1 1131 . 18 1 1 A 81 81 ARG N N 81 122.844 125.497 -2.653 1
1 1133 . 18 1 1 A 82 82 LYS H H 82 8.721 8.570 0.151 1
1 1134 . 18 1 1 A 82 82 LYS HA H 82 4.701 4.848 -0.147 1
1 1143 . 18 1 1 A 82 82 LYS C C 82 175.667 176.056 -0.389 1
1 1144 . 18 1 1 A 82 82 LYS CA C 82 54.960 56.113 -1.153 1
1 1145 . 18 1 1 A 82 82 LYS CB C 82 32.603 32.982 -0.379 1
1 1149 . 18 1 1 A 82 82 LYS N N 82 124.668 124.045 0.623 1
1 1150 . 18 1 1 A 83 83 VAL H H 83 9.112 9.042 0.070 1
1 1151 . 18 1 1 A 83 83 VAL HA H 83 4.796 4.783 0.013 1
1 1159 . 18 1 1 A 83 83 VAL C C 83 174.594 174.973 -0.379 1
1 1160 . 18 1 1 A 83 83 VAL CA C 83 59.413 59.713 -0.300 1
1 1161 . 18 1 1 A 83 83 VAL CB C 83 35.298 35.282 0.016 1
1 1164 . 18 1 1 A 83 83 VAL N N 83 122.381 121.543 0.838 1
1 1165 . 18 1 1 A 84 84 THR H H 84 9.200 8.505 0.695 1
1 1166 . 18 1 1 A 84 84 THR HA H 84 4.579 4.545 0.034 1
1 1171 . 18 1 1 A 84 84 THR C C 84 173.993 174.730 -0.737 1
1 1172 . 18 1 1 A 84 84 THR CA C 84 60.960 61.577 -0.617 1
1 1173 . 18 1 1 A 84 84 THR CB C 84 70.100 70.108 -0.008 1
1 1175 . 18 1 1 A 84 84 THR N N 84 113.183 115.403 -2.220 1
1 1176 . 18 1 1 A 85 85 SER H H 85 7.688 7.728 -0.040 1
1 1177 . 18 1 1 A 85 85 SER HA H 85 5.136 4.575 0.561 1
1 1180 . 18 1 1 A 85 85 SER CA C 85 55.205 56.782 -1.577 1
1 1181 . 18 1 1 A 85 85 SER CB C 85 64.376 63.625 0.751 1
1 1182 . 18 1 1 A 85 85 SER N N 85 115.555 118.730 -3.175 1
1 1183 . 18 1 1 A 86 86 PRO HA H 86 4.090 4.305 -0.215 1
1 1190 . 18 1 1 A 86 86 PRO C C 86 177.227 177.825 -0.598 1
1 1191 . 18 1 1 A 86 86 PRO CA C 86 65.038 65.674 -0.636 1
1 1192 . 18 1 1 A 86 86 PRO CB C 86 31.711 31.811 -0.100 1
1 1195 . 18 1 1 A 87 87 ASP H H 87 8.131 8.424 -0.293 1
1 1196 . 18 1 1 A 87 87 ASP HA H 87 4.223 4.386 -0.163 1
1 1199 . 18 1 1 A 87 87 ASP C C 87 178.721 178.592 0.129 1
1 1200 . 18 1 1 A 87 87 ASP CA C 87 57.311 57.055 0.256 1
1 1201 . 18 1 1 A 87 87 ASP CB C 87 40.102 42.034 -1.932 1
1 1202 . 18 1 1 A 87 87 ASP N N 87 115.381 117.400 -2.019 1
1 1203 . 18 1 1 A 88 88 GLU H H 88 7.571 8.025 -0.454 1
1 1204 . 18 1 1 A 88 88 GLU HA H 88 3.659 4.120 -0.461 1
1 1209 . 18 1 1 A 88 88 GLU C C 88 177.097 178.747 -1.650 1
1 1210 . 18 1 1 A 88 88 GLU CA C 88 58.729 58.985 -0.256 1
1 1211 . 18 1 1 A 88 88 GLU CB C 88 30.052 29.721 0.331 1
1 1213 . 18 1 1 A 88 88 GLU N N 88 120.009 118.804 1.205 1
1 1214 . 18 1 1 A 89 89 ALA H H 89 7.423 7.889 -0.466 1
1 1215 . 18 1 1 A 89 89 ALA HA H 89 3.900 4.253 -0.353 1
1 1219 . 18 1 1 A 89 89 ALA C C 89 178.267 180.239 -1.972 1
1 1220 . 18 1 1 A 89 89 ALA CA C 89 55.607 55.264 0.343 1
1 1221 . 18 1 1 A 89 89 ALA CB C 89 17.348 18.320 -0.972 1
1 1222 . 18 1 1 A 89 89 ALA N N 89 118.873 122.414 -3.541 1
1 1223 . 18 1 1 A 90 90 LYS H H 90 8.046 8.228 -0.182 1
1 1224 . 18 1 1 A 90 90 LYS HA H 90 3.669 3.969 -0.300 1
1 1233 . 18 1 1 A 90 90 LYS C C 90 177.649 179.007 -1.358 1
1 1234 . 18 1 1 A 90 90 LYS CA C 90 60.351 59.721 0.630 1
1 1235 . 18 1 1 A 90 90 LYS CB C 90 32.087 32.350 -0.263 1
1 1239 . 18 1 1 A 90 90 LYS N N 90 114.834 117.542 -2.708 1
1 1240 . 18 1 1 A 91 91 ARG H H 91 7.468 8.019 -0.551 1
1 1241 . 18 1 1 A 91 91 ARG HA H 91 3.887 3.870 0.017 1
1 1249 . 18 1 1 A 91 91 ARG C C 91 178.998 178.907 0.091 1
1 1250 . 18 1 1 A 91 91 ARG CA C 91 59.164 59.172 -0.008 1
1 1251 . 18 1 1 A 91 91 ARG CB C 91 29.274 29.946 -0.672 1
1 1254 . 18 1 1 A 91 91 ARG N N 91 119.029 119.319 -0.290 1
1 1256 . 18 1 1 A 92 92 TRP H H 92 8.136 8.333 -0.197 1
1 1257 . 18 1 1 A 92 92 TRP HA H 92 4.818 4.577 0.241 1
1 1266 . 18 1 1 A 92 92 TRP C C 92 179.566 179.162 0.404 1
1 1267 . 18 1 1 A 92 92 TRP CA C 92 58.663 60.116 -1.453 1
1 1268 . 18 1 1 A 92 92 TRP CB C 92 29.790 29.484 0.306 1
1 1274 . 18 1 1 A 92 92 TRP N N 92 118.100 119.880 -1.780 1
1 1276 . 18 1 1 A 93 93 ILE H H 93 8.363 8.147 0.216 1
1 1277 . 18 1 1 A 93 93 ILE HA H 93 3.544 3.709 -0.165 1
1 1287 . 18 1 1 A 93 93 ILE C C 93 176.820 178.230 -1.410 1
1 1288 . 18 1 1 A 93 93 ILE CA C 93 66.225 65.392 0.833 1
1 1289 . 18 1 1 A 93 93 ILE CB C 93 37.571 37.902 -0.331 1
1 1293 . 18 1 1 A 93 93 ILE N N 93 120.588 120.708 -0.120 1
1 1294 . 18 1 1 A 94 94 LYS H H 94 8.264 7.745 0.519 1
1 1295 . 18 1 1 A 94 94 LYS HA H 94 3.865 3.957 -0.092 1
1 1304 . 18 1 1 A 94 94 LYS C C 94 179.258 178.785 0.473 1
1 1305 . 18 1 1 A 94 94 LYS CA C 94 59.889 59.428 0.461 1
1 1306 . 18 1 1 A 94 94 LYS CB C 94 32.225 32.159 0.066 1
1 1310 . 18 1 1 A 94 94 LYS N N 94 121.687 120.746 0.941 1
1 1311 . 18 1 1 A 95 95 GLU H H 95 8.360 8.472 -0.112 1
1 1312 . 18 1 1 A 95 95 GLU HA H 95 4.023 4.011 0.012 1
1 1317 . 18 1 1 A 95 95 GLU C C 95 178.884 179.242 -0.358 1
1 1318 . 18 1 1 A 95 95 GLU CA C 95 59.366 59.462 -0.096 1
1 1319 . 18 1 1 A 95 95 GLU CB C 95 29.508 29.424 0.084 1
1 1321 . 18 1 1 A 95 95 GLU N N 95 118.505 118.655 -0.150 1
1 1322 . 18 1 1 A 96 96 PHE H H 96 8.212 8.608 -0.396 1
1 1323 . 18 1 1 A 96 96 PHE HA H 96 4.512 4.232 0.280 1
1 1331 . 18 1 1 A 96 96 PHE C C 96 176.820 178.227 -1.407 1
1 1332 . 18 1 1 A 96 96 PHE CA C 96 59.608 61.468 -1.860 1
1 1333 . 18 1 1 A 96 96 PHE CB C 96 40.431 39.126 1.305 1
1 1339 . 18 1 1 A 96 96 PHE N N 96 120.369 122.417 -2.048 1
1 1340 . 18 1 1 A 97 97 SER H H 97 8.216 7.899 0.317 1
1 1341 . 18 1 1 A 97 97 SER HA H 97 3.816 4.131 -0.315 1
1 1344 . 18 1 1 A 97 97 SER C C 97 175.618 177.322 -1.704 1
1 1345 . 18 1 1 A 97 97 SER CA C 97 60.492 61.299 -0.807 1
1 1346 . 18 1 1 A 97 97 SER CB C 97 63.022 62.900 0.122 1
1 1347 . 18 1 1 A 97 97 SER N N 97 111.969 114.241 -2.272 1
1 1348 . 18 1 1 A 98 98 GLU H H 98 7.655 8.173 -0.518 1
1 1349 . 18 1 1 A 98 98 GLU HA H 98 4.187 4.047 0.140 1
1 1354 . 18 1 1 A 98 98 GLU C C 98 177.698 179.222 -1.524 1
1 1355 . 18 1 1 A 98 98 GLU CA C 98 57.069 59.348 -2.279 1
1 1356 . 18 1 1 A 98 98 GLU CB C 98 29.321 29.224 0.097 1
1 1358 . 18 1 1 A 98 98 GLU N N 98 120.588 121.973 -1.385 1
1 1359 . 18 1 1 A 99 99 GLU H H 99 7.794 8.161 -0.367 1
1 1360 . 18 1 1 A 99 99 GLU HA H 99 4.123 4.039 0.084 1
1 1365 . 18 1 1 A 99 99 GLU C C 99 177.665 176.737 0.928 1
1 1366 . 18 1 1 A 99 99 GLU CA C 99 57.304 58.862 -1.558 1
1 1367 . 18 1 1 A 99 99 GLU CB C 99 29.368 29.233 0.135 1
1 1369 . 18 1 1 A 99 99 GLU N N 99 120.067 120.007 0.060 1
1 1370 . 18 1 1 A 100 100 GLY H H 100 8.138 8.338 -0.200 1
1 1371 . 18 1 1 A 100 100 GLY HA2 H 100 3.865 3.735 0.130 1
1 1372 . 18 1 1 A 100 100 GLY HA3 H 100 3.715 3.778 -0.063 1
1 1373 . 18 1 1 A 100 100 GLY C C 100 174.464 175.177 -0.713 1
1 1374 . 18 1 1 A 100 100 GLY CA C 100 45.305 45.948 -0.643 1
1 1375 . 18 1 1 A 100 100 GLY N N 100 107.802 107.617 0.185 1
1 1376 . 18 1 1 A 101 101 GLY H H 101 8.023 8.363 -0.340 1
1 1377 . 18 1 1 A 101 101 GLY HA2 H 101 3.865 3.758 0.107 1
1 1378 . 18 1 1 A 101 101 GLY HA3 H 101 3.892 3.805 0.087 1
1 1379 . 18 1 1 A 101 101 GLY C C 101 174.204 174.524 -0.320 1
1 1380 . 18 1 1 A 101 101 GLY CA C 101 45.036 45.977 -0.941 1
1 1381 . 18 1 1 A 101 101 GLY N N 101 108.032 108.067 -0.035 1
1 1382 . 18 1 1 A 102 102 SER H H 102 8.059 7.726 0.333 1
1 1383 . 18 1 1 A 102 102 SER HA H 102 4.380 4.513 -0.133 1
1 1386 . 18 1 1 A 102 102 SER C C 102 174.627 174.250 0.377 1
1 1387 . 18 1 1 A 102 102 SER CA C 102 58.194 58.467 -0.273 1
1 1388 . 18 1 1 A 102 102 SER CB C 102 63.538 61.641 1.897 1
1 1389 . 18 1 1 A 102 102 SER N N 102 115.266 115.903 -0.637 1
1 1390 . 18 1 1 A 103 103 LEU H H 103 8.287 8.084 0.203 1
1 1391 . 18 1 1 A 103 103 LEU HA H 103 4.301 4.130 0.171 1
1 1401 . 18 1 1 A 103 103 LEU C C 103 177.292 177.109 0.183 1
1 1402 . 18 1 1 A 103 103 LEU CA C 103 55.007 54.884 0.123 1
1 1403 . 18 1 1 A 103 103 LEU CB C 103 42.023 42.004 0.019 1
1 1407 . 18 1 1 A 103 103 LEU N N 103 123.596 127.771 -4.175 1
1 1408 . 18 1 1 A 104 104 GLU H H 104 8.216 7.477 0.739 1
1 1409 . 18 1 1 A 104 104 GLU HA H 104 4.126 4.411 -0.285 1
1 1414 . 18 1 1 A 104 104 GLU CA C 104 56.518 56.503 0.015 1
1 1415 . 18 1 1 A 104 104 GLU CB C 104 29.837 30.426 -0.589 1
1 1417 . 18 1 1 A 104 104 GLU N N 104 120.510 119.093 1.417 1
1 1418 . 18 1 1 A 105 105 HIS HA H 105 4.593 5.162 -0.569 1
1 1421 . 18 1 1 A 105 105 HIS C C 105 173.766 174.877 -1.111 1
1 1422 . 18 1 1 A 105 105 HIS CA C 105 55.536 58.130 -2.594 1
1 1423 . 18 1 1 A 105 105 HIS CB C 105 30.001 29.777 0.224 1
1 1424 . 18 1 1 A 106 106 HIS H H 106 8.154 8.660 -0.506 1
1 1425 . 18 1 1 A 106 106 HIS HA H 106 4.407 4.366 0.041 1
1 1428 . 18 1 1 A 106 106 HIS CA C 106 56.920 58.567 -1.647 1
1 1429 . 18 1 1 A 106 106 HIS CB C 106 30.001 29.407 0.594 1
1 14 . 19 1 1 A 2 2 LEU H H 2 8.509 9.083 -0.574 1
1 15 . 19 1 1 A 2 2 LEU HA H 2 4.463 5.054 -0.591 1
1 25 . 19 1 1 A 2 2 LEU C C 2 173.944 176.149 -2.205 1
1 26 . 19 1 1 A 2 2 LEU CA C 2 54.471 53.870 0.601 1
1 27 . 19 1 1 A 2 2 LEU CB C 2 43.595 43.808 -0.213 1
1 31 . 19 1 1 A 2 2 LEU N N 2 127.160 126.743 0.417 1
1 32 . 19 1 1 A 3 3 LEU H H 3 7.844 8.643 -0.799 1
1 33 . 19 1 1 A 3 3 LEU HA H 3 5.128 5.473 -0.345 1
1 43 . 19 1 1 A 3 3 LEU C C 3 175.423 174.971 0.452 1
1 44 . 19 1 1 A 3 3 LEU CA C 3 53.566 53.161 0.405 1
1 45 . 19 1 1 A 3 3 LEU CB C 3 44.039 44.768 -0.729 1
1 49 . 19 1 1 A 3 3 LEU N N 3 122.555 123.020 -0.465 1
1 50 . 19 1 1 A 4 4 TYR H H 4 8.360 9.015 -0.655 1
1 51 . 19 1 1 A 4 4 TYR HA H 4 5.143 5.102 0.041 1
1 58 . 19 1 1 A 4 4 TYR C C 4 174.481 174.979 -0.498 1
1 59 . 19 1 1 A 4 4 TYR CA C 4 56.577 56.388 0.189 1
1 60 . 19 1 1 A 4 4 TYR CB C 4 43.840 42.700 1.140 1
1 65 . 19 1 1 A 4 4 TYR N N 4 119.315 123.279 -3.964 1
1 66 . 19 1 1 A 5 5 VAL H H 5 8.918 9.115 -0.197 1
1 67 . 19 1 1 A 5 5 VAL HA H 5 5.106 4.980 0.126 1
1 75 . 19 1 1 A 5 5 VAL C C 5 174.042 174.486 -0.444 1
1 76 . 19 1 1 A 5 5 VAL CA C 5 59.852 60.974 -1.122 1
1 77 . 19 1 1 A 5 5 VAL CB C 5 33.816 34.429 -0.613 1
1 80 . 19 1 1 A 5 5 VAL N N 5 119.952 121.557 -1.605 1
1 81 . 19 1 1 A 6 6 LEU H H 6 9.315 9.459 -0.144 1
1 82 . 19 1 1 A 6 6 LEU HA H 6 5.466 5.296 0.170 1
1 92 . 19 1 1 A 6 6 LEU C C 6 175.049 174.899 0.150 1
1 93 . 19 1 1 A 6 6 LEU CA C 6 52.090 53.347 -1.257 1
1 94 . 19 1 1 A 6 6 LEU CB C 6 44.103 43.694 0.409 1
1 98 . 19 1 1 A 6 6 LEU N N 6 126.917 126.462 0.455 1
1 99 . 19 1 1 A 7 7 ILE H H 7 8.458 8.964 -0.506 1
1 100 . 19 1 1 A 7 7 ILE HA H 7 5.131 5.140 -0.009 1
1 110 . 19 1 1 A 7 7 ILE C C 7 173.213 173.844 -0.631 1
1 111 . 19 1 1 A 7 7 ILE CA C 7 58.463 59.585 -1.122 1
1 112 . 19 1 1 A 7 7 ILE CB C 7 41.020 41.151 -0.131 1
1 116 . 19 1 1 A 7 7 ILE N N 7 119.778 125.912 -6.134 1
1 117 . 19 1 1 A 8 8 ILE H H 8 8.797 9.362 -0.565 1
1 118 . 19 1 1 A 8 8 ILE HA H 8 4.611 5.096 -0.485 1
1 128 . 19 1 1 A 8 8 ILE C C 8 174.611 174.757 -0.146 1
1 129 . 19 1 1 A 8 8 ILE CA C 8 60.227 60.423 -0.196 1
1 130 . 19 1 1 A 8 8 ILE CB C 8 37.665 39.193 -1.528 1
1 134 . 19 1 1 A 8 8 ILE N N 8 128.919 129.684 -0.765 1
1 135 . 19 1 1 A 9 9 SER H H 9 7.811 8.770 -0.959 1
1 136 . 19 1 1 A 9 9 SER HA H 9 4.429 4.983 -0.554 1
1 140 . 19 1 1 A 9 9 SER C C 9 172.937 173.709 -0.772 1
1 141 . 19 1 1 A 9 9 SER CA C 9 58.241 56.920 1.321 1
1 142 . 19 1 1 A 9 9 SER CB C 9 64.261 64.461 -0.200 1
1 143 . 19 1 1 A 9 9 SER N N 9 116.365 121.657 -5.292 1
1 144 . 19 1 1 A 10 10 ASN H H 10 8.641 8.900 -0.259 1
1 145 . 19 1 1 A 10 10 ASN HA H 10 4.938 4.674 0.264 1
1 150 . 19 1 1 A 10 10 ASN C C 10 174.497 174.728 -0.231 1
1 151 . 19 1 1 A 10 10 ASN CA C 10 52.221 54.757 -2.536 1
1 152 . 19 1 1 A 10 10 ASN CB C 10 39.128 39.581 -0.453 1
1 153 . 19 1 1 A 10 10 ASN N N 10 122.612 122.831 -0.219 1
1 155 . 19 1 1 A 11 11 ASP H H 11 8.673 7.189 1.484 1
1 156 . 19 1 1 A 11 11 ASP HA H 11 4.596 4.760 -0.164 1
1 159 . 19 1 1 A 11 11 ASP C C 11 175.342 176.317 -0.975 1
1 160 . 19 1 1 A 11 11 ASP CA C 11 53.233 53.885 -0.652 1
1 161 . 19 1 1 A 11 11 ASP CB C 11 40.965 41.239 -0.274 1
1 162 . 19 1 1 A 11 11 ASP N N 11 122.717 119.006 3.711 1
1 163 . 19 1 1 A 12 12 LYS H H 12 8.562 8.904 -0.342 1
1 164 . 19 1 1 A 12 12 LYS HA H 12 3.854 4.058 -0.204 1
1 173 . 19 1 1 A 12 12 LYS C C 12 178.754 178.462 0.292 1
1 174 . 19 1 1 A 12 12 LYS CA C 12 59.581 59.530 0.051 1
1 175 . 19 1 1 A 12 12 LYS CB C 12 32.378 32.108 0.270 1
1 179 . 19 1 1 A 12 12 LYS N N 12 125.737 125.174 0.563 1
1 180 . 19 1 1 A 13 13 LYS H H 13 8.075 7.882 0.193 1
1 181 . 19 1 1 A 13 13 LYS HA H 13 4.154 4.097 0.057 1
1 190 . 19 1 1 A 13 13 LYS C C 13 178.315 179.002 -0.687 1
1 191 . 19 1 1 A 13 13 LYS CA C 13 58.532 59.035 -0.503 1
1 192 . 19 1 1 A 13 13 LYS CB C 13 31.452 32.607 -1.155 1
1 196 . 19 1 1 A 13 13 LYS N N 13 119.604 119.991 -0.387 1
1 197 . 19 1 1 A 14 14 LEU H H 14 7.552 7.864 -0.312 1
1 198 . 19 1 1 A 14 14 LEU HA H 14 3.682 4.101 -0.419 1
1 208 . 19 1 1 A 14 14 LEU C C 14 178.429 178.766 -0.337 1
1 209 . 19 1 1 A 14 14 LEU CA C 14 58.999 57.843 1.156 1
1 210 . 19 1 1 A 14 14 LEU CB C 14 41.228 41.864 -0.636 1
1 214 . 19 1 1 A 14 14 LEU N N 14 122.266 120.939 1.327 1
1 215 . 19 1 1 A 15 15 ILE H H 15 8.074 7.907 0.167 1
1 216 . 19 1 1 A 15 15 ILE HA H 15 3.264 3.488 -0.224 1
1 226 . 19 1 1 A 15 15 ILE C C 15 177.000 177.536 -0.536 1
1 227 . 19 1 1 A 15 15 ILE CA C 15 65.939 65.820 0.119 1
1 228 . 19 1 1 A 15 15 ILE CB C 15 37.983 37.805 0.178 1
1 232 . 19 1 1 A 15 15 ILE N N 15 118.214 119.274 -1.060 1
1 233 . 19 1 1 A 16 16 GLU H H 16 8.016 8.439 -0.423 1
1 234 . 19 1 1 A 16 16 GLU HA H 16 4.045 3.927 0.118 1
1 239 . 19 1 1 A 16 16 GLU C C 16 179.388 179.585 -0.197 1
1 240 . 19 1 1 A 16 16 GLU CA C 16 59.032 59.833 -0.801 1
1 241 . 19 1 1 A 16 16 GLU CB C 16 29.200 29.430 -0.230 1
1 243 . 19 1 1 A 16 16 GLU N N 16 118.484 118.764 -0.280 1
1 244 . 19 1 1 A 17 17 GLU H H 17 8.063 7.878 0.185 1
1 245 . 19 1 1 A 17 17 GLU HA H 17 4.053 3.996 0.057 1
1 250 . 19 1 1 A 17 17 GLU C C 17 179.306 179.340 -0.034 1
1 251 . 19 1 1 A 17 17 GLU CA C 17 58.636 59.198 -0.562 1
1 252 . 19 1 1 A 17 17 GLU CB C 17 29.011 29.583 -0.572 1
1 254 . 19 1 1 A 17 17 GLU N N 17 118.100 120.803 -2.703 1
1 255 . 19 1 1 A 18 18 ALA H H 18 8.655 8.123 0.532 1
1 256 . 19 1 1 A 18 18 ALA HA H 18 3.775 4.036 -0.261 1
1 260 . 19 1 1 A 18 18 ALA C C 18 178.559 179.797 -1.238 1
1 261 . 19 1 1 A 18 18 ALA CA C 18 54.960 55.424 -0.464 1
1 262 . 19 1 1 A 18 18 ALA CB C 18 17.960 18.097 -0.137 1
1 263 . 19 1 1 A 18 18 ALA N N 18 122.439 122.561 -0.122 1
1 264 . 19 1 1 A 19 19 ARG H H 19 8.900 8.134 0.766 1
1 265 . 19 1 1 A 19 19 ARG HA H 19 3.809 4.015 -0.206 1
1 273 . 19 1 1 A 19 19 ARG C C 19 178.721 179.054 -0.333 1
1 274 . 19 1 1 A 19 19 ARG CA C 19 59.976 59.853 0.123 1
1 275 . 19 1 1 A 19 19 ARG CB C 19 29.572 30.056 -0.484 1
1 278 . 19 1 1 A 19 19 ARG N N 19 118.563 117.720 0.843 1
1 280 . 19 1 1 A 20 20 LYS H H 20 7.792 8.038 -0.246 1
1 281 . 19 1 1 A 20 20 LYS HA H 20 4.052 4.025 0.027 1
1 290 . 19 1 1 A 20 20 LYS C C 20 179.648 179.632 0.016 1
1 291 . 19 1 1 A 20 20 LYS CA C 20 59.296 59.388 -0.092 1
1 292 . 19 1 1 A 20 20 LYS CB C 20 32.216 32.298 -0.082 1
1 296 . 19 1 1 A 20 20 LYS N N 20 118.638 119.333 -0.695 1
1 297 . 19 1 1 A 21 21 MET H H 21 7.684 8.153 -0.469 1
