data_16266_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16266
_Entry.PDB_ID 2KI7
_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 10
_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
1 128 . 1 1 1 A 18 18 GLY H H 18 8.343 8.535 -0.192 1
1 129 . 1 1 1 A 18 18 GLY HA2 H 18 3.894 4.204 -0.310 1
1 130 . 1 1 1 A 18 18 GLY C C 18 177.743 174.844 2.899 1
1 131 . 1 1 1 A 18 18 GLY CA C 18 45.497 43.844 1.653 1
1 132 . 1 1 1 A 18 18 GLY N N 18 109.925 110.016 -0.091 1
1 133 . 1 1 1 A 19 19 SER H H 19 8.005 9.253 -1.248 1
1 134 . 1 1 1 A 19 19 SER HA H 19 4.329 4.185 0.144 1
1 136 . 1 1 1 A 19 19 SER C C 19 175.168 176.272 -1.104 1
1 137 . 1 1 1 A 19 19 SER CA C 19 58.852 61.586 -2.734 1
1 138 . 1 1 1 A 19 19 SER CB C 19 63.604 62.462 1.142 1
1 139 . 1 1 1 A 19 19 SER N N 19 115.090 116.318 -1.228 1
1 140 . 1 1 1 A 20 20 TYR H H 20 8.040 8.066 -0.026 1
1 141 . 1 1 1 A 20 20 TYR HA H 20 4.439 4.294 0.145 1
1 146 . 1 1 1 A 20 20 TYR C C 20 176.111 178.706 -2.595 1
1 147 . 1 1 1 A 20 20 TYR CA C 20 57.966 61.655 -3.689 1
1 148 . 1 1 1 A 20 20 TYR CB C 20 37.472 38.385 -0.913 1
1 149 . 1 1 1 A 20 20 TYR N N 20 118.675 119.867 -1.192 1
1 150 . 1 1 1 A 21 21 GLN H H 21 7.909 8.436 -0.527 1
1 151 . 1 1 1 A 21 21 GLN HA H 21 3.903 4.245 -0.342 1
1 155 . 1 1 1 A 21 21 GLN C C 21 178.003 177.258 0.745 1
1 156 . 1 1 1 A 21 21 GLN CA C 21 58.523 58.434 0.089 1
1 157 . 1 1 1 A 21 21 GLN CB C 21 28.438 28.708 -0.270 1
1 159 . 1 1 1 A 21 21 GLN N N 21 117.056 118.264 -1.208 1
1 160 . 1 1 1 A 22 22 GLU H H 22 8.965 9.340 -0.375 1
1 161 . 1 1 1 A 22 22 GLU HA H 22 4.267 4.451 -0.184 1
1 165 . 1 1 1 A 22 22 GLU C C 22 176.451 178.148 -1.697 1
1 166 . 1 1 1 A 22 22 GLU CA C 22 58.273 58.253 0.020 1
1 167 . 1 1 1 A 22 22 GLU CB C 22 29.412 30.428 -1.016 1
1 169 . 1 1 1 A 22 22 GLU N N 22 117.289 119.319 -2.030 1
1 170 . 1 1 1 A 23 23 ILE H H 23 7.596 8.111 -0.515 1
1 171 . 1 1 1 A 23 23 ILE HA H 23 4.161 4.419 -0.258 1
1 180 . 1 1 1 A 23 23 ILE C C 23 176.195 175.840 0.355 1
1 181 . 1 1 1 A 23 23 ILE CA C 23 58.120 60.787 -2.667 1
1 182 . 1 1 1 A 23 23 ILE CB C 23 38.461 37.242 1.219 1
1 186 . 1 1 1 A 23 23 ILE N N 23 114.005 117.165 -3.160 1
1 187 . 1 1 1 A 24 24 ILE H H 24 7.178 7.676 -0.498 1
1 188 . 1 1 1 A 24 24 ILE HA H 24 3.740 4.020 -0.280 1
1 197 . 1 1 1 A 24 24 ILE C C 24 177.831 176.766 1.065 1
1 198 . 1 1 1 A 24 24 ILE CA C 24 63.318 62.102 1.216 1
1 199 . 1 1 1 A 24 24 ILE CB C 24 36.590 38.339 -1.749 1
1 203 . 1 1 1 A 24 24 ILE N N 24 122.099 125.706 -3.607 1
1 204 . 1 1 1 A 25 25 GLY H H 25 8.618 9.019 -0.401 1
1 205 . 1 1 1 A 25 25 GLY HA2 H 25 4.390 3.995 0.395 1
1 206 . 1 1 1 A 25 25 GLY HA3 H 25 4.168 4.025 0.143 1
1 207 . 1 1 1 A 25 25 GLY C C 25 175.210 176.180 -0.970 1
1 208 . 1 1 1 A 25 25 GLY CA C 25 45.798 45.052 0.746 1
1 209 . 1 1 1 A 25 25 GLY N N 25 115.531 118.371 -2.840 1
1 210 . 1 1 1 A 26 26 ARG H H 26 8.277 8.223 0.054 1
1 211 . 1 1 1 A 26 26 ARG HA H 26 4.477 4.515 -0.038 1
1 218 . 1 1 1 A 26 26 ARG C C 26 175.944 177.561 -1.617 1
1 219 . 1 1 1 A 26 26 ARG CA C 26 54.408 56.986 -2.578 1
1 220 . 1 1 1 A 26 26 ARG CB C 26 29.501 30.233 -0.732 1
1 223 . 1 1 1 A 26 26 ARG N N 26 119.689 121.531 -1.842 1
1 224 . 1 1 1 A 27 27 THR H H 27 7.923 9.009 -1.086 1
1 225 . 1 1 1 A 27 27 THR HA H 27 3.792 4.004 -0.212 1
1 230 . 1 1 1 A 27 27 THR C C 27 175.251 176.480 -1.229 1
1 231 . 1 1 1 A 27 27 THR CA C 27 64.791 65.180 -0.389 1
1 232 . 1 1 1 A 27 27 THR CB C 27 68.354 68.028 0.326 1
1 234 . 1 1 1 A 27 27 THR N N 27 109.195 113.184 -3.989 1
1 235 . 1 1 1 A 28 28 TRP H H 28 7.389 8.095 -0.706 1
1 236 . 1 1 1 A 28 28 TRP HA H 28 4.441 4.352 0.089 1
1 240 . 1 1 1 A 28 28 TRP C C 28 178.519 178.512 0.007 1
1 241 . 1 1 1 A 28 28 TRP CA C 28 57.789 61.400 -3.611 1
1 242 . 1 1 1 A 28 28 TRP CB C 28 27.387 29.999 -2.612 1
1 243 . 1 1 1 A 28 28 TRP N N 28 120.127 124.947 -4.820 1
1 244 . 1 1 1 A 29 29 ILE H H 29 6.832 8.173 -1.341 1
1 245 . 1 1 1 A 29 29 ILE HA H 29 3.612 3.573 0.039 1
1 254 . 1 1 1 A 29 29 ILE C C 29 176.023 176.701 -0.678 1
1 255 . 1 1 1 A 29 29 ILE CA C 29 63.773 63.389 0.384 1
1 256 . 1 1 1 A 29 29 ILE CB C 29 37.567 37.307 0.260 1
1 260 . 1 1 1 A 29 29 ILE N N 29 119.913 117.299 2.614 1
1 261 . 1 1 1 A 30 30 PHE H H 30 7.329 7.911 -0.582 1
1 262 . 1 1 1 A 30 30 PHE HA H 30 3.912 4.473 -0.561 1
1 268 . 1 1 1 A 30 30 PHE C C 30 177.101 177.530 -0.429 1
1 269 . 1 1 1 A 30 30 PHE CA C 30 59.436 59.985 -0.549 1
1 270 . 1 1 1 A 30 30 PHE CB C 30 38.734 39.759 -1.025 1
1 271 . 1 1 1 A 30 30 PHE N N 30 116.638 119.986 -3.348 1
1 272 . 1 1 1 A 31 31 ARG H H 31 7.399 8.076 -0.677 1
1 273 . 1 1 1 A 31 31 ARG HA H 31 4.287 4.483 -0.196 1
1 278 . 1 1 1 A 31 31 ARG C C 31 176.539 177.784 -1.245 1
1 279 . 1 1 1 A 31 31 ARG CA C 31 58.852 58.666 0.186 1
1 280 . 1 1 1 A 31 31 ARG CB C 31 29.461 30.988 -1.527 1
1 281 . 1 1 1 A 31 31 ARG N N 31 122.099 120.317 1.782 1
1 282 . 1 1 1 A 32 32 GLY H H 32 8.346 7.786 0.560 1
1 283 . 1 1 1 A 32 32 GLY HA2 H 32 4.284 3.460 0.824 1
1 284 . 1 1 1 A 32 32 GLY HA3 H 32 3.629 3.734 -0.105 1
1 285 . 1 1 1 A 32 32 GLY C C 32 173.791 173.839 -0.048 1
1 286 . 1 1 1 A 32 32 GLY CA C 32 45.793 46.465 -0.672 1
1 287 . 1 1 1 A 32 32 GLY N N 32 109.964 106.417 3.547 1
1 288 . 1 1 1 A 33 33 ALA H H 33 7.510 8.580 -1.070 1
1 289 . 1 1 1 A 33 33 ALA HA H 33 4.193 4.376 -0.183 1
1 293 . 1 1 1 A 33 33 ALA C C 33 176.672 176.624 0.048 1
1 294 . 1 1 1 A 33 33 ALA CA C 33 54.401 52.344 2.057 1
1 295 . 1 1 1 A 33 33 ALA CB C 33 19.368 21.582 -2.214 1
1 296 . 1 1 1 A 33 33 ALA N N 33 122.266 120.411 1.855 1
1 297 . 1 1 1 A 34 34 HIS H H 34 8.759 7.907 0.852 1
1 298 . 1 1 1 A 34 34 HIS HA H 34 4.529 5.034 -0.505 1
1 302 . 1 1 1 A 34 34 HIS C C 34 175.767 174.895 0.872 1
1 303 . 1 1 1 A 34 34 HIS CA C 34 54.997 54.319 0.678 1
1 304 . 1 1 1 A 34 34 HIS CB C 34 31.089 31.560 -0.471 1
1 305 . 1 1 1 A 34 34 HIS N N 34 119.038 118.577 0.461 1
1 306 . 1 1 1 A 35 35 ARG H H 35 8.142 8.603 -0.461 1
1 307 . 1 1 1 A 35 35 ARG HA H 35 4.700 5.138 -0.438 1
1 314 . 1 1 1 A 35 35 ARG C C 35 177.572 177.004 0.568 1
1 315 . 1 1 1 A 35 35 ARG CA C 35 54.103 55.803 -1.700 1
1 316 . 1 1 1 A 35 35 ARG CB C 35 29.112 31.736 -2.624 1
1 319 . 1 1 1 A 35 35 ARG N N 35 127.785 123.901 3.884 1
1 320 . 1 1 1 A 36 36 GLY H H 36 9.352 8.084 1.268 1
1 321 . 1 1 1 A 36 36 GLY HA2 H 36 4.291 3.983 0.308 1
1 322 . 1 1 1 A 36 36 GLY HA3 H 36 3.247 4.081 -0.834 1
1 323 . 1 1 1 A 36 36 GLY C C 36 173.876 173.483 0.393 1
1 324 . 1 1 1 A 36 36 GLY CA C 36 45.644 45.624 0.020 1
1 325 . 1 1 1 A 36 36 GLY N N 36 109.626 109.505 0.121 1
1 326 . 1 1 1 A 37 37 ARG H H 37 9.384 8.498 0.886 1
1 327 . 1 1 1 A 37 37 ARG HA H 37 4.688 4.557 0.131 1
1 333 . 1 1 1 A 37 37 ARG C C 37 175.081 175.595 -0.514 1
1 334 . 1 1 1 A 37 37 ARG CA C 37 55.742 56.666 -0.924 1
1 335 . 1 1 1 A 37 37 ARG CB C 37 28.138 30.604 -2.466 1
1 338 . 1 1 1 A 37 37 ARG N N 37 127.132 123.009 4.123 1
1 339 . 1 1 1 A 38 38 VAL H H 38 7.605 8.113 -0.508 1
1 340 . 1 1 1 A 38 38 VAL HA H 38 4.591 4.029 0.562 1
1 348 . 1 1 1 A 38 38 VAL C C 38 174.391 175.709 -1.318 1
1 349 . 1 1 1 A 38 38 VAL CA C 38 60.092 61.863 -1.771 1
1 350 . 1 1 1 A 38 38 VAL CB C 38 33.328 31.073 2.255 1
1 353 . 1 1 1 A 38 38 VAL N N 38 126.253 127.287 -1.034 1
1 354 . 1 1 1 A 39 39 ASN H H 39 9.007 8.105 0.902 1
1 355 . 1 1 1 A 39 39 ASN HA H 39 4.736 4.968 -0.232 1
1 358 . 1 1 1 A 39 39 ASN C C 39 174.562 175.258 -0.696 1
1 359 . 1 1 1 A 39 39 ASN CA C 39 51.577 52.640 -1.063 1
1 360 . 1 1 1 A 39 39 ASN CB C 39 40.749 41.796 -1.047 1
1 361 . 1 1 1 A 39 39 ASN N N 39 123.411 122.851 0.560 1
1 362 . 1 1 1 A 40 40 LYS H H 40 8.510 8.768 -0.258 1
1 363 . 1 1 1 A 40 40 LYS HA H 40 3.909 3.874 0.035 1
1 370 . 1 1 1 A 40 40 LYS C C 40 176.629 178.259 -1.630 1
1 371 . 1 1 1 A 40 40 LYS CA C 40 59.141 60.338 -1.197 1