1 298 . 19 1 1 A 21 21 MET HA H 21 4.411 4.135 0.276 1
1 306 . 19 1 1 A 21 21 MET C C 21 177.909 178.210 -0.301 1
1 307 . 19 1 1 A 21 21 MET CA C 21 57.009 59.228 -2.219 1
1 308 . 19 1 1 A 21 21 MET CB C 21 32.028 32.231 -0.203 1
1 311 . 19 1 1 A 21 21 MET N N 21 118.100 118.350 -0.250 1
1 312 . 19 1 1 A 22 22 ALA H H 22 8.815 8.533 0.282 1
1 313 . 19 1 1 A 22 22 ALA HA H 22 3.826 3.918 -0.092 1
1 317 . 19 1 1 A 22 22 ALA C C 22 178.835 179.844 -1.009 1
1 318 . 19 1 1 A 22 22 ALA CA C 22 55.427 55.604 -0.177 1
1 319 . 19 1 1 A 22 22 ALA CB C 22 18.059 18.552 -0.493 1
1 320 . 19 1 1 A 22 22 ALA N N 22 122.150 121.354 0.796 1
1 321 . 19 1 1 A 23 23 GLU H H 23 8.276 7.875 0.401 1
1 322 . 19 1 1 A 23 23 GLU HA H 23 4.146 3.954 0.192 1
1 327 . 19 1 1 A 23 23 GLU C C 23 180.151 179.416 0.735 1
1 328 . 19 1 1 A 23 23 GLU CA C 23 58.999 59.403 -0.404 1
1 329 . 19 1 1 A 23 23 GLU CB C 23 29.160 29.449 -0.289 1
1 331 . 19 1 1 A 23 23 GLU N N 23 117.001 117.896 -0.895 1
1 332 . 19 1 1 A 24 24 LYS H H 24 7.573 7.840 -0.267 1
1 333 . 19 1 1 A 24 24 LYS HA H 24 4.101 4.106 -0.005 1
1 342 . 19 1 1 A 24 24 LYS C C 24 177.145 177.571 -0.426 1
1 343 . 19 1 1 A 24 24 LYS CA C 24 58.261 58.736 -0.475 1
1 344 . 19 1 1 A 24 24 LYS CB C 24 32.079 32.156 -0.077 1
1 348 . 19 1 1 A 24 24 LYS N N 24 119.960 119.500 0.460 1
1 349 . 19 1 1 A 25 25 ALA H H 25 7.710 7.745 -0.035 1
1 350 . 19 1 1 A 25 25 ALA HA H 25 4.413 4.349 0.064 1
1 354 . 19 1 1 A 25 25 ALA C C 25 175.325 176.476 -1.151 1
1 355 . 19 1 1 A 25 25 ALA CA C 25 51.208 51.613 -0.405 1
1 356 . 19 1 1 A 25 25 ALA CB C 25 18.520 19.102 -0.582 1
1 357 . 19 1 1 A 25 25 ALA N N 25 119.257 118.831 0.426 1
1 358 . 19 1 1 A 26 26 ASN H H 26 7.840 7.870 -0.030 1
1 359 . 19 1 1 A 26 26 ASN HA H 26 4.357 4.275 0.082 1
1 364 . 19 1 1 A 26 26 ASN C C 26 173.587 173.730 -0.143 1
1 365 . 19 1 1 A 26 26 ASN CA C 26 54.307 54.552 -0.245 1
1 366 . 19 1 1 A 26 26 ASN CB C 26 36.972 36.679 0.293 1
1 367 . 19 1 1 A 26 26 ASN N N 26 115.266 113.696 1.570 1
1 369 . 19 1 1 A 27 27 LEU H H 27 8.241 7.939 0.302 1
1 370 . 19 1 1 A 27 27 LEU HA H 27 4.652 4.730 -0.078 1
1 380 . 19 1 1 A 27 27 LEU C C 27 175.894 175.670 0.224 1
1 381 . 19 1 1 A 27 27 LEU CA C 27 52.923 53.289 -0.366 1
1 382 . 19 1 1 A 27 27 LEU CB C 27 44.090 43.618 0.472 1
1 386 . 19 1 1 A 27 27 LEU N N 27 116.828 118.709 -1.881 1
1 387 . 19 1 1 A 28 28 GLU H H 28 7.798 7.816 -0.018 1
1 388 . 19 1 1 A 28 28 GLU HA H 28 4.310 4.709 -0.399 1
1 393 . 19 1 1 A 28 28 GLU C C 28 173.944 175.090 -1.146 1
1 394 . 19 1 1 A 28 28 GLU CA C 28 55.460 56.012 -0.552 1
1 395 . 19 1 1 A 28 28 GLU CB C 28 30.512 30.469 0.043 1
1 397 . 19 1 1 A 28 28 GLU N N 28 121.340 122.076 -0.736 1
1 398 . 19 1 1 A 29 29 LEU H H 29 8.451 8.935 -0.484 1
1 399 . 19 1 1 A 29 29 LEU HA H 29 5.662 5.560 0.102 1
1 409 . 19 1 1 A 29 29 LEU C C 29 176.902 174.818 2.084 1
1 410 . 19 1 1 A 29 29 LEU CA C 29 53.186 53.552 -0.366 1
1 411 . 19 1 1 A 29 29 LEU CB C 29 44.914 45.478 -0.564 1
1 415 . 19 1 1 A 29 29 LEU N N 29 126.547 127.416 -0.869 1
1 416 . 19 1 1 A 30 30 ARG H H 30 9.094 9.076 0.018 1
1 417 . 19 1 1 A 30 30 ARG HA H 30 4.910 5.140 -0.230 1
1 425 . 19 1 1 A 30 30 ARG C C 30 175.147 175.388 -0.241 1
1 426 . 19 1 1 A 30 30 ARG CA C 30 53.417 54.049 -0.632 1
1 427 . 19 1 1 A 30 30 ARG CB C 30 32.555 34.067 -1.512 1
1 430 . 19 1 1 A 30 30 ARG N N 30 125.043 125.433 -0.390 1
1 432 . 19 1 1 A 31 31 THR H H 31 8.496 8.530 -0.034 1
1 433 . 19 1 1 A 31 31 THR HA H 31 4.888 4.904 -0.016 1
1 438 . 19 1 1 A 31 31 THR C C 31 173.961 173.877 0.084 1
1 439 . 19 1 1 A 31 31 THR CA C 31 60.445 60.455 -0.010 1
1 440 . 19 1 1 A 31 31 THR CB C 31 69.492 70.462 -0.970 1
1 442 . 19 1 1 A 31 31 THR N N 31 114.745 114.092 0.653 1
1 443 . 19 1 1 A 32 32 VAL H H 32 8.480 8.628 -0.148 1
1 444 . 19 1 1 A 32 32 VAL HA H 32 4.411 4.774 -0.363 1
1 452 . 19 1 1 A 32 32 VAL C C 32 175.082 175.314 -0.232 1
1 453 . 19 1 1 A 32 32 VAL CA C 32 60.946 60.538 0.408 1
1 454 . 19 1 1 A 32 32 VAL CB C 32 34.487 35.805 -1.318 1
1 457 . 19 1 1 A 32 32 VAL N N 32 122.324 121.356 0.968 1
1 458 . 19 1 1 A 33 33 LYS H H 33 9.304 8.776 0.528 1
1 459 . 19 1 1 A 33 33 LYS HA H 33 4.534 4.584 -0.050 1
1 468 . 19 1 1 A 33 33 LYS C C 33 176.740 176.365 0.375 1
1 469 . 19 1 1 A 33 33 LYS CA C 33 56.846 56.955 -0.109 1
1 470 . 19 1 1 A 33 33 LYS CB C 33 34.355 34.736 -0.381 1
1 474 . 19 1 1 A 33 33 LYS N N 33 123.654 125.738 -2.084 1
1 475 . 19 1 1 A 34 34 THR H H 34 7.245 7.450 -0.205 1
1 476 . 19 1 1 A 34 34 THR HA H 34 4.780 4.676 0.104 1
1 481 . 19 1 1 A 34 34 THR C C 34 174.529 175.302 -0.773 1
1 482 . 19 1 1 A 34 34 THR CA C 34 58.859 59.188 -0.329 1
1 483 . 19 1 1 A 34 34 THR CB C 34 73.023 71.964 1.059 1
1 485 . 19 1 1 A 34 34 THR N N 34 106.300 111.498 -5.198 1
1 486 . 19 1 1 A 35 35 GLU H H 35 9.174 9.081 0.093 1
1 487 . 19 1 1 A 35 35 GLU HA H 35 3.886 3.966 -0.080 1
1 492 . 19 1 1 A 35 35 GLU C C 35 177.714 177.651 0.063 1
1 493 . 19 1 1 A 35 35 GLU CA C 35 59.233 59.848 -0.615 1
1 494 . 19 1 1 A 35 35 GLU CB C 35 29.377 29.359 0.018 1
1 496 . 19 1 1 A 35 35 GLU N N 35 121.919 122.053 -0.134 1
1 497 . 19 1 1 A 36 36 ASP H H 36 8.185 8.417 -0.232 1
1 498 . 19 1 1 A 36 36 ASP HA H 36 4.289 4.323 -0.034 1
1 501 . 19 1 1 A 36 36 ASP C C 36 178.348 178.531 -0.183 1
1 502 . 19 1 1 A 36 36 ASP CA C 36 56.962 57.770 -0.808 1
1 503 . 19 1 1 A 36 36 ASP CB C 36 40.214 42.131 -1.917 1
1 504 . 19 1 1 A 36 36 ASP N N 36 118.332 120.134 -1.802 1
1 505 . 19 1 1 A 37 37 GLU H H 37 7.741 7.734 0.007 1
1 506 . 19 1 1 A 37 37 GLU HA H 37 3.708 3.985 -0.277 1
1 511 . 19 1 1 A 37 37 GLU C C 37 177.324 178.974 -1.650 1
1 512 . 19 1 1 A 37 37 GLU CA C 37 58.698 59.241 -0.543 1
1 513 . 19 1 1 A 37 37 GLU CB C 37 30.199 29.472 0.727 1
1 515 . 19 1 1 A 37 37 GLU N N 37 120.704 119.107 1.597 1
1 516 . 19 1 1 A 38 38 LEU H H 38 7.531 8.057 -0.526 1
1 517 . 19 1 1 A 38 38 LEU HA H 38 3.873 4.196 -0.323 1
1 527 . 19 1 1 A 38 38 LEU C C 38 177.357 178.671 -1.314 1
1 528 . 19 1 1 A 38 38 LEU CA C 38 58.305 58.211 0.094 1
1 529 . 19 1 1 A 38 38 LEU CB C 38 40.837 41.577 -0.740 1
1 533 . 19 1 1 A 38 38 LEU N N 38 119.200 121.490 -2.290 1
1 534 . 19 1 1 A 39 39 LYS H H 39 8.083 8.192 -0.109 1
1 535 . 19 1 1 A 39 39 LYS HA H 39 3.608 3.888 -0.280 1
1 544 . 19 1 1 A 39 39 LYS C C 39 177.373 178.870 -1.497 1
1 545 . 19 1 1 A 39 39 LYS CA C 39 60.290 59.550 0.740 1
1 546 . 19 1 1 A 39 39 LYS CB C 39 32.178 32.119 0.059 1
1 550 . 19 1 1 A 39 39 LYS N N 39 116.943 118.801 -1.858 1
1 551 . 19 1 1 A 40 40 LYS H H 40 7.632 7.977 -0.345 1
1 552 . 19 1 1 A 40 40 LYS HA H 40 3.864 3.829 0.035 1
1 561 . 19 1 1 A 40 40 LYS C C 40 179.566 178.334 1.232 1
1 562 . 19 1 1 A 40 40 LYS CA C 40 58.993 58.925 0.068 1
1 563 . 19 1 1 A 40 40 LYS CB C 40 31.758 31.901 -0.143 1
1 567 . 19 1 1 A 40 40 LYS N N 40 118.274 119.218 -0.944 1
1 568 . 19 1 1 A 41 41 TYR H H 41 7.823 7.570 0.253 1
1 569 . 19 1 1 A 41 41 TYR HA H 41 3.926 3.878 0.048 1
1 576 . 19 1 1 A 41 41 TYR C C 41 176.625 177.677 -1.052 1
1 577 . 19 1 1 A 41 41 TYR CA C 41 59.757 60.679 -0.922 1
1 578 . 19 1 1 A 41 41 TYR CB C 41 36.901 37.789 -0.888 1
1 583 . 19 1 1 A 41 41 TYR N N 41 117.811 119.150 -1.339 1
1 584 . 19 1 1 A 42 42 LEU H H 42 7.964 8.296 -0.332 1
1 585 . 19 1 1 A 42 42 LEU HA H 42 3.704 3.947 -0.243 1
1 595 . 19 1 1 A 42 42 LEU C C 42 178.396 179.318 -0.922 1
1 596 . 19 1 1 A 42 42 LEU CA C 42 58.237 57.948 0.289 1
1 597 . 19 1 1 A 42 42 LEU CB C 42 40.507 41.189 -0.682 1
1 601 . 19 1 1 A 42 42 LEU N N 42 115.960 120.050 -4.090 1
1 602 . 19 1 1 A 43 43 GLU H H 43 8.193 8.268 -0.075 1
1 603 . 19 1 1 A 43 43 GLU HA H 43 3.882 3.871 0.011 1
1 608 . 19 1 1 A 43 43 GLU C C 43 179.193 179.397 -0.204 1
1 609 . 19 1 1 A 43 43 GLU CA C 43 59.122 59.876 -0.754 1
1 610 . 19 1 1 A 43 43 GLU CB C 43 29.244 29.258 -0.014 1
1 612 . 19 1 1 A 43 43 GLU N N 43 117.175 118.068 -0.893 1
1 613 . 19 1 1 A 44 44 GLU H H 44 7.601 7.592 0.009 1
1 614 . 19 1 1 A 44 44 GLU HA H 44 3.936 3.996 -0.060 1
1 619 . 19 1 1 A 44 44 GLU C C 44 179.875 178.027 1.848 1
1 620 . 19 1 1 A 44 44 GLU CA C 44 58.867 58.844 0.023 1
1 621 . 19 1 1 A 44 44 GLU CB C 44 28.648 29.161 -0.513 1
1 623 . 19 1 1 A 44 44 GLU N N 44 120.472 119.039 1.433 1
1 624 . 19 1 1 A 45 45 PHE H H 45 8.260 7.370 0.890 1
1 625 . 19 1 1 A 45 45 PHE HA H 45 4.520 4.236 0.284 1
1 633 . 19 1 1 A 45 45 PHE C C 45 177.942 177.985 -0.043 1
1 634 . 19 1 1 A 45 45 PHE CA C 45 55.945 60.449 -4.504 1
1 635 . 19 1 1 A 45 45 PHE CB C 45 36.680 39.531 -2.851 1
1 641 . 19 1 1 A 45 45 PHE N N 45 119.272 117.841 1.431 1
1 642 . 19 1 1 A 46 46 ARG H H 46 8.023 8.395 -0.372 1
1 643 . 19 1 1 A 46 46 ARG HA H 46 4.074 4.011 0.063 1
1 651 . 19 1 1 A 46 46 ARG C C 46 177.617 178.853 -1.236 1
1 652 . 19 1 1 A 46 46 ARG CA C 46 58.194 59.398 -1.204 1
1 653 . 19 1 1 A 46 46 ARG CB C 46 29.737 30.002 -0.265 1
1 656 . 19 1 1 A 46 46 ARG N N 46 118.136 119.940 -1.804 1
1 658 . 19 1 1 A 47 47 LYS H H 47 7.470 8.554 -1.084 1
1 659 . 19 1 1 A 47 47 LYS HA H 47 4.143 4.094 0.049 1
1 668 . 19 1 1 A 47 47 LYS C C 47 177.324 177.667 -0.343 1
1 669 . 19 1 1 A 47 47 LYS CA C 47 57.726 59.360 -1.634 1
1 670 . 19 1 1 A 47 47 LYS CB C 47 32.409 32.238 0.171 1
1 674 . 19 1 1 A 47 47 LYS N N 47 116.943 118.203 -1.260 1
1 675 . 19 1 1 A 48 48 GLU H H 48 7.615 7.979 -0.364 1
1 676 . 19 1 1 A 48 48 GLU HA H 48 4.428 4.717 -0.289 1
1 681 . 19 1 1 A 48 48 GLU C C 48 176.869 176.992 -0.123 1
1 682 . 19 1 1 A 48 48 GLU CA C 48 55.945 55.895 0.050 1
1 683 . 19 1 1 A 48 48 GLU CB C 48 29.696 30.214 -0.518 1
1 685 . 19 1 1 A 48 48 GLU N N 48 118.852 118.853 -0.001 1
1 686 . 19 1 1 A 49 49 SER H H 49 7.725 7.867 -0.142 1
1 687 . 19 1 1 A 49 49 SER HA H 49 4.244 4.274 -0.030 1
1 690 . 19 1 1 A 49 49 SER C C 49 174.838 176.531 -1.693 1
1 691 . 19 1 1 A 49 49 SER CA C 49 59.366 60.683 -1.317 1
1 692 . 19 1 1 A 49 49 SER CB C 49 63.116 63.063 0.053 1
1 693 . 19 1 1 A 49 49 SER N N 49 114.224 116.901 -2.677 1
1 694 . 19 1 1 A 50 50 GLN H H 50 8.548 7.998 0.550 1
1 695 . 19 1 1 A 50 50 GLN HA H 50 4.398 4.209 0.189 1
1 702 . 19 1 1 A 50 50 GLN C C 50 175.732 176.443 -0.711 1
1 703 . 19 1 1 A 50 50 GLN CA C 50 56.272 58.074 -1.802 1
1 704 . 19 1 1 A 50 50 GLN CB C 50 28.946 29.061 -0.115 1
1 706 . 19 1 1 A 50 50 GLN N N 50 120.125 119.717 0.408 1
1 708 . 19 1 1 A 51 51 ASN H H 51 8.534 8.034 0.500 1
1 709 . 19 1 1 A 51 51 ASN HA H 51 4.980 4.940 0.040 1
1 714 . 19 1 1 A 51 51 ASN C C 51 173.717 173.972 -0.255 1
1 715 . 19 1 1 A 51 51 ASN CA C 51 52.804 52.568 0.236 1
1 716 . 19 1 1 A 51 51 ASN CB C 51 39.583 39.641 -0.058 1
1 717 . 19 1 1 A 51 51 ASN N N 51 118.158 114.677 3.481 1
1 719 . 19 1 1 A 52 52 ILE H H 52 7.492 7.541 -0.049 1
1 720 . 19 1 1 A 52 52 ILE HA H 52 5.338 5.070 0.268 1
1 730 . 19 1 1 A 52 52 ILE C C 52 175.049 174.229 0.820 1
1 731 . 19 1 1 A 52 52 ILE CA C 52 59.364 59.892 -0.528 1
1 732 . 19 1 1 A 52 52 ILE CB C 52 42.163 41.129 1.034 1
1 736 . 19 1 1 A 52 52 ILE N N 52 117.927 121.388 -3.461 1
1 737 . 19 1 1 A 53 53 LYS H H 53 8.467 9.191 -0.724 1
1 738 . 19 1 1 A 53 53 LYS HA H 53 5.044 5.153 -0.109 1
1 747 . 19 1 1 A 53 53 LYS C C 53 175.082 175.523 -0.441 1
1 748 . 19 1 1 A 53 53 LYS CA C 53 55.429 54.955 0.474 1
1 749 . 19 1 1 A 53 53 LYS CB C 53 36.446 35.189 1.257 1
1 753 . 19 1 1 A 53 53 LYS N N 53 123.249 128.387 -5.138 1
1 754 . 19 1 1 A 54 54 VAL H H 54 8.490 9.189 -0.699 1
1 755 . 19 1 1 A 54 54 VAL HA H 54 5.159 5.061 0.098 1
1 763 . 19 1 1 A 54 54 VAL C C 54 173.473 173.517 -0.044 1
1 764 . 19 1 1 A 54 54 VAL CA C 54 60.163 60.763 -0.600 1
1 765 . 19 1 1 A 54 54 VAL CB C 54 35.509 34.049 1.460 1
1 768 . 19 1 1 A 54 54 VAL N N 54 120.762 125.385 -4.623 1
1 769 . 19 1 1 A 55 55 LEU H H 55 8.636 8.737 -0.101 1
1 770 . 19 1 1 A 55 55 LEU HA H 55 4.670 4.819 -0.149 1
1 780 . 19 1 1 A 55 55 LEU C C 55 173.652 174.354 -0.702 1
1 781 . 19 1 1 A 55 55 LEU CA C 55 52.289 52.997 -0.708 1
1 782 . 19 1 1 A 55 55 LEU CB C 55 42.070 44.109 -2.039 1
1 786 . 19 1 1 A 55 55 LEU N N 55 131.898 129.527 2.371 1
1 787 . 19 1 1 A 56 56 ILE H H 56 9.188 9.162 0.026 1
1 788 . 19 1 1 A 56 56 ILE HA H 56 4.879 5.051 -0.172 1
1 798 . 19 1 1 A 56 56 ILE C C 56 174.172 174.068 0.104 1
1 799 . 19 1 1 A 56 56 ILE CA C 56 59.976 59.752 0.224 1
1 800 . 19 1 1 A 56 56 ILE CB C 56 38.181 40.657 -2.476 1
1 804 . 19 1 1 A 56 56 ILE N N 56 126.373 126.723 -0.350 1
1 805 . 19 1 1 A 57 57 LEU H H 57 8.929 9.268 -0.339 1
1 806 . 19 1 1 A 57 57 LEU HA H 57 5.394 5.249 0.145 1
1 816 . 19 1 1 A 57 57 LEU C C 57 175.358 176.022 -0.664 1
1 817 . 19 1 1 A 57 57 LEU CA C 57 52.086 53.050 -0.964 1
1 818 . 19 1 1 A 57 57 LEU CB C 57 42.445 42.968 -0.523 1
1 822 . 19 1 1 A 57 57 LEU N N 57 126.547 127.795 -1.248 1
1 823 . 19 1 1 A 58 58 VAL H H 58 8.542 8.665 -0.123 1
1 824 . 19 1 1 A 58 58 VAL HA H 58 5.253 4.710 0.543 1
1 832 . 19 1 1 A 58 58 VAL C C 58 175.244 175.989 -0.745 1
1 833 . 19 1 1 A 58 58 VAL CA C 58 58.241 58.678 -0.437 1
1 834 . 19 1 1 A 58 58 VAL CB C 58 33.165 34.679 -1.514 1
1 837 . 19 1 1 A 58 58 VAL N N 58 114.398 119.478 -5.080 1
1 838 . 19 1 1 A 59 59 SER H H 59 8.797 8.864 -0.067 1
1 839 . 19 1 1 A 59 59 SER HA H 59 5.063 4.400 0.663 1
1 842 . 19 1 1 A 59 59 SER C C 59 174.172 174.241 -0.069 1
1 843 . 19 1 1 A 59 59 SER CA C 59 59.320 59.819 -0.499 1
1 844 . 19 1 1 A 59 59 SER CB C 59 65.600 63.580 2.020 1
1 845 . 19 1 1 A 59 59 SER N N 59 115.497 116.268 -0.771 1
1 846 . 19 1 1 A 60 60 ASN H H 60 7.730 7.862 -0.132 1
1 847 . 19 1 1 A 60 60 ASN HA H 60 4.811 5.164 -0.353 1
1 852 . 19 1 1 A 60 60 ASN C C 60 174.464 174.688 -0.224 1
1 853 . 19 1 1 A 60 60 ASN CA C 60 52.007 51.785 0.222 1
1 854 . 19 1 1 A 60 60 ASN CB C 60 40.336 42.186 -1.850 1
1 855 . 19 1 1 A 60 60 ASN N N 60 117.522 117.575 -0.053 1
1 857 . 19 1 1 A 61 61 ASP H H 61 8.577 9.032 -0.455 1
1 858 . 19 1 1 A 61 61 ASP HA H 61 4.365 4.273 0.092 1
1 861 . 19 1 1 A 61 61 ASP C C 61 177.357 178.154 -0.797 1
1 862 . 19 1 1 A 61 61 ASP CA C 61 57.351 57.214 0.137 1
1 863 . 19 1 1 A 61 61 ASP CB C 61 40.383 40.535 -0.152 1
1 864 . 19 1 1 A 61 61 ASP N N 61 119.431 121.890 -2.459 1
1 865 . 19 1 1 A 62 62 GLU H H 62 8.405 8.382 0.023 1
1 866 . 19 1 1 A 62 62 GLU HA H 62 4.121 4.041 0.080 1
1 871 . 19 1 1 A 62 62 GLU C C 62 179.615 178.923 0.692 1
1 872 . 19 1 1 A 62 62 GLU CA C 62 59.593 59.861 -0.268 1
1 873 . 19 1 1 A 62 62 GLU CB C 62 28.478 29.001 -0.523 1
1 875 . 19 1 1 A 62 62 GLU N N 62 122.150 119.589 2.561 1
1 876 . 19 1 1 A 63 63 GLU H H 63 8.384 8.252 0.132 1
1 877 . 19 1 1 A 63 63 GLU HA H 63 3.913 3.997 -0.084 1
1 882 . 19 1 1 A 63 63 GLU C C 63 178.478 179.079 -0.601 1
1 883 . 19 1 1 A 63 63 GLU CA C 63 58.273 59.102 -0.829 1
1 884 . 19 1 1 A 63 63 GLU CB C 63 29.931 29.180 0.751 1
1 886 . 19 1 1 A 63 63 GLU N N 63 119.084 119.360 -0.276 1
1 887 . 19 1 1 A 64 64 LEU H H 64 7.717 8.195 -0.478 1
1 888 . 19 1 1 A 64 64 LEU HA H 64 3.750 4.017 -0.267 1
1 898 . 19 1 1 A 64 64 LEU C C 64 177.535 178.122 -0.587 1