1 372 . 1 1 1 A 40 40 LYS CB C 40 32.301 32.389 -0.088 1
1 376 . 1 1 1 A 40 40 LYS N N 40 116.303 124.545 -8.242 1
1 377 . 1 1 1 A 41 41 LYS H H 41 7.907 8.615 -0.708 1
1 378 . 1 1 1 A 41 41 LYS HA H 41 4.172 3.435 0.737 1
1 384 . 1 1 1 A 41 41 LYS C C 41 177.229 175.898 1.331 1
1 385 . 1 1 1 A 41 41 LYS CA C 41 57.392 57.752 -0.360 1
1 386 . 1 1 1 A 41 41 LYS CB C 41 32.667 30.794 1.873 1
1 390 . 1 1 1 A 41 41 LYS N N 41 117.066 117.513 -0.447 1
1 391 . 1 1 1 A 42 42 ASN H H 42 7.962 8.465 -0.503 1
1 392 . 1 1 1 A 42 42 ASN HA H 42 4.392 4.689 -0.297 1
1 395 . 1 1 1 A 42 42 ASN C C 42 179.805 175.838 3.967 1
1 396 . 1 1 1 A 42 42 ASN CA C 42 52.335 52.636 -0.301 1
1 397 . 1 1 1 A 42 42 ASN CB C 42 39.348 39.243 0.105 1
1 398 . 1 1 1 A 42 42 ASN N N 42 114.442 116.780 -2.338 1
1 399 . 1 1 1 A 43 43 ILE H H 43 7.806 8.405 -0.599 1
1 400 . 1 1 1 A 43 43 ILE HA H 43 3.747 3.846 -0.099 1
1 409 . 1 1 1 A 43 43 ILE C C 43 174.219 177.253 -3.034 1
1 410 . 1 1 1 A 43 43 ILE CA C 43 64.505 63.474 1.031 1
1 411 . 1 1 1 A 43 43 ILE CB C 43 36.595 38.346 -1.751 1
1 415 . 1 1 1 A 43 43 ILE N N 43 121.001 120.567 0.434 1
1 416 . 1 1 1 A 44 44 VAL H H 44 6.154 7.627 -1.473 1
1 417 . 1 1 1 A 44 44 VAL HA H 44 3.497 3.847 -0.350 1
1 425 . 1 1 1 A 44 44 VAL C C 44 176.282 176.334 -0.052 1
1 426 . 1 1 1 A 44 44 VAL CA C 44 63.606 63.113 0.493 1
1 427 . 1 1 1 A 44 44 VAL CB C 44 30.614 31.968 -1.354 1
1 430 . 1 1 1 A 44 44 VAL N N 44 110.500 119.482 -8.982 1
1 431 . 1 1 1 A 45 45 TRP H H 45 7.419 8.111 -0.692 1
1 432 . 1 1 1 A 45 45 TRP HA H 45 4.716 4.874 -0.158 1
1 438 . 1 1 1 A 45 45 TRP C C 45 175.422 175.754 -0.332 1
1 439 . 1 1 1 A 45 45 TRP CA C 45 56.188 56.790 -0.602 1
1 440 . 1 1 1 A 45 45 TRP CB C 45 31.245 30.054 1.191 1
1 441 . 1 1 1 A 45 45 TRP N N 45 118.601 121.107 -2.506 1
1 442 . 1 1 1 A 46 46 HIS H H 46 7.582 7.564 0.018 1
1 443 . 1 1 1 A 46 46 HIS HA H 46 4.227 4.909 -0.682 1
1 448 . 1 1 1 A 46 46 HIS C C 46 177.485 173.763 3.722 1
1 449 . 1 1 1 A 46 46 HIS CA C 46 56.799 54.895 1.904 1
1 450 . 1 1 1 A 46 46 HIS CB C 46 32.017 33.762 -1.745 1
1 451 . 1 1 1 A 46 46 HIS N N 46 122.648 118.121 4.527 1
1 452 . 1 1 1 A 47 47 GLU H H 47 7.948 8.224 -0.276 1
1 453 . 1 1 1 A 47 47 GLU HA H 47 4.098 4.616 -0.518 1
1 457 . 1 1 1 A 47 47 GLU C C 47 175.596 175.801 -0.205 1
1 458 . 1 1 1 A 47 47 GLU CA C 47 56.482 55.579 0.903 1
1 459 . 1 1 1 A 47 47 GLU CB C 47 31.839 30.103 1.736 1
1 461 . 1 1 1 A 47 47 GLU N N 47 120.485 119.904 0.581 1
1 462 . 1 1 1 A 48 48 LEU H H 48 9.304 8.737 0.567 1
1 463 . 1 1 1 A 48 48 LEU HA H 48 4.218 4.374 -0.156 1
1 472 . 1 1 1 A 48 48 LEU C C 48 177.743 176.358 1.385 1
1 473 . 1 1 1 A 48 48 LEU CA C 48 55.043 54.849 0.194 1
1 474 . 1 1 1 A 48 48 LEU CB C 48 41.948 40.982 0.966 1
1 477 . 1 1 1 A 48 48 LEU N N 48 128.658 125.989 2.669 1
1 478 . 1 1 1 A 49 49 ILE H H 49 8.028 8.907 -0.879 1
1 479 . 1 1 1 A 49 49 ILE HA H 49 3.279 4.588 -1.309 1
1 488 . 1 1 1 A 49 49 ILE C C 49 174.821 177.484 -2.663 1
1 489 . 1 1 1 A 49 49 ILE CA C 49 63.901 62.304 1.597 1
1 490 . 1 1 1 A 49 49 ILE CB C 49 37.775 40.883 -3.108 1
1 494 . 1 1 1 A 49 49 ILE N N 49 120.341 123.612 -3.271 1
1 495 . 1 1 1 A 50 50 GLY H H 50 9.038 7.364 1.674 1
1 496 . 1 1 1 A 50 50 GLY HA2 H 50 4.717 4.246 0.471 1
1 497 . 1 1 1 A 50 50 GLY HA3 H 50 3.491 4.383 -0.892 1
1 498 . 1 1 1 A 50 50 GLY C C 50 175.084 173.720 1.364 1
1 499 . 1 1 1 A 50 50 GLY CA C 50 44.599 45.487 -0.888 1
1 500 . 1 1 1 A 50 50 GLY N N 50 110.284 109.688 0.596 1
1 501 . 1 1 1 A 51 51 LEU H H 51 8.400 6.371 2.029 1
1 502 . 1 1 1 A 51 51 LEU HA H 51 4.723 3.884 0.839 1
1 512 . 1 1 1 A 51 51 LEU C C 51 177.147 175.593 1.554 1
1 513 . 1 1 1 A 51 51 LEU CA C 51 54.350 55.565 -1.215 1
1 514 . 1 1 1 A 51 51 LEU CB C 51 42.985 42.804 0.181 1
1 518 . 1 1 1 A 51 51 LEU N N 51 120.471 122.067 -1.596 1
1 519 . 1 1 1 A 52 52 LYS H H 52 7.505 8.635 -1.130 1
1 520 . 1 1 1 A 52 52 LYS HA H 52 4.250 4.312 -0.062 1
1 527 . 1 1 1 A 52 52 LYS C C 52 174.995 175.227 -0.232 1
1 528 . 1 1 1 A 52 52 LYS CA C 52 55.589 55.236 0.353 1
1 529 . 1 1 1 A 52 52 LYS CB C 52 33.025 33.267 -0.242 1
1 533 . 1 1 1 A 52 52 LYS N N 52 122.406 126.288 -3.882 1
1 534 . 1 1 1 A 53 53 VAL H H 53 9.075 8.133 0.942 1
1 535 . 1 1 1 A 53 53 VAL HA H 53 5.071 4.982 0.089 1
1 543 . 1 1 1 A 53 53 VAL C C 53 171.170 173.587 -2.417 1
1 544 . 1 1 1 A 53 53 VAL CA C 53 58.523 59.150 -0.627 1
1 545 . 1 1 1 A 53 53 VAL CB C 53 35.698 35.212 0.486 1
1 548 . 1 1 1 A 53 53 VAL N N 53 124.509 124.141 0.368 1
1 549 . 1 1 1 A 54 54 ARG H H 54 8.148 8.158 -0.010 1
1 550 . 1 1 1 A 54 54 ARG HA H 54 5.329 4.904 0.425 1
1 557 . 1 1 1 A 54 54 ARG C C 54 176.113 174.491 1.622 1
1 558 . 1 1 1 A 54 54 ARG CA C 54 53.817 53.910 -0.093 1
1 559 . 1 1 1 A 54 54 ARG CB C 54 34.511 33.689 0.822 1
1 562 . 1 1 1 A 54 54 ARG N N 54 123.625 121.821 1.804 1
1 563 . 1 1 1 A 55 55 VAL H H 55 8.659 10.415 -1.756 1
1 564 . 1 1 1 A 55 55 VAL HA H 55 4.085 4.005 0.080 1
1 572 . 1 1 1 A 55 55 VAL C C 55 176.282 175.419 0.863 1
1 573 . 1 1 1 A 55 55 VAL CA C 55 62.814 62.303 0.511 1
1 574 . 1 1 1 A 55 55 VAL CB C 55 30.628 31.096 -0.468 1
1 577 . 1 1 1 A 55 55 VAL N N 55 125.383 123.124 2.259 1
1 578 . 1 1 1 A 56 56 VAL H H 56 8.057 8.530 -0.473 1
1 579 . 1 1 1 A 56 56 VAL HA H 56 4.123 3.976 0.147 1
1 587 . 1 1 1 A 56 56 VAL C C 56 175.426 176.113 -0.687 1
1 588 . 1 1 1 A 56 56 VAL CA C 56 62.786 64.241 -1.455 1
1 589 . 1 1 1 A 56 56 VAL CB C 56 32.267 32.514 -0.247 1
1 592 . 1 1 1 A 56 56 VAL N N 56 124.936 129.146 -4.210 1
1 593 . 1 1 1 A 57 57 ASN H H 57 7.527 8.204 -0.677 1
1 594 . 1 1 1 A 57 57 ASN HA H 57 4.817 5.223 -0.406 1
1 597 . 1 1 1 A 57 57 ASN C C 57 172.973 173.515 -0.542 1
1 598 . 1 1 1 A 57 57 ASN CA C 57 52.460 51.620 0.840 1
1 599 . 1 1 1 A 57 57 ASN CB C 57 42.070 41.618 0.452 1
1 600 . 1 1 1 A 57 57 ASN N N 57 114.777 117.152 -2.375 1
1 601 . 1 1 1 A 58 58 SER H H 58 8.193 8.899 -0.706 1
1 602 . 1 1 1 A 58 58 SER HA H 58 5.214 4.930 0.284 1
1 605 . 1 1 1 A 58 58 SER C C 58 174.221 172.028 2.193 1
1 606 . 1 1 1 A 58 58 SER CA C 58 56.778 56.389 0.389 1
1 607 . 1 1 1 A 58 58 SER CB C 58 63.906 65.143 -1.237 1
1 608 . 1 1 1 A 58 58 SER N N 58 115.531 119.907 -4.376 1
1 609 . 1 1 1 A 59 59 THR H H 59 8.053 8.388 -0.335 1
1 610 . 1 1 1 A 59 59 THR HA H 59 4.305 4.757 -0.452 1
1 615 . 1 1 1 A 59 59 THR C C 59 174.478 172.785 1.693 1
1 616 . 1 1 1 A 59 59 THR CA C 59 63.305 60.146 3.159 1
1 617 . 1 1 1 A 59 59 THR CB C 59 68.354 69.189 -0.835 1
1 619 . 1 1 1 A 59 59 THR N N 59 116.405 116.391 0.014 1
1 620 . 1 1 1 A 60 60 HIS H H 60 8.359 8.124 0.235 1
1 621 . 1 1 1 A 60 60 HIS HA H 60 5.167 5.137 0.030 1
1 626 . 1 1 1 A 60 60 HIS CA C 60 52.792 53.009 -0.217 1
1 627 . 1 1 1 A 60 60 HIS CB C 60 32.142 31.777 0.365 1
1 628 . 1 1 1 A 60 60 HIS N N 60 123.625 125.048 -1.423 1
1 629 . 1 1 1 A 61 61 PRO HA H 61 4.277 4.324 -0.047 1
1 636 . 1 1 1 A 61 61 PRO C C 61 178.217 177.413 0.804 1
1 637 . 1 1 1 A 61 61 PRO CA C 61 64.375 64.424 -0.049 1
1 638 . 1 1 1 A 61 61 PRO CB C 61 32.007 32.137 -0.130 1
1 641 . 1 1 1 A 62 62 GLY H H 62 8.421 8.072 0.349 1
1 642 . 1 1 1 A 62 62 GLY HA2 H 62 3.889 3.751 0.138 1
1 643 . 1 1 1 A 62 62 GLY HA3 H 62 3.653 3.890 -0.237 1
1 644 . 1 1 1 A 62 62 GLY C C 62 174.994 173.956 1.038 1
1 645 . 1 1 1 A 62 62 GLY CA C 62 45.831 45.292 0.539 1
1 646 . 1 1 1 A 62 62 GLY N N 62 106.132 105.854 0.278 1
1 647 . 1 1 1 A 63 63 TYR H H 63 7.327 7.884 -0.557 1
1 648 . 1 1 1 A 63 63 TYR HA H 63 4.846 4.573 0.273 1
1 652 . 1 1 1 A 63 63 TYR C C 63 175.593 175.484 0.109 1
1 653 . 1 1 1 A 63 63 TYR CA C 63 56.071 58.290 -2.219 1
1 654 . 1 1 1 A 63 63 TYR CB C 63 38.962 40.300 -1.338 1
1 655 . 1 1 1 A 63 63 TYR N N 63 116.628 117.202 -0.574 1
1 656 . 1 1 1 A 64 64 VAL H H 64 7.296 7.024 0.272 1
1 657 . 1 1 1 A 64 64 VAL HA H 64 3.180 4.099 -0.919 1
1 665 . 1 1 1 A 64 64 VAL C C 64 177.312 176.553 0.759 1
1 666 . 1 1 1 A 64 64 VAL CA C 64 65.688 63.082 2.606 1
1 667 . 1 1 1 A 64 64 VAL CB C 64 30.957 31.499 -0.542 1
1 670 . 1 1 1 A 64 64 VAL N N 64 117.940 117.837 0.103 1
1 671 . 1 1 1 A 65 65 GLY H H 65 8.449 9.287 -0.838 1
1 672 . 1 1 1 A 65 65 GLY HA2 H 65 4.320 3.950 0.370 1
1 673 . 1 1 1 A 65 65 GLY HA3 H 65 3.515 3.951 -0.436 1
1 674 . 1 1 1 A 65 65 GLY C C 65 174.821 173.380 1.441 1
1 675 . 1 1 1 A 65 65 GLY CA C 65 44.599 45.188 -0.589 1
1 676 . 1 1 1 A 65 65 GLY N N 65 115.317 114.252 1.065 1
1 677 . 1 1 1 A 66 66 ILE H H 66 7.095 7.518 -0.423 1
1 678 . 1 1 1 A 66 66 ILE HA H 66 3.193 4.720 -1.527 1
1 687 . 1 1 1 A 66 66 ILE C C 66 174.308 174.883 -0.575 1
1 688 . 1 1 1 A 66 66 ILE CA C 66 63.470 60.462 3.008 1
1 689 . 1 1 1 A 66 66 ILE CB C 66 37.775 40.561 -2.786 1
1 693 . 1 1 1 A 66 66 ILE N N 66 122.099 122.761 -0.662 1
1 694 . 1 1 1 A 67 67 GLU H H 67 7.126 9.241 -2.115 1
1 695 . 1 1 1 A 67 67 GLU HA H 67 5.343 5.284 0.059 1
1 699 . 1 1 1 A 67 67 GLU C C 67 174.652 175.181 -0.529 1
1 700 . 1 1 1 A 67 67 GLU CA C 67 54.109 54.322 -0.213 1
1 701 . 1 1 1 A 67 67 GLU CB C 67 33.619 33.026 0.593 1
1 703 . 1 1 1 A 67 67 GLU N N 67 125.164 128.768 -3.604 1
1 704 . 1 1 1 A 68 68 GLY H H 68 8.401 8.042 0.359 1
1 705 . 1 1 1 A 68 68 GLY HA2 H 68 4.364 2.762 1.602 1
1 706 . 1 1 1 A 68 68 GLY HA3 H 68 4.041 3.479 0.562 1
1 707 . 1 1 1 A 68 68 GLY C C 68 171.644 171.183 0.461 1
1 708 . 1 1 1 A 68 68 GLY CA C 68 45.680 44.108 1.572 1
1 709 . 1 1 1 A 68 68 GLY N N 68 109.626 111.673 -2.047 1
1 710 . 1 1 1 A 69 69 TYR H H 69 8.422 9.767 -1.345 1
1 711 . 1 1 1 A 69 69 TYR HA H 69 5.079 4.926 0.153 1
1 714 . 1 1 1 A 69 69 TYR C C 69 176.194 175.312 0.882 1
1 715 . 1 1 1 A 69 69 TYR CA C 69 57.681 57.066 0.615 1
1 716 . 1 1 1 A 69 69 TYR CB C 69 41.043 39.611 1.432 1
1 717 . 1 1 1 A 69 69 TYR N N 69 119.689 121.290 -1.601 1
1 718 . 1 1 1 A 70 70 VAL H H 70 8.753 8.520 0.233 1
1 719 . 1 1 1 A 70 70 VAL HA H 70 4.143 4.547 -0.404 1
1 727 . 1 1 1 A 70 70 VAL C C 70 176.540 175.680 0.860 1
1 728 . 1 1 1 A 70 70 VAL CA C 70 63.477 63.739 -0.262 1
1 729 . 1 1 1 A 70 70 VAL CB C 70 30.952 32.176 -1.224 1
1 732 . 1 1 1 A 70 70 VAL N N 70 123.420 126.822 -3.402 1
1 733 . 1 1 1 A 71 71 ILE H H 71 9.101 10.308 -1.207 1
1 734 . 1 1 1 A 71 71 ILE HA H 71 4.834 4.743 0.091 1
1 743 . 1 1 1 A 71 71 ILE C C 71 175.418 175.938 -0.520 1
1 744 . 1 1 1 A 71 71 ILE CA C 71 60.637 62.394 -1.757 1
1 745 . 1 1 1 A 71 71 ILE CB C 71 39.853 40.172 -0.319 1
1 749 . 1 1 1 A 71 71 ILE N N 71 119.913 125.108 -5.195 1
1 750 . 1 1 1 A 72 72 ASP H H 72 8.030 8.321 -0.291 1
1 751 . 1 1 1 A 72 72 ASP HA H 72 4.964 5.291 -0.327 1
1 754 . 1 1 1 A 72 72 ASP C C 72 173.017 174.926 -1.909 1
1 755 . 1 1 1 A 72 72 ASP CA C 72 53.511 53.217 0.294 1
1 756 . 1 1 1 A 72 72 ASP CB C 72 41.932 44.289 -2.357 1
1 757 . 1 1 1 A 72 72 ASP N N 72 118.377 119.632 -1.255 1
1 758 . 1 1 1 A 73 73 GLU H H 73 9.349 8.778 0.571 1
1 759 . 1 1 1 A 73 73 GLU HA H 73 4.868 5.171 -0.303 1
1 762 . 1 1 1 A 73 73 GLU C C 73 173.793 174.697 -0.904 1
1 763 . 1 1 1 A 73 73 GLU CA C 73 55.521 56.285 -0.764 1
1 764 . 1 1 1 A 73 73 GLU CB C 73 33.138 32.171 0.967 1
1 766 . 1 1 1 A 73 73 GLU N N 73 123.848 123.165 0.683 1
1 767 . 1 1 1 A 74 74 THR H H 74 8.748 8.878 -0.130 1
1 768 . 1 1 1 A 74 74 THR HA H 74 4.992 4.892 0.100 1
1 773 . 1 1 1 A 74 74 THR CA C 74 59.450 59.676 -0.226 1
1 774 . 1 1 1 A 74 74 THR CB C 74 70.429 72.358 -1.929 1
1 776 . 1 1 1 A 74 74 THR N N 74 116.628 118.167 -1.539 1
1 777 . 1 1 1 A 75 75 ARG HA H 75 3.741 4.458 -0.717 1
1 782 . 1 1 1 A 75 75 ARG C C 75 177.140 176.515 0.625 1
1 783 . 1 1 1 A 75 75 ARG CA C 75 60.041 58.351 1.690 1
1 784 . 1 1 1 A 75 75 ARG CB C 75 29.930 29.638 0.292 1
1 787 . 1 1 1 A 76 76 ASN H H 76 8.497 8.165 0.332 1
1 788 . 1 1 1 A 76 76 ASN HA H 76 5.310 5.053 0.257 1
1 791 . 1 1 1 A 76 76 ASN C C 76 175.509 174.518 0.991 1
1 792 . 1 1 1 A 76 76 ASN CA C 76 52.320 52.244 0.076 1
1 793 . 1 1 1 A 76 76 ASN CB C 76 40.744 39.804 0.940 1
1 794 . 1 1 1 A 76 76 ASN N N 76 111.053 118.294 -7.241 1
1 795 . 1 1 1 A 77 77 MET H H 77 7.528 7.485 0.043 1
1 796 . 1 1 1 A 77 77 MET HA H 77 5.392 5.070 0.322 1
1 801 . 1 1 1 A 77 77 MET C C 77 174.824 174.318 0.506 1
1 802 . 1 1 1 A 77 77 MET CA C 77 54.994 53.905 1.089 1
1 803 . 1 1 1 A 77 77 MET CB C 77 36.753 35.866 0.887 1
1 805 . 1 1 1 A 77 77 MET N N 77 119.913 116.238 3.675 1
1 806 . 1 1 1 A 78 78 LEU H H 78 8.977 8.605 0.372 1
1 807 . 1 1 1 A 78 78 LEU HA H 78 4.803 5.399 -0.596 1
1 817 . 1 1 1 A 78 78 LEU C C 78 174.563 174.748 -0.185 1
1 818 . 1 1 1 A 78 78 LEU CA C 78 53.964 54.623 -0.659 1
1 819 . 1 1 1 A 78 78 LEU CB C 78 44.903 45.093 -0.190 1
1 823 . 1 1 1 A 78 78 LEU N N 78 121.224 121.803 -0.579 1
1 824 . 1 1 1 A 79 79 VAL H H 79 8.115 9.486 -1.371 1
1 825 . 1 1 1 A 79 79 VAL HA H 79 4.783 5.122 -0.339 1
1 833 . 1 1 1 A 79 79 VAL C C 79 175.297 175.029 0.268 1
1 834 . 1 1 1 A 79 79 VAL CA C 79 61.821 60.984 0.837 1
1 835 . 1 1 1 A 79 79 VAL CB C 79 31.146 34.713 -3.567 1
1 838 . 1 1 1 A 79 79 VAL N N 79 124.062 127.585 -3.523 1
1 839 . 1 1 1 A 80 80 ILE H H 80 9.342 8.727 0.615 1
1 840 . 1 1 1 A 80 80 ILE HA H 80 4.764 5.368 -0.604 1
1 849 . 1 1 1 A 80 80 ILE C C 80 174.127 174.841 -0.714 1
1 850 . 1 1 1 A 80 80 ILE CA C 80 59.897 59.941 -0.044 1
1 851 . 1 1 1 A 80 80 ILE CB C 80 42.225 41.828 0.397 1
1 855 . 1 1 1 A 80 80 ILE N N 80 129.970 126.777 3.193 1
1 856 . 1 1 1 A 81 81 ALA H H 81 9.478 10.123 -0.645 1
1 857 . 1 1 1 A 81 81 ALA HA H 81 5.139 5.546 -0.407 1
1 861 . 1 1 1 A 81 81 ALA C C 81 176.970 176.720 0.250 1
1 862 . 1 1 1 A 81 81 ALA CA C 81 50.835 50.343 0.492 1
1 863 . 1 1 1 A 81 81 ALA CB C 81 21.451 22.069 -0.618 1
1 864 . 1 1 1 A 81 81 ALA N N 81 129.756 127.554 2.202 1
1 865 . 1 1 1 A 82 82 GLY H H 82 8.691 8.927 -0.236 1
1 866 . 1 1 1 A 82 82 GLY HA2 H 82 5.110 4.069 1.041 1
1 867 . 1 1 1 A 82 82 GLY HA3 H 82 4.241 4.200 0.041 1
1 868 . 1 1 1 A 82 82 GLY C C 82 173.017 174.538 -1.521 1
1 869 . 1 1 1 A 82 82 GLY CA C 82 44.166 44.599 -0.433 1
1 870 . 1 1 1 A 82 82 GLY N N 82 113.568 108.792 4.776 1
1 871 . 1 1 1 A 83 83 GLU H H 83 8.659 8.846 -0.187 1
1 872 . 1 1 1 A 83 83 GLU HA H 83 4.286 4.336 -0.050 1
1 876 . 1 1 1 A 83 83 GLU C C 83 177.570 176.304 1.266 1
1 877 . 1 1 1 A 83 83 GLU CA C 83 59.017 58.155 0.862 1
1 878 . 1 1 1 A 83 83 GLU CB C 83 29.762 29.370 0.392 1
1 880 . 1 1 1 A 83 83 GLU N N 83 120.019 121.586 -1.567 1
1 881 . 1 1 1 A 84 84 ASN H H 84 8.549 8.553 -0.004 1
1 882 . 1 1 1 A 84 84 ASN HA H 84 4.821 4.952 -0.131 1
1 884 . 1 1 1 A 84 84 ASN C C 84 173.878 174.093 -0.215 1
1 885 . 1 1 1 A 84 84 ASN CA C 84 52.919 53.091 -0.172 1
1 886 . 1 1 1 A 84 84 ASN CB C 84 40.150 39.144 1.006 1
1 887 . 1 1 1 A 84 84 ASN N N 84 112.778 124.493 -11.715 1
1 888 . 1 1 1 A 85 85 LYS H H 85 7.116 7.660 -0.544 1
1 889 . 1 1 1 A 85 85 LYS HA H 85 4.344 4.897 -0.553 1
1 895 . 1 1 1 A 85 85 LYS C C 85 173.278 174.656 -1.378 1
1 896 . 1 1 1 A 85 85 LYS CA C 85 55.292 55.399 -0.107 1
1 897 . 1 1 1 A 85 85 LYS CB C 85 36.124 35.949 0.175 1
1 901 . 1 1 1 A 85 85 LYS N N 85 118.377 120.351 -1.974 1
1 902 . 1 1 1 A 86 86 VAL H H 86 7.781 8.726 -0.945 1
1 903 . 1 1 1 A 86 86 VAL HA H 86 4.749 5.397 -0.648 1
1 911 . 1 1 1 A 86 86 VAL C C 86 174.739 174.392 0.347 1
1 912 . 1 1 1 A 86 86 VAL CA C 86 60.716 59.591 1.125 1
1 913 . 1 1 1 A 86 86 VAL CB C 86 33.619 35.107 -1.488 1
1 916 . 1 1 1 A 86 86 VAL N N 86 120.127 117.835 2.292 1
1 917 . 1 1 1 A 87 87 TRP H H 87 9.558 10.492 -0.934 1
1 918 . 1 1 1 A 87 87 TRP HA H 87 4.958 5.107 -0.149 1
1 923 . 1 1 1 A 87 87 TRP C C 87 174.909 175.070 -0.161 1
1 924 . 1 1 1 A 87 87 TRP CA C 87 57.073 56.281 0.792 1
1 925 . 1 1 1 A 87 87 TRP CB C 87 33.028 28.594 4.434 1