1 899 . 19 1 1 A 64 64 LEU CA C 64 58.944 58.471 0.473 1
1 900 . 19 1 1 A 64 64 LEU CB C 64 41.695 41.706 -0.011 1
1 904 . 19 1 1 A 64 64 LEU N N 64 120.357 122.293 -1.936 1
1 905 . 19 1 1 A 65 65 ASP H H 65 7.922 8.285 -0.363 1
1 906 . 19 1 1 A 65 65 ASP HA H 65 4.313 4.210 0.103 1
1 909 . 19 1 1 A 65 65 ASP C C 65 179.095 178.579 0.516 1
1 910 . 19 1 1 A 65 65 ASP CA C 65 57.272 57.928 -0.656 1
1 911 . 19 1 1 A 65 65 ASP CB C 65 40.196 42.003 -1.807 1
1 912 . 19 1 1 A 65 65 ASP N N 65 118.100 118.493 -0.393 1
1 913 . 19 1 1 A 66 66 LYS H H 66 7.802 7.974 -0.172 1
1 914 . 19 1 1 A 66 66 LYS HA H 66 4.078 3.920 0.158 1
1 923 . 19 1 1 A 66 66 LYS C C 66 178.624 178.710 -0.086 1
1 924 . 19 1 1 A 66 66 LYS CA C 66 58.429 59.668 -1.239 1
1 925 . 19 1 1 A 66 66 LYS CB C 66 31.727 32.362 -0.635 1
1 929 . 19 1 1 A 66 66 LYS N N 66 119.343 118.002 1.341 1
1 930 . 19 1 1 A 67 67 ALA H H 67 8.480 8.247 0.233 1
1 931 . 19 1 1 A 67 67 ALA HA H 67 3.853 4.149 -0.296 1
1 935 . 19 1 1 A 67 67 ALA C C 67 178.591 179.750 -1.159 1
1 936 . 19 1 1 A 67 67 ALA CA C 67 55.403 55.424 -0.021 1
1 937 . 19 1 1 A 67 67 ALA CB C 67 17.793 18.404 -0.611 1
1 938 . 19 1 1 A 67 67 ALA N N 67 121.562 122.299 -0.737 1
1 939 . 19 1 1 A 68 68 LYS H H 68 8.186 7.987 0.199 1
1 940 . 19 1 1 A 68 68 LYS HA H 68 3.805 4.054 -0.249 1
1 949 . 19 1 1 A 68 68 LYS C C 68 179.095 178.977 0.118 1
1 950 . 19 1 1 A 68 68 LYS CA C 68 59.952 59.131 0.821 1
1 951 . 19 1 1 A 68 68 LYS CB C 68 32.181 32.262 -0.081 1
1 955 . 19 1 1 A 68 68 LYS N N 68 116.165 116.931 -0.766 1
1 956 . 19 1 1 A 69 69 GLU H H 69 7.904 8.379 -0.475 1
1 957 . 19 1 1 A 69 69 GLU HA H 69 3.995 4.050 -0.055 1
1 962 . 19 1 1 A 69 69 GLU C C 69 179.079 179.137 -0.058 1
1 963 . 19 1 1 A 69 69 GLU CA C 69 59.022 59.033 -0.011 1
1 964 . 19 1 1 A 69 69 GLU CB C 69 29.274 29.482 -0.208 1
1 966 . 19 1 1 A 69 69 GLU N N 69 119.489 119.627 -0.138 1
1 967 . 19 1 1 A 70 70 LEU H H 70 7.962 8.014 -0.052 1
1 968 . 19 1 1 A 70 70 LEU HA H 70 4.020 3.945 0.075 1
1 978 . 19 1 1 A 70 70 LEU C C 70 178.738 178.758 -0.020 1
1 979 . 19 1 1 A 70 70 LEU CA C 70 57.486 57.955 -0.469 1
1 980 . 19 1 1 A 70 70 LEU CB C 70 41.695 41.432 0.263 1
1 984 . 19 1 1 A 70 70 LEU N N 70 119.431 120.417 -0.986 1
1 985 . 19 1 1 A 71 71 ALA H H 71 8.260 8.284 -0.024 1
1 986 . 19 1 1 A 71 71 ALA HA H 71 3.845 3.982 -0.137 1
1 990 . 19 1 1 A 71 71 ALA C C 71 179.518 180.092 -0.574 1
1 991 . 19 1 1 A 71 71 ALA CA C 71 55.139 55.309 -0.170 1
1 992 . 19 1 1 A 71 71 ALA CB C 71 18.487 18.487 0.000 1
1 993 . 19 1 1 A 71 71 ALA N N 71 119.604 120.564 -0.960 1
1 994 . 19 1 1 A 72 72 GLN H H 72 7.910 8.296 -0.386 1
1 995 . 19 1 1 A 72 72 GLN HA H 72 4.154 3.981 0.173 1
1 1002 . 19 1 1 A 72 72 GLN C C 72 178.900 178.584 0.316 1
1 1003 . 19 1 1 A 72 72 GLN CA C 72 58.194 59.117 -0.923 1
1 1004 . 19 1 1 A 72 72 GLN CB C 72 28.056 28.286 -0.230 1
1 1006 . 19 1 1 A 72 72 GLN N N 72 115.960 117.935 -1.975 1
1 1008 . 19 1 1 A 73 73 LYS H H 73 7.841 8.064 -0.223 1
1 1009 . 19 1 1 A 73 73 LYS HA H 73 4.171 4.232 -0.061 1
1 1018 . 19 1 1 A 73 73 LYS C C 73 177.730 177.798 -0.068 1
1 1019 . 19 1 1 A 73 73 LYS CA C 73 57.867 58.233 -0.366 1
1 1020 . 19 1 1 A 73 73 LYS CB C 73 32.277 32.461 -0.184 1
1 1024 . 19 1 1 A 73 73 LYS N N 73 119.027 118.685 0.342 1
1 1025 . 19 1 1 A 74 74 MET H H 74 7.746 7.940 -0.194 1
1 1026 . 19 1 1 A 74 74 MET HA H 74 4.403 4.552 -0.149 1
1 1034 . 19 1 1 A 74 74 MET C C 74 174.416 174.841 -0.425 1
1 1035 . 19 1 1 A 74 74 MET CA C 74 55.194 55.488 -0.294 1
1 1036 . 19 1 1 A 74 74 MET CB C 74 33.366 33.250 0.116 1
1 1039 . 19 1 1 A 74 74 MET N N 74 115.786 116.176 -0.390 1
1 1040 . 19 1 1 A 75 75 GLU H H 75 8.076 7.976 0.100 1
1 1041 . 19 1 1 A 75 75 GLU HA H 75 4.001 3.910 0.091 1
1 1046 . 19 1 1 A 75 75 GLU C C 75 175.130 174.978 0.152 1
1 1047 . 19 1 1 A 75 75 GLU CA C 75 56.722 57.747 -1.025 1
1 1048 . 19 1 1 A 75 75 GLU CB C 75 27.118 27.115 0.003 1
1 1050 . 19 1 1 A 75 75 GLU N N 75 116.249 115.937 0.312 1
1 1051 . 19 1 1 A 76 76 ILE H H 76 7.560 7.804 -0.244 1
1 1052 . 19 1 1 A 76 76 ILE HA H 76 4.428 4.544 -0.116 1
1 1062 . 19 1 1 A 76 76 ILE C C 76 174.529 174.769 -0.240 1
1 1063 . 19 1 1 A 76 76 ILE CA C 76 58.475 59.931 -1.456 1
1 1064 . 19 1 1 A 76 76 ILE CB C 76 40.337 39.630 0.707 1
1 1068 . 19 1 1 A 76 76 ILE N N 76 115.960 119.755 -3.795 1
1 1069 . 19 1 1 A 77 77 ASP H H 77 8.889 8.701 0.188 1
1 1070 . 19 1 1 A 77 77 ASP HA H 77 4.569 4.870 -0.301 1
1 1073 . 19 1 1 A 77 77 ASP C C 77 174.123 176.047 -1.924 1
1 1074 . 19 1 1 A 77 77 ASP CA C 77 54.069 53.526 0.543 1
1 1075 . 19 1 1 A 77 77 ASP CB C 77 40.233 41.219 -0.986 1
1 1076 . 19 1 1 A 77 77 ASP N N 77 126.142 127.212 -1.070 1
1 1077 . 19 1 1 A 78 78 VAL H H 78 7.754 8.985 -1.231 1
1 1078 . 19 1 1 A 78 78 VAL HA H 78 5.192 5.390 -0.198 1
1 1086 . 19 1 1 A 78 78 VAL C C 78 174.968 174.478 0.490 1
1 1087 . 19 1 1 A 78 78 VAL CA C 78 58.804 58.716 0.088 1
1 1088 . 19 1 1 A 78 78 VAL CB C 78 35.293 35.704 -0.411 1
1 1091 . 19 1 1 A 78 78 VAL N N 78 122.844 120.266 2.578 1
1 1092 . 19 1 1 A 79 79 ARG H H 79 8.499 8.998 -0.499 1
1 1093 . 19 1 1 A 79 79 ARG HA H 79 4.712 4.935 -0.223 1
1 1100 . 19 1 1 A 79 79 ARG C C 79 174.221 175.148 -0.927 1
1 1101 . 19 1 1 A 79 79 ARG CA C 79 54.117 54.724 -0.607 1
1 1102 . 19 1 1 A 79 79 ARG CB C 79 31.196 31.705 -0.509 1
1 1105 . 19 1 1 A 79 79 ARG N N 79 125.637 122.297 3.340 1
1 1106 . 19 1 1 A 80 80 THR H H 80 8.416 8.502 -0.086 1
1 1107 . 19 1 1 A 80 80 THR HA H 80 5.332 5.253 0.079 1
1 1112 . 19 1 1 A 80 80 THR C C 80 174.497 173.976 0.521 1
1 1113 . 19 1 1 A 80 80 THR CA C 80 59.694 60.774 -1.080 1
1 1114 . 19 1 1 A 80 80 THR CB C 80 69.772 70.000 -0.228 1
1 1116 . 19 1 1 A 80 80 THR N N 80 118.084 117.316 0.768 1
1 1117 . 19 1 1 A 81 81 ARG H H 81 8.758 8.940 -0.182 1
1 1118 . 19 1 1 A 81 81 ARG HA H 81 4.362 4.749 -0.387 1
1 1126 . 19 1 1 A 81 81 ARG C C 81 173.733 173.856 -0.123 1
1 1127 . 19 1 1 A 81 81 ARG CA C 81 53.273 53.716 -0.443 1
1 1128 . 19 1 1 A 81 81 ARG CB C 81 33.915 33.471 0.444 1
1 1131 . 19 1 1 A 81 81 ARG N N 81 122.844 123.438 -0.594 1
1 1133 . 19 1 1 A 82 82 LYS H H 82 8.721 8.268 0.453 1
1 1134 . 19 1 1 A 82 82 LYS HA H 82 4.701 4.865 -0.164 1
1 1143 . 19 1 1 A 82 82 LYS C C 82 175.667 176.094 -0.427 1
1 1144 . 19 1 1 A 82 82 LYS CA C 82 54.960 55.400 -0.440 1
1 1145 . 19 1 1 A 82 82 LYS CB C 82 32.603 33.761 -1.158 1
1 1149 . 19 1 1 A 82 82 LYS N N 82 124.668 123.159 1.509 1
1 1150 . 19 1 1 A 83 83 VAL H H 83 9.112 9.303 -0.191 1
1 1151 . 19 1 1 A 83 83 VAL HA H 83 4.796 4.939 -0.143 1
1 1159 . 19 1 1 A 83 83 VAL C C 83 174.594 175.420 -0.826 1
1 1160 . 19 1 1 A 83 83 VAL CA C 83 59.413 60.378 -0.965 1
1 1161 . 19 1 1 A 83 83 VAL CB C 83 35.298 34.430 0.868 1
1 1164 . 19 1 1 A 83 83 VAL N N 83 122.381 122.045 0.336 1
1 1165 . 19 1 1 A 84 84 THR H H 84 9.200 8.845 0.355 1
1 1166 . 19 1 1 A 84 84 THR HA H 84 4.579 4.627 -0.048 1
1 1171 . 19 1 1 A 84 84 THR C C 84 173.993 175.044 -1.051 1
1 1172 . 19 1 1 A 84 84 THR CA C 84 60.960 61.403 -0.443 1
1 1173 . 19 1 1 A 84 84 THR CB C 84 70.100 70.008 0.092 1
1 1175 . 19 1 1 A 84 84 THR N N 84 113.183 115.962 -2.779 1
1 1176 . 19 1 1 A 85 85 SER H H 85 7.688 7.949 -0.261 1
1 1177 . 19 1 1 A 85 85 SER HA H 85 5.136 4.954 0.182 1
1 1180 . 19 1 1 A 85 85 SER CA C 85 55.205 55.427 -0.222 1
1 1181 . 19 1 1 A 85 85 SER CB C 85 64.376 65.412 -1.036 1
1 1182 . 19 1 1 A 85 85 SER N N 85 115.555 116.847 -1.292 1
1 1183 . 19 1 1 A 86 86 PRO HA H 86 4.090 4.263 -0.173 1
1 1190 . 19 1 1 A 86 86 PRO C C 86 177.227 177.681 -0.454 1
1 1191 . 19 1 1 A 86 86 PRO CA C 86 65.038 65.738 -0.700 1
1 1192 . 19 1 1 A 86 86 PRO CB C 86 31.711 31.748 -0.037 1
1 1195 . 19 1 1 A 87 87 ASP H H 87 8.131 8.322 -0.191 1
1 1196 . 19 1 1 A 87 87 ASP HA H 87 4.223 4.423 -0.200 1
1 1199 . 19 1 1 A 87 87 ASP C C 87 178.721 178.406 0.315 1
1 1200 . 19 1 1 A 87 87 ASP CA C 87 57.311 56.788 0.523 1
1 1201 . 19 1 1 A 87 87 ASP CB C 87 40.102 40.765 -0.663 1
1 1202 . 19 1 1 A 87 87 ASP N N 87 115.381 117.230 -1.849 1
1 1203 . 19 1 1 A 88 88 GLU H H 88 7.571 8.043 -0.472 1
1 1204 . 19 1 1 A 88 88 GLU HA H 88 3.659 4.163 -0.504 1
1 1209 . 19 1 1 A 88 88 GLU C C 88 177.097 178.784 -1.687 1
1 1210 . 19 1 1 A 88 88 GLU CA C 88 58.729 58.972 -0.243 1
1 1211 . 19 1 1 A 88 88 GLU CB C 88 30.052 29.655 0.397 1
1 1213 . 19 1 1 A 88 88 GLU N N 88 120.009 119.114 0.895 1
1 1214 . 19 1 1 A 89 89 ALA H H 89 7.423 7.600 -0.177 1
1 1215 . 19 1 1 A 89 89 ALA HA H 89 3.900 4.271 -0.371 1
1 1219 . 19 1 1 A 89 89 ALA C C 89 178.267 180.210 -1.943 1
1 1220 . 19 1 1 A 89 89 ALA CA C 89 55.607 55.319 0.288 1
1 1221 . 19 1 1 A 89 89 ALA CB C 89 17.348 18.379 -1.031 1
1 1222 . 19 1 1 A 89 89 ALA N N 89 118.873 122.444 -3.571 1
1 1223 . 19 1 1 A 90 90 LYS H H 90 8.046 7.909 0.137 1
1 1224 . 19 1 1 A 90 90 LYS HA H 90 3.669 4.014 -0.345 1
1 1233 . 19 1 1 A 90 90 LYS C C 90 177.649 179.046 -1.397 1
1 1234 . 19 1 1 A 90 90 LYS CA C 90 60.351 59.789 0.562 1
1 1235 . 19 1 1 A 90 90 LYS CB C 90 32.087 32.364 -0.277 1
1 1239 . 19 1 1 A 90 90 LYS N N 90 114.834 117.425 -2.591 1
1 1240 . 19 1 1 A 91 91 ARG H H 91 7.468 8.277 -0.809 1
1 1241 . 19 1 1 A 91 91 ARG HA H 91 3.887 3.934 -0.047 1
1 1249 . 19 1 1 A 91 91 ARG C C 91 178.998 179.194 -0.196 1
1 1250 . 19 1 1 A 91 91 ARG CA C 91 59.164 59.197 -0.033 1
1 1251 . 19 1 1 A 91 91 ARG CB C 91 29.274 29.745 -0.471 1
1 1254 . 19 1 1 A 91 91 ARG N N 91 119.029 119.476 -0.447 1
1 1256 . 19 1 1 A 92 92 TRP H H 92 8.136 8.371 -0.235 1
1 1257 . 19 1 1 A 92 92 TRP HA H 92 4.818 4.523 0.295 1
1 1266 . 19 1 1 A 92 92 TRP C C 92 179.566 178.984 0.582 1
1 1267 . 19 1 1 A 92 92 TRP CA C 92 58.663 59.026 -0.363 1
1 1268 . 19 1 1 A 92 92 TRP CB C 92 29.790 29.372 0.418 1
1 1274 . 19 1 1 A 92 92 TRP N N 92 118.100 120.152 -2.052 1
1 1276 . 19 1 1 A 93 93 ILE H H 93 8.363 8.501 -0.138 1
1 1277 . 19 1 1 A 93 93 ILE HA H 93 3.544 3.828 -0.284 1
1 1287 . 19 1 1 A 93 93 ILE C C 93 176.820 178.283 -1.463 1
1 1288 . 19 1 1 A 93 93 ILE CA C 93 66.225 65.341 0.884 1
1 1289 . 19 1 1 A 93 93 ILE CB C 93 37.571 37.799 -0.228 1
1 1293 . 19 1 1 A 93 93 ILE N N 93 120.588 120.465 0.123 1
1 1294 . 19 1 1 A 94 94 LYS H H 94 8.264 7.827 0.437 1
1 1295 . 19 1 1 A 94 94 LYS HA H 94 3.865 3.993 -0.128 1
1 1304 . 19 1 1 A 94 94 LYS C C 94 179.258 179.562 -0.304 1
1 1305 . 19 1 1 A 94 94 LYS CA C 94 59.889 59.841 0.048 1
1 1306 . 19 1 1 A 94 94 LYS CB C 94 32.225 32.254 -0.029 1
1 1310 . 19 1 1 A 94 94 LYS N N 94 121.687 121.007 0.680 1
1 1311 . 19 1 1 A 95 95 GLU H H 95 8.360 8.297 0.063 1
1 1312 . 19 1 1 A 95 95 GLU HA H 95 4.023 4.100 -0.077 1
1 1317 . 19 1 1 A 95 95 GLU C C 95 178.884 179.242 -0.358 1
1 1318 . 19 1 1 A 95 95 GLU CA C 95 59.366 58.981 0.385 1
1 1319 . 19 1 1 A 95 95 GLU CB C 95 29.508 29.591 -0.083 1
1 1321 . 19 1 1 A 95 95 GLU N N 95 118.505 118.563 -0.058 1
1 1322 . 19 1 1 A 96 96 PHE H H 96 8.212 8.510 -0.298 1
1 1323 . 19 1 1 A 96 96 PHE HA H 96 4.512 4.196 0.316 1
1 1331 . 19 1 1 A 96 96 PHE C C 96 176.820 177.910 -1.090 1
1 1332 . 19 1 1 A 96 96 PHE CA C 96 59.608 61.463 -1.855 1
1 1333 . 19 1 1 A 96 96 PHE CB C 96 40.431 38.948 1.483 1
1 1339 . 19 1 1 A 96 96 PHE N N 96 120.369 122.783 -2.414 1
1 1340 . 19 1 1 A 97 97 SER H H 97 8.216 7.895 0.321 1
1 1341 . 19 1 1 A 97 97 SER HA H 97 3.816 4.143 -0.327 1
1 1344 . 19 1 1 A 97 97 SER C C 97 175.618 177.190 -1.572 1
1 1345 . 19 1 1 A 97 97 SER CA C 97 60.492 61.155 -0.663 1
1 1346 . 19 1 1 A 97 97 SER CB C 97 63.022 63.154 -0.132 1
1 1347 . 19 1 1 A 97 97 SER N N 97 111.969 114.053 -2.084 1
1 1348 . 19 1 1 A 98 98 GLU H H 98 7.655 8.281 -0.626 1
1 1349 . 19 1 1 A 98 98 GLU HA H 98 4.187 3.998 0.189 1
1 1354 . 19 1 1 A 98 98 GLU C C 98 177.698 179.405 -1.707 1
1 1355 . 19 1 1 A 98 98 GLU CA C 98 57.069 59.549 -2.480 1
1 1356 . 19 1 1 A 98 98 GLU CB C 98 29.321 29.166 0.155 1
1 1358 . 19 1 1 A 98 98 GLU N N 98 120.588 121.394 -0.806 1
1 1359 . 19 1 1 A 99 99 GLU H H 99 7.794 7.826 -0.032 1
1 1360 . 19 1 1 A 99 99 GLU HA H 99 4.123 4.042 0.081 1
1 1365 . 19 1 1 A 99 99 GLU C C 99 177.665 177.557 0.108 1
1 1366 . 19 1 1 A 99 99 GLU CA C 99 57.304 57.755 -0.451 1
1 1367 . 19 1 1 A 99 99 GLU CB C 99 29.368 29.834 -0.466 1
1 1369 . 19 1 1 A 99 99 GLU N N 99 120.067 118.940 1.127 1
1 1370 . 19 1 1 A 100 100 GLY H H 100 8.138 7.676 0.462 1
1 1371 . 19 1 1 A 100 100 GLY HA2 H 100 3.865 3.683 0.182 1
1 1372 . 19 1 1 A 100 100 GLY HA3 H 100 3.715 3.780 -0.065 1
1 1373 . 19 1 1 A 100 100 GLY C C 100 174.464 175.471 -1.007 1
1 1374 . 19 1 1 A 100 100 GLY CA C 100 45.305 46.919 -1.614 1
1 1375 . 19 1 1 A 100 100 GLY N N 100 107.802 108.132 -0.330 1
1 1376 . 19 1 1 A 101 101 GLY H H 101 8.023 8.753 -0.730 1
1 1377 . 19 1 1 A 101 101 GLY HA2 H 101 3.865 3.800 0.065 1
1 1378 . 19 1 1 A 101 101 GLY HA3 H 101 3.892 3.817 0.075 1
1 1379 . 19 1 1 A 101 101 GLY C C 101 174.204 175.101 -0.897 1
1 1380 . 19 1 1 A 101 101 GLY CA C 101 45.036 47.177 -2.141 1
1 1381 . 19 1 1 A 101 101 GLY N N 101 108.032 114.357 -6.325 1
1 1382 . 19 1 1 A 102 102 SER H H 102 8.059 8.084 -0.025 1
1 1383 . 19 1 1 A 102 102 SER HA H 102 4.380 4.177 0.203 1
1 1386 . 19 1 1 A 102 102 SER C C 102 174.627 174.446 0.181 1
1 1387 . 19 1 1 A 102 102 SER CA C 102 58.194 58.896 -0.702 1
1 1388 . 19 1 1 A 102 102 SER CB C 102 63.538 60.735 2.803 1
1 1389 . 19 1 1 A 102 102 SER N N 102 115.266 113.821 1.445 1
1 1390 . 19 1 1 A 103 103 LEU H H 103 8.287 7.914 0.373 1
1 1391 . 19 1 1 A 103 103 LEU HA H 103 4.301 4.230 0.071 1
1 1401 . 19 1 1 A 103 103 LEU C C 103 177.292 176.862 0.430 1
1 1402 . 19 1 1 A 103 103 LEU CA C 103 55.007 55.655 -0.648 1
1 1403 . 19 1 1 A 103 103 LEU CB C 103 42.023 42.392 -0.369 1
1 1407 . 19 1 1 A 103 103 LEU N N 103 123.596 119.986 3.610 1
1 1408 . 19 1 1 A 104 104 GLU H H 104 8.216 7.680 0.536 1
1 1409 . 19 1 1 A 104 104 GLU HA H 104 4.126 4.420 -0.294 1
1 1414 . 19 1 1 A 104 104 GLU CA C 104 56.518 54.256 2.262 1
1 1415 . 19 1 1 A 104 104 GLU CB C 104 29.837 30.621 -0.784 1
1 1417 . 19 1 1 A 104 104 GLU N N 104 120.510 117.281 3.229 1
1 1418 . 19 1 1 A 105 105 HIS HA H 105 4.593 4.418 0.175 1
1 1421 . 19 1 1 A 105 105 HIS C C 105 173.766 175.219 -1.453 1
1 1422 . 19 1 1 A 105 105 HIS CA C 105 55.536 56.214 -0.678 1
1 1423 . 19 1 1 A 105 105 HIS CB C 105 30.001 29.286 0.715 1
1 1424 . 19 1 1 A 106 106 HIS H H 106 8.154 7.605 0.549 1
1 1425 . 19 1 1 A 106 106 HIS HA H 106 4.407 4.456 -0.049 1
1 1428 . 19 1 1 A 106 106 HIS CA C 106 56.920 55.119 1.801 1
1 1429 . 19 1 1 A 106 106 HIS CB C 106 30.001 28.480 1.521 1
1 14 . 20 1 1 A 2 2 LEU H H 2 8.509 9.055 -0.546 1
1 15 . 20 1 1 A 2 2 LEU HA H 2 4.463 5.272 -0.809 1
1 25 . 20 1 1 A 2 2 LEU C C 2 173.944 176.222 -2.278 1
1 26 . 20 1 1 A 2 2 LEU CA C 2 54.471 53.416 1.055 1
1 27 . 20 1 1 A 2 2 LEU CB C 2 43.595 43.245 0.350 1
1 31 . 20 1 1 A 2 2 LEU N N 2 127.160 126.544 0.616 1
1 32 . 20 1 1 A 3 3 LEU H H 3 7.844 8.929 -1.085 1