1 926 . 1 1 1 A 87 87 TRP N N 87 127.346 123.462 3.884 1
1 927 . 1 1 1 A 88 88 LYS H H 88 8.590 8.365 0.225 1
1 928 . 1 1 1 A 88 88 LYS HA H 88 4.856 4.395 0.461 1
1 935 . 1 1 1 A 88 88 LYS C C 88 175.382 174.918 0.464 1
1 936 . 1 1 1 A 88 88 LYS CA C 88 55.887 55.638 0.249 1
1 937 . 1 1 1 A 88 88 LYS CB C 88 32.434 32.762 -0.328 1
1 941 . 1 1 1 A 88 88 LYS N N 88 123.625 126.114 -2.489 1
1 942 . 1 1 1 A 89 89 VAL H H 89 8.829 7.846 0.983 1
1 943 . 1 1 1 A 89 89 VAL HA H 89 4.406 4.546 -0.140 1
1 951 . 1 1 1 A 89 89 VAL CA C 89 58.371 59.108 -0.737 1
1 952 . 1 1 1 A 89 89 VAL CB C 89 34.512 35.054 -0.542 1
1 955 . 1 1 1 A 89 89 VAL N N 89 124.285 126.673 -2.388 1
1 956 . 1 1 1 A 90 90 PRO HA H 90 5.073 4.620 0.453 1
1 961 . 1 1 1 A 90 90 PRO C C 90 177.231 177.198 0.033 1
1 962 . 1 1 1 A 90 90 PRO CA C 90 61.795 62.759 -0.964 1
1 963 . 1 1 1 A 90 90 PRO CB C 90 31.660 33.018 -1.358 1
1 964 . 1 1 1 A 91 91 LYS H H 91 8.116 8.474 -0.358 1
1 965 . 1 1 1 A 91 91 LYS HA H 91 4.024 4.166 -0.142 1
1 969 . 1 1 1 A 91 91 LYS C C 91 178.518 177.490 1.028 1
1 970 . 1 1 1 A 91 91 LYS CA C 91 59.621 59.369 0.252 1
1 971 . 1 1 1 A 91 91 LYS CB C 91 34.217 32.169 2.048 1
1 973 . 1 1 1 A 91 91 LYS N N 91 121.224 121.302 -0.078 1
1 974 . 1 1 1 A 92 92 ASP H H 92 8.505 8.348 0.157 1
1 975 . 1 1 1 A 92 92 ASP HA H 92 3.781 4.575 -0.794 1
1 978 . 1 1 1 A 92 92 ASP C C 92 176.975 176.538 0.437 1
1 979 . 1 1 1 A 92 92 ASP CA C 92 56.773 54.792 1.981 1
1 980 . 1 1 1 A 92 92 ASP CB C 92 39.590 40.306 -0.716 1
1 981 . 1 1 1 A 92 92 ASP N N 92 111.815 116.522 -4.707 1
1 982 . 1 1 1 A 93 93 VAL H H 93 6.691 7.749 -1.058 1
1 983 . 1 1 1 A 93 93 VAL HA H 93 4.678 4.260 0.418 1
1 991 . 1 1 1 A 93 93 VAL C C 93 176.537 174.939 1.598 1
1 992 . 1 1 1 A 93 93 VAL CA C 93 60.120 62.200 -2.080 1
1 993 . 1 1 1 A 93 93 VAL CB C 93 31.093 32.496 -1.403 1
1 996 . 1 1 1 A 93 93 VAL N N 93 107.879 117.078 -9.199 1
1 997 . 1 1 1 A 94 94 CYS H H 94 7.249 7.651 -0.402 1
1 998 . 1 1 1 A 94 94 CYS HA H 94 5.062 4.587 0.475 1
1 1001 . 1 1 1 A 94 94 CYS C C 94 173.103 172.074 1.029 1
1 1002 . 1 1 1 A 94 94 CYS CA C 94 58.001 57.377 0.624 1
1 1003 . 1 1 1 A 94 94 CYS CB C 94 31.418 30.200 1.218 1
1 1004 . 1 1 1 A 94 94 CYS N N 94 117.940 117.903 0.037 1
1 1005 . 1 1 1 A 95 95 ILE H H 95 8.153 8.373 -0.220 1
1 1006 . 1 1 1 A 95 95 ILE HA H 95 4.159 4.722 -0.563 1
1 1016 . 1 1 1 A 95 95 ILE C C 95 174.736 174.923 -0.187 1
1 1017 . 1 1 1 A 95 95 ILE CA C 95 61.234 60.318 0.916 1
1 1018 . 1 1 1 A 95 95 ILE CB C 95 38.071 39.755 -1.684 1
1 1022 . 1 1 1 A 95 95 ILE N N 95 121.876 119.789 2.087 1
1 1023 . 1 1 1 A 96 96 PHE H H 96 8.400 8.952 -0.552 1
1 1024 . 1 1 1 A 96 96 PHE HA H 96 5.004 4.778 0.226 1
1 1029 . 1 1 1 A 96 96 PHE C C 96 174.005 174.491 -0.486 1
1 1030 . 1 1 1 A 96 96 PHE CA C 96 56.922 57.135 -0.213 1
1 1031 . 1 1 1 A 96 96 PHE CB C 96 44.006 40.812 3.194 1
1 1032 . 1 1 1 A 96 96 PHE N N 96 125.820 126.970 -1.150 1
1 1033 . 1 1 1 A 97 97 GLU H H 97 8.985 8.497 0.488 1
1 1034 . 1 1 1 A 97 97 GLU HA H 97 5.275 5.148 0.127 1
1 1038 . 1 1 1 A 97 97 GLU C C 97 175.596 174.773 0.823 1
1 1039 . 1 1 1 A 97 97 GLU CA C 97 55.070 54.492 0.578 1
1 1040 . 1 1 1 A 97 97 GLU CB C 97 33.628 30.679 2.949 1
1 1042 . 1 1 1 A 97 97 GLU N N 97 121.010 124.009 -2.999 1
1 1043 . 1 1 1 A 98 98 PHE H H 98 9.304 9.138 0.166 1
1 1044 . 1 1 1 A 98 98 PHE HA H 98 5.337 5.035 0.302 1
1 1048 . 1 1 1 A 98 98 PHE C C 98 174.650 175.724 -1.074 1
1 1049 . 1 1 1 A 98 98 PHE CA C 98 57.363 57.757 -0.394 1
1 1050 . 1 1 1 A 98 98 PHE CB C 98 41.936 40.567 1.369 1
1 1051 . 1 1 1 A 98 98 PHE N N 98 128.658 126.396 2.262 1
1 1052 . 1 1 1 A 99 99 GLU H H 99 8.721 8.735 -0.014 1
1 1053 . 1 1 1 A 99 99 GLU HA H 99 5.457 4.769 0.688 1
1 1058 . 1 1 1 A 99 99 GLU C C 99 176.368 176.687 -0.319 1
1 1059 . 1 1 1 A 99 99 GLU CA C 99 54.401 55.307 -0.906 1
1 1060 . 1 1 1 A 99 99 GLU CB C 99 33.068 31.385 1.683 1
1 1062 . 1 1 1 A 99 99 GLU N N 99 122.759 123.720 -0.961 1
1 1063 . 1 1 1 A 100 100 THR H H 100 8.588 11.098 -2.510 1
1 1064 . 1 1 1 A 100 100 THR HA H 100 4.603 4.369 0.234 1
1 1069 . 1 1 1 A 100 100 THR C C 100 177.144 175.756 1.388 1
1 1070 . 1 1 1 A 100 100 THR CA C 100 60.774 63.645 -2.871 1
1 1071 . 1 1 1 A 100 100 THR CB C 100 70.136 69.497 0.639 1
1 1073 . 1 1 1 A 100 100 THR N N 100 116.191 121.310 -5.119 1
1 1074 . 1 1 1 A 101 101 TRP H H 101 9.287 8.677 0.610 1
1 1075 . 1 1 1 A 101 101 TRP HA H 101 4.591 4.598 -0.007 1
1 1080 . 1 1 1 A 101 101 TRP C C 101 176.457 176.877 -0.420 1
1 1081 . 1 1 1 A 101 101 TRP CA C 101 60.045 59.760 0.285 1
1 1082 . 1 1 1 A 101 101 TRP CB C 101 28.578 28.823 -0.245 1
1 1083 . 1 1 1 A 101 101 TRP N N 101 122.220 126.126 -3.906 1
1 1084 . 1 1 1 A 102 102 ASP H H 102 7.553 8.056 -0.503 1
1 1085 . 1 1 1 A 102 102 ASP HA H 102 4.129 4.868 -0.739 1
1 1088 . 1 1 1 A 102 102 ASP C C 102 176.714 176.426 0.288 1
1 1089 . 1 1 1 A 102 102 ASP CA C 102 52.775 53.748 -0.973 1
1 1090 . 1 1 1 A 102 102 ASP CB C 102 39.231 41.400 -2.169 1
1 1091 . 1 1 1 A 102 102 ASP N N 102 115.763 116.561 -0.798 1
1 1092 . 1 1 1 A 103 103 GLY H H 103 7.910 8.452 -0.542 1
1 1093 . 1 1 1 A 103 103 GLY HA2 H 103 4.216 4.009 0.207 1
1 1094 . 1 1 1 A 103 103 GLY HA3 H 103 3.686 4.030 -0.344 1
1 1095 . 1 1 1 A 103 103 GLY C C 103 174.566 174.449 0.117 1
1 1096 . 1 1 1 A 103 103 GLY CA C 103 45.179 46.337 -1.158 1
1 1097 . 1 1 1 A 103 103 GLY N N 103 108.311 109.066 -0.755 1
1 1098 . 1 1 1 A 104 104 THR H H 104 7.691 7.805 -0.114 1
1 1099 . 1 1 1 A 104 104 THR HA H 104 4.031 4.542 -0.511 1
1 1104 . 1 1 1 A 104 104 THR C C 104 173.405 173.545 -0.140 1
1 1105 . 1 1 1 A 104 104 THR CA C 104 64.307 61.994 2.313 1
1 1106 . 1 1 1 A 104 104 THR CB C 104 68.354 70.603 -2.249 1
1 1108 . 1 1 1 A 104 104 THR N N 104 119.913 116.016 3.897 1
1 1109 . 1 1 1 A 105 105 LYS H H 105 8.297 8.633 -0.336 1
1 1110 . 1 1 1 A 105 105 LYS HA H 105 5.457 4.725 0.732 1
1 1116 . 1 1 1 A 105 105 LYS C C 105 177.055 175.837 1.218 1
1 1117 . 1 1 1 A 105 105 LYS CA C 105 54.401 56.367 -1.966 1
1 1118 . 1 1 1 A 105 105 LYS CB C 105 34.230 33.147 1.083 1
1 1122 . 1 1 1 A 105 105 LYS N N 105 125.597 126.326 -0.729 1
1 1123 . 1 1 1 A 106 106 ILE H H 106 9.238 8.954 0.284 1
1 1124 . 1 1 1 A 106 106 ILE HA H 106 4.289 4.770 -0.481 1
1 1133 . 1 1 1 A 106 106 ILE C C 106 174.221 174.507 -0.286 1
1 1134 . 1 1 1 A 106 106 ILE CA C 106 60.631 59.798 0.833 1
1 1135 . 1 1 1 A 106 106 ILE CB C 106 41.927 39.893 2.034 1
1 1139 . 1 1 1 A 106 106 ILE N N 106 124.499 124.964 -0.465 1
1 1140 . 1 1 1 A 107 107 LYS H H 107 8.650 9.085 -0.435 1
1 1141 . 1 1 1 A 107 107 LYS HA H 107 5.608 5.010 0.598 1
1 1147 . 1 1 1 A 107 107 LYS C C 107 175.681 174.935 0.746 1
1 1148 . 1 1 1 A 107 107 LYS CA C 107 55.248 54.919 0.329 1
1 1149 . 1 1 1 A 107 107 LYS CB C 107 33.618 34.199 -0.581 1
1 1153 . 1 1 1 A 107 107 LYS N N 107 130.844 128.270 2.574 1
1 1154 . 1 1 1 A 108 108 ILE H H 108 9.448 8.628 0.820 1
1 1155 . 1 1 1 A 108 108 ILE HA H 108 4.741 4.931 -0.190 1
1 1164 . 1 1 1 A 108 108 ILE C C 108 172.670 174.461 -1.791 1
1 1165 . 1 1 1 A 108 108 ILE CA C 108 59.157 59.377 -0.220 1
1 1166 . 1 1 1 A 108 108 ILE CB C 108 42.241 42.113 0.128 1
1 1170 . 1 1 1 A 108 108 ILE N N 108 125.160 127.950 -2.790 1
1 1171 . 1 1 1 A 109 109 SER H H 109 8.490 8.885 -0.395 1
1 1172 . 1 1 1 A 109 109 SER HA H 109 4.437 4.710 -0.273 1
1 1175 . 1 1 1 A 109 109 SER C C 109 176.536 176.225 0.311 1
1 1176 . 1 1 1 A 109 109 SER CA C 109 58.850 57.561 1.289 1
1 1177 . 1 1 1 A 109 109 SER CB C 109 63.010 63.266 -0.256 1
1 1178 . 1 1 1 A 109 109 SER N N 109 122.750 120.571 2.179 1
1 1179 . 1 1 1 A 110 110 GLY H H 110 9.292 8.664 0.628 1
1 1180 . 1 1 1 A 110 110 GLY HA2 H 110 5.193 3.987 1.206 1
1 1181 . 1 1 1 A 110 110 GLY HA3 H 110 3.755 4.148 -0.393 1
1 1182 . 1 1 1 A 110 110 GLY C C 110 176.964 175.087 1.877 1
1 1183 . 1 1 1 A 110 110 GLY CA C 110 48.168 46.894 1.274 1
1 1184 . 1 1 1 A 110 110 GLY N N 110 116.628 110.946 5.682 1
1 1185 . 1 1 1 A 111 111 GLU H H 111 8.576 8.695 -0.119 1
1 1186 . 1 1 1 A 111 111 GLU HA H 111 4.080 4.154 -0.074 1
1 1191 . 1 1 1 A 111 111 GLU C C 111 178.867 178.623 0.244 1
1 1192 . 1 1 1 A 111 111 GLU CA C 111 59.150 58.559 0.591 1
1 1193 . 1 1 1 A 111 111 GLU CB C 111 28.831 28.841 -0.010 1
1 1195 . 1 1 1 A 111 111 GLU N N 111 120.564 118.309 2.255 1
1 1196 . 1 1 1 A 112 112 LYS H H 112 7.605 8.292 -0.687 1
1 1197 . 1 1 1 A 112 112 LYS HA H 112 4.229 4.014 0.215 1
1 1202 . 1 1 1 A 112 112 LYS C C 112 176.710 178.051 -1.341 1
1 1203 . 1 1 1 A 112 112 LYS CA C 112 57.083 59.391 -2.308 1
1 1204 . 1 1 1 A 112 112 LYS CB C 112 32.183 32.086 0.097 1
1 1208 . 1 1 1 A 112 112 LYS N N 112 116.628 118.781 -2.153 1
1 1209 . 1 1 1 A 113 113 LEU H H 113 7.784 7.732 0.052 1
1 1210 . 1 1 1 A 113 113 LEU HA H 113 4.387 4.255 0.132 1
1 1220 . 1 1 1 A 113 113 LEU C C 113 176.195 176.612 -0.417 1
1 1221 . 1 1 1 A 113 113 LEU CA C 113 52.617 54.125 -1.508 1
1 1222 . 1 1 1 A 113 113 LEU CB C 113 42.820 41.045 1.775 1
1 1226 . 1 1 1 A 113 113 LEU N N 113 114.219 114.404 -0.185 1
1 1227 . 1 1 1 A 114 114 VAL H H 114 7.032 7.260 -0.228 1
1 1228 . 1 1 1 A 114 114 VAL HA H 114 3.723 3.767 -0.044 1
1 1236 . 1 1 1 A 114 114 VAL C C 114 175.430 177.223 -1.793 1
1 1237 . 1 1 1 A 114 114 VAL CA C 114 65.537 63.970 1.567 1
1 1238 . 1 1 1 A 114 114 VAL CB C 114 32.115 31.299 0.816 1
1 1241 . 1 1 1 A 114 114 VAL N N 114 121.773 121.104 0.669 1
1 1242 . 1 1 1 A 115 115 GLY H H 115 8.678 8.816 -0.138 1
1 1243 . 1 1 1 A 115 115 GLY HA2 H 115 4.313 3.945 0.368 1
1 1244 . 1 1 1 A 115 115 GLY HA3 H 115 3.846 3.955 -0.109 1
1 1245 . 1 1 1 A 115 115 GLY C C 115 172.462 173.645 -1.183 1
1 1246 . 1 1 1 A 115 115 GLY CA C 115 43.743 45.544 -1.801 1
1 1247 . 1 1 1 A 115 115 GLY N N 115 117.503 116.882 0.621 1
1 1248 . 1 1 1 A 116 116 ARG H H 116 8.701 8.368 0.333 1
1 1249 . 1 1 1 A 116 116 ARG HA H 116 3.926 4.627 -0.701 1
1 1254 . 1 1 1 A 116 116 ARG CA C 116 56.470 53.222 3.248 1
1 1255 . 1 1 1 A 116 116 ARG CB C 116 29.585 29.656 -0.071 1
1 1257 . 1 1 1 A 116 116 ARG N N 116 123.504 121.077 2.427 1
1 1258 . 1 1 1 A 117 117 PRO HA H 117 4.242 4.235 0.007 1
1 1264 . 1 1 1 A 117 117 PRO C C 117 178.947 178.110 0.837 1
1 1265 . 1 1 1 A 117 117 PRO CA C 117 65.684 64.530 1.154 1
1 1266 . 1 1 1 A 117 117 PRO CB C 117 30.949 32.060 -1.111 1
1 1269 . 1 1 1 A 118 118 GLU H H 118 10.821 8.860 1.961 1
1 1270 . 1 1 1 A 118 118 GLU HA H 118 4.197 4.068 0.129 1
1 1271 . 1 1 1 A 118 118 GLU C C 118 176.627 178.680 -2.053 1
1 1272 . 1 1 1 A 118 118 GLU CA C 118 58.045 59.187 -1.142 1
1 1273 . 1 1 1 A 118 118 GLU CB C 118 27.101 29.205 -2.104 1
1 1274 . 1 1 1 A 118 118 GLU N N 118 119.242 116.444 2.798 1
1 1275 . 1 1 1 A 119 119 MET H H 119 7.226 8.015 -0.789 1
1 1276 . 1 1 1 A 119 119 MET HA H 119 4.591 3.900 0.691 1
1 1279 . 1 1 1 A 119 119 MET C C 119 180.024 178.388 1.636 1
1 1280 . 1 1 1 A 119 119 MET CA C 119 54.695 58.492 -3.797 1
1 1281 . 1 1 1 A 119 119 MET CB C 119 31.012 31.686 -0.674 1
1 1283 . 1 1 1 A 119 119 MET N N 119 119.475 120.092 -0.617 1
1 1284 . 1 1 1 A 120 120 ARG H H 120 7.877 7.561 0.316 1
1 1285 . 1 1 1 A 120 120 ARG HA H 120 3.988 3.928 0.060 1
1 1292 . 1 1 1 A 120 120 ARG C C 120 177.705 178.748 -1.043 1
1 1293 . 1 1 1 A 120 120 ARG CA C 120 60.773 58.315 2.458 1
1 1294 . 1 1 1 A 120 120 ARG CB C 120 31.159 29.856 1.303 1
1 1295 . 1 1 1 A 120 120 ARG N N 120 122.099 120.054 2.045 1
1 1296 . 1 1 1 A 121 121 LEU H H 121 6.732 7.922 -1.190 1
1 1297 . 1 1 1 A 121 121 LEU HA H 121 4.170 4.029 0.141 1
1 1307 . 1 1 1 A 121 121 LEU C C 121 176.220 178.151 -1.931 1
1 1308 . 1 1 1 A 121 121 LEU CA C 121 57.370 57.824 -0.454 1
1 1309 . 1 1 1 A 121 121 LEU CB C 121 42.945 41.836 1.109 1
1 1312 . 1 1 1 A 121 121 LEU N N 121 114.436 119.536 -5.100 1
1 1313 . 1 1 1 A 122 122 LYS H H 122 7.555 8.847 -1.292 1
1 1314 . 1 1 1 A 122 122 LYS HA H 122 4.338 4.334 0.004 1
1 1321 . 1 1 1 A 122 122 LYS C C 122 176.969 176.279 0.690 1
1 1322 . 1 1 1 A 122 122 LYS CA C 122 55.621 55.271 0.350 1
1 1323 . 1 1 1 A 122 122 LYS CB C 122 32.414 31.775 0.639 1
1 1327 . 1 1 1 A 122 122 LYS N N 122 115.754 114.731 1.023 1
1 1328 . 1 1 1 A 123 123 LYS H H 123 7.688 7.919 -0.231 1
1 1329 . 1 1 1 A 123 123 LYS HA H 123 4.535 4.222 0.313 1
1 1330 . 1 1 1 A 123 123 LYS CA C 123 58.461 58.319 0.142 1
1 1331 . 1 1 1 A 123 123 LYS CB C 123 33.138 31.620 1.518 1
1 1332 . 1 1 1 A 123 123 LYS N N 123 120.843 116.068 4.775 1
1 1333 . 1 1 1 A 126 126 ARG HA H 126 4.347 4.806 -0.459 1
1 1338 . 1 1 1 A 126 126 ARG C C 126 174.573 175.064 -0.491 1
1 1339 . 1 1 1 A 126 126 ARG CA C 126 55.998 55.785 0.213 1
1 1340 . 1 1 1 A 126 126 ARG CB C 126 31.569 31.006 0.563 1
1 128 . 2 1 1 A 18 18 GLY H H 18 8.343 8.290 0.053 1
1 129 . 2 1 1 A 18 18 GLY HA2 H 18 3.894 4.106 -0.212 1
1 130 . 2 1 1 A 18 18 GLY C C 18 177.743 175.465 2.278 1
1 131 . 2 1 1 A 18 18 GLY CA C 18 45.497 44.669 0.828 1
1 132 . 2 1 1 A 18 18 GLY N N 18 109.925 109.300 0.625 1
1 133 . 2 1 1 A 19 19 SER H H 19 8.005 8.598 -0.593 1
1 134 . 2 1 1 A 19 19 SER HA H 19 4.329 4.182 0.147 1
1 136 . 2 1 1 A 19 19 SER C C 19 175.168 176.404 -1.236 1
1 137 . 2 1 1 A 19 19 SER CA C 19 58.852 61.491 -2.639 1
1 138 . 2 1 1 A 19 19 SER CB C 19 63.604 62.339 1.265 1
1 139 . 2 1 1 A 19 19 SER N N 19 115.090 115.717 -0.627 1
1 140 . 2 1 1 A 20 20 TYR H H 20 8.040 8.054 -0.014 1
1 141 . 2 1 1 A 20 20 TYR HA H 20 4.439 4.253 0.186 1
1 146 . 2 1 1 A 20 20 TYR C C 20 176.111 178.485 -2.374 1
1 147 . 2 1 1 A 20 20 TYR CA C 20 57.966 61.394 -3.428 1
1 148 . 2 1 1 A 20 20 TYR CB C 20 37.472 38.464 -0.992 1
1 149 . 2 1 1 A 20 20 TYR N N 20 118.675 119.872 -1.197 1
1 150 . 2 1 1 A 21 21 GLN H H 21 7.909 8.343 -0.434 1
1 151 . 2 1 1 A 21 21 GLN HA H 21 3.903 4.166 -0.263 1
1 155 . 2 1 1 A 21 21 GLN C C 21 178.003 178.015 -0.012 1
1 156 . 2 1 1 A 21 21 GLN CA C 21 58.523 58.765 -0.242 1
1 157 . 2 1 1 A 21 21 GLN CB C 21 28.438 28.532 -0.094 1
1 159 . 2 1 1 A 21 21 GLN N N 21 117.056 119.073 -2.017 1
1 160 . 2 1 1 A 22 22 GLU H H 22 8.965 9.134 -0.169 1
1 161 . 2 1 1 A 22 22 GLU HA H 22 4.267 4.278 -0.011 1
1 165 . 2 1 1 A 22 22 GLU C C 22 176.451 178.186 -1.735 1
1 166 . 2 1 1 A 22 22 GLU CA C 22 58.273 58.476 -0.203 1
1 167 . 2 1 1 A 22 22 GLU CB C 22 29.412 30.061 -0.649 1
1 169 . 2 1 1 A 22 22 GLU N N 22 117.289 118.375 -1.086 1
1 170 . 2 1 1 A 23 23 ILE H H 23 7.596 7.917 -0.321 1
1 171 . 2 1 1 A 23 23 ILE HA H 23 4.161 4.396 -0.235 1
1 180 . 2 1 1 A 23 23 ILE C C 23 176.195 175.924 0.271 1
1 181 . 2 1 1 A 23 23 ILE CA C 23 58.120 60.748 -2.628 1
1 182 . 2 1 1 A 23 23 ILE CB C 23 38.461 37.521 0.940 1
1 186 . 2 1 1 A 23 23 ILE N N 23 114.005 117.322 -3.317 1
1 187 . 2 1 1 A 24 24 ILE H H 24 7.178 7.422 -0.244 1
1 188 . 2 1 1 A 24 24 ILE HA H 24 3.740 4.036 -0.296 1
1 197 . 2 1 1 A 24 24 ILE C C 24 177.831 176.779 1.052 1
1 198 . 2 1 1 A 24 24 ILE CA C 24 63.318 62.298 1.020 1
1 199 . 2 1 1 A 24 24 ILE CB C 24 36.590 38.264 -1.674 1
1 203 . 2 1 1 A 24 24 ILE N N 24 122.099 125.419 -3.320 1
1 204 . 2 1 1 A 25 25 GLY H H 25 8.618 8.900 -0.282 1
1 205 . 2 1 1 A 25 25 GLY HA2 H 25 4.390 3.983 0.407 1
1 206 . 2 1 1 A 25 25 GLY HA3 H 25 4.168 4.012 0.156 1
1 207 . 2 1 1 A 25 25 GLY C C 25 175.210 176.307 -1.097 1
1 208 . 2 1 1 A 25 25 GLY CA C 25 45.798 45.181 0.617 1
1 209 . 2 1 1 A 25 25 GLY N N 25 115.531 117.898 -2.367 1
1 210 . 2 1 1 A 26 26 ARG H H 26 8.277 8.271 0.006 1
1 211 . 2 1 1 A 26 26 ARG HA H 26 4.477 4.520 -0.043 1
1 218 . 2 1 1 A 26 26 ARG C C 26 175.944 177.808 -1.864 1
1 219 . 2 1 1 A 26 26 ARG CA C 26 54.408 57.262 -2.854 1
1 220 . 2 1 1 A 26 26 ARG CB C 26 29.501 30.095 -0.594 1
1 223 . 2 1 1 A 26 26 ARG N N 26 119.689 121.502 -1.813 1