1 33 . 20 1 1 A 3 3 LEU HA H 3 5.128 5.421 -0.293 1
1 43 . 20 1 1 A 3 3 LEU C C 3 175.423 175.311 0.112 1
1 44 . 20 1 1 A 3 3 LEU CA C 3 53.566 53.112 0.454 1
1 45 . 20 1 1 A 3 3 LEU CB C 3 44.039 44.952 -0.913 1
1 49 . 20 1 1 A 3 3 LEU N N 3 122.555 124.274 -1.719 1
1 50 . 20 1 1 A 4 4 TYR H H 4 8.360 9.319 -0.959 1
1 51 . 20 1 1 A 4 4 TYR HA H 4 5.143 5.181 -0.038 1
1 58 . 20 1 1 A 4 4 TYR C C 4 174.481 175.022 -0.541 1
1 59 . 20 1 1 A 4 4 TYR CA C 4 56.577 55.967 0.610 1
1 60 . 20 1 1 A 4 4 TYR CB C 4 43.840 42.369 1.471 1
1 65 . 20 1 1 A 4 4 TYR N N 4 119.315 123.438 -4.123 1
1 66 . 20 1 1 A 5 5 VAL H H 5 8.918 8.761 0.157 1
1 67 . 20 1 1 A 5 5 VAL HA H 5 5.106 4.686 0.420 1
1 75 . 20 1 1 A 5 5 VAL C C 5 174.042 174.772 -0.730 1
1 76 . 20 1 1 A 5 5 VAL CA C 5 59.852 60.296 -0.444 1
1 77 . 20 1 1 A 5 5 VAL CB C 5 33.816 35.268 -1.452 1
1 80 . 20 1 1 A 5 5 VAL N N 5 119.952 120.247 -0.295 1
1 81 . 20 1 1 A 6 6 LEU H H 6 9.315 9.240 0.075 1
1 82 . 20 1 1 A 6 6 LEU HA H 6 5.466 5.429 0.037 1
1 92 . 20 1 1 A 6 6 LEU C C 6 175.049 175.050 -0.001 1
1 93 . 20 1 1 A 6 6 LEU CA C 6 52.090 53.236 -1.146 1
1 94 . 20 1 1 A 6 6 LEU CB C 6 44.103 45.331 -1.228 1
1 98 . 20 1 1 A 6 6 LEU N N 6 126.917 126.229 0.688 1
1 99 . 20 1 1 A 7 7 ILE H H 7 8.458 9.023 -0.565 1
1 100 . 20 1 1 A 7 7 ILE HA H 7 5.131 5.149 -0.018 1
1 110 . 20 1 1 A 7 7 ILE C C 7 173.213 173.584 -0.371 1
1 111 . 20 1 1 A 7 7 ILE CA C 7 58.463 59.917 -1.454 1
1 112 . 20 1 1 A 7 7 ILE CB C 7 41.020 41.469 -0.449 1
1 116 . 20 1 1 A 7 7 ILE N N 7 119.778 125.337 -5.559 1
1 117 . 20 1 1 A 8 8 ILE H H 8 8.797 9.231 -0.434 1
1 118 . 20 1 1 A 8 8 ILE HA H 8 4.611 4.856 -0.245 1
1 128 . 20 1 1 A 8 8 ILE C C 8 174.611 174.834 -0.223 1
1 129 . 20 1 1 A 8 8 ILE CA C 8 60.227 60.361 -0.134 1
1 130 . 20 1 1 A 8 8 ILE CB C 8 37.665 37.961 -0.296 1
1 134 . 20 1 1 A 8 8 ILE N N 8 128.919 130.907 -1.988 1
1 135 . 20 1 1 A 9 9 SER H H 9 7.811 8.752 -0.941 1
1 136 . 20 1 1 A 9 9 SER HA H 9 4.429 5.020 -0.591 1
1 140 . 20 1 1 A 9 9 SER C C 9 172.937 173.283 -0.346 1
1 141 . 20 1 1 A 9 9 SER CA C 9 58.241 56.954 1.287 1
1 142 . 20 1 1 A 9 9 SER CB C 9 64.261 64.346 -0.085 1
1 143 . 20 1 1 A 9 9 SER N N 9 116.365 121.509 -5.144 1
1 144 . 20 1 1 A 10 10 ASN H H 10 8.641 8.654 -0.013 1
1 145 . 20 1 1 A 10 10 ASN HA H 10 4.938 4.812 0.126 1
1 150 . 20 1 1 A 10 10 ASN C C 10 174.497 175.624 -1.127 1
1 151 . 20 1 1 A 10 10 ASN CA C 10 52.221 55.003 -2.782 1
1 152 . 20 1 1 A 10 10 ASN CB C 10 39.128 39.943 -0.815 1
1 153 . 20 1 1 A 10 10 ASN N N 10 122.612 121.495 1.117 1
1 155 . 20 1 1 A 11 11 ASP H H 11 8.673 7.049 1.624 1
1 156 . 20 1 1 A 11 11 ASP HA H 11 4.596 4.714 -0.118 1
1 159 . 20 1 1 A 11 11 ASP C C 11 175.342 176.189 -0.847 1
1 160 . 20 1 1 A 11 11 ASP CA C 11 53.233 54.048 -0.815 1
1 161 . 20 1 1 A 11 11 ASP CB C 11 40.965 40.428 0.537 1
1 162 . 20 1 1 A 11 11 ASP N N 11 122.717 118.824 3.893 1
1 163 . 20 1 1 A 12 12 LYS H H 12 8.562 8.563 -0.001 1
1 164 . 20 1 1 A 12 12 LYS HA H 12 3.854 4.030 -0.176 1
1 173 . 20 1 1 A 12 12 LYS C C 12 178.754 178.283 0.471 1
1 174 . 20 1 1 A 12 12 LYS CA C 12 59.581 60.119 -0.538 1
1 175 . 20 1 1 A 12 12 LYS CB C 12 32.378 32.084 0.294 1
1 179 . 20 1 1 A 12 12 LYS N N 12 125.737 125.674 0.063 1
1 180 . 20 1 1 A 13 13 LYS H H 13 8.075 7.658 0.417 1
1 181 . 20 1 1 A 13 13 LYS HA H 13 4.154 4.074 0.080 1
1 190 . 20 1 1 A 13 13 LYS C C 13 178.315 179.134 -0.819 1
1 191 . 20 1 1 A 13 13 LYS CA C 13 58.532 58.957 -0.425 1
1 192 . 20 1 1 A 13 13 LYS CB C 13 31.452 32.563 -1.111 1
1 196 . 20 1 1 A 13 13 LYS N N 13 119.604 119.878 -0.274 1
1 197 . 20 1 1 A 14 14 LEU H H 14 7.552 7.869 -0.317 1
1 198 . 20 1 1 A 14 14 LEU HA H 14 3.682 4.053 -0.371 1
1 208 . 20 1 1 A 14 14 LEU C C 14 178.429 178.328 0.101 1
1 209 . 20 1 1 A 14 14 LEU CA C 14 58.999 58.150 0.849 1
1 210 . 20 1 1 A 14 14 LEU CB C 14 41.228 41.381 -0.153 1
1 214 . 20 1 1 A 14 14 LEU N N 14 122.266 121.114 1.152 1
1 215 . 20 1 1 A 15 15 ILE H H 15 8.074 8.083 -0.009 1
1 216 . 20 1 1 A 15 15 ILE HA H 15 3.264 3.446 -0.182 1
1 226 . 20 1 1 A 15 15 ILE C C 15 177.000 177.791 -0.791 1
1 227 . 20 1 1 A 15 15 ILE CA C 15 65.939 65.660 0.279 1
1 228 . 20 1 1 A 15 15 ILE CB C 15 37.983 37.991 -0.008 1
1 232 . 20 1 1 A 15 15 ILE N N 15 118.214 119.514 -1.300 1
1 233 . 20 1 1 A 16 16 GLU H H 16 8.016 8.379 -0.363 1
1 234 . 20 1 1 A 16 16 GLU HA H 16 4.045 3.929 0.116 1
1 239 . 20 1 1 A 16 16 GLU C C 16 179.388 179.684 -0.296 1
1 240 . 20 1 1 A 16 16 GLU CA C 16 59.032 59.849 -0.817 1
1 241 . 20 1 1 A 16 16 GLU CB C 16 29.200 29.523 -0.323 1
1 243 . 20 1 1 A 16 16 GLU N N 16 118.484 118.849 -0.365 1
1 244 . 20 1 1 A 17 17 GLU H H 17 8.063 8.228 -0.165 1
1 245 . 20 1 1 A 17 17 GLU HA H 17 4.053 4.052 0.001 1
1 250 . 20 1 1 A 17 17 GLU C C 17 179.306 179.222 0.084 1
1 251 . 20 1 1 A 17 17 GLU CA C 17 58.636 59.260 -0.624 1
1 252 . 20 1 1 A 17 17 GLU CB C 17 29.011 29.407 -0.396 1
1 254 . 20 1 1 A 17 17 GLU N N 17 118.100 120.372 -2.272 1
1 255 . 20 1 1 A 18 18 ALA H H 18 8.655 7.980 0.675 1
1 256 . 20 1 1 A 18 18 ALA HA H 18 3.775 4.005 -0.230 1
1 260 . 20 1 1 A 18 18 ALA C C 18 178.559 179.823 -1.264 1
1 261 . 20 1 1 A 18 18 ALA CA C 18 54.960 55.486 -0.526 1
1 262 . 20 1 1 A 18 18 ALA CB C 18 17.960 18.253 -0.293 1
1 263 . 20 1 1 A 18 18 ALA N N 18 122.439 122.590 -0.151 1
1 264 . 20 1 1 A 19 19 ARG H H 19 8.900 8.185 0.715 1
1 265 . 20 1 1 A 19 19 ARG HA H 19 3.809 4.070 -0.261 1
1 273 . 20 1 1 A 19 19 ARG C C 19 178.721 179.050 -0.329 1
1 274 . 20 1 1 A 19 19 ARG CA C 19 59.976 59.756 0.220 1
1 275 . 20 1 1 A 19 19 ARG CB C 19 29.572 29.962 -0.390 1
1 278 . 20 1 1 A 19 19 ARG N N 19 118.563 117.759 0.804 1
1 280 . 20 1 1 A 20 20 LYS H H 20 7.792 7.981 -0.189 1
1 281 . 20 1 1 A 20 20 LYS HA H 20 4.052 4.048 0.004 1
1 290 . 20 1 1 A 20 20 LYS C C 20 179.648 179.603 0.045 1
1 291 . 20 1 1 A 20 20 LYS CA C 20 59.296 58.906 0.390 1
1 292 . 20 1 1 A 20 20 LYS CB C 20 32.216 31.912 0.304 1
1 296 . 20 1 1 A 20 20 LYS N N 20 118.638 119.574 -0.936 1
1 297 . 20 1 1 A 21 21 MET H H 21 7.684 7.941 -0.257 1
1 298 . 20 1 1 A 21 21 MET HA H 21 4.411 4.111 0.300 1
1 306 . 20 1 1 A 21 21 MET C C 21 177.909 177.964 -0.055 1
1 307 . 20 1 1 A 21 21 MET CA C 21 57.009 59.350 -2.341 1
1 308 . 20 1 1 A 21 21 MET CB C 21 32.028 32.742 -0.714 1
1 311 . 20 1 1 A 21 21 MET N N 21 118.100 118.616 -0.516 1
1 312 . 20 1 1 A 22 22 ALA H H 22 8.815 8.396 0.419 1
1 313 . 20 1 1 A 22 22 ALA HA H 22 3.826 3.893 -0.067 1
1 317 . 20 1 1 A 22 22 ALA C C 22 178.835 179.945 -1.110 1
1 318 . 20 1 1 A 22 22 ALA CA C 22 55.427 55.552 -0.125 1
1 319 . 20 1 1 A 22 22 ALA CB C 22 18.059 18.369 -0.310 1
1 320 . 20 1 1 A 22 22 ALA N N 22 122.150 121.490 0.660 1
1 321 . 20 1 1 A 23 23 GLU H H 23 8.276 8.340 -0.064 1
1 322 . 20 1 1 A 23 23 GLU HA H 23 4.146 3.958 0.188 1
1 327 . 20 1 1 A 23 23 GLU C C 23 180.151 179.166 0.985 1
1 328 . 20 1 1 A 23 23 GLU CA C 23 58.999 59.523 -0.524 1
1 329 . 20 1 1 A 23 23 GLU CB C 23 29.160 29.266 -0.106 1
1 331 . 20 1 1 A 23 23 GLU N N 23 117.001 117.786 -0.785 1
1 332 . 20 1 1 A 24 24 LYS H H 24 7.573 7.591 -0.018 1
1 333 . 20 1 1 A 24 24 LYS HA H 24 4.101 4.025 0.076 1
1 342 . 20 1 1 A 24 24 LYS C C 24 177.145 178.816 -1.671 1
1 343 . 20 1 1 A 24 24 LYS CA C 24 58.261 59.245 -0.984 1
1 344 . 20 1 1 A 24 24 LYS CB C 24 32.079 32.104 -0.025 1
1 348 . 20 1 1 A 24 24 LYS N N 24 119.960 119.598 0.362 1
1 349 . 20 1 1 A 25 25 ALA H H 25 7.710 7.695 0.015 1
1 350 . 20 1 1 A 25 25 ALA HA H 25 4.413 4.337 0.076 1
1 354 . 20 1 1 A 25 25 ALA C C 25 175.325 176.494 -1.169 1
1 355 . 20 1 1 A 25 25 ALA CA C 25 51.208 52.112 -0.904 1
1 356 . 20 1 1 A 25 25 ALA CB C 25 18.520 19.447 -0.927 1
1 357 . 20 1 1 A 25 25 ALA N N 25 119.257 118.463 0.794 1
1 358 . 20 1 1 A 26 26 ASN H H 26 7.840 7.801 0.039 1
1 359 . 20 1 1 A 26 26 ASN HA H 26 4.357 4.304 0.053 1
1 364 . 20 1 1 A 26 26 ASN C C 26 173.587 174.155 -0.568 1
1 365 . 20 1 1 A 26 26 ASN CA C 26 54.307 54.518 -0.211 1
1 366 . 20 1 1 A 26 26 ASN CB C 26 36.972 36.905 0.067 1
1 367 . 20 1 1 A 26 26 ASN N N 26 115.266 113.557 1.709 1
1 369 . 20 1 1 A 27 27 LEU H H 27 8.241 7.920 0.321 1
1 370 . 20 1 1 A 27 27 LEU HA H 27 4.652 4.372 0.280 1
1 380 . 20 1 1 A 27 27 LEU C C 27 175.894 175.831 0.063 1
1 381 . 20 1 1 A 27 27 LEU CA C 27 52.923 53.592 -0.669 1
1 382 . 20 1 1 A 27 27 LEU CB C 27 44.090 42.564 1.526 1
1 386 . 20 1 1 A 27 27 LEU N N 27 116.828 119.428 -2.600 1
1 387 . 20 1 1 A 28 28 GLU H H 28 7.798 8.458 -0.660 1
1 388 . 20 1 1 A 28 28 GLU HA H 28 4.310 4.527 -0.217 1
1 393 . 20 1 1 A 28 28 GLU C C 28 173.944 175.489 -1.545 1
1 394 . 20 1 1 A 28 28 GLU CA C 28 55.460 55.956 -0.496 1
1 395 . 20 1 1 A 28 28 GLU CB C 28 30.512 29.943 0.569 1
1 397 . 20 1 1 A 28 28 GLU N N 28 121.340 124.854 -3.514 1
1 398 . 20 1 1 A 29 29 LEU H H 29 8.451 8.849 -0.398 1
1 399 . 20 1 1 A 29 29 LEU HA H 29 5.662 5.057 0.605 1
1 409 . 20 1 1 A 29 29 LEU C C 29 176.902 174.635 2.267 1
1 410 . 20 1 1 A 29 29 LEU CA C 29 53.186 54.087 -0.901 1
1 411 . 20 1 1 A 29 29 LEU CB C 29 44.914 43.628 1.286 1
1 415 . 20 1 1 A 29 29 LEU N N 29 126.547 129.582 -3.035 1
1 416 . 20 1 1 A 30 30 ARG H H 30 9.094 9.174 -0.080 1
1 417 . 20 1 1 A 30 30 ARG HA H 30 4.910 4.626 0.284 1
1 425 . 20 1 1 A 30 30 ARG C C 30 175.147 176.087 -0.940 1
1 426 . 20 1 1 A 30 30 ARG CA C 30 53.417 54.673 -1.256 1
1 427 . 20 1 1 A 30 30 ARG CB C 30 32.555 32.105 0.450 1
1 430 . 20 1 1 A 30 30 ARG N N 30 125.043 126.730 -1.687 1
1 432 . 20 1 1 A 31 31 THR H H 31 8.496 8.367 0.129 1
1 433 . 20 1 1 A 31 31 THR HA H 31 4.888 4.759 0.129 1
1 438 . 20 1 1 A 31 31 THR C C 31 173.961 174.247 -0.286 1
1 439 . 20 1 1 A 31 31 THR CA C 31 60.445 60.950 -0.505 1
1 440 . 20 1 1 A 31 31 THR CB C 31 69.492 69.861 -0.369 1
1 442 . 20 1 1 A 31 31 THR N N 31 114.745 115.314 -0.569 1
1 443 . 20 1 1 A 32 32 VAL H H 32 8.480 9.320 -0.840 1
1 444 . 20 1 1 A 32 32 VAL HA H 32 4.411 4.738 -0.327 1
1 452 . 20 1 1 A 32 32 VAL C C 32 175.082 175.570 -0.488 1
1 453 . 20 1 1 A 32 32 VAL CA C 32 60.946 61.153 -0.207 1
1 454 . 20 1 1 A 32 32 VAL CB C 32 34.487 34.262 0.225 1
1 457 . 20 1 1 A 32 32 VAL N N 32 122.324 125.967 -3.643 1
1 458 . 20 1 1 A 33 33 LYS H H 33 9.304 9.000 0.304 1
1 459 . 20 1 1 A 33 33 LYS HA H 33 4.534 4.626 -0.092 1
1 468 . 20 1 1 A 33 33 LYS C C 33 176.740 176.379 0.361 1
1 469 . 20 1 1 A 33 33 LYS CA C 33 56.846 57.028 -0.182 1
1 470 . 20 1 1 A 33 33 LYS CB C 33 34.355 35.185 -0.830 1
1 474 . 20 1 1 A 33 33 LYS N N 33 123.654 123.366 0.288 1
1 475 . 20 1 1 A 34 34 THR H H 34 7.245 7.647 -0.402 1
1 476 . 20 1 1 A 34 34 THR HA H 34 4.780 4.674 0.106 1
1 481 . 20 1 1 A 34 34 THR C C 34 174.529 175.429 -0.900 1
1 482 . 20 1 1 A 34 34 THR CA C 34 58.859 59.299 -0.440 1
1 483 . 20 1 1 A 34 34 THR CB C 34 73.023 71.901 1.122 1
1 485 . 20 1 1 A 34 34 THR N N 34 106.300 111.735 -5.435 1
1 486 . 20 1 1 A 35 35 GLU H H 35 9.174 9.018 0.156 1
1 487 . 20 1 1 A 35 35 GLU HA H 35 3.886 3.977 -0.091 1
1 492 . 20 1 1 A 35 35 GLU C C 35 177.714 177.506 0.208 1
1 493 . 20 1 1 A 35 35 GLU CA C 35 59.233 59.525 -0.292 1
1 494 . 20 1 1 A 35 35 GLU CB C 35 29.377 29.467 -0.090 1
1 496 . 20 1 1 A 35 35 GLU N N 35 121.919 122.053 -0.134 1
1 497 . 20 1 1 A 36 36 ASP H H 36 8.185 8.250 -0.065 1
1 498 . 20 1 1 A 36 36 ASP HA H 36 4.289 4.320 -0.031 1
1 501 . 20 1 1 A 36 36 ASP C C 36 178.348 178.443 -0.095 1
1 502 . 20 1 1 A 36 36 ASP CA C 36 56.962 57.650 -0.688 1
1 503 . 20 1 1 A 36 36 ASP CB C 36 40.214 41.224 -1.010 1
1 504 . 20 1 1 A 36 36 ASP N N 36 118.332 119.900 -1.568 1
1 505 . 20 1 1 A 37 37 GLU H H 37 7.741 8.041 -0.300 1
1 506 . 20 1 1 A 37 37 GLU HA H 37 3.708 3.887 -0.179 1
1 511 . 20 1 1 A 37 37 GLU C C 37 177.324 178.911 -1.587 1
1 512 . 20 1 1 A 37 37 GLU CA C 37 58.698 59.209 -0.511 1
1 513 . 20 1 1 A 37 37 GLU CB C 37 30.199 29.371 0.828 1
1 515 . 20 1 1 A 37 37 GLU N N 37 120.704 119.064 1.640 1
1 516 . 20 1 1 A 38 38 LEU H H 38 7.531 8.177 -0.646 1
1 517 . 20 1 1 A 38 38 LEU HA H 38 3.873 4.172 -0.299 1
1 527 . 20 1 1 A 38 38 LEU C C 38 177.357 178.567 -1.210 1
1 528 . 20 1 1 A 38 38 LEU CA C 38 58.305 58.389 -0.084 1
1 529 . 20 1 1 A 38 38 LEU CB C 38 40.837 41.737 -0.900 1
1 533 . 20 1 1 A 38 38 LEU N N 38 119.200 121.857 -2.657 1
1 534 . 20 1 1 A 39 39 LYS H H 39 8.083 7.907 0.176 1
1 535 . 20 1 1 A 39 39 LYS HA H 39 3.608 3.922 -0.314 1
1 544 . 20 1 1 A 39 39 LYS C C 39 177.373 178.811 -1.438 1
1 545 . 20 1 1 A 39 39 LYS CA C 39 60.290 59.590 0.700 1
1 546 . 20 1 1 A 39 39 LYS CB C 39 32.178 32.156 0.022 1
1 550 . 20 1 1 A 39 39 LYS N N 39 116.943 118.877 -1.934 1
1 551 . 20 1 1 A 40 40 LYS H H 40 7.632 8.083 -0.451 1
1 552 . 20 1 1 A 40 40 LYS HA H 40 3.864 3.875 -0.011 1
1 561 . 20 1 1 A 40 40 LYS C C 40 179.566 178.403 1.163 1
1 562 . 20 1 1 A 40 40 LYS CA C 40 58.993 58.976 0.017 1
1 563 . 20 1 1 A 40 40 LYS CB C 40 31.758 31.970 -0.212 1
1 567 . 20 1 1 A 40 40 LYS N N 40 118.274 119.020 -0.746 1
1 568 . 20 1 1 A 41 41 TYR H H 41 7.823 7.633 0.190 1
1 569 . 20 1 1 A 41 41 TYR HA H 41 3.926 3.983 -0.057 1
1 576 . 20 1 1 A 41 41 TYR C C 41 176.625 177.754 -1.129 1
1 577 . 20 1 1 A 41 41 TYR CA C 41 59.757 60.818 -1.061 1
1 578 . 20 1 1 A 41 41 TYR CB C 41 36.901 37.818 -0.917 1
1 583 . 20 1 1 A 41 41 TYR N N 41 117.811 118.942 -1.131 1
1 584 . 20 1 1 A 42 42 LEU H H 42 7.964 8.038 -0.074 1
1 585 . 20 1 1 A 42 42 LEU HA H 42 3.704 3.992 -0.288 1
1 595 . 20 1 1 A 42 42 LEU C C 42 178.396 179.208 -0.812 1
1 596 . 20 1 1 A 42 42 LEU CA C 42 58.237 57.918 0.319 1
1 597 . 20 1 1 A 42 42 LEU CB C 42 40.507 41.341 -0.834 1
1 601 . 20 1 1 A 42 42 LEU N N 42 115.960 120.159 -4.199 1
1 602 . 20 1 1 A 43 43 GLU H H 43 8.193 8.349 -0.156 1
1 603 . 20 1 1 A 43 43 GLU HA H 43 3.882 3.876 0.006 1
1 608 . 20 1 1 A 43 43 GLU C C 43 179.193 179.059 0.134 1
1 609 . 20 1 1 A 43 43 GLU CA C 43 59.122 59.838 -0.716 1
1 610 . 20 1 1 A 43 43 GLU CB C 43 29.244 29.188 0.056 1
1 612 . 20 1 1 A 43 43 GLU N N 43 117.175 117.800 -0.625 1
1 613 . 20 1 1 A 44 44 GLU H H 44 7.601 7.558 0.043 1
1 614 . 20 1 1 A 44 44 GLU HA H 44 3.936 3.957 -0.021 1
1 619 . 20 1 1 A 44 44 GLU C C 44 179.875 178.985 0.890 1
1 620 . 20 1 1 A 44 44 GLU CA C 44 58.867 59.293 -0.426 1
1 621 . 20 1 1 A 44 44 GLU CB C 44 28.648 29.302 -0.654 1
1 623 . 20 1 1 A 44 44 GLU N N 44 120.472 119.454 1.018 1
1 624 . 20 1 1 A 45 45 PHE H H 45 8.260 7.880 0.380 1
1 625 . 20 1 1 A 45 45 PHE HA H 45 4.520 4.123 0.397 1
1 633 . 20 1 1 A 45 45 PHE C C 45 177.942 178.363 -0.421 1
1 634 . 20 1 1 A 45 45 PHE CA C 45 55.945 60.998 -5.053 1
1 635 . 20 1 1 A 45 45 PHE CB C 45 36.680 37.992 -1.312 1
1 641 . 20 1 1 A 45 45 PHE N N 45 119.272 119.305 -0.033 1
1 642 . 20 1 1 A 46 46 ARG H H 46 8.023 7.990 0.033 1
1 643 . 20 1 1 A 46 46 ARG HA H 46 4.074 3.987 0.087 1
1 651 . 20 1 1 A 46 46 ARG C C 46 177.617 178.957 -1.340 1
1 652 . 20 1 1 A 46 46 ARG CA C 46 58.194 59.700 -1.506 1
1 653 . 20 1 1 A 46 46 ARG CB C 46 29.737 30.038 -0.301 1