1 224 . 2 1 1 A 27 27 THR H H 27 7.923 8.864 -0.941 1
1 225 . 2 1 1 A 27 27 THR HA H 27 3.792 3.947 -0.155 1
1 230 . 2 1 1 A 27 27 THR C C 27 175.251 176.537 -1.286 1
1 231 . 2 1 1 A 27 27 THR CA C 27 64.791 65.350 -0.559 1
1 232 . 2 1 1 A 27 27 THR CB C 27 68.354 68.160 0.194 1
1 234 . 2 1 1 A 27 27 THR N N 27 109.195 113.137 -3.942 1
1 235 . 2 1 1 A 28 28 TRP H H 28 7.389 8.172 -0.783 1
1 236 . 2 1 1 A 28 28 TRP HA H 28 4.441 4.271 0.170 1
1 240 . 2 1 1 A 28 28 TRP C C 28 178.519 178.383 0.136 1
1 241 . 2 1 1 A 28 28 TRP CA C 28 57.789 61.261 -3.472 1
1 242 . 2 1 1 A 28 28 TRP CB C 28 27.387 29.849 -2.462 1
1 243 . 2 1 1 A 28 28 TRP N N 28 120.127 124.786 -4.659 1
1 244 . 2 1 1 A 29 29 ILE H H 29 6.832 8.222 -1.390 1
1 245 . 2 1 1 A 29 29 ILE HA H 29 3.612 3.268 0.344 1
1 254 . 2 1 1 A 29 29 ILE C C 29 176.023 176.728 -0.705 1
1 255 . 2 1 1 A 29 29 ILE CA C 29 63.773 63.678 0.095 1
1 256 . 2 1 1 A 29 29 ILE CB C 29 37.567 37.102 0.465 1
1 260 . 2 1 1 A 29 29 ILE N N 29 119.913 117.836 2.077 1
1 261 . 2 1 1 A 30 30 PHE H H 30 7.329 7.784 -0.455 1
1 262 . 2 1 1 A 30 30 PHE HA H 30 3.912 4.424 -0.512 1
1 268 . 2 1 1 A 30 30 PHE C C 30 177.101 177.735 -0.634 1
1 269 . 2 1 1 A 30 30 PHE CA C 30 59.436 61.419 -1.983 1
1 270 . 2 1 1 A 30 30 PHE CB C 30 38.734 39.510 -0.776 1
1 271 . 2 1 1 A 30 30 PHE N N 30 116.638 120.446 -3.808 1
1 272 . 2 1 1 A 31 31 ARG H H 31 7.399 8.167 -0.768 1
1 273 . 2 1 1 A 31 31 ARG HA H 31 4.287 4.484 -0.197 1
1 278 . 2 1 1 A 31 31 ARG C C 31 176.539 178.335 -1.796 1
1 279 . 2 1 1 A 31 31 ARG CA C 31 58.852 58.916 -0.064 1
1 280 . 2 1 1 A 31 31 ARG CB C 31 29.461 31.007 -1.546 1
1 281 . 2 1 1 A 31 31 ARG N N 31 122.099 120.875 1.224 1
1 282 . 2 1 1 A 32 32 GLY H H 32 8.346 8.385 -0.039 1
1 283 . 2 1 1 A 32 32 GLY HA2 H 32 4.284 3.167 1.117 1
1 284 . 2 1 1 A 32 32 GLY HA3 H 32 3.629 3.711 -0.082 1
1 285 . 2 1 1 A 32 32 GLY C C 32 173.791 173.695 0.096 1
1 286 . 2 1 1 A 32 32 GLY CA C 32 45.793 46.322 -0.529 1
1 287 . 2 1 1 A 32 32 GLY N N 32 109.964 106.583 3.381 1
1 288 . 2 1 1 A 33 33 ALA H H 33 7.510 8.745 -1.235 1
1 289 . 2 1 1 A 33 33 ALA HA H 33 4.193 4.437 -0.244 1
1 293 . 2 1 1 A 33 33 ALA C C 33 176.672 177.168 -0.496 1
1 294 . 2 1 1 A 33 33 ALA CA C 33 54.401 52.243 2.158 1
1 295 . 2 1 1 A 33 33 ALA CB C 33 19.368 21.774 -2.406 1
1 296 . 2 1 1 A 33 33 ALA N N 33 122.266 120.328 1.938 1
1 297 . 2 1 1 A 34 34 HIS H H 34 8.759 7.667 1.092 1
1 298 . 2 1 1 A 34 34 HIS HA H 34 4.529 4.874 -0.345 1
1 302 . 2 1 1 A 34 34 HIS C C 34 175.767 174.772 0.995 1
1 303 . 2 1 1 A 34 34 HIS CA C 34 54.997 54.964 0.033 1
1 304 . 2 1 1 A 34 34 HIS CB C 34 31.089 30.129 0.960 1
1 305 . 2 1 1 A 34 34 HIS N N 34 119.038 117.802 1.236 1
1 306 . 2 1 1 A 35 35 ARG H H 35 8.142 8.748 -0.606 1
1 307 . 2 1 1 A 35 35 ARG HA H 35 4.700 4.692 0.008 1
1 314 . 2 1 1 A 35 35 ARG C C 35 177.572 176.485 1.087 1
1 315 . 2 1 1 A 35 35 ARG CA C 35 54.103 56.010 -1.907 1
1 316 . 2 1 1 A 35 35 ARG CB C 35 29.112 31.909 -2.797 1
1 319 . 2 1 1 A 35 35 ARG N N 35 127.785 128.086 -0.301 1
1 320 . 2 1 1 A 36 36 GLY H H 36 9.352 8.120 1.232 1
1 321 . 2 1 1 A 36 36 GLY HA2 H 36 4.291 4.020 0.271 1
1 322 . 2 1 1 A 36 36 GLY HA3 H 36 3.247 4.115 -0.868 1
1 323 . 2 1 1 A 36 36 GLY C C 36 173.876 173.398 0.478 1
1 324 . 2 1 1 A 36 36 GLY CA C 36 45.644 45.671 -0.027 1
1 325 . 2 1 1 A 36 36 GLY N N 36 109.626 108.335 1.291 1
1 326 . 2 1 1 A 37 37 ARG H H 37 9.384 8.547 0.837 1
1 327 . 2 1 1 A 37 37 ARG HA H 37 4.688 4.313 0.375 1
1 333 . 2 1 1 A 37 37 ARG C C 37 175.081 175.093 -0.012 1
1 334 . 2 1 1 A 37 37 ARG CA C 37 55.742 56.769 -1.027 1
1 335 . 2 1 1 A 37 37 ARG CB C 37 28.138 30.540 -2.402 1
1 338 . 2 1 1 A 37 37 ARG N N 37 127.132 123.348 3.784 1
1 339 . 2 1 1 A 38 38 VAL H H 38 7.605 6.430 1.175 1
1 340 . 2 1 1 A 38 38 VAL HA H 38 4.591 4.056 0.535 1
1 348 . 2 1 1 A 38 38 VAL C C 38 174.391 174.398 -0.007 1
1 349 . 2 1 1 A 38 38 VAL CA C 38 60.092 60.291 -0.199 1
1 350 . 2 1 1 A 38 38 VAL CB C 38 33.328 32.981 0.347 1
1 353 . 2 1 1 A 38 38 VAL N N 38 126.253 125.234 1.019 1
1 354 . 2 1 1 A 39 39 ASN H H 39 9.007 7.822 1.185 1
1 355 . 2 1 1 A 39 39 ASN HA H 39 4.736 4.897 -0.161 1
1 358 . 2 1 1 A 39 39 ASN C C 39 174.562 175.067 -0.505 1
1 359 . 2 1 1 A 39 39 ASN CA C 39 51.577 51.888 -0.311 1
1 360 . 2 1 1 A 39 39 ASN CB C 39 40.749 41.967 -1.218 1
1 361 . 2 1 1 A 39 39 ASN N N 39 123.411 124.070 -0.659 1
1 362 . 2 1 1 A 40 40 LYS H H 40 8.510 8.733 -0.223 1
1 363 . 2 1 1 A 40 40 LYS HA H 40 3.909 3.900 0.009 1
1 370 . 2 1 1 A 40 40 LYS C C 40 176.629 178.245 -1.616 1
1 371 . 2 1 1 A 40 40 LYS CA C 40 59.141 60.348 -1.207 1
1 372 . 2 1 1 A 40 40 LYS CB C 40 32.301 32.277 0.024 1
1 376 . 2 1 1 A 40 40 LYS N N 40 116.303 124.022 -7.719 1
1 377 . 2 1 1 A 41 41 LYS H H 41 7.907 8.520 -0.613 1
1 378 . 2 1 1 A 41 41 LYS HA H 41 4.172 3.816 0.356 1
1 384 . 2 1 1 A 41 41 LYS C C 41 177.229 175.808 1.421 1
1 385 . 2 1 1 A 41 41 LYS CA C 41 57.392 57.810 -0.418 1
1 386 . 2 1 1 A 41 41 LYS CB C 41 32.667 30.832 1.835 1
1 390 . 2 1 1 A 41 41 LYS N N 41 117.066 117.702 -0.636 1
1 391 . 2 1 1 A 42 42 ASN H H 42 7.962 8.639 -0.677 1
1 392 . 2 1 1 A 42 42 ASN HA H 42 4.392 4.522 -0.130 1
1 395 . 2 1 1 A 42 42 ASN C C 42 179.805 176.134 3.671 1
1 396 . 2 1 1 A 42 42 ASN CA C 42 52.335 53.240 -0.905 1
1 397 . 2 1 1 A 42 42 ASN CB C 42 39.348 39.382 -0.034 1
1 398 . 2 1 1 A 42 42 ASN N N 42 114.442 116.678 -2.236 1
1 399 . 2 1 1 A 43 43 ILE H H 43 7.806 8.425 -0.619 1
1 400 . 2 1 1 A 43 43 ILE HA H 43 3.747 3.859 -0.112 1
1 409 . 2 1 1 A 43 43 ILE C C 43 174.219 177.308 -3.089 1
1 410 . 2 1 1 A 43 43 ILE CA C 43 64.505 63.752 0.753 1
1 411 . 2 1 1 A 43 43 ILE CB C 43 36.595 37.740 -1.145 1
1 415 . 2 1 1 A 43 43 ILE N N 43 121.001 120.915 0.086 1
1 416 . 2 1 1 A 44 44 VAL H H 44 6.154 7.941 -1.787 1
1 417 . 2 1 1 A 44 44 VAL HA H 44 3.497 3.923 -0.426 1
1 425 . 2 1 1 A 44 44 VAL C C 44 176.282 176.174 0.108 1
1 426 . 2 1 1 A 44 44 VAL CA C 44 63.606 63.368 0.238 1
1 427 . 2 1 1 A 44 44 VAL CB C 44 30.614 31.581 -0.967 1
1 430 . 2 1 1 A 44 44 VAL N N 44 110.500 119.602 -9.102 1
1 431 . 2 1 1 A 45 45 TRP H H 45 7.419 8.152 -0.733 1
1 432 . 2 1 1 A 45 45 TRP HA H 45 4.716 4.797 -0.081 1
1 438 . 2 1 1 A 45 45 TRP C C 45 175.422 176.294 -0.872 1
1 439 . 2 1 1 A 45 45 TRP CA C 45 56.188 57.813 -1.625 1
1 440 . 2 1 1 A 45 45 TRP CB C 45 31.245 31.329 -0.084 1
1 441 . 2 1 1 A 45 45 TRP N N 45 118.601 121.611 -3.010 1
1 442 . 2 1 1 A 46 46 HIS H H 46 7.582 8.023 -0.441 1
1 443 . 2 1 1 A 46 46 HIS HA H 46 4.227 4.575 -0.348 1
1 448 . 2 1 1 A 46 46 HIS C C 46 177.485 174.612 2.873 1
1 449 . 2 1 1 A 46 46 HIS CA C 46 56.799 56.206 0.593 1
1 450 . 2 1 1 A 46 46 HIS CB C 46 32.017 30.549 1.468 1
1 451 . 2 1 1 A 46 46 HIS N N 46 122.648 117.449 5.199 1
1 452 . 2 1 1 A 47 47 GLU H H 47 7.948 8.252 -0.304 1
1 453 . 2 1 1 A 47 47 GLU HA H 47 4.098 4.210 -0.112 1
1 457 . 2 1 1 A 47 47 GLU C C 47 175.596 176.433 -0.837 1
1 458 . 2 1 1 A 47 47 GLU CA C 47 56.482 56.395 0.087 1
1 459 . 2 1 1 A 47 47 GLU CB C 47 31.839 29.474 2.365 1
1 461 . 2 1 1 A 47 47 GLU N N 47 120.485 121.256 -0.771 1
1 462 . 2 1 1 A 48 48 LEU H H 48 9.304 8.701 0.603 1
1 463 . 2 1 1 A 48 48 LEU HA H 48 4.218 4.288 -0.070 1
1 472 . 2 1 1 A 48 48 LEU C C 48 177.743 176.502 1.241 1
1 473 . 2 1 1 A 48 48 LEU CA C 48 55.043 54.898 0.145 1
1 474 . 2 1 1 A 48 48 LEU CB C 48 41.948 41.114 0.834 1
1 477 . 2 1 1 A 48 48 LEU N N 48 128.658 125.552 3.106 1
1 478 . 2 1 1 A 49 49 ILE H H 49 8.028 9.037 -1.009 1
1 479 . 2 1 1 A 49 49 ILE HA H 49 3.279 4.549 -1.270 1
1 488 . 2 1 1 A 49 49 ILE C C 49 174.821 176.898 -2.077 1
1 489 . 2 1 1 A 49 49 ILE CA C 49 63.901 61.948 1.953 1
1 490 . 2 1 1 A 49 49 ILE CB C 49 37.775 40.492 -2.717 1
1 494 . 2 1 1 A 49 49 ILE N N 49 120.341 123.475 -3.134 1
1 495 . 2 1 1 A 50 50 GLY H H 50 9.038 7.883 1.155 1
1 496 . 2 1 1 A 50 50 GLY HA2 H 50 4.717 4.441 0.276 1
1 497 . 2 1 1 A 50 50 GLY HA3 H 50 3.491 4.450 -0.959 1
1 498 . 2 1 1 A 50 50 GLY C C 50 175.084 173.278 1.806 1
1 499 . 2 1 1 A 50 50 GLY CA C 50 44.599 45.956 -1.357 1
1 500 . 2 1 1 A 50 50 GLY N N 50 110.284 108.631 1.653 1
1 501 . 2 1 1 A 51 51 LEU H H 51 8.400 7.823 0.577 1
1 502 . 2 1 1 A 51 51 LEU HA H 51 4.723 4.466 0.257 1
1 512 . 2 1 1 A 51 51 LEU C C 51 177.147 174.871 2.276 1
1 513 . 2 1 1 A 51 51 LEU CA C 51 54.350 53.416 0.934 1
1 514 . 2 1 1 A 51 51 LEU CB C 51 42.985 44.536 -1.551 1
1 518 . 2 1 1 A 51 51 LEU N N 51 120.471 121.767 -1.296 1
1 519 . 2 1 1 A 52 52 LYS H H 52 7.505 8.431 -0.926 1
1 520 . 2 1 1 A 52 52 LYS HA H 52 4.250 4.660 -0.410 1
1 527 . 2 1 1 A 52 52 LYS C C 52 174.995 175.216 -0.221 1
1 528 . 2 1 1 A 52 52 LYS CA C 52 55.589 55.167 0.422 1
1 529 . 2 1 1 A 52 52 LYS CB C 52 33.025 33.913 -0.888 1
1 533 . 2 1 1 A 52 52 LYS N N 52 122.406 123.236 -0.830 1
1 534 . 2 1 1 A 53 53 VAL H H 53 9.075 8.305 0.770 1
1 535 . 2 1 1 A 53 53 VAL HA H 53 5.071 5.026 0.045 1
1 543 . 2 1 1 A 53 53 VAL C C 53 171.170 173.618 -2.448 1
1 544 . 2 1 1 A 53 53 VAL CA C 53 58.523 59.207 -0.684 1
1 545 . 2 1 1 A 53 53 VAL CB C 53 35.698 35.436 0.262 1
1 548 . 2 1 1 A 53 53 VAL N N 53 124.509 124.644 -0.135 1
1 549 . 2 1 1 A 54 54 ARG H H 54 8.148 8.591 -0.443 1
1 550 . 2 1 1 A 54 54 ARG HA H 54 5.329 4.889 0.440 1
1 557 . 2 1 1 A 54 54 ARG C C 54 176.113 174.393 1.720 1
1 558 . 2 1 1 A 54 54 ARG CA C 54 53.817 54.024 -0.207 1
1 559 . 2 1 1 A 54 54 ARG CB C 54 34.511 33.856 0.655 1
1 562 . 2 1 1 A 54 54 ARG N N 54 123.625 121.962 1.663 1
1 563 . 2 1 1 A 55 55 VAL H H 55 8.659 9.670 -1.011 1
1 564 . 2 1 1 A 55 55 VAL HA H 55 4.085 4.001 0.084 1
1 572 . 2 1 1 A 55 55 VAL C C 55 176.282 175.361 0.921 1
1 573 . 2 1 1 A 55 55 VAL CA C 55 62.814 62.431 0.383 1
1 574 . 2 1 1 A 55 55 VAL CB C 55 30.628 31.055 -0.427 1
1 577 . 2 1 1 A 55 55 VAL N N 55 125.383 123.040 2.343 1
1 578 . 2 1 1 A 56 56 VAL H H 56 8.057 8.009 0.048 1
1 579 . 2 1 1 A 56 56 VAL HA H 56 4.123 3.977 0.146 1
1 587 . 2 1 1 A 56 56 VAL C C 56 175.426 176.146 -0.720 1
1 588 . 2 1 1 A 56 56 VAL CA C 56 62.786 64.234 -1.448 1
1 589 . 2 1 1 A 56 56 VAL CB C 56 32.267 32.570 -0.303 1
1 592 . 2 1 1 A 56 56 VAL N N 56 124.936 129.197 -4.261 1
1 593 . 2 1 1 A 57 57 ASN H H 57 7.527 8.268 -0.741 1
1 594 . 2 1 1 A 57 57 ASN HA H 57 4.817 5.223 -0.406 1
1 597 . 2 1 1 A 57 57 ASN C C 57 172.973 173.581 -0.608 1
1 598 . 2 1 1 A 57 57 ASN CA C 57 52.460 51.608 0.852 1
1 599 . 2 1 1 A 57 57 ASN CB C 57 42.070 41.337 0.733 1
1 600 . 2 1 1 A 57 57 ASN N N 57 114.777 117.145 -2.368 1
1 601 . 2 1 1 A 58 58 SER H H 58 8.193 8.869 -0.676 1
1 602 . 2 1 1 A 58 58 SER HA H 58 5.214 4.810 0.404 1
1 605 . 2 1 1 A 58 58 SER C C 58 174.221 171.908 2.313 1
1 606 . 2 1 1 A 58 58 SER CA C 58 56.778 56.402 0.376 1
1 607 . 2 1 1 A 58 58 SER CB C 58 63.906 65.175 -1.269 1
1 608 . 2 1 1 A 58 58 SER N N 58 115.531 119.898 -4.367 1
1 609 . 2 1 1 A 59 59 THR H H 59 8.053 8.266 -0.213 1
1 610 . 2 1 1 A 59 59 THR HA H 59 4.305 4.630 -0.325 1
1 615 . 2 1 1 A 59 59 THR C C 59 174.478 172.463 2.015 1
1 616 . 2 1 1 A 59 59 THR CA C 59 63.305 60.092 3.213 1
1 617 . 2 1 1 A 59 59 THR CB C 59 68.354 68.429 -0.075 1
1 619 . 2 1 1 A 59 59 THR N N 59 116.405 116.665 -0.260 1
1 620 . 2 1 1 A 60 60 HIS H H 60 8.359 8.007 0.352 1
1 621 . 2 1 1 A 60 60 HIS HA H 60 5.167 5.071 0.096 1
1 626 . 2 1 1 A 60 60 HIS CA C 60 52.792 52.944 -0.152 1
1 627 . 2 1 1 A 60 60 HIS CB C 60 32.142 30.079 2.063 1
1 628 . 2 1 1 A 60 60 HIS N N 60 123.625 124.875 -1.250 1
1 629 . 2 1 1 A 61 61 PRO HA H 61 4.277 4.305 -0.028 1
1 636 . 2 1 1 A 61 61 PRO C C 61 178.217 177.675 0.542 1
1 637 . 2 1 1 A 61 61 PRO CA C 61 64.375 64.506 -0.131 1
1 638 . 2 1 1 A 61 61 PRO CB C 61 32.007 32.144 -0.137 1
1 641 . 2 1 1 A 62 62 GLY H H 62 8.421 8.180 0.241 1
1 642 . 2 1 1 A 62 62 GLY HA2 H 62 3.889 3.672 0.217 1
1 643 . 2 1 1 A 62 62 GLY HA3 H 62 3.653 3.781 -0.128 1
1 644 . 2 1 1 A 62 62 GLY C C 62 174.994 173.887 1.107 1
1 645 . 2 1 1 A 62 62 GLY CA C 62 45.831 44.851 0.980 1
1 646 . 2 1 1 A 62 62 GLY N N 62 106.132 106.514 -0.382 1
1 647 . 2 1 1 A 63 63 TYR H H 63 7.327 8.176 -0.849 1
1 648 . 2 1 1 A 63 63 TYR HA H 63 4.846 4.584 0.262 1
1 652 . 2 1 1 A 63 63 TYR C C 63 175.593 175.442 0.151 1
1 653 . 2 1 1 A 63 63 TYR CA C 63 56.071 58.306 -2.235 1
1 654 . 2 1 1 A 63 63 TYR CB C 63 38.962 40.389 -1.427 1
1 655 . 2 1 1 A 63 63 TYR N N 63 116.628 117.432 -0.804 1
1 656 . 2 1 1 A 64 64 VAL H H 64 7.296 7.128 0.168 1
1 657 . 2 1 1 A 64 64 VAL HA H 64 3.180 4.104 -0.924 1
1 665 . 2 1 1 A 64 64 VAL C C 64 177.312 176.552 0.760 1
1 666 . 2 1 1 A 64 64 VAL CA C 64 65.688 63.158 2.530 1
1 667 . 2 1 1 A 64 64 VAL CB C 64 30.957 31.544 -0.587 1
1 670 . 2 1 1 A 64 64 VAL N N 64 117.940 117.861 0.079 1
1 671 . 2 1 1 A 65 65 GLY H H 65 8.449 9.824 -1.375 1
1 672 . 2 1 1 A 65 65 GLY HA2 H 65 4.320 3.944 0.376 1
1 673 . 2 1 1 A 65 65 GLY HA3 H 65 3.515 3.946 -0.431 1
1 674 . 2 1 1 A 65 65 GLY C C 65 174.821 173.337 1.484 1
1 675 . 2 1 1 A 65 65 GLY CA C 65 44.599 45.217 -0.618 1
1 676 . 2 1 1 A 65 65 GLY N N 65 115.317 114.249 1.068 1
1 677 . 2 1 1 A 66 66 ILE H H 66 7.095 7.459 -0.364 1
1 678 . 2 1 1 A 66 66 ILE HA H 66 3.193 4.714 -1.521 1
1 687 . 2 1 1 A 66 66 ILE C C 66 174.308 174.896 -0.588 1
1 688 . 2 1 1 A 66 66 ILE CA C 66 63.470 60.380 3.090 1
1 689 . 2 1 1 A 66 66 ILE CB C 66 37.775 40.472 -2.697 1
1 693 . 2 1 1 A 66 66 ILE N N 66 122.099 122.661 -0.562 1
1 694 . 2 1 1 A 67 67 GLU H H 67 7.126 9.214 -2.088 1
1 695 . 2 1 1 A 67 67 GLU HA H 67 5.343 5.322 0.021 1
1 699 . 2 1 1 A 67 67 GLU C C 67 174.652 175.322 -0.670 1
1 700 . 2 1 1 A 67 67 GLU CA C 67 54.109 54.418 -0.309 1
1 701 . 2 1 1 A 67 67 GLU CB C 67 33.619 33.120 0.499 1
1 703 . 2 1 1 A 67 67 GLU N N 67 125.164 128.862 -3.698 1
1 704 . 2 1 1 A 68 68 GLY H H 68 8.401 8.142 0.259 1
1 705 . 2 1 1 A 68 68 GLY HA2 H 68 4.364 2.607 1.757 1
1 706 . 2 1 1 A 68 68 GLY HA3 H 68 4.041 3.540 0.501 1
1 707 . 2 1 1 A 68 68 GLY C C 68 171.644 171.204 0.440 1
1 708 . 2 1 1 A 68 68 GLY CA C 68 45.680 44.155 1.525 1
1 709 . 2 1 1 A 68 68 GLY N N 68 109.626 111.638 -2.012 1
1 710 . 2 1 1 A 69 69 TYR H H 69 8.422 9.920 -1.498 1
1 711 . 2 1 1 A 69 69 TYR HA H 69 5.079 4.922 0.157 1
1 714 . 2 1 1 A 69 69 TYR C C 69 176.194 175.371 0.823 1
1 715 . 2 1 1 A 69 69 TYR CA C 69 57.681 56.502 1.179 1
1 716 . 2 1 1 A 69 69 TYR CB C 69 41.043 39.732 1.311 1
1 717 . 2 1 1 A 69 69 TYR N N 69 119.689 122.028 -2.339 1
1 718 . 2 1 1 A 70 70 VAL H H 70 8.753 8.794 -0.041 1
1 719 . 2 1 1 A 70 70 VAL HA H 70 4.143 4.393 -0.250 1
1 727 . 2 1 1 A 70 70 VAL C C 70 176.540 175.715 0.825 1
1 728 . 2 1 1 A 70 70 VAL CA C 70 63.477 63.752 -0.275 1
1 729 . 2 1 1 A 70 70 VAL CB C 70 30.952 32.248 -1.296 1
1 732 . 2 1 1 A 70 70 VAL N N 70 123.420 127.502 -4.082 1
1 733 . 2 1 1 A 71 71 ILE H H 71 9.101 10.232 -1.131 1
1 734 . 2 1 1 A 71 71 ILE HA H 71 4.834 4.603 0.231 1
1 743 . 2 1 1 A 71 71 ILE C C 71 175.418 175.627 -0.209 1
1 744 . 2 1 1 A 71 71 ILE CA C 71 60.637 62.173 -1.536 1
1 745 . 2 1 1 A 71 71 ILE CB C 71 39.853 40.794 -0.941 1
1 749 . 2 1 1 A 71 71 ILE N N 71 119.913 126.032 -6.119 1
1 750 . 2 1 1 A 72 72 ASP H H 72 8.030 7.968 0.062 1
1 751 . 2 1 1 A 72 72 ASP HA H 72 4.964 5.291 -0.327 1
1 754 . 2 1 1 A 72 72 ASP C C 72 173.017 174.273 -1.256 1
1 755 . 2 1 1 A 72 72 ASP CA C 72 53.511 53.184 0.327 1
1 756 . 2 1 1 A 72 72 ASP CB C 72 41.932 44.649 -2.717 1
1 757 . 2 1 1 A 72 72 ASP N N 72 118.377 121.995 -3.618 1
1 758 . 2 1 1 A 73 73 GLU H H 73 9.349 8.787 0.562 1
1 759 . 2 1 1 A 73 73 GLU HA H 73 4.868 5.090 -0.222 1
1 762 . 2 1 1 A 73 73 GLU C C 73 173.793 174.585 -0.792 1
1 763 . 2 1 1 A 73 73 GLU CA C 73 55.521 56.537 -1.016 1
1 764 . 2 1 1 A 73 73 GLU CB C 73 33.138 32.181 0.957 1