1 656 . 20 1 1 A 46 46 ARG N N 46 118.136 120.080 -1.944 1
1 658 . 20 1 1 A 47 47 LYS H H 47 7.470 7.812 -0.342 1
1 659 . 20 1 1 A 47 47 LYS HA H 47 4.143 4.103 0.040 1
1 668 . 20 1 1 A 47 47 LYS C C 47 177.324 178.082 -0.758 1
1 669 . 20 1 1 A 47 47 LYS CA C 47 57.726 59.765 -2.039 1
1 670 . 20 1 1 A 47 47 LYS CB C 47 32.409 32.301 0.108 1
1 674 . 20 1 1 A 47 47 LYS N N 47 116.943 119.980 -3.037 1
1 675 . 20 1 1 A 48 48 GLU H H 48 7.615 7.647 -0.032 1
1 676 . 20 1 1 A 48 48 GLU HA H 48 4.428 4.719 -0.291 1
1 681 . 20 1 1 A 48 48 GLU C C 48 176.869 177.105 -0.236 1
1 682 . 20 1 1 A 48 48 GLU CA C 48 55.945 56.101 -0.156 1
1 683 . 20 1 1 A 48 48 GLU CB C 48 29.696 30.334 -0.638 1
1 685 . 20 1 1 A 48 48 GLU N N 48 118.852 116.274 2.578 1
1 686 . 20 1 1 A 49 49 SER H H 49 7.725 7.784 -0.059 1
1 687 . 20 1 1 A 49 49 SER HA H 49 4.244 4.340 -0.096 1
1 690 . 20 1 1 A 49 49 SER C C 49 174.838 176.752 -1.914 1
1 691 . 20 1 1 A 49 49 SER CA C 49 59.366 60.533 -1.167 1
1 692 . 20 1 1 A 49 49 SER CB C 49 63.116 62.798 0.318 1
1 693 . 20 1 1 A 49 49 SER N N 49 114.224 114.938 -0.714 1
1 694 . 20 1 1 A 50 50 GLN H H 50 8.548 7.891 0.657 1
1 695 . 20 1 1 A 50 50 GLN HA H 50 4.398 4.214 0.184 1
1 702 . 20 1 1 A 50 50 GLN C C 50 175.732 176.759 -1.027 1
1 703 . 20 1 1 A 50 50 GLN CA C 50 56.272 58.265 -1.993 1
1 704 . 20 1 1 A 50 50 GLN CB C 50 28.946 29.040 -0.094 1
1 706 . 20 1 1 A 50 50 GLN N N 50 120.125 119.789 0.336 1
1 708 . 20 1 1 A 51 51 ASN H H 51 8.534 7.729 0.805 1
1 709 . 20 1 1 A 51 51 ASN HA H 51 4.980 4.943 0.037 1
1 714 . 20 1 1 A 51 51 ASN C C 51 173.717 173.900 -0.183 1
1 715 . 20 1 1 A 51 51 ASN CA C 51 52.804 52.575 0.229 1
1 716 . 20 1 1 A 51 51 ASN CB C 51 39.583 39.509 0.074 1
1 717 . 20 1 1 A 51 51 ASN N N 51 118.158 115.005 3.153 1
1 719 . 20 1 1 A 52 52 ILE H H 52 7.492 7.512 -0.020 1
1 720 . 20 1 1 A 52 52 ILE HA H 52 5.338 5.259 0.079 1
1 730 . 20 1 1 A 52 52 ILE C C 52 175.049 174.265 0.784 1
1 731 . 20 1 1 A 52 52 ILE CA C 52 59.364 59.895 -0.531 1
1 732 . 20 1 1 A 52 52 ILE CB C 52 42.163 41.009 1.154 1
1 736 . 20 1 1 A 52 52 ILE N N 52 117.927 121.372 -3.445 1
1 737 . 20 1 1 A 53 53 LYS H H 53 8.467 9.207 -0.740 1
1 738 . 20 1 1 A 53 53 LYS HA H 53 5.044 5.229 -0.185 1
1 747 . 20 1 1 A 53 53 LYS C C 53 175.082 175.240 -0.158 1
1 748 . 20 1 1 A 53 53 LYS CA C 53 55.429 54.900 0.529 1
1 749 . 20 1 1 A 53 53 LYS CB C 53 36.446 36.008 0.438 1
1 753 . 20 1 1 A 53 53 LYS N N 53 123.249 128.305 -5.056 1
1 754 . 20 1 1 A 54 54 VAL H H 54 8.490 8.977 -0.487 1
1 755 . 20 1 1 A 54 54 VAL HA H 54 5.159 4.827 0.332 1
1 763 . 20 1 1 A 54 54 VAL C C 54 173.473 173.453 0.020 1
1 764 . 20 1 1 A 54 54 VAL CA C 54 60.163 60.714 -0.551 1
1 765 . 20 1 1 A 54 54 VAL CB C 54 35.509 34.206 1.303 1
1 768 . 20 1 1 A 54 54 VAL N N 54 120.762 123.485 -2.723 1
1 769 . 20 1 1 A 55 55 LEU H H 55 8.636 8.787 -0.151 1
1 770 . 20 1 1 A 55 55 LEU HA H 55 4.670 4.746 -0.076 1
1 780 . 20 1 1 A 55 55 LEU C C 55 173.652 174.319 -0.667 1
1 781 . 20 1 1 A 55 55 LEU CA C 55 52.289 52.833 -0.544 1
1 782 . 20 1 1 A 55 55 LEU CB C 55 42.070 44.283 -2.213 1
1 786 . 20 1 1 A 55 55 LEU N N 55 131.898 129.433 2.465 1
1 787 . 20 1 1 A 56 56 ILE H H 56 9.188 9.132 0.056 1
1 788 . 20 1 1 A 56 56 ILE HA H 56 4.879 5.044 -0.165 1
1 798 . 20 1 1 A 56 56 ILE C C 56 174.172 174.555 -0.383 1
1 799 . 20 1 1 A 56 56 ILE CA C 56 59.976 59.830 0.146 1
1 800 . 20 1 1 A 56 56 ILE CB C 56 38.181 40.779 -2.598 1
1 804 . 20 1 1 A 56 56 ILE N N 56 126.373 126.207 0.166 1
1 805 . 20 1 1 A 57 57 LEU H H 57 8.929 9.274 -0.345 1
1 806 . 20 1 1 A 57 57 LEU HA H 57 5.394 5.136 0.258 1
1 816 . 20 1 1 A 57 57 LEU C C 57 175.358 175.943 -0.585 1
1 817 . 20 1 1 A 57 57 LEU CA C 57 52.086 53.502 -1.416 1
1 818 . 20 1 1 A 57 57 LEU CB C 57 42.445 43.275 -0.830 1
1 822 . 20 1 1 A 57 57 LEU N N 57 126.547 127.494 -0.947 1
1 823 . 20 1 1 A 58 58 VAL H H 58 8.542 9.010 -0.468 1
1 824 . 20 1 1 A 58 58 VAL HA H 58 5.253 4.793 0.460 1
1 832 . 20 1 1 A 58 58 VAL C C 58 175.244 175.691 -0.447 1
1 833 . 20 1 1 A 58 58 VAL CA C 58 58.241 58.769 -0.528 1
1 834 . 20 1 1 A 58 58 VAL CB C 58 33.165 34.922 -1.757 1
1 837 . 20 1 1 A 58 58 VAL N N 58 114.398 120.056 -5.658 1
1 838 . 20 1 1 A 59 59 SER H H 59 8.797 8.673 0.124 1
1 839 . 20 1 1 A 59 59 SER HA H 59 5.063 4.521 0.542 1
1 842 . 20 1 1 A 59 59 SER C C 59 174.172 175.037 -0.865 1
1 843 . 20 1 1 A 59 59 SER CA C 59 59.320 59.571 -0.251 1
1 844 . 20 1 1 A 59 59 SER CB C 59 65.600 63.894 1.706 1
1 845 . 20 1 1 A 59 59 SER N N 59 115.497 116.107 -0.610 1
1 846 . 20 1 1 A 60 60 ASN H H 60 7.730 7.929 -0.199 1
1 847 . 20 1 1 A 60 60 ASN HA H 60 4.811 4.898 -0.087 1
1 852 . 20 1 1 A 60 60 ASN C C 60 174.464 175.635 -1.171 1
1 853 . 20 1 1 A 60 60 ASN CA C 60 52.007 52.877 -0.870 1
1 854 . 20 1 1 A 60 60 ASN CB C 60 40.336 39.300 1.036 1
1 855 . 20 1 1 A 60 60 ASN N N 60 117.522 118.631 -1.109 1
1 857 . 20 1 1 A 61 61 ASP H H 61 8.577 8.989 -0.412 1
1 858 . 20 1 1 A 61 61 ASP HA H 61 4.365 4.301 0.064 1
1 861 . 20 1 1 A 61 61 ASP C C 61 177.357 178.606 -1.249 1
1 862 . 20 1 1 A 61 61 ASP CA C 61 57.351 57.021 0.330 1
1 863 . 20 1 1 A 61 61 ASP CB C 61 40.383 39.742 0.641 1
1 864 . 20 1 1 A 61 61 ASP N N 61 119.431 123.062 -3.631 1
1 865 . 20 1 1 A 62 62 GLU H H 62 8.405 8.111 0.294 1
1 866 . 20 1 1 A 62 62 GLU HA H 62 4.121 4.099 0.022 1
1 871 . 20 1 1 A 62 62 GLU C C 62 179.615 179.274 0.341 1
1 872 . 20 1 1 A 62 62 GLU CA C 62 59.593 59.123 0.470 1
1 873 . 20 1 1 A 62 62 GLU CB C 62 28.478 29.378 -0.900 1
1 875 . 20 1 1 A 62 62 GLU N N 62 122.150 120.334 1.816 1
1 876 . 20 1 1 A 63 63 GLU H H 63 8.384 8.248 0.136 1
1 877 . 20 1 1 A 63 63 GLU HA H 63 3.913 4.024 -0.111 1
1 882 . 20 1 1 A 63 63 GLU C C 63 178.478 179.159 -0.681 1
1 883 . 20 1 1 A 63 63 GLU CA C 63 58.273 59.230 -0.957 1
1 884 . 20 1 1 A 63 63 GLU CB C 63 29.931 29.309 0.622 1
1 886 . 20 1 1 A 63 63 GLU N N 63 119.084 120.764 -1.680 1
1 887 . 20 1 1 A 64 64 LEU H H 64 7.717 8.102 -0.385 1
1 888 . 20 1 1 A 64 64 LEU HA H 64 3.750 4.057 -0.307 1
1 898 . 20 1 1 A 64 64 LEU C C 64 177.535 178.052 -0.517 1
1 899 . 20 1 1 A 64 64 LEU CA C 64 58.944 58.147 0.797 1
1 900 . 20 1 1 A 64 64 LEU CB C 64 41.695 41.484 0.211 1
1 904 . 20 1 1 A 64 64 LEU N N 64 120.357 122.326 -1.969 1
1 905 . 20 1 1 A 65 65 ASP H H 65 7.922 8.269 -0.347 1
1 906 . 20 1 1 A 65 65 ASP HA H 65 4.313 4.248 0.065 1
1 909 . 20 1 1 A 65 65 ASP C C 65 179.095 178.607 0.488 1
1 910 . 20 1 1 A 65 65 ASP CA C 65 57.272 57.938 -0.666 1
1 911 . 20 1 1 A 65 65 ASP CB C 65 40.196 41.373 -1.177 1
1 912 . 20 1 1 A 65 65 ASP N N 65 118.100 118.852 -0.752 1
1 913 . 20 1 1 A 66 66 LYS H H 66 7.802 8.024 -0.222 1
1 914 . 20 1 1 A 66 66 LYS HA H 66 4.078 4.055 0.023 1
1 923 . 20 1 1 A 66 66 LYS C C 66 178.624 178.776 -0.152 1
1 924 . 20 1 1 A 66 66 LYS CA C 66 58.429 59.444 -1.015 1
1 925 . 20 1 1 A 66 66 LYS CB C 66 31.727 32.239 -0.512 1
1 929 . 20 1 1 A 66 66 LYS N N 66 119.343 118.875 0.468 1
1 930 . 20 1 1 A 67 67 ALA H H 67 8.480 8.081 0.399 1
1 931 . 20 1 1 A 67 67 ALA HA H 67 3.853 4.137 -0.284 1
1 935 . 20 1 1 A 67 67 ALA C C 67 178.591 179.443 -0.852 1
1 936 . 20 1 1 A 67 67 ALA CA C 67 55.403 55.427 -0.024 1
1 937 . 20 1 1 A 67 67 ALA CB C 67 17.793 18.529 -0.736 1
1 938 . 20 1 1 A 67 67 ALA N N 67 121.562 122.641 -1.079 1
1 939 . 20 1 1 A 68 68 LYS H H 68 8.186 7.878 0.308 1
1 940 . 20 1 1 A 68 68 LYS HA H 68 3.805 4.029 -0.224 1
1 949 . 20 1 1 A 68 68 LYS C C 68 179.095 178.715 0.380 1
1 950 . 20 1 1 A 68 68 LYS CA C 68 59.952 59.043 0.909 1
1 951 . 20 1 1 A 68 68 LYS CB C 68 32.181 31.870 0.311 1
1 955 . 20 1 1 A 68 68 LYS N N 68 116.165 116.875 -0.710 1
1 956 . 20 1 1 A 69 69 GLU H H 69 7.904 8.123 -0.219 1
1 957 . 20 1 1 A 69 69 GLU HA H 69 3.995 4.099 -0.104 1
1 962 . 20 1 1 A 69 69 GLU C C 69 179.079 179.402 -0.323 1
1 963 . 20 1 1 A 69 69 GLU CA C 69 59.022 58.859 0.163 1
1 964 . 20 1 1 A 69 69 GLU CB C 69 29.274 29.438 -0.164 1
1 966 . 20 1 1 A 69 69 GLU N N 69 119.489 119.558 -0.069 1
1 967 . 20 1 1 A 70 70 LEU H H 70 7.962 8.031 -0.069 1
1 968 . 20 1 1 A 70 70 LEU HA H 70 4.020 3.922 0.098 1
1 978 . 20 1 1 A 70 70 LEU C C 70 178.738 178.892 -0.154 1
1 979 . 20 1 1 A 70 70 LEU CA C 70 57.486 57.915 -0.429 1
1 980 . 20 1 1 A 70 70 LEU CB C 70 41.695 41.565 0.130 1
1 984 . 20 1 1 A 70 70 LEU N N 70 119.431 120.515 -1.084 1
1 985 . 20 1 1 A 71 71 ALA H H 71 8.260 8.534 -0.274 1
1 986 . 20 1 1 A 71 71 ALA HA H 71 3.845 4.060 -0.215 1
1 990 . 20 1 1 A 71 71 ALA C C 71 179.518 179.911 -0.393 1
1 991 . 20 1 1 A 71 71 ALA CA C 71 55.139 55.705 -0.566 1
1 992 . 20 1 1 A 71 71 ALA CB C 71 18.487 18.428 0.059 1
1 993 . 20 1 1 A 71 71 ALA N N 71 119.604 120.961 -1.357 1
1 994 . 20 1 1 A 72 72 GLN H H 72 7.910 8.221 -0.311 1
1 995 . 20 1 1 A 72 72 GLN HA H 72 4.154 3.957 0.197 1
1 1002 . 20 1 1 A 72 72 GLN C C 72 178.900 178.852 0.048 1
1 1003 . 20 1 1 A 72 72 GLN CA C 72 58.194 58.947 -0.753 1
1 1004 . 20 1 1 A 72 72 GLN CB C 72 28.056 28.350 -0.294 1
1 1006 . 20 1 1 A 72 72 GLN N N 72 115.960 117.341 -1.381 1
1 1008 . 20 1 1 A 73 73 LYS H H 73 7.841 8.058 -0.217 1
1 1009 . 20 1 1 A 73 73 LYS HA H 73 4.171 4.196 -0.025 1
1 1018 . 20 1 1 A 73 73 LYS C C 73 177.730 178.027 -0.297 1
1 1019 . 20 1 1 A 73 73 LYS CA C 73 57.867 58.529 -0.662 1
1 1020 . 20 1 1 A 73 73 LYS CB C 73 32.277 32.428 -0.151 1
1 1024 . 20 1 1 A 73 73 LYS N N 73 119.027 118.995 0.032 1
1 1025 . 20 1 1 A 74 74 MET H H 74 7.746 7.846 -0.100 1
1 1026 . 20 1 1 A 74 74 MET HA H 74 4.403 4.560 -0.157 1
1 1034 . 20 1 1 A 74 74 MET C C 74 174.416 174.699 -0.283 1
1 1035 . 20 1 1 A 74 74 MET CA C 74 55.194 55.389 -0.195 1
1 1036 . 20 1 1 A 74 74 MET CB C 74 33.366 33.259 0.107 1
1 1039 . 20 1 1 A 74 74 MET N N 74 115.786 116.040 -0.254 1
1 1040 . 20 1 1 A 75 75 GLU H H 75 8.076 7.974 0.102 1
1 1041 . 20 1 1 A 75 75 GLU HA H 75 4.001 3.856 0.145 1
1 1046 . 20 1 1 A 75 75 GLU C C 75 175.130 175.189 -0.059 1
1 1047 . 20 1 1 A 75 75 GLU CA C 75 56.722 57.672 -0.950 1
1 1048 . 20 1 1 A 75 75 GLU CB C 75 27.118 27.194 -0.076 1
1 1050 . 20 1 1 A 75 75 GLU N N 75 116.249 116.313 -0.064 1
1 1051 . 20 1 1 A 76 76 ILE H H 76 7.560 7.890 -0.330 1
1 1052 . 20 1 1 A 76 76 ILE HA H 76 4.428 4.344 0.084 1
1 1062 . 20 1 1 A 76 76 ILE C C 76 174.529 175.011 -0.482 1
1 1063 . 20 1 1 A 76 76 ILE CA C 76 58.475 60.502 -2.027 1
1 1064 . 20 1 1 A 76 76 ILE CB C 76 40.337 39.119 1.218 1
1 1068 . 20 1 1 A 76 76 ILE N N 76 115.960 120.104 -4.144 1
1 1069 . 20 1 1 A 77 77 ASP H H 77 8.889 8.707 0.182 1
1 1070 . 20 1 1 A 77 77 ASP HA H 77 4.569 4.853 -0.284 1
1 1073 . 20 1 1 A 77 77 ASP C C 77 174.123 176.075 -1.952 1
1 1074 . 20 1 1 A 77 77 ASP CA C 77 54.069 53.986 0.083 1
1 1075 . 20 1 1 A 77 77 ASP CB C 77 40.233 41.541 -1.308 1
1 1076 . 20 1 1 A 77 77 ASP N N 77 126.142 127.276 -1.134 1
1 1077 . 20 1 1 A 78 78 VAL H H 78 7.754 8.926 -1.172 1
1 1078 . 20 1 1 A 78 78 VAL HA H 78 5.192 5.454 -0.262 1
1 1086 . 20 1 1 A 78 78 VAL C C 78 174.968 174.274 0.694 1
1 1087 . 20 1 1 A 78 78 VAL CA C 78 58.804 58.598 0.206 1
1 1088 . 20 1 1 A 78 78 VAL CB C 78 35.293 35.697 -0.404 1
1 1091 . 20 1 1 A 78 78 VAL N N 78 122.844 119.212 3.632 1
1 1092 . 20 1 1 A 79 79 ARG H H 79 8.499 8.692 -0.193 1
1 1093 . 20 1 1 A 79 79 ARG HA H 79 4.712 4.782 -0.070 1
1 1100 . 20 1 1 A 79 79 ARG C C 79 174.221 175.128 -0.907 1
1 1101 . 20 1 1 A 79 79 ARG CA C 79 54.117 54.781 -0.664 1
1 1102 . 20 1 1 A 79 79 ARG CB C 79 31.196 30.941 0.255 1
1 1105 . 20 1 1 A 79 79 ARG N N 79 125.637 122.013 3.624 1
1 1106 . 20 1 1 A 80 80 THR H H 80 8.416 8.533 -0.117 1
1 1107 . 20 1 1 A 80 80 THR HA H 80 5.332 4.576 0.756 1
1 1112 . 20 1 1 A 80 80 THR C C 80 174.497 174.394 0.103 1
1 1113 . 20 1 1 A 80 80 THR CA C 80 59.694 61.231 -1.537 1
1 1114 . 20 1 1 A 80 80 THR CB C 80 69.772 69.387 0.385 1
1 1116 . 20 1 1 A 80 80 THR N N 80 118.084 117.702 0.382 1
1 1117 . 20 1 1 A 81 81 ARG H H 81 8.758 9.030 -0.272 1
1 1118 . 20 1 1 A 81 81 ARG HA H 81 4.362 4.842 -0.480 1
1 1126 . 20 1 1 A 81 81 ARG C C 81 173.733 174.120 -0.387 1
1 1127 . 20 1 1 A 81 81 ARG CA C 81 53.273 53.811 -0.538 1
1 1128 . 20 1 1 A 81 81 ARG CB C 81 33.915 32.927 0.988 1
1 1131 . 20 1 1 A 81 81 ARG N N 81 122.844 124.869 -2.025 1
1 1133 . 20 1 1 A 82 82 LYS H H 82 8.721 8.678 0.043 1
1 1134 . 20 1 1 A 82 82 LYS HA H 82 4.701 5.402 -0.701 1
1 1143 . 20 1 1 A 82 82 LYS C C 82 175.667 175.258 0.409 1
1 1144 . 20 1 1 A 82 82 LYS CA C 82 54.960 54.612 0.348 1
1 1145 . 20 1 1 A 82 82 LYS CB C 82 32.603 35.329 -2.726 1
1 1149 . 20 1 1 A 82 82 LYS N N 82 124.668 124.641 0.027 1
1 1150 . 20 1 1 A 83 83 VAL H H 83 9.112 9.372 -0.260 1
1 1151 . 20 1 1 A 83 83 VAL HA H 83 4.796 4.894 -0.098 1
1 1159 . 20 1 1 A 83 83 VAL C C 83 174.594 176.043 -1.449 1
1 1160 . 20 1 1 A 83 83 VAL CA C 83 59.413 60.705 -1.292 1
1 1161 . 20 1 1 A 83 83 VAL CB C 83 35.298 34.025 1.273 1
1 1164 . 20 1 1 A 83 83 VAL N N 83 122.381 122.387 -0.006 1
1 1165 . 20 1 1 A 84 84 THR H H 84 9.200 8.950 0.250 1
1 1166 . 20 1 1 A 84 84 THR HA H 84 4.579 4.552 0.027 1
1 1171 . 20 1 1 A 84 84 THR C C 84 173.993 175.113 -1.120 1
1 1172 . 20 1 1 A 84 84 THR CA C 84 60.960 62.407 -1.447 1
1 1173 . 20 1 1 A 84 84 THR CB C 84 70.100 69.535 0.565 1
1 1175 . 20 1 1 A 84 84 THR N N 84 113.183 116.555 -3.372 1
1 1176 . 20 1 1 A 85 85 SER H H 85 7.688 8.128 -0.440 1
1 1177 . 20 1 1 A 85 85 SER HA H 85 5.136 4.922 0.214 1
1 1180 . 20 1 1 A 85 85 SER CA C 85 55.205 55.497 -0.292 1
1 1181 . 20 1 1 A 85 85 SER CB C 85 64.376 64.867 -0.491 1
1 1182 . 20 1 1 A 85 85 SER N N 85 115.555 116.751 -1.196 1
1 1183 . 20 1 1 A 86 86 PRO HA H 86 4.090 4.236 -0.146 1
1 1190 . 20 1 1 A 86 86 PRO C C 86 177.227 177.508 -0.281 1
1 1191 . 20 1 1 A 86 86 PRO CA C 86 65.038 65.664 -0.626 1
1 1192 . 20 1 1 A 86 86 PRO CB C 86 31.711 31.872 -0.161 1
1 1195 . 20 1 1 A 87 87 ASP H H 87 8.131 8.982 -0.851 1
1 1196 . 20 1 1 A 87 87 ASP HA H 87 4.223 4.316 -0.093 1
1 1199 . 20 1 1 A 87 87 ASP C C 87 178.721 179.061 -0.340 1
1 1200 . 20 1 1 A 87 87 ASP CA C 87 57.311 56.839 0.472 1
1 1201 . 20 1 1 A 87 87 ASP CB C 87 40.102 39.638 0.464 1
1 1202 . 20 1 1 A 87 87 ASP N N 87 115.381 116.939 -1.558 1
1 1203 . 20 1 1 A 88 88 GLU H H 88 7.571 8.149 -0.578 1
1 1204 . 20 1 1 A 88 88 GLU HA H 88 3.659 4.024 -0.365 1
1 1209 . 20 1 1 A 88 88 GLU C C 88 177.097 178.743 -1.646 1
1 1210 . 20 1 1 A 88 88 GLU CA C 88 58.729 58.917 -0.188 1
1 1211 . 20 1 1 A 88 88 GLU CB C 88 30.052 29.569 0.483 1
1 1213 . 20 1 1 A 88 88 GLU N N 88 120.009 120.018 -0.009 1
1 1214 . 20 1 1 A 89 89 ALA H H 89 7.423 8.109 -0.686 1
1 1215 . 20 1 1 A 89 89 ALA HA H 89 3.900 4.306 -0.406 1
1 1219 . 20 1 1 A 89 89 ALA C C 89 178.267 180.021 -1.754 1
1 1220 . 20 1 1 A 89 89 ALA CA C 89 55.607 55.350 0.257 1
1 1221 . 20 1 1 A 89 89 ALA CB C 89 17.348 18.372 -1.024 1
1 1222 . 20 1 1 A 89 89 ALA N N 89 118.873 122.419 -3.546 1
1 1223 . 20 1 1 A 90 90 LYS H H 90 8.046 8.006 0.040 1
1 1224 . 20 1 1 A 90 90 LYS HA H 90 3.669 3.966 -0.297 1
1 1233 . 20 1 1 A 90 90 LYS C C 90 177.649 179.130 -1.481 1
1 1234 . 20 1 1 A 90 90 LYS CA C 90 60.351 59.695 0.656 1
1 1235 . 20 1 1 A 90 90 LYS CB C 90 32.087 32.306 -0.219 1
1 1239 . 20 1 1 A 90 90 LYS N N 90 114.834 117.430 -2.596 1
1 1240 . 20 1 1 A 91 91 ARG H H 91 7.468 7.779 -0.311 1
1 1241 . 20 1 1 A 91 91 ARG HA H 91 3.887 3.866 0.021 1
1 1249 . 20 1 1 A 91 91 ARG C C 91 178.998 179.066 -0.068 1
1 1250 . 20 1 1 A 91 91 ARG CA C 91 59.164 59.155 0.009 1
1 1251 . 20 1 1 A 91 91 ARG CB C 91 29.274 29.725 -0.451 1
1 1254 . 20 1 1 A 91 91 ARG N N 91 119.029 119.349 -0.320 1
1 1256 . 20 1 1 A 92 92 TRP H H 92 8.136 8.291 -0.155 1
1 1257 . 20 1 1 A 92 92 TRP HA H 92 4.818 4.496 0.322 1
1 1266 . 20 1 1 A 92 92 TRP C C 92 179.566 179.240 0.326 1
1 1267 . 20 1 1 A 92 92 TRP CA C 92 58.663 59.760 -1.097 1
1 1268 . 20 1 1 A 92 92 TRP CB C 92 29.790 29.204 0.586 1
1 1274 . 20 1 1 A 92 92 TRP N N 92 118.100 120.071 -1.971 1
1 1276 . 20 1 1 A 93 93 ILE H H 93 8.363 8.178 0.185 1
1 1277 . 20 1 1 A 93 93 ILE HA H 93 3.544 3.754 -0.210 1
1 1287 . 20 1 1 A 93 93 ILE C C 93 176.820 178.003 -1.183 1
1 1288 . 20 1 1 A 93 93 ILE CA C 93 66.225 65.503 0.722 1
1 1289 . 20 1 1 A 93 93 ILE CB C 93 37.571 37.980 -0.409 1
1 1293 . 20 1 1 A 93 93 ILE N N 93 120.588 120.800 -0.212 1
1 1294 . 20 1 1 A 94 94 LYS H H 94 8.264 7.775 0.489 1
1 1295 . 20 1 1 A 94 94 LYS HA H 94 3.865 4.024 -0.159 1
1 1304 . 20 1 1 A 94 94 LYS C C 94 179.258 178.518 0.740 1
1 1305 . 20 1 1 A 94 94 LYS CA C 94 59.889 59.725 0.164 1
1 1306 . 20 1 1 A 94 94 LYS CB C 94 32.225 32.298 -0.073 1
1 1310 . 20 1 1 A 94 94 LYS N N 94 121.687 120.251 1.436 1
1 1311 . 20 1 1 A 95 95 GLU H H 95 8.360 8.401 -0.041 1
1 1312 . 20 1 1 A 95 95 GLU HA H 95 4.023 4.028 -0.005 1
1 1317 . 20 1 1 A 95 95 GLU C C 95 178.884 179.412 -0.528 1
1 1318 . 20 1 1 A 95 95 GLU CA C 95 59.366 59.656 -0.290 1
1 1319 . 20 1 1 A 95 95 GLU CB C 95 29.508 29.519 -0.011 1
1 1321 . 20 1 1 A 95 95 GLU N N 95 118.505 117.723 0.782 1
1 1322 . 20 1 1 A 96 96 PHE H H 96 8.212 8.363 -0.151 1
1 1323 . 20 1 1 A 96 96 PHE HA H 96 4.512 4.188 0.324 1
1 1331 . 20 1 1 A 96 96 PHE C C 96 176.820 178.129 -1.309 1
1 1332 . 20 1 1 A 96 96 PHE CA C 96 59.608 61.391 -1.783 1
1 1333 . 20 1 1 A 96 96 PHE CB C 96 40.431 39.002 1.429 1
1 1339 . 20 1 1 A 96 96 PHE N N 96 120.369 121.988 -1.619 1
1 1340 . 20 1 1 A 97 97 SER H H 97 8.216 8.117 0.099 1
1 1341 . 20 1 1 A 97 97 SER HA H 97 3.816 4.043 -0.227 1
1 1344 . 20 1 1 A 97 97 SER C C 97 175.618 176.362 -0.744 1
1 1345 . 20 1 1 A 97 97 SER CA C 97 60.492 61.267 -0.775 1
1 1346 . 20 1 1 A 97 97 SER CB C 97 63.022 62.977 0.045 1
1 1347 . 20 1 1 A 97 97 SER N N 97 111.969 113.894 -1.925 1
1 1348 . 20 1 1 A 98 98 GLU H H 98 7.655 8.393 -0.738 1
1 1349 . 20 1 1 A 98 98 GLU HA H 98 4.187 4.119 0.068 1
1 1354 . 20 1 1 A 98 98 GLU C C 98 177.698 178.570 -0.872 1
1 1355 . 20 1 1 A 98 98 GLU CA C 98 57.069 58.360 -1.291 1
1 1356 . 20 1 1 A 98 98 GLU CB C 98 29.321 29.488 -0.167 1
1 1358 . 20 1 1 A 98 98 GLU N N 98 120.588 118.772 1.816 1
1 1359 . 20 1 1 A 99 99 GLU H H 99 7.794 7.582 0.212 1
1 1360 . 20 1 1 A 99 99 GLU HA H 99 4.123 4.208 -0.085 1
1 1365 . 20 1 1 A 99 99 GLU C C 99 177.665 177.447 0.218 1
1 1366 . 20 1 1 A 99 99 GLU CA C 99 57.304 55.841 1.463 1
1 1367 . 20 1 1 A 99 99 GLU CB C 99 29.368 30.320 -0.952 1
1 1369 . 20 1 1 A 99 99 GLU N N 99 120.067 117.162 2.905 1
1 1370 . 20 1 1 A 100 100 GLY H H 100 8.138 8.854 -0.716 1
1 1371 . 20 1 1 A 100 100 GLY HA2 H 100 3.865 3.815 0.050 1
1 1372 . 20 1 1 A 100 100 GLY HA3 H 100 3.715 3.865 -0.150 1
1 1373 . 20 1 1 A 100 100 GLY C C 100 174.464 173.649 0.815 1
1 1374 . 20 1 1 A 100 100 GLY CA C 100 45.305 45.907 -0.602 1
1 1375 . 20 1 1 A 100 100 GLY N N 100 107.802 110.474 -2.672 1
1 1376 . 20 1 1 A 101 101 GLY H H 101 8.023 8.007 0.016 1
1 1377 . 20 1 1 A 101 101 GLY HA2 H 101 3.865 4.031 -0.166 1
1 1378 . 20 1 1 A 101 101 GLY HA3 H 101 3.892 4.048 -0.156 1
1 1379 . 20 1 1 A 101 101 GLY C C 101 174.204 172.757 1.447 1
1 1380 . 20 1 1 A 101 101 GLY CA C 101 45.036 45.663 -0.627 1
1 1381 . 20 1 1 A 101 101 GLY N N 101 108.032 106.673 1.359 1
1 1382 . 20 1 1 A 102 102 SER H H 102 8.059 8.590 -0.531 1
1 1383 . 20 1 1 A 102 102 SER HA H 102 4.380 4.538 -0.158 1
1 1386 . 20 1 1 A 102 102 SER C C 102 174.627 174.572 0.055 1
1 1387 . 20 1 1 A 102 102 SER CA C 102 58.194 58.492 -0.298 1
1 1388 . 20 1 1 A 102 102 SER CB C 102 63.538 63.858 -0.320 1
1 1389 . 20 1 1 A 102 102 SER N N 102 115.266 118.498 -3.232 1
1 1390 . 20 1 1 A 103 103 LEU H H 103 8.287 9.093 -0.806 1
1 1391 . 20 1 1 A 103 103 LEU HA H 103 4.301 4.337 -0.036 1
1 1401 . 20 1 1 A 103 103 LEU C C 103 177.292 176.963 0.329 1
1 1402 . 20 1 1 A 103 103 LEU CA C 103 55.007 56.347 -1.340 1
1 1403 . 20 1 1 A 103 103 LEU CB C 103 42.023 42.930 -0.907 1
1 1407 . 20 1 1 A 103 103 LEU N N 103 123.596 125.398 -1.802 1
1 1408 . 20 1 1 A 104 104 GLU H H 104 8.216 7.867 0.349 1
1 1409 . 20 1 1 A 104 104 GLU HA H 104 4.126 4.704 -0.578 1
1 1414 . 20 1 1 A 104 104 GLU CA C 104 56.518 54.710 1.808 1
1 1415 . 20 1 1 A 104 104 GLU CB C 104 29.837 30.958 -1.121 1
1 1417 . 20 1 1 A 104 104 GLU N N 104 120.510 117.330 3.180 1
1 1418 . 20 1 1 A 105 105 HIS HA H 105 4.593 4.879 -0.286 1
1 1421 . 20 1 1 A 105 105 HIS C C 105 173.766 175.245 -1.479 1
1 1422 . 20 1 1 A 105 105 HIS CA C 105 55.536 55.914 -0.378 1
1 1423 . 20 1 1 A 105 105 HIS CB C 105 30.001 30.364 -0.363 1
1 1424 . 20 1 1 A 106 106 HIS H H 106 8.154 7.685 0.469 1
1 1425 . 20 1 1 A 106 106 HIS HA H 106 4.407 4.533 -0.126 1
1 1428 . 20 1 1 A 106 106 HIS CA C 106 56.920 54.898 2.022 1
1 1429 . 20 1 1 A 106 106 HIS CB C 106 30.001 27.829 2.172 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 102 0.864 1
2 1 1 1 "RMS(OBS, PRED)" CA 105 1.085 1
3 1 1 1 "RMS(OBS, PRED)" CB 103 0.855 1
4 1 1 1 "RMS(OBS, PRED)" H 103 0.423 1
5 1 1 1 "RMS(OBS, PRED)" HA 107 0.250 1
6 1 1 1 "RMS(OBS, PRED)" N 102 2.338 1
7 1 2 1 "RMS(OBS, PRED)" C 102 0.857 1
8 1 2 1 "RMS(OBS, PRED)" CA 105 1.030 1
9 1 2 1 "RMS(OBS, PRED)" CB 103 0.792 1
10 1 2 1 "RMS(OBS, PRED)" H 103 0.455 1
11 1 2 1 "RMS(OBS, PRED)" HA 107 0.236 1
12 1 2 1 "RMS(OBS, PRED)" N 102 2.209 1
13 1 3 1 "RMS(OBS, PRED)" C 102 0.902 1
14 1 3 1 "RMS(OBS, PRED)" CA 105 1.046 1
15 1 3 1 "RMS(OBS, PRED)" CB 103 0.767 1
16 1 3 1 "RMS(OBS, PRED)" H 103 0.445 1
17 1 3 1 "RMS(OBS, PRED)" HA 107 0.257 1
18 1 3 1 "RMS(OBS, PRED)" N 102 2.300 1
19 1 4 1 "RMS(OBS, PRED)" C 102 0.873 1
20 1 4 1 "RMS(OBS, PRED)" CA 105 1.051 1
21 1 4 1 "RMS(OBS, PRED)" CB 103 0.856 1
22 1 4 1 "RMS(OBS, PRED)" H 103 0.419 1
23 1 4 1 "RMS(OBS, PRED)" HA 107 0.249 1
24 1 4 1 "RMS(OBS, PRED)" N 102 2.360 1
25 1 5 1 "RMS(OBS, PRED)" C 102 0.928 1
26 1 5 1 "RMS(OBS, PRED)" CA 105 1.008 1
27 1 5 1 "RMS(OBS, PRED)" CB 103 0.857 1
28 1 5 1 "RMS(OBS, PRED)" H 103 0.443 1
29 1 5 1 "RMS(OBS, PRED)" HA 107 0.259 1
30 1 5 1 "RMS(OBS, PRED)" N 102 2.195 1
31 1 6 1 "RMS(OBS, PRED)" C 102 0.871 1
32 1 6 1 "RMS(OBS, PRED)" CA 105 1.067 1
33 1 6 1 "RMS(OBS, PRED)" CB 103 0.879 1
34 1 6 1 "RMS(OBS, PRED)" H 103 0.436 1
35 1 6 1 "RMS(OBS, PRED)" HA 107 0.266 1
36 1 6 1 "RMS(OBS, PRED)" N 102 2.299 1
37 1 7 1 "RMS(OBS, PRED)" C 102 0.884 1
38 1 7 1 "RMS(OBS, PRED)" CA 105 1.129 1
39 1 7 1 "RMS(OBS, PRED)" CB 103 0.809 1
40 1 7 1 "RMS(OBS, PRED)" H 103 0.411 1
41 1 7 1 "RMS(OBS, PRED)" HA 107 0.248 1
42 1 7 1 "RMS(OBS, PRED)" N 102 2.442 1
43 1 8 1 "RMS(OBS, PRED)" C 102 0.835 1
44 1 8 1 "RMS(OBS, PRED)" CA 105 1.091 1
45 1 8 1 "RMS(OBS, PRED)" CB 103 0.906 1
46 1 8 1 "RMS(OBS, PRED)" H 103 0.410 1
47 1 8 1 "RMS(OBS, PRED)" HA 107 0.245 1
48 1 8 1 "RMS(OBS, PRED)" N 102 2.492 1
49 1 9 1 "RMS(OBS, PRED)" C 102 0.820 1
50 1 9 1 "RMS(OBS, PRED)" CA 105 0.992 1
51 1 9 1 "RMS(OBS, PRED)" CB 103 0.919 1
52 1 9 1 "RMS(OBS, PRED)" H 103 0.421 1
53 1 9 1 "RMS(OBS, PRED)" HA 107 0.235 1
54 1 9 1 "RMS(OBS, PRED)" N 102 2.290 1
55 1 10 1 "RMS(OBS, PRED)" C 102 0.878 1
56 1 10 1 "RMS(OBS, PRED)" CA 105 1.065 1
57 1 10 1 "RMS(OBS, PRED)" CB 103 0.834 1
58 1 10 1 "RMS(OBS, PRED)" H 103 0.417 1
59 1 10 1 "RMS(OBS, PRED)" HA 107 0.261 1
60 1 10 1 "RMS(OBS, PRED)" N 102 2.296 1
61 1 11 1 "RMS(OBS, PRED)" C 102 0.927 1
62 1 11 1 "RMS(OBS, PRED)" CA 105 1.052 1
63 1 11 1 "RMS(OBS, PRED)" CB 103 0.792 1
64 1 11 1 "RMS(OBS, PRED)" H 103 0.432 1
65 1 11 1 "RMS(OBS, PRED)" HA 107 0.214 1
66 1 11 1 "RMS(OBS, PRED)" N 102 2.301 1
67 1 12 1 "RMS(OBS, PRED)" C 102 0.859 1
68 1 12 1 "RMS(OBS, PRED)" CA 105 0.940 1
69 1 12 1 "RMS(OBS, PRED)" CB 103 0.819 1
70 1 12 1 "RMS(OBS, PRED)" H 103 0.399 1
71 1 12 1 "RMS(OBS, PRED)" HA 107 0.245 1
72 1 12 1 "RMS(OBS, PRED)" N 102 2.413 1
73 1 13 1 "RMS(OBS, PRED)" C 102 0.800 1
74 1 13 1 "RMS(OBS, PRED)" CA 105 1.063 1
75 1 13 1 "RMS(OBS, PRED)" CB 103 0.809 1
76 1 13 1 "RMS(OBS, PRED)" H 103 0.415 1
77 1 13 1 "RMS(OBS, PRED)" HA 107 0.229 1
78 1 13 1 "RMS(OBS, PRED)" N 102 2.358 1
79 1 14 1 "RMS(OBS, PRED)" C 102 0.891 1
80 1 14 1 "RMS(OBS, PRED)" CA 105 1.091 1
81 1 14 1 "RMS(OBS, PRED)" CB 103 0.790 1
82 1 14 1 "RMS(OBS, PRED)" H 103 0.406 1
83 1 14 1 "RMS(OBS, PRED)" HA 107 0.223 1
84 1 14 1 "RMS(OBS, PRED)" N 102 2.510 1
85 1 15 1 "RMS(OBS, PRED)" C 102 0.857 1
86 1 15 1 "RMS(OBS, PRED)" CA 105 1.083 1
87 1 15 1 "RMS(OBS, PRED)" CB 103 0.826 1
88 1 15 1 "RMS(OBS, PRED)" H 103 0.433 1
89 1 15 1 "RMS(OBS, PRED)" HA 107 0.240 1
90 1 15 1 "RMS(OBS, PRED)" N 102 2.271 1
91 1 16 1 "RMS(OBS, PRED)" C 102 0.908 1
92 1 16 1 "RMS(OBS, PRED)" CA 105 1.068 1
93 1 16 1 "RMS(OBS, PRED)" CB 103 0.842 1
94 1 16 1 "RMS(OBS, PRED)" H 103 0.444 1
95 1 16 1 "RMS(OBS, PRED)" HA 107 0.245 1
96 1 16 1 "RMS(OBS, PRED)" N 102 2.404 1
97 1 17 1 "RMS(OBS, PRED)" C 102 0.888 1
98 1 17 1 "RMS(OBS, PRED)" CA 105 0.942 1
99 1 17 1 "RMS(OBS, PRED)" CB 103 0.827 1
100 1 17 1 "RMS(OBS, PRED)" H 103 0.433 1
101 1 17 1 "RMS(OBS, PRED)" HA 107 0.233 1
102 1 17 1 "RMS(OBS, PRED)" N 102 2.367 1
103 1 18 1 "RMS(OBS, PRED)" C 102 0.886 1
104 1 18 1 "RMS(OBS, PRED)" CA 105 1.112 1
105 1 18 1 "RMS(OBS, PRED)" CB 103 0.794 1
106 1 18 1 "RMS(OBS, PRED)" H 103 0.436 1
107 1 18 1 "RMS(OBS, PRED)" HA 107 0.241 1
108 1 18 1 "RMS(OBS, PRED)" N 102 2.320 1
109 1 19 1 "RMS(OBS, PRED)" C 102 0.860 1
110 1 19 1 "RMS(OBS, PRED)" CA 105 0.979 1
111 1 19 1 "RMS(OBS, PRED)" CB 103 0.895 1
112 1 19 1 "RMS(OBS, PRED)" H 103 0.435 1
113 1 19 1 "RMS(OBS, PRED)" HA 107 0.231 1
114 1 19 1 "RMS(OBS, PRED)" N 102 2.197 1
115 1 20 1 "RMS(OBS, PRED)" C 102 0.896 1
116 1 20 1 "RMS(OBS, PRED)" CA 105 1.042 1
117 1 20 1 "RMS(OBS, PRED)" CB 103 0.875 1
118 1 20 1 "RMS(OBS, PRED)" H 103 0.450 1
119 1 20 1 "RMS(OBS, PRED)" HA 107 0.259 1
120 1 20 1 "RMS(OBS, PRED)" N 102 2.252 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 14 . 1 1 A 2 2 LEU H H 2 8.509 8.980 -0.471 2
1 15 . 1 1 A 2 2 LEU HA H 2 4.463 4.822 -0.359 2
1 25 . 1 1 A 2 2 LEU C C 2 173.944 176.166 -2.222 2
1 26 . 1 1 A 2 2 LEU CA C 2 54.471 54.216 0.255 2
1 27 . 1 1 A 2 2 LEU CB C 2 43.595 43.028 0.567 2
1 31 . 1 1 A 2 2 LEU N N 2 127.160 126.632 0.528 2
1 32 . 1 1 A 3 3 LEU H H 3 7.844 8.628 -0.784 2
1 33 . 1 1 A 3 3 LEU HA H 3 5.128 5.462 -0.334 2
1 43 . 1 1 A 3 3 LEU C C 3 175.423 175.178 0.245 2
1 44 . 1 1 A 3 3 LEU CA C 3 53.566 53.161 0.405 2
1 45 . 1 1 A 3 3 LEU CB C 3 44.039 44.670 -0.631 2
1 49 . 1 1 A 3 3 LEU N N 3 122.555 123.649 -1.094 2
1 50 . 1 1 A 4 4 TYR H H 4 8.360 9.205 -0.845 2
1 51 . 1 1 A 4 4 TYR HA H 4 5.143 5.212 -0.069 2
1 58 . 1 1 A 4 4 TYR C C 4 174.481 174.950 -0.469 2
1 59 . 1 1 A 4 4 TYR CA C 4 56.577 56.083 0.494 2
1 60 . 1 1 A 4 4 TYR CB C 4 43.840 42.692 1.148 2
1 65 . 1 1 A 4 4 TYR N N 4 119.315 123.119 -3.804 2
1 66 . 1 1 A 5 5 VAL H H 5 8.918 8.822 0.096 2
1 67 . 1 1 A 5 5 VAL HA H 5 5.106 4.912 0.194 2
1 75 . 1 1 A 5 5 VAL C C 5 174.042 174.676 -0.634 2
1 76 . 1 1 A 5 5 VAL CA C 5 59.852 60.787 -0.935 2
1 77 . 1 1 A 5 5 VAL CB C 5 33.816 34.782 -0.966 2
1 80 . 1 1 A 5 5 VAL N N 5 119.952 120.639 -0.687 2
1 81 . 1 1 A 6 6 LEU H H 6 9.315 9.403 -0.088 2
1 82 . 1 1 A 6 6 LEU HA H 6 5.466 5.273 0.193 2
1 92 . 1 1 A 6 6 LEU C C 6 175.049 174.910 0.139 2
1 93 . 1 1 A 6 6 LEU CA C 6 52.090 53.233 -1.143 2
1 94 . 1 1 A 6 6 LEU CB C 6 44.103 43.708 0.395 2
1 98 . 1 1 A 6 6 LEU N N 6 126.917 126.456 0.461 2
1 99 . 1 1 A 7 7 ILE H H 7 8.458 8.929 -0.471 2
1 100 . 1 1 A 7 7 ILE HA H 7 5.131 5.090 0.041 2
1 110 . 1 1 A 7 7 ILE C C 7 173.213 173.715 -0.502 2
1 111 . 1 1 A 7 7 ILE CA C 7 58.463 59.726 -1.263 2
1 112 . 1 1 A 7 7 ILE CB C 7 41.020 40.979 0.041 2
1 116 . 1 1 A 7 7 ILE N N 7 119.778 126.174 -6.396 2
1 117 . 1 1 A 8 8 ILE H H 8 8.797 9.327 -0.530 2
1 118 . 1 1 A 8 8 ILE HA H 8 4.611 4.930 -0.319 2
1 128 . 1 1 A 8 8 ILE C C 8 174.611 174.743 -0.132 2
1 129 . 1 1 A 8 8 ILE CA C 8 60.227 60.389 -0.162 2
1 130 . 1 1 A 8 8 ILE CB C 8 37.665 38.730 -1.065 2
1 134 . 1 1 A 8 8 ILE N N 8 128.919 130.524 -1.605 2
1 135 . 1 1 A 9 9 SER H H 9 7.811 8.756 -0.945 2
1 136 . 1 1 A 9 9 SER HA H 9 4.429 5.012 -0.583 2
1 140 . 1 1 A 9 9 SER C C 9 172.937 173.110 -0.173 2
1 141 . 1 1 A 9 9 SER CA C 9 58.241 56.945 1.296 2
1 142 . 1 1 A 9 9 SER CB C 9 64.261 64.418 -0.157 2
1 143 . 1 1 A 9 9 SER N N 9 116.365 121.711 -5.346 2
1 144 . 1 1 A 10 10 ASN H H 10 8.641 8.688 -0.047 2
1 145 . 1 1 A 10 10 ASN HA H 10 4.938 4.908 0.030 2
1 150 . 1 1 A 10 10 ASN C C 10 174.497 174.902 -0.405 2
1 151 . 1 1 A 10 10 ASN CA C 10 52.221 53.804 -1.583 2
1 152 . 1 1 A 10 10 ASN CB C 10 39.128 39.718 -0.590 2
1 153 . 1 1 A 10 10 ASN N N 10 122.612 121.290 1.322 2
1 155 . 1 1 A 11 11 ASP H H 11 8.673 7.394 1.279 2
1 156 . 1 1 A 11 11 ASP HA H 11 4.596 4.746 -0.150 2
1 159 . 1 1 A 11 11 ASP C C 11 175.342 176.410 -1.068 2
1 160 . 1 1 A 11 11 ASP CA C 11 53.233 53.713 -0.480 2
1 161 . 1 1 A 11 11 ASP CB C 11 40.965 41.200 -0.235 2
1 162 . 1 1 A 11 11 ASP N N 11 122.717 120.126 2.591 2
1 163 . 1 1 A 12 12 LYS H H 12 8.562 8.758 -0.196 2
1 164 . 1 1 A 12 12 LYS HA H 12 3.854 4.020 -0.166 2
1 173 . 1 1 A 12 12 LYS C C 12 178.754 178.390 0.364 2
1 174 . 1 1 A 12 12 LYS CA C 12 59.581 59.862 -0.281 2
1 175 . 1 1 A 12 12 LYS CB C 12 32.378 32.338 0.040 2
1 179 . 1 1 A 12 12 LYS N N 12 125.737 125.834 -0.097 2
1 180 . 1 1 A 13 13 LYS H H 13 8.075 7.723 0.352 2
1 181 . 1 1 A 13 13 LYS HA H 13 4.154 4.068 0.086 2
1 190 . 1 1 A 13 13 LYS C C 13 178.315 179.074 -0.759 2
1 191 . 1 1 A 13 13 LYS CA C 13 58.532 59.144 -0.612 2
1 192 . 1 1 A 13 13 LYS CB C 13 31.452 32.351 -0.899 2
1 196 . 1 1 A 13 13 LYS N N 13 119.604 120.005 -0.401 2
1 197 . 1 1 A 14 14 LEU H H 14 7.552 7.918 -0.366 2
1 198 . 1 1 A 14 14 LEU HA H 14 3.682 4.054 -0.372 2
1 208 . 1 1 A 14 14 LEU C C 14 178.429 178.396 0.033 2
1 209 . 1 1 A 14 14 LEU CA C 14 58.999 58.115 0.884 2
1 210 . 1 1 A 14 14 LEU CB C 14 41.228 41.501 -0.273 2
1 214 . 1 1 A 14 14 LEU N N 14 122.266 121.217 1.049 2
1 215 . 1 1 A 15 15 ILE H H 15 8.074 7.997 0.077 2
1 216 . 1 1 A 15 15 ILE HA H 15 3.264 3.489 -0.225 2
1 226 . 1 1 A 15 15 ILE C C 15 177.000 177.889 -0.889 2
1 227 . 1 1 A 15 15 ILE CA C 15 65.939 65.529 0.410 2
1 228 . 1 1 A 15 15 ILE CB C 15 37.983 37.766 0.217 2
1 232 . 1 1 A 15 15 ILE N N 15 118.214 119.664 -1.450 2
1 233 . 1 1 A 16 16 GLU H H 16 8.016 8.434 -0.418 2
1 234 . 1 1 A 16 16 GLU HA H 16 4.045 3.942 0.103 2
1 239 . 1 1 A 16 16 GLU C C 16 179.388 179.600 -0.212 2
1 240 . 1 1 A 16 16 GLU CA C 16 59.032 59.862 -0.830 2
1 241 . 1 1 A 16 16 GLU CB C 16 29.200 29.264 -0.064 2
1 243 . 1 1 A 16 16 GLU N N 16 118.484 119.089 -0.605 2
1 244 . 1 1 A 17 17 GLU H H 17 8.063 8.234 -0.171 2
1 245 . 1 1 A 17 17 GLU HA H 17 4.053 4.027 0.026 2
1 250 . 1 1 A 17 17 GLU C C 17 179.306 179.210 0.096 2
1 251 . 1 1 A 17 17 GLU CA C 17 58.636 59.278 -0.642 2
1 252 . 1 1 A 17 17 GLU CB C 17 29.011 29.416 -0.405 2
1 254 . 1 1 A 17 17 GLU N N 17 118.100 120.589 -2.489 2
1 255 . 1 1 A 18 18 ALA H H 18 8.655 8.138 0.517 2
1 256 . 1 1 A 18 18 ALA HA H 18 3.775 4.038 -0.263 2
1 260 . 1 1 A 18 18 ALA C C 18 178.559 179.768 -1.209 2
1 261 . 1 1 A 18 18 ALA CA C 18 54.960 55.382 -0.422 2
1 262 . 1 1 A 18 18 ALA CB C 18 17.960 18.221 -0.261 2
1 263 . 1 1 A 18 18 ALA N N 18 122.439 122.709 -0.270 2
1 264 . 1 1 A 19 19 ARG H H 19 8.900 8.106 0.794 2
1 265 . 1 1 A 19 19 ARG HA H 19 3.809 4.070 -0.261 2
1 273 . 1 1 A 19 19 ARG C C 19 178.721 178.987 -0.266 2
1 274 . 1 1 A 19 19 ARG CA C 19 59.976 59.788 0.188 2
1 275 . 1 1 A 19 19 ARG CB C 19 29.572 29.935 -0.363 2
1 278 . 1 1 A 19 19 ARG N N 19 118.563 117.733 0.830 2
1 280 . 1 1 A 20 20 LYS H H 20 7.792 8.099 -0.307 2
1 281 . 1 1 A 20 20 LYS HA H 20 4.052 4.034 0.018 2
1 290 . 1 1 A 20 20 LYS C C 20 179.648 179.698 -0.050 2
1 291 . 1 1 A 20 20 LYS CA C 20 59.296 59.170 0.126 2
1 292 . 1 1 A 20 20 LYS CB C 20 32.216 32.197 0.019 2
1 296 . 1 1 A 20 20 LYS N N 20 118.638 119.432 -0.794 2
1 297 . 1 1 A 21 21 MET H H 21 7.684 8.075 -0.391 2
1 298 . 1 1 A 21 21 MET HA H 21 4.411 4.149 0.262 2
1 306 . 1 1 A 21 21 MET C C 21 177.909 178.142 -0.233 2
1 307 . 1 1 A 21 21 MET CA C 21 57.009 59.249 -2.240 2
1 308 . 1 1 A 21 21 MET CB C 21 32.028 32.677 -0.649 2
1 311 . 1 1 A 21 21 MET N N 21 118.100 118.537 -0.437 2
1 312 . 1 1 A 22 22 ALA H H 22 8.815 8.313 0.502 2
1 313 . 1 1 A 22 22 ALA HA H 22 3.826 3.946 -0.120 2
1 317 . 1 1 A 22 22 ALA C C 22 178.835 179.928 -1.093 2
1 318 . 1 1 A 22 22 ALA CA C 22 55.427 55.544 -0.117 2
1 319 . 1 1 A 22 22 ALA CB C 22 18.059 18.437 -0.378 2
1 320 . 1 1 A 22 22 ALA N N 22 122.150 121.250 0.900 2
1 321 . 1 1 A 23 23 GLU H H 23 8.276 8.159 0.117 2
1 322 . 1 1 A 23 23 GLU HA H 23 4.146 3.985 0.161 2
1 327 . 1 1 A 23 23 GLU C C 23 180.151 179.357 0.794 2
1 328 . 1 1 A 23 23 GLU CA C 23 58.999 59.449 -0.450 2
1 329 . 1 1 A 23 23 GLU CB C 23 29.160 29.454 -0.295 2
1 331 . 1 1 A 23 23 GLU N N 23 117.001 117.919 -0.918 2
1 332 . 1 1 A 24 24 LYS H H 24 7.573 7.909 -0.336 2
1 333 . 1 1 A 24 24 LYS HA H 24 4.101 4.067 0.034 2
1 342 . 1 1 A 24 24 LYS C C 24 177.145 178.253 -1.108 2
1 343 . 1 1 A 24 24 LYS CA C 24 58.261 59.011 -0.750 2
1 344 . 1 1 A 24 24 LYS CB C 24 32.079 32.142 -0.063 2
1 348 . 1 1 A 24 24 LYS N N 24 119.960 119.357 0.603 2
1 349 . 1 1 A 25 25 ALA H H 25 7.710 7.717 -0.007 2
1 350 . 1 1 A 25 25 ALA HA H 25 4.413 4.363 0.050 2
1 354 . 1 1 A 25 25 ALA C C 25 175.325 176.717 -1.392 2
1 355 . 1 1 A 25 25 ALA CA C 25 51.208 51.956 -0.748 2
1 356 . 1 1 A 25 25 ALA CB C 25 18.520 19.259 -0.738 2
1 357 . 1 1 A 25 25 ALA N N 25 119.257 118.741 0.516 2
1 358 . 1 1 A 26 26 ASN H H 26 7.840 7.947 -0.107 2
1 359 . 1 1 A 26 26 ASN HA H 26 4.357 4.319 0.038 2
1 364 . 1 1 A 26 26 ASN C C 26 173.587 173.992 -0.405 2
1 365 . 1 1 A 26 26 ASN CA C 26 54.307 54.517 -0.210 2
1 366 . 1 1 A 26 26 ASN CB C 26 36.972 37.159 -0.187 2
1 367 . 1 1 A 26 26 ASN N N 26 115.266 114.264 1.002 2
1 369 . 1 1 A 27 27 LEU H H 27 8.241 7.912 0.329 2
1 370 . 1 1 A 27 27 LEU HA H 27 4.652 4.491 0.161 2
1 380 . 1 1 A 27 27 LEU C C 27 175.894 176.007 -0.113 2
1 381 . 1 1 A 27 27 LEU CA C 27 52.923 53.719 -0.796 2
1 382 . 1 1 A 27 27 LEU CB C 27 44.090 43.178 0.912 2
1 386 . 1 1 A 27 27 LEU N N 27 116.828 119.447 -2.619 2
1 387 . 1 1 A 28 28 GLU H H 28 7.798 8.336 -0.538 2
1 388 . 1 1 A 28 28 GLU HA H 28 4.310 4.648 -0.338 2
1 393 . 1 1 A 28 28 GLU C C 28 173.944 175.222 -1.278 2
1 394 . 1 1 A 28 28 GLU CA C 28 55.460 56.004 -0.544 2
1 395 . 1 1 A 28 28 GLU CB C 28 30.512 30.429 0.083 2
1 397 . 1 1 A 28 28 GLU N N 28 121.340 123.298 -1.958 2
1 398 . 1 1 A 29 29 LEU H H 29 8.451 8.902 -0.451 2
1 399 . 1 1 A 29 29 LEU HA H 29 5.662 5.318 0.344 2
1 409 . 1 1 A 29 29 LEU C C 29 176.902 174.818 2.084 2
1 410 . 1 1 A 29 29 LEU CA C 29 53.186 53.971 -0.785 2
1 411 . 1 1 A 29 29 LEU CB C 29 44.914 44.658 0.256 2
1 415 . 1 1 A 29 29 LEU N N 29 126.547 128.191 -1.644 2
1 416 . 1 1 A 30 30 ARG H H 30 9.094 9.228 -0.134 2
1 417 . 1 1 A 30 30 ARG HA H 30 4.910 4.845 0.065 2
1 425 . 1 1 A 30 30 ARG C C 30 175.147 175.593 -0.446 2
1 426 . 1 1 A 30 30 ARG CA C 30 53.417 54.399 -0.982 2
1 427 . 1 1 A 30 30 ARG CB C 30 32.555 32.914 -0.359 2
1 430 . 1 1 A 30 30 ARG N N 30 125.043 126.246 -1.203 2
1 432 . 1 1 A 31 31 THR H H 31 8.496 8.529 -0.033 2
1 433 . 1 1 A 31 31 THR HA H 31 4.888 4.866 0.022 2
1 438 . 1 1 A 31 31 THR C C 31 173.961 174.031 -0.070 2
1 439 . 1 1 A 31 31 THR CA C 31 60.445 60.928 -0.482 2
1 440 . 1 1 A 31 31 THR CB C 31 69.492 69.931 -0.439 2
1 442 . 1 1 A 31 31 THR N N 31 114.745 115.299 -0.554 2
1 443 . 1 1 A 32 32 VAL H H 32 8.480 9.045 -0.565 2
1 444 . 1 1 A 32 32 VAL HA H 32 4.411 4.543 -0.132 2
1 452 . 1 1 A 32 32 VAL C C 32 175.082 175.515 -0.433 2
1 453 . 1 1 A 32 32 VAL CA C 32 60.946 61.517 -0.571 2
1 454 . 1 1 A 32 32 VAL CB C 32 34.487 33.481 1.006 2
1 457 . 1 1 A 32 32 VAL N N 32 122.324 125.738 -3.414 2
1 458 . 1 1 A 33 33 LYS H H 33 9.304 8.885 0.419 2
1 459 . 1 1 A 33 33 LYS HA H 33 4.534 4.539 -0.005 2
1 468 . 1 1 A 33 33 LYS C C 33 176.740 176.480 0.260 2
1 469 . 1 1 A 33 33 LYS CA C 33 56.846 57.115 -0.269 2
1 470 . 1 1 A 33 33 LYS CB C 33 34.355 34.216 0.139 2
1 474 . 1 1 A 33 33 LYS N N 33 123.654 125.826 -2.172 2
1 475 . 1 1 A 34 34 THR H H 34 7.245 7.649 -0.404 2
1 476 . 1 1 A 34 34 THR HA H 34 4.780 4.640 0.140 2
1 481 . 1 1 A 34 34 THR C C 34 174.529 175.395 -0.866 2
1 482 . 1 1 A 34 34 THR CA C 34 58.859 59.787 -0.928 2
1 483 . 1 1 A 34 34 THR CB C 34 73.023 72.137 0.886 2
1 485 . 1 1 A 34 34 THR N N 34 106.300 111.394 -5.094 2
1 486 . 1 1 A 35 35 GLU H H 35 9.174 8.944 0.230 2
1 487 . 1 1 A 35 35 GLU HA H 35 3.886 3.954 -0.068 2
1 492 . 1 1 A 35 35 GLU C C 35 177.714 177.523 0.191 2
1 493 . 1 1 A 35 35 GLU CA C 35 59.233 59.626 -0.393 2
1 494 . 1 1 A 35 35 GLU CB C 35 29.377 29.405 -0.028 2
1 496 . 1 1 A 35 35 GLU N N 35 121.919 122.059 -0.140 2
1 497 . 1 1 A 36 36 ASP H H 36 8.185 8.346 -0.161 2
1 498 . 1 1 A 36 36 ASP HA H 36 4.289 4.304 -0.015 2
1 501 . 1 1 A 36 36 ASP C C 36 178.348 178.537 -0.189 2
1 502 . 1 1 A 36 36 ASP CA C 36 56.962 57.596 -0.634 2
1 503 . 1 1 A 36 36 ASP CB C 36 40.214 41.700 -1.487 2
1 504 . 1 1 A 36 36 ASP N N 36 118.332 119.898 -1.566 2
1 505 . 1 1 A 37 37 GLU H H 37 7.741 7.754 -0.013 2
1 506 . 1 1 A 37 37 GLU HA H 37 3.708 3.872 -0.164 2
1 511 . 1 1 A 37 37 GLU C C 37 177.324 178.817 -1.493 2
1 512 . 1 1 A 37 37 GLU CA C 37 58.698 59.156 -0.458 2
1 513 . 1 1 A 37 37 GLU CB C 37 30.199 29.427 0.772 2
1 515 . 1 1 A 37 37 GLU N N 37 120.704 119.085 1.619 2
1 516 . 1 1 A 38 38 LEU H H 38 7.531 8.090 -0.559 2
1 517 . 1 1 A 38 38 LEU HA H 38 3.873 4.119 -0.246 2
1 527 . 1 1 A 38 38 LEU C C 38 177.357 178.530 -1.173 2
1 528 . 1 1 A 38 38 LEU CA C 38 58.305 58.253 0.052 2
1 529 . 1 1 A 38 38 LEU CB C 38 40.837 41.630 -0.792 2
1 533 . 1 1 A 38 38 LEU N N 38 119.200 121.739 -2.539 2
1 534 . 1 1 A 39 39 LYS H H 39 8.083 8.070 0.013 2
1 535 . 1 1 A 39 39 LYS HA H 39 3.608 3.902 -0.294 2
1 544 . 1 1 A 39 39 LYS C C 39 177.373 178.819 -1.446 2
1 545 . 1 1 A 39 39 LYS CA C 39 60.290 59.625 0.665 2
1 546 . 1 1 A 39 39 LYS CB C 39 32.178 32.316 -0.138 2
1 550 . 1 1 A 39 39 LYS N N 39 116.943 118.803 -1.860 2
1 551 . 1 1 A 40 40 LYS H H 40 7.632 8.014 -0.382 2
1 552 . 1 1 A 40 40 LYS HA H 40 3.864 3.967 -0.103 2
1 561 . 1 1 A 40 40 LYS C C 40 179.566 178.459 1.107 2
1 562 . 1 1 A 40 40 LYS CA C 40 58.993 58.934 0.059 2
1 563 . 1 1 A 40 40 LYS CB C 40 31.758 31.953 -0.195 2
1 567 . 1 1 A 40 40 LYS N N 40 118.274 119.103 -0.829 2
1 568 . 1 1 A 41 41 TYR H H 41 7.823 7.799 0.024 2
1 569 . 1 1 A 41 41 TYR HA H 41 3.926 3.991 -0.065 2
1 576 . 1 1 A 41 41 TYR C C 41 176.625 177.786 -1.161 2
1 577 . 1 1 A 41 41 TYR CA C 41 59.757 60.745 -0.988 2
1 578 . 1 1 A 41 41 TYR CB C 41 36.901 37.922 -1.020 2
1 583 . 1 1 A 41 41 TYR N N 41 117.811 119.025 -1.214 2
1 584 . 1 1 A 42 42 LEU H H 42 7.964 8.226 -0.262 2
1 585 . 1 1 A 42 42 LEU HA H 42 3.704 3.939 -0.235 2
1 595 . 1 1 A 42 42 LEU C C 42 178.396 179.213 -0.817 2
1 596 . 1 1 A 42 42 LEU CA C 42 58.237 57.831 0.406 2
1 597 . 1 1 A 42 42 LEU CB C 42 40.507 41.247 -0.740 2
1 601 . 1 1 A 42 42 LEU N N 42 115.960 120.110 -4.150 2
1 602 . 1 1 A 43 43 GLU H H 43 8.193 8.206 -0.013 2
1 603 . 1 1 A 43 43 GLU HA H 43 3.882 3.889 -0.007 2
1 608 . 1 1 A 43 43 GLU C C 43 179.193 179.171 0.023 2
1 609 . 1 1 A 43 43 GLU CA C 43 59.122 59.802 -0.680 2
1 610 . 1 1 A 43 43 GLU CB C 43 29.244 29.154 0.089 2
1 612 . 1 1 A 43 43 GLU N N 43 117.175 118.539 -1.364 2
1 613 . 1 1 A 44 44 GLU H H 44 7.601 7.655 -0.055 2
1 614 . 1 1 A 44 44 GLU HA H 44 3.936 3.986 -0.050 2
1 619 . 1 1 A 44 44 GLU C C 44 179.875 178.935 0.940 2
1 620 . 1 1 A 44 44 GLU CA C 44 58.867 59.175 -0.308 2
1 621 . 1 1 A 44 44 GLU CB C 44 28.648 29.166 -0.518 2
1 623 . 1 1 A 44 44 GLU N N 44 120.472 119.384 1.088 2
1 624 . 1 1 A 45 45 PHE H H 45 8.260 7.615 0.645 2
1 625 . 1 1 A 45 45 PHE HA H 45 4.520 4.170 0.350 2
1 633 . 1 1 A 45 45 PHE C C 45 177.942 178.324 -0.382 2
1 634 . 1 1 A 45 45 PHE CA C 45 55.945 61.052 -5.107 2
1 635 . 1 1 A 45 45 PHE CB C 45 36.680 38.198 -1.518 2
1 641 . 1 1 A 45 45 PHE N N 45 119.272 118.988 0.284 2
1 642 . 1 1 A 46 46 ARG H H 46 8.023 8.197 -0.175 2
1 643 . 1 1 A 46 46 ARG HA H 46 4.074 4.057 0.017 2
1 651 . 1 1 A 46 46 ARG C C 46 177.617 178.939 -1.322 2
1 652 . 1 1 A 46 46 ARG CA C 46 58.194 59.326 -1.132 2
1 653 . 1 1 A 46 46 ARG CB C 46 29.737 29.960 -0.223 2
1 656 . 1 1 A 46 46 ARG N N 46 118.136 120.402 -2.266 2
1 658 . 1 1 A 47 47 LYS H H 47 7.470 7.861 -0.391 2
1 659 . 1 1 A 47 47 LYS HA H 47 4.143 4.095 0.048 2
1 668 . 1 1 A 47 47 LYS C C 47 177.324 178.100 -0.776 2
1 669 . 1 1 A 47 47 LYS CA C 47 57.726 59.482 -1.756 2
1 670 . 1 1 A 47 47 LYS CB C 47 32.409 32.302 0.107 2
1 674 . 1 1 A 47 47 LYS N N 47 116.943 119.525 -2.582 2
1 675 . 1 1 A 48 48 GLU H H 48 7.615 7.843 -0.228 2
1 676 . 1 1 A 48 48 GLU HA H 48 4.428 4.666 -0.238 2
1 681 . 1 1 A 48 48 GLU C C 48 176.869 176.948 -0.079 2
1 682 . 1 1 A 48 48 GLU CA C 48 55.945 56.018 -0.073 2
1 683 . 1 1 A 48 48 GLU CB C 48 29.696 30.127 -0.431 2
1 685 . 1 1 A 48 48 GLU N N 48 118.852 116.865 1.987 2
1 686 . 1 1 A 49 49 SER H H 49 7.725 7.954 -0.229 2
1 687 . 1 1 A 49 49 SER HA H 49 4.244 4.291 -0.047 2
1 690 . 1 1 A 49 49 SER C C 49 174.838 176.214 -1.376 2
1 691 . 1 1 A 49 49 SER CA C 49 59.366 60.484 -1.118 2
1 692 . 1 1 A 49 49 SER CB C 49 63.116 62.806 0.310 2
1 693 . 1 1 A 49 49 SER N N 49 114.224 116.132 -1.908 2
1 694 . 1 1 A 50 50 GLN H H 50 8.548 8.064 0.484 2
1 695 . 1 1 A 50 50 GLN HA H 50 4.398 4.217 0.181 2
1 702 . 1 1 A 50 50 GLN C C 50 175.732 176.711 -0.979 2
1 703 . 1 1 A 50 50 GLN CA C 50 56.272 58.286 -2.014 2
1 704 . 1 1 A 50 50 GLN CB C 50 28.946 29.206 -0.260 2
1 706 . 1 1 A 50 50 GLN N N 50 120.125 120.398 -0.273 2
1 708 . 1 1 A 51 51 ASN H H 51 8.534 8.043 0.491 2
1 709 . 1 1 A 51 51 ASN HA H 51 4.980 4.949 0.031 2
1 714 . 1 1 A 51 51 ASN C C 51 173.717 173.972 -0.256 2
1 715 . 1 1 A 51 51 ASN CA C 51 52.804 52.648 0.156 2
1 716 . 1 1 A 51 51 ASN CB C 51 39.583 39.540 0.043 2
1 717 . 1 1 A 51 51 ASN N N 51 118.158 115.076 3.082 2
1 719 . 1 1 A 52 52 ILE H H 52 7.492 7.583 -0.091 2
1 720 . 1 1 A 52 52 ILE HA H 52 5.338 5.217 0.121 2
1 730 . 1 1 A 52 52 ILE C C 52 175.049 174.100 0.949 2
1 731 . 1 1 A 52 52 ILE CA C 52 59.364 59.799 -0.435 2
1 732 . 1 1 A 52 52 ILE CB C 52 42.163 41.366 0.797 2
1 736 . 1 1 A 52 52 ILE N N 52 117.927 121.735 -3.808 2
1 737 . 1 1 A 53 53 LYS H H 53 8.467 9.081 -0.614 2
1 738 . 1 1 A 53 53 LYS HA H 53 5.044 5.266 -0.222 2
1 747 . 1 1 A 53 53 LYS C C 53 175.082 175.355 -0.273 2
1 748 . 1 1 A 53 53 LYS CA C 53 55.429 54.905 0.524 2
1 749 . 1 1 A 53 53 LYS CB C 53 36.446 35.982 0.464 2
1 753 . 1 1 A 53 53 LYS N N 53 123.249 127.856 -4.607 2
1 754 . 1 1 A 54 54 VAL H H 54 8.490 8.906 -0.416 2
1 755 . 1 1 A 54 54 VAL HA H 54 5.159 4.959 0.200 2
1 763 . 1 1 A 54 54 VAL C C 54 173.473 173.678 -0.205 2
1 764 . 1 1 A 54 54 VAL CA C 54 60.163 60.889 -0.726 2
1 765 . 1 1 A 54 54 VAL CB C 54 35.509 33.888 1.621 2
1 768 . 1 1 A 54 54 VAL N N 54 120.762 124.161 -3.399 2
1 769 . 1 1 A 55 55 LEU H H 55 8.636 8.730 -0.095 2
1 770 . 1 1 A 55 55 LEU HA H 55 4.670 4.710 -0.040 2
1 780 . 1 1 A 55 55 LEU C C 55 173.652 174.364 -0.712 2
1 781 . 1 1 A 55 55 LEU CA C 55 52.289 53.137 -0.848 2
1 782 . 1 1 A 55 55 LEU CB C 55 42.070 43.442 -1.372 2
1 786 . 1 1 A 55 55 LEU N N 55 131.898 129.316 2.582 2
1 787 . 1 1 A 56 56 ILE H H 56 9.188 9.143 0.045 2
1 788 . 1 1 A 56 56 ILE HA H 56 4.879 5.055 -0.176 2
1 798 . 1 1 A 56 56 ILE C C 56 174.172 174.356 -0.184 2
1 799 . 1 1 A 56 56 ILE CA C 56 59.976 59.835 0.141 2
1 800 . 1 1 A 56 56 ILE CB C 56 38.181 39.576 -1.395 2
1 804 . 1 1 A 56 56 ILE N N 56 126.373 128.089 -1.716 2
1 805 . 1 1 A 57 57 LEU H H 57 8.929 9.300 -0.371 2
1 806 . 1 1 A 57 57 LEU HA H 57 5.394 5.223 0.171 2
1 816 . 1 1 A 57 57 LEU C C 57 175.358 175.954 -0.596 2
1 817 . 1 1 A 57 57 LEU CA C 57 52.086 53.287 -1.201 2
1 818 . 1 1 A 57 57 LEU CB C 57 42.445 42.986 -0.541 2
1 822 . 1 1 A 57 57 LEU N N 57 126.547 128.227 -1.680 2
1 823 . 1 1 A 58 58 VAL H H 58 8.542 8.976 -0.434 2
1 824 . 1 1 A 58 58 VAL HA H 58 5.253 4.795 0.458 2
1 832 . 1 1 A 58 58 VAL C C 58 175.244 175.804 -0.560 2
1 833 . 1 1 A 58 58 VAL CA C 58 58.241 59.149 -0.908 2
1 834 . 1 1 A 58 58 VAL CB C 58 33.165 34.605 -1.440 2
1 837 . 1 1 A 58 58 VAL N N 58 114.398 121.420 -7.022 2
1 838 . 1 1 A 59 59 SER H H 59 8.797 8.716 0.081 2
1 839 . 1 1 A 59 59 SER HA H 59 5.063 4.538 0.525 2
1 842 . 1 1 A 59 59 SER C C 59 174.172 174.097 0.075 2
1 843 . 1 1 A 59 59 SER CA C 59 59.320 60.171 -0.851 2
1 844 . 1 1 A 59 59 SER CB C 59 65.600 63.803 1.797 2
1 845 . 1 1 A 59 59 SER N N 59 115.497 116.518 -1.021 2
1 846 . 1 1 A 60 60 ASN H H 60 7.730 7.946 -0.216 2
1 847 . 1 1 A 60 60 ASN HA H 60 4.811 5.107 -0.296 2
1 852 . 1 1 A 60 60 ASN C C 60 174.464 175.290 -0.826 2
1 853 . 1 1 A 60 60 ASN CA C 60 52.007 52.139 -0.132 2
1 854 . 1 1 A 60 60 ASN CB C 60 40.336 41.178 -0.842 2
1 855 . 1 1 A 60 60 ASN N N 60 117.522 117.351 0.171 2
1 857 . 1 1 A 61 61 ASP H H 61 8.577 8.988 -0.411 2
1 858 . 1 1 A 61 61 ASP HA H 61 4.365 4.295 0.070 2
1 861 . 1 1 A 61 61 ASP C C 61 177.357 178.286 -0.929 2
1 862 . 1 1 A 61 61 ASP CA C 61 57.351 57.025 0.326 2
1 863 . 1 1 A 61 61 ASP CB C 61 40.383 40.181 0.202 2
1 864 . 1 1 A 61 61 ASP N N 61 119.431 122.025 -2.594 2
1 865 . 1 1 A 62 62 GLU H H 62 8.405 8.383 0.022 2
1 866 . 1 1 A 62 62 GLU HA H 62 4.121 4.026 0.095 2
1 871 . 1 1 A 62 62 GLU C C 62 179.615 179.073 0.542 2
1 872 . 1 1 A 62 62 GLU CA C 62 59.593 59.626 -0.033 2
1 873 . 1 1 A 62 62 GLU CB C 62 28.478 29.196 -0.718 2
1 875 . 1 1 A 62 62 GLU N N 62 122.150 119.934 2.216 2
1 876 . 1 1 A 63 63 GLU H H 63 8.384 8.206 0.178 2
1 877 . 1 1 A 63 63 GLU HA H 63 3.913 4.013 -0.100 2
1 882 . 1 1 A 63 63 GLU C C 63 178.478 179.048 -0.570 2
1 883 . 1 1 A 63 63 GLU CA C 63 58.273 59.111 -0.838 2
1 884 . 1 1 A 63 63 GLU CB C 63 29.931 29.099 0.832 2
1 886 . 1 1 A 63 63 GLU N N 63 119.084 119.227 -0.143 2
1 887 . 1 1 A 64 64 LEU H H 64 7.717 8.063 -0.346 2
1 888 . 1 1 A 64 64 LEU HA H 64 3.750 4.022 -0.272 2
1 898 . 1 1 A 64 64 LEU C C 64 177.535 178.079 -0.544 2
1 899 . 1 1 A 64 64 LEU CA C 64 58.944 58.366 0.578 2
1 900 . 1 1 A 64 64 LEU CB C 64 41.695 41.546 0.149 2
1 904 . 1 1 A 64 64 LEU N N 64 120.357 122.186 -1.829 2
1 905 . 1 1 A 65 65 ASP H H 65 7.922 8.260 -0.338 2
1 906 . 1 1 A 65 65 ASP HA H 65 4.313 4.258 0.055 2
1 909 . 1 1 A 65 65 ASP C C 65 179.095 178.773 0.322 2
1 910 . 1 1 A 65 65 ASP CA C 65 57.272 57.683 -0.411 2
1 911 . 1 1 A 65 65 ASP CB C 65 40.196 41.269 -1.073 2
1 912 . 1 1 A 65 65 ASP N N 65 118.100 118.489 -0.389 2
1 913 . 1 1 A 66 66 LYS H H 66 7.802 7.946 -0.144 2
1 914 . 1 1 A 66 66 LYS HA H 66 4.078 3.965 0.113 2
1 923 . 1 1 A 66 66 LYS C C 66 178.624 178.939 -0.315 2
1 924 . 1 1 A 66 66 LYS CA C 66 58.429 59.374 -0.945 2
1 925 . 1 1 A 66 66 LYS CB C 66 31.727 32.211 -0.484 2
1 929 . 1 1 A 66 66 LYS N N 66 119.343 118.515 0.828 2
1 930 . 1 1 A 67 67 ALA H H 67 8.480 8.281 0.199 2
1 931 . 1 1 A 67 67 ALA HA H 67 3.853 4.106 -0.253 2
1 935 . 1 1 A 67 67 ALA C C 67 178.591 179.548 -0.957 2
1 936 . 1 1 A 67 67 ALA CA C 67 55.403 55.307 0.096 2
1 937 . 1 1 A 67 67 ALA CB C 67 17.793 18.470 -0.677 2
1 938 . 1 1 A 67 67 ALA N N 67 121.562 122.361 -0.799 2
1 939 . 1 1 A 68 68 LYS H H 68 8.186 7.751 0.435 2
1 940 . 1 1 A 68 68 LYS HA H 68 3.805 4.042 -0.237 2
1 949 . 1 1 A 68 68 LYS C C 68 179.095 178.804 0.291 2
1 950 . 1 1 A 68 68 LYS CA C 68 59.952 59.168 0.784 2
1 951 . 1 1 A 68 68 LYS CB C 68 32.181 31.966 0.215 2
1 955 . 1 1 A 68 68 LYS N N 68 116.165 116.781 -0.616 2
1 956 . 1 1 A 69 69 GLU H H 69 7.904 8.138 -0.234 2
1 957 . 1 1 A 69 69 GLU HA H 69 3.995 4.047 -0.052 2
1 962 . 1 1 A 69 69 GLU C C 69 179.079 179.292 -0.213 2
1 963 . 1 1 A 69 69 GLU CA C 69 59.022 59.040 -0.018 2
1 964 . 1 1 A 69 69 GLU CB C 69 29.274 29.464 -0.190 2
1 966 . 1 1 A 69 69 GLU N N 69 119.489 119.506 -0.017 2
1 967 . 1 1 A 70 70 LEU H H 70 7.962 8.062 -0.100 2
1 968 . 1 1 A 70 70 LEU HA H 70 4.020 3.950 0.070 2
1 978 . 1 1 A 70 70 LEU C C 70 178.738 178.922 -0.184 2
1 979 . 1 1 A 70 70 LEU CA C 70 57.486 57.909 -0.423 2
1 980 . 1 1 A 70 70 LEU CB C 70 41.695 41.587 0.108 2
1 984 . 1 1 A 70 70 LEU N N 70 119.431 120.389 -0.958 2
1 985 . 1 1 A 71 71 ALA H H 71 8.260 8.265 -0.005 2
1 986 . 1 1 A 71 71 ALA HA H 71 3.845 4.055 -0.210 2
1 990 . 1 1 A 71 71 ALA C C 71 179.518 180.071 -0.553 2
1 991 . 1 1 A 71 71 ALA CA C 71 55.139 55.437 -0.298 2
1 992 . 1 1 A 71 71 ALA CB C 71 18.487 18.396 0.091 2
1 993 . 1 1 A 71 71 ALA N N 71 119.604 121.340 -1.736 2
1 994 . 1 1 A 72 72 GLN H H 72 7.910 8.270 -0.360 2
1 995 . 1 1 A 72 72 GLN HA H 72 4.154 3.998 0.156 2
1 1002 . 1 1 A 72 72 GLN C C 72 178.900 178.751 0.149 2
1 1003 . 1 1 A 72 72 GLN CA C 72 58.194 58.819 -0.625 2
1 1004 . 1 1 A 72 72 GLN CB C 72 28.056 28.355 -0.299 2
1 1006 . 1 1 A 72 72 GLN N N 72 115.960 117.534 -1.574 2
1 1008 . 1 1 A 73 73 LYS H H 73 7.841 8.002 -0.161 2
1 1009 . 1 1 A 73 73 LYS HA H 73 4.171 4.130 0.041 2
1 1018 . 1 1 A 73 73 LYS C C 73 177.730 178.107 -0.378 2
1 1019 . 1 1 A 73 73 LYS CA C 73 57.867 58.664 -0.797 2
1 1020 . 1 1 A 73 73 LYS CB C 73 32.277 32.317 -0.040 2
1 1024 . 1 1 A 73 73 LYS N N 73 119.027 119.164 -0.137 2
1 1025 . 1 1 A 74 74 MET H H 74 7.746 7.808 -0.062 2
1 1026 . 1 1 A 74 74 MET HA H 74 4.403 4.563 -0.160 2
1 1034 . 1 1 A 74 74 MET C C 74 174.416 174.937 -0.521 2
1 1035 . 1 1 A 74 74 MET CA C 74 55.194 55.239 -0.045 2
1 1036 . 1 1 A 74 74 MET CB C 74 33.366 33.170 0.196 2
1 1039 . 1 1 A 74 74 MET N N 74 115.786 115.485 0.301 2
1 1040 . 1 1 A 75 75 GLU H H 75 8.076 7.860 0.216 2
1 1041 . 1 1 A 75 75 GLU HA H 75 4.001 3.905 0.097 2
1 1046 . 1 1 A 75 75 GLU C C 75 175.130 175.100 0.030 2
1 1047 . 1 1 A 75 75 GLU CA C 75 56.722 57.532 -0.810 2
1 1048 . 1 1 A 75 75 GLU CB C 75 27.118 27.341 -0.223 2
1 1050 . 1 1 A 75 75 GLU N N 75 116.249 116.203 0.046 2
1 1051 . 1 1 A 76 76 ILE H H 76 7.560 7.771 -0.211 2
1 1052 . 1 1 A 76 76 ILE HA H 76 4.428 4.486 -0.058 2
1 1062 . 1 1 A 76 76 ILE C C 76 174.529 174.788 -0.259 2
1 1063 . 1 1 A 76 76 ILE CA C 76 58.475 60.059 -1.584 2
1 1064 . 1 1 A 76 76 ILE CB C 76 40.337 40.224 0.113 2
1 1068 . 1 1 A 76 76 ILE N N 76 115.960 119.612 -3.652 2
1 1069 . 1 1 A 77 77 ASP H H 77 8.889 8.712 0.177 2
1 1070 . 1 1 A 77 77 ASP HA H 77 4.569 4.908 -0.339 2
1 1073 . 1 1 A 77 77 ASP C C 77 174.123 175.953 -1.830 2
1 1074 . 1 1 A 77 77 ASP CA C 77 54.069 53.940 0.129 2
1 1075 . 1 1 A 77 77 ASP CB C 77 40.233 41.055 -0.822 2
1 1076 . 1 1 A 77 77 ASP N N 77 126.142 127.642 -1.500 2
1 1077 . 1 1 A 78 78 VAL H H 78 7.754 8.832 -1.078 2
1 1078 . 1 1 A 78 78 VAL HA H 78 5.192 5.270 -0.078 2
1 1086 . 1 1 A 78 78 VAL C C 78 174.968 174.191 0.777 2
1 1087 . 1 1 A 78 78 VAL CA C 78 58.804 58.836 -0.032 2
1 1088 . 1 1 A 78 78 VAL CB C 78 35.293 35.456 -0.163 2
1 1091 . 1 1 A 78 78 VAL N N 78 122.844 118.871 3.973 2
1 1092 . 1 1 A 79 79 ARG H H 79 8.499 8.912 -0.413 2
1 1093 . 1 1 A 79 79 ARG HA H 79 4.712 4.820 -0.108 2
1 1100 . 1 1 A 79 79 ARG C C 79 174.221 174.991 -0.770 2
1 1101 . 1 1 A 79 79 ARG CA C 79 54.117 54.897 -0.780 2
1 1102 . 1 1 A 79 79 ARG CB C 79 31.196 31.438 -0.242 2
1 1105 . 1 1 A 79 79 ARG N N 79 125.637 122.004 3.633 2
1 1106 . 1 1 A 80 80 THR H H 80 8.416 8.695 -0.280 2
1 1107 . 1 1 A 80 80 THR HA H 80 5.332 4.881 0.451 2
1 1112 . 1 1 A 80 80 THR C C 80 174.497 174.055 0.442 2
1 1113 . 1 1 A 80 80 THR CA C 80 59.694 61.526 -1.832 2
1 1114 . 1 1 A 80 80 THR CB C 80 69.772 69.512 0.260 2
1 1116 . 1 1 A 80 80 THR N N 80 118.084 119.371 -1.287 2
1 1117 . 1 1 A 81 81 ARG H H 81 8.758 9.000 -0.242 2
1 1118 . 1 1 A 81 81 ARG HA H 81 4.362 4.770 -0.408 2
1 1126 . 1 1 A 81 81 ARG C C 81 173.733 173.977 -0.244 2
1 1127 . 1 1 A 81 81 ARG CA C 81 53.273 53.844 -0.571 2
1 1128 . 1 1 A 81 81 ARG CB C 81 33.915 33.204 0.711 2
1 1131 . 1 1 A 81 81 ARG N N 81 122.844 124.781 -1.937 2
1 1133 . 1 1 A 82 82 LYS H H 82 8.721 8.534 0.187 2
1 1134 . 1 1 A 82 82 LYS HA H 82 4.701 5.094 -0.393 2
1 1143 . 1 1 A 82 82 LYS C C 82 175.667 175.788 -0.121 2
1 1144 . 1 1 A 82 82 LYS CA C 82 54.960 55.187 -0.227 2
1 1145 . 1 1 A 82 82 LYS CB C 82 32.603 34.192 -1.589 2
1 1149 . 1 1 A 82 82 LYS N N 82 124.668 123.547 1.120 2
1 1150 . 1 1 A 83 83 VAL H H 83 9.112 9.187 -0.075 2
1 1151 . 1 1 A 83 83 VAL HA H 83 4.796 4.902 -0.106 2
1 1159 . 1 1 A 83 83 VAL C C 83 174.594 175.255 -0.661 2
1 1160 . 1 1 A 83 83 VAL CA C 83 59.413 60.021 -0.608 2
1 1161 . 1 1 A 83 83 VAL CB C 83 35.298 34.823 0.475 2
1 1164 . 1 1 A 83 83 VAL N N 83 122.381 121.446 0.935 2
1 1165 . 1 1 A 84 84 THR H H 84 9.200 8.729 0.471 2
1 1166 . 1 1 A 84 84 THR HA H 84 4.579 4.581 -0.002 2
1 1171 . 1 1 A 84 84 THR C C 84 173.993 174.758 -0.765 2
1 1172 . 1 1 A 84 84 THR CA C 84 60.960 61.874 -0.914 2
1 1173 . 1 1 A 84 84 THR CB C 84 70.100 69.935 0.165 2
1 1175 . 1 1 A 84 84 THR N N 84 113.183 115.540 -2.357 2
1 1176 . 1 1 A 85 85 SER H H 85 7.688 7.965 -0.277 2
1 1177 . 1 1 A 85 85 SER HA H 85 5.136 4.769 0.367 2
1 1180 . 1 1 A 85 85 SER CA C 85 55.205 56.115 -0.910 2
1 1181 . 1 1 A 85 85 SER CB C 85 64.376 64.349 0.027 2
1 1182 . 1 1 A 85 85 SER N N 85 115.555 117.080 -1.525 2
1 1183 . 1 1 A 86 86 PRO HA H 86 4.090 4.274 -0.184 2
1 1190 . 1 1 A 86 86 PRO C C 86 177.227 177.894 -0.667 2
1 1191 . 1 1 A 86 86 PRO CA C 86 65.038 65.696 -0.658 2
1 1192 . 1 1 A 86 86 PRO CB C 86 31.711 31.793 -0.082 2
1 1195 . 1 1 A 87 87 ASP H H 87 8.131 8.523 -0.392 2
1 1196 . 1 1 A 87 87 ASP HA H 87 4.223 4.350 -0.127 2
1 1199 . 1 1 A 87 87 ASP C C 87 178.721 179.025 -0.304 2
1 1200 . 1 1 A 87 87 ASP CA C 87 57.311 56.887 0.424 2
1 1201 . 1 1 A 87 87 ASP CB C 87 40.102 40.552 -0.450 2
1 1202 . 1 1 A 87 87 ASP N N 87 115.381 116.968 -1.587 2
1 1203 . 1 1 A 88 88 GLU H H 88 7.571 7.997 -0.426 2
1 1204 . 1 1 A 88 88 GLU HA H 88 3.659 4.061 -0.402 2
1 1209 . 1 1 A 88 88 GLU C C 88 177.097 178.775 -1.678 2
1 1210 . 1 1 A 88 88 GLU CA C 88 58.729 58.885 -0.156 2
1 1211 . 1 1 A 88 88 GLU CB C 88 30.052 29.666 0.386 2
1 1213 . 1 1 A 88 88 GLU N N 88 120.009 120.330 -0.321 2
1 1214 . 1 1 A 89 89 ALA H H 89 7.423 7.801 -0.378 2
1 1215 . 1 1 A 89 89 ALA HA H 89 3.900 4.301 -0.401 2
1 1219 . 1 1 A 89 89 ALA C C 89 178.267 180.039 -1.772 2
1 1220 . 1 1 A 89 89 ALA CA C 89 55.607 55.171 0.436 2
1 1221 . 1 1 A 89 89 ALA CB C 89 17.348 18.424 -1.076 2
1 1222 . 1 1 A 89 89 ALA N N 89 118.873 122.288 -3.415 2
1 1223 . 1 1 A 90 90 LYS H H 90 8.046 8.168 -0.122 2
1 1224 . 1 1 A 90 90 LYS HA H 90 3.669 3.981 -0.312 2
1 1233 . 1 1 A 90 90 LYS C C 90 177.649 179.047 -1.398 2
1 1234 . 1 1 A 90 90 LYS CA C 90 60.351 59.794 0.557 2
1 1235 . 1 1 A 90 90 LYS CB C 90 32.087 32.304 -0.217 2
1 1239 . 1 1 A 90 90 LYS N N 90 114.834 117.371 -2.537 2
1 1240 . 1 1 A 91 91 ARG H H 91 7.468 7.906 -0.438 2
1 1241 . 1 1 A 91 91 ARG HA H 91 3.887 3.896 -0.009 2
1 1249 . 1 1 A 91 91 ARG C C 91 178.998 179.090 -0.092 2
1 1250 . 1 1 A 91 91 ARG CA C 91 59.164 59.135 0.029 2
1 1251 . 1 1 A 91 91 ARG CB C 91 29.274 29.756 -0.482 2
1 1254 . 1 1 A 91 91 ARG N N 91 119.029 119.401 -0.372 2
1 1256 . 1 1 A 92 92 TRP H H 92 8.136 8.149 -0.013 2
1 1257 . 1 1 A 92 92 TRP HA H 92 4.818 4.527 0.291 2
1 1266 . 1 1 A 92 92 TRP C C 92 179.566 179.080 0.486 2
1 1267 . 1 1 A 92 92 TRP CA C 92 58.663 59.409 -0.746 2
1 1268 . 1 1 A 92 92 TRP CB C 92 29.790 29.394 0.396 2
1 1274 . 1 1 A 92 92 TRP N N 92 118.100 120.221 -2.121 2
1 1276 . 1 1 A 93 93 ILE H H 93 8.363 8.406 -0.043 2
1 1277 . 1 1 A 93 93 ILE HA H 93 3.544 3.774 -0.230 2
1 1287 . 1 1 A 93 93 ILE C C 93 176.820 178.091 -1.271 2
1 1288 . 1 1 A 93 93 ILE CA C 93 66.225 65.472 0.753 2
1 1289 . 1 1 A 93 93 ILE CB C 93 37.571 37.793 -0.222 2
1 1293 . 1 1 A 93 93 ILE N N 93 120.588 120.422 0.166 2
1 1294 . 1 1 A 94 94 LYS H H 94 8.264 7.829 0.435 2
1 1295 . 1 1 A 94 94 LYS HA H 94 3.865 4.012 -0.147 2
1 1304 . 1 1 A 94 94 LYS C C 94 179.258 178.877 0.381 2
1 1305 . 1 1 A 94 94 LYS CA C 94 59.889 59.746 0.143 2
1 1306 . 1 1 A 94 94 LYS CB C 94 32.225 32.267 -0.042 2
1 1310 . 1 1 A 94 94 LYS N N 94 121.687 120.775 0.911 2
1 1311 . 1 1 A 95 95 GLU H H 95 8.360 8.394 -0.034 2
1 1312 . 1 1 A 95 95 GLU HA H 95 4.023 4.070 -0.047 2
1 1317 . 1 1 A 95 95 GLU C C 95 178.884 179.171 -0.287 2
1 1318 . 1 1 A 95 95 GLU CA C 95 59.366 59.400 -0.034 2
1 1319 . 1 1 A 95 95 GLU CB C 95 29.508 29.427 0.080 2
1 1321 . 1 1 A 95 95 GLU N N 95 118.505 117.917 0.588 2
1 1322 . 1 1 A 96 96 PHE H H 96 8.212 8.470 -0.258 2
1 1323 . 1 1 A 96 96 PHE HA H 96 4.512 4.306 0.206 2
1 1331 . 1 1 A 96 96 PHE C C 96 176.820 178.034 -1.214 2
1 1332 . 1 1 A 96 96 PHE CA C 96 59.608 61.343 -1.735 2
1 1333 . 1 1 A 96 96 PHE CB C 96 40.431 39.182 1.249 2
1 1339 . 1 1 A 96 96 PHE N N 96 120.369 122.195 -1.826 2
1 1340 . 1 1 A 97 97 SER H H 97 8.216 8.204 0.012 2
1 1341 . 1 1 A 97 97 SER HA H 97 3.816 4.075 -0.259 2
1 1344 . 1 1 A 97 97 SER C C 97 175.618 176.973 -1.355 2
1 1345 . 1 1 A 97 97 SER CA C 97 60.492 61.286 -0.794 2
1 1346 . 1 1 A 97 97 SER CB C 97 63.022 62.804 0.218 2
1 1347 . 1 1 A 97 97 SER N N 97 111.969 113.868 -1.899 2
1 1348 . 1 1 A 98 98 GLU H H 98 7.655 7.803 -0.148 2
1 1349 . 1 1 A 98 98 GLU HA H 98 4.187 4.094 0.093 2
1 1354 . 1 1 A 98 98 GLU C C 98 177.698 179.187 -1.489 2
1 1355 . 1 1 A 98 98 GLU CA C 98 57.069 59.012 -1.943 2
1 1356 . 1 1 A 98 98 GLU CB C 98 29.321 29.296 0.025 2
1 1358 . 1 1 A 98 98 GLU N N 98 120.588 121.913 -1.325 2
1 1359 . 1 1 A 99 99 GLU H H 99 7.794 7.772 0.022 2
1 1360 . 1 1 A 99 99 GLU HA H 99 4.123 4.074 0.049 2
1 1365 . 1 1 A 99 99 GLU C C 99 177.665 177.364 0.301 2
1 1366 . 1 1 A 99 99 GLU CA C 99 57.304 57.958 -0.654 2
1 1367 . 1 1 A 99 99 GLU CB C 99 29.368 29.741 -0.373 2
1 1369 . 1 1 A 99 99 GLU N N 99 120.067 118.683 1.384 2
1 1370 . 1 1 A 100 100 GLY H H 100 8.138 8.271 -0.133 2
1 1371 . 1 1 A 100 100 GLY HA2 H 100 3.865 3.749 0.116 2
1 1372 . 1 1 A 100 100 GLY HA3 H 100 3.715 3.821 -0.106 2
1 1373 . 1 1 A 100 100 GLY C C 100 174.464 174.626 -0.162 2
1 1374 . 1 1 A 100 100 GLY CA C 100 45.305 46.191 -0.886 2
1 1375 . 1 1 A 100 100 GLY N N 100 107.802 108.381 -0.579 2
1 1376 . 1 1 A 101 101 GLY H H 101 8.023 8.355 -0.332 2
1 1377 . 1 1 A 101 101 GLY HA2 H 101 3.865 3.934 -0.069 2
1 1378 . 1 1 A 101 101 GLY HA3 H 101 3.892 3.955 -0.063 2
1 1379 . 1 1 A 101 101 GLY C C 101 174.204 173.850 0.354 2
1 1380 . 1 1 A 101 101 GLY CA C 101 45.036 45.615 -0.579 2
1 1381 . 1 1 A 101 101 GLY N N 101 108.032 108.442 -0.410 2
1 1382 . 1 1 A 102 102 SER H H 102 8.059 8.220 -0.161 2
1 1383 . 1 1 A 102 102 SER HA H 102 4.380 4.596 -0.216 2
1 1386 . 1 1 A 102 102 SER C C 102 174.627 174.409 0.218 2
1 1387 . 1 1 A 102 102 SER CA C 102 58.194 58.058 0.136 2
1 1388 . 1 1 A 102 102 SER CB C 102 63.538 63.168 0.370 2
1 1389 . 1 1 A 102 102 SER N N 102 115.266 115.860 -0.594 2
1 1390 . 1 1 A 103 103 LEU H H 103 8.287 8.227 0.060 2
1 1391 . 1 1 A 103 103 LEU HA H 103 4.301 4.121 0.180 2
1 1401 . 1 1 A 103 103 LEU C C 103 177.292 177.446 -0.154 2
1 1402 . 1 1 A 103 103 LEU CA C 103 55.007 56.758 -1.751 2
1 1403 . 1 1 A 103 103 LEU CB C 103 42.023 42.014 0.009 2
1 1407 . 1 1 A 103 103 LEU N N 103 123.596 125.238 -1.642 2
1 1408 . 1 1 A 104 104 GLU H H 104 8.216 7.873 0.343 2
1 1409 . 1 1 A 104 104 GLU HA H 104 4.126 4.355 -0.229 2
1 1414 . 1 1 A 104 104 GLU CA C 104 56.518 56.451 0.067 2
1 1415 . 1 1 A 104 104 GLU CB C 104 29.837 29.863 -0.026 2
1 1417 . 1 1 A 104 104 GLU N N 104 120.510 117.331 3.179 2
1 1418 . 1 1 A 105 105 HIS HA H 105 4.593 4.726 -0.133 2
1 1421 . 1 1 A 105 105 HIS C C 105 173.766 174.997 -1.231 2
1 1422 . 1 1 A 105 105 HIS CA C 105 55.536 55.904 -0.368 2
1 1423 . 1 1 A 105 105 HIS CB C 105 30.001 30.097 -0.096 2
1 1424 . 1 1 A 106 106 HIS H H 106 8.154 8.486 -0.332 2
1 1425 . 1 1 A 106 106 HIS HA H 106 4.407 4.556 -0.149 2
1 1428 . 1 1 A 106 106 HIS CA C 106 56.920 56.170 0.750 2
1 1429 . 1 1 A 106 106 HIS CB C 106 30.001 29.795 0.206 2
stop_
save_