1 766 . 2 1 1 A 73 73 GLU N N 73 123.848 122.917 0.931 1
1 767 . 2 1 1 A 74 74 THR H H 74 8.748 8.475 0.273 1
1 768 . 2 1 1 A 74 74 THR HA H 74 4.992 4.843 0.149 1
1 773 . 2 1 1 A 74 74 THR CA C 74 59.450 60.252 -0.802 1
1 774 . 2 1 1 A 74 74 THR CB C 74 70.429 72.164 -1.735 1
1 776 . 2 1 1 A 74 74 THR N N 74 116.628 118.262 -1.634 1
1 777 . 2 1 1 A 75 75 ARG HA H 75 3.741 4.136 -0.395 1
1 782 . 2 1 1 A 75 75 ARG C C 75 177.140 176.683 0.457 1
1 783 . 2 1 1 A 75 75 ARG CA C 75 60.041 58.899 1.142 1
1 784 . 2 1 1 A 75 75 ARG CB C 75 29.930 29.974 -0.044 1
1 787 . 2 1 1 A 76 76 ASN H H 76 8.497 7.808 0.689 1
1 788 . 2 1 1 A 76 76 ASN HA H 76 5.310 4.896 0.414 1
1 791 . 2 1 1 A 76 76 ASN C C 76 175.509 174.104 1.405 1
1 792 . 2 1 1 A 76 76 ASN CA C 76 52.320 52.648 -0.328 1
1 793 . 2 1 1 A 76 76 ASN CB C 76 40.744 39.653 1.091 1
1 794 . 2 1 1 A 76 76 ASN N N 76 111.053 115.059 -4.006 1
1 795 . 2 1 1 A 77 77 MET H H 77 7.528 7.372 0.156 1
1 796 . 2 1 1 A 77 77 MET HA H 77 5.392 4.927 0.465 1
1 801 . 2 1 1 A 77 77 MET C C 77 174.824 174.420 0.404 1
1 802 . 2 1 1 A 77 77 MET CA C 77 54.994 53.882 1.112 1
1 803 . 2 1 1 A 77 77 MET CB C 77 36.753 35.388 1.365 1
1 805 . 2 1 1 A 77 77 MET N N 77 119.913 115.737 4.176 1
1 806 . 2 1 1 A 78 78 LEU H H 78 8.977 8.548 0.429 1
1 807 . 2 1 1 A 78 78 LEU HA H 78 4.803 5.522 -0.719 1
1 817 . 2 1 1 A 78 78 LEU C C 78 174.563 174.611 -0.048 1
1 818 . 2 1 1 A 78 78 LEU CA C 78 53.964 54.467 -0.503 1
1 819 . 2 1 1 A 78 78 LEU CB C 78 44.903 45.510 -0.607 1
1 823 . 2 1 1 A 78 78 LEU N N 78 121.224 121.241 -0.017 1
1 824 . 2 1 1 A 79 79 VAL H H 79 8.115 9.583 -1.468 1
1 825 . 2 1 1 A 79 79 VAL HA H 79 4.783 5.208 -0.425 1
1 833 . 2 1 1 A 79 79 VAL C C 79 175.297 175.067 0.230 1
1 834 . 2 1 1 A 79 79 VAL CA C 79 61.821 60.838 0.983 1
1 835 . 2 1 1 A 79 79 VAL CB C 79 31.146 34.851 -3.705 1
1 838 . 2 1 1 A 79 79 VAL N N 79 124.062 127.384 -3.322 1
1 839 . 2 1 1 A 80 80 ILE H H 80 9.342 8.698 0.644 1
1 840 . 2 1 1 A 80 80 ILE HA H 80 4.764 5.233 -0.469 1
1 849 . 2 1 1 A 80 80 ILE C C 80 174.127 174.839 -0.712 1
1 850 . 2 1 1 A 80 80 ILE CA C 80 59.897 59.672 0.225 1
1 851 . 2 1 1 A 80 80 ILE CB C 80 42.225 41.550 0.675 1
1 855 . 2 1 1 A 80 80 ILE N N 80 129.970 126.801 3.169 1
1 856 . 2 1 1 A 81 81 ALA H H 81 9.478 10.274 -0.796 1
1 857 . 2 1 1 A 81 81 ALA HA H 81 5.139 5.528 -0.389 1
1 861 . 2 1 1 A 81 81 ALA C C 81 176.970 176.329 0.641 1
1 862 . 2 1 1 A 81 81 ALA CA C 81 50.835 50.416 0.419 1
1 863 . 2 1 1 A 81 81 ALA CB C 81 21.451 21.946 -0.495 1
1 864 . 2 1 1 A 81 81 ALA N N 81 129.756 127.714 2.042 1
1 865 . 2 1 1 A 82 82 GLY H H 82 8.691 8.614 0.077 1
1 866 . 2 1 1 A 82 82 GLY HA2 H 82 5.110 4.151 0.959 1
1 867 . 2 1 1 A 82 82 GLY HA3 H 82 4.241 4.286 -0.045 1
1 868 . 2 1 1 A 82 82 GLY C C 82 173.017 174.543 -1.526 1
1 869 . 2 1 1 A 82 82 GLY CA C 82 44.166 45.012 -0.846 1
1 870 . 2 1 1 A 82 82 GLY N N 82 113.568 109.046 4.522 1
1 871 . 2 1 1 A 83 83 GLU H H 83 8.659 9.111 -0.452 1
1 872 . 2 1 1 A 83 83 GLU HA H 83 4.286 4.268 0.018 1
1 876 . 2 1 1 A 83 83 GLU C C 83 177.570 176.650 0.920 1
1 877 . 2 1 1 A 83 83 GLU CA C 83 59.017 58.738 0.279 1
1 878 . 2 1 1 A 83 83 GLU CB C 83 29.762 29.096 0.666 1
1 880 . 2 1 1 A 83 83 GLU N N 83 120.019 122.939 -2.920 1
1 881 . 2 1 1 A 84 84 ASN H H 84 8.549 8.817 -0.268 1
1 882 . 2 1 1 A 84 84 ASN HA H 84 4.821 5.019 -0.198 1
1 884 . 2 1 1 A 84 84 ASN C C 84 173.878 174.437 -0.559 1
1 885 . 2 1 1 A 84 84 ASN CA C 84 52.919 52.074 0.845 1
1 886 . 2 1 1 A 84 84 ASN CB C 84 40.150 38.349 1.801 1
1 887 . 2 1 1 A 84 84 ASN N N 84 112.778 124.360 -11.582 1
1 888 . 2 1 1 A 85 85 LYS H H 85 7.116 7.273 -0.157 1
1 889 . 2 1 1 A 85 85 LYS HA H 85 4.344 4.876 -0.532 1
1 895 . 2 1 1 A 85 85 LYS C C 85 173.278 174.623 -1.345 1
1 896 . 2 1 1 A 85 85 LYS CA C 85 55.292 55.379 -0.087 1
1 897 . 2 1 1 A 85 85 LYS CB C 85 36.124 36.172 -0.048 1
1 901 . 2 1 1 A 85 85 LYS N N 85 118.377 120.512 -2.135 1
1 902 . 2 1 1 A 86 86 VAL H H 86 7.781 8.765 -0.984 1
1 903 . 2 1 1 A 86 86 VAL HA H 86 4.749 5.365 -0.616 1
1 911 . 2 1 1 A 86 86 VAL C C 86 174.739 174.265 0.474 1
1 912 . 2 1 1 A 86 86 VAL CA C 86 60.716 59.526 1.190 1
1 913 . 2 1 1 A 86 86 VAL CB C 86 33.619 35.550 -1.931 1
1 916 . 2 1 1 A 86 86 VAL N N 86 120.127 117.316 2.811 1
1 917 . 2 1 1 A 87 87 TRP H H 87 9.558 10.501 -0.943 1
1 918 . 2 1 1 A 87 87 TRP HA H 87 4.958 5.400 -0.442 1
1 923 . 2 1 1 A 87 87 TRP C C 87 174.909 175.161 -0.252 1
1 924 . 2 1 1 A 87 87 TRP CA C 87 57.073 56.111 0.962 1
1 925 . 2 1 1 A 87 87 TRP CB C 87 33.028 31.202 1.826 1
1 926 . 2 1 1 A 87 87 TRP N N 87 127.346 123.333 4.013 1
1 927 . 2 1 1 A 88 88 LYS H H 88 8.590 8.003 0.587 1
1 928 . 2 1 1 A 88 88 LYS HA H 88 4.856 4.685 0.171 1
1 935 . 2 1 1 A 88 88 LYS C C 88 175.382 174.407 0.975 1
1 936 . 2 1 1 A 88 88 LYS CA C 88 55.887 54.598 1.289 1
1 937 . 2 1 1 A 88 88 LYS CB C 88 32.434 33.446 -1.012 1
1 941 . 2 1 1 A 88 88 LYS N N 88 123.625 124.968 -1.343 1
1 942 . 2 1 1 A 89 89 VAL H H 89 8.829 8.103 0.726 1
1 943 . 2 1 1 A 89 89 VAL HA H 89 4.406 4.612 -0.206 1
1 951 . 2 1 1 A 89 89 VAL CA C 89 58.371 58.983 -0.612 1
1 952 . 2 1 1 A 89 89 VAL CB C 89 34.512 32.120 2.392 1
1 955 . 2 1 1 A 89 89 VAL N N 89 124.285 120.754 3.531 1
1 956 . 2 1 1 A 90 90 PRO HA H 90 5.073 4.602 0.471 1
1 961 . 2 1 1 A 90 90 PRO C C 90 177.231 177.705 -0.474 1
1 962 . 2 1 1 A 90 90 PRO CA C 90 61.795 63.482 -1.687 1
1 963 . 2 1 1 A 90 90 PRO CB C 90 31.660 32.234 -0.574 1
1 964 . 2 1 1 A 91 91 LYS H H 91 8.116 8.658 -0.542 1
1 965 . 2 1 1 A 91 91 LYS HA H 91 4.024 4.240 -0.216 1
1 969 . 2 1 1 A 91 91 LYS C C 91 178.518 177.276 1.242 1
1 970 . 2 1 1 A 91 91 LYS CA C 91 59.621 58.693 0.928 1
1 971 . 2 1 1 A 91 91 LYS CB C 91 34.217 31.885 2.332 1
1 973 . 2 1 1 A 91 91 LYS N N 91 121.224 123.297 -2.073 1
1 974 . 2 1 1 A 92 92 ASP H H 92 8.505 8.501 0.004 1
1 975 . 2 1 1 A 92 92 ASP HA H 92 3.781 4.627 -0.846 1
1 978 . 2 1 1 A 92 92 ASP C C 92 176.975 176.639 0.336 1
1 979 . 2 1 1 A 92 92 ASP CA C 92 56.773 54.797 1.976 1
1 980 . 2 1 1 A 92 92 ASP CB C 92 39.590 40.082 -0.492 1
1 981 . 2 1 1 A 92 92 ASP N N 92 111.815 117.551 -5.736 1
1 982 . 2 1 1 A 93 93 VAL H H 93 6.691 8.847 -2.156 1
1 983 . 2 1 1 A 93 93 VAL HA H 93 4.678 4.434 0.244 1
1 991 . 2 1 1 A 93 93 VAL C C 93 176.537 174.592 1.945 1
1 992 . 2 1 1 A 93 93 VAL CA C 93 60.120 61.365 -1.245 1
1 993 . 2 1 1 A 93 93 VAL CB C 93 31.093 32.414 -1.321 1
1 996 . 2 1 1 A 93 93 VAL N N 93 107.879 118.080 -10.201 1
1 997 . 2 1 1 A 94 94 CYS H H 94 7.249 7.876 -0.627 1
1 998 . 2 1 1 A 94 94 CYS HA H 94 5.062 4.751 0.311 1
1 1001 . 2 1 1 A 94 94 CYS C C 94 173.103 172.387 0.716 1
1 1002 . 2 1 1 A 94 94 CYS CA C 94 58.001 57.831 0.170 1
1 1003 . 2 1 1 A 94 94 CYS CB C 94 31.418 31.139 0.279 1
1 1004 . 2 1 1 A 94 94 CYS N N 94 117.940 119.718 -1.778 1
1 1005 . 2 1 1 A 95 95 ILE H H 95 8.153 8.130 0.023 1
1 1006 . 2 1 1 A 95 95 ILE HA H 95 4.159 4.669 -0.510 1
1 1016 . 2 1 1 A 95 95 ILE C C 95 174.736 174.812 -0.076 1
1 1017 . 2 1 1 A 95 95 ILE CA C 95 61.234 60.371 0.863 1
1 1018 . 2 1 1 A 95 95 ILE CB C 95 38.071 39.497 -1.426 1
1 1022 . 2 1 1 A 95 95 ILE N N 95 121.876 122.297 -0.421 1
1 1023 . 2 1 1 A 96 96 PHE H H 96 8.400 8.816 -0.416 1
1 1024 . 2 1 1 A 96 96 PHE HA H 96 5.004 4.761 0.243 1
1 1029 . 2 1 1 A 96 96 PHE C C 96 174.005 174.363 -0.358 1
1 1030 . 2 1 1 A 96 96 PHE CA C 96 56.922 57.057 -0.135 1
1 1031 . 2 1 1 A 96 96 PHE CB C 96 44.006 40.712 3.294 1
1 1032 . 2 1 1 A 96 96 PHE N N 96 125.820 126.593 -0.773 1
1 1033 . 2 1 1 A 97 97 GLU H H 97 8.985 8.473 0.512 1
1 1034 . 2 1 1 A 97 97 GLU HA H 97 5.275 5.307 -0.032 1
1 1038 . 2 1 1 A 97 97 GLU C C 97 175.596 174.724 0.872 1
1 1039 . 2 1 1 A 97 97 GLU CA C 97 55.070 54.557 0.513 1
1 1040 . 2 1 1 A 97 97 GLU CB C 97 33.628 30.975 2.653 1
1 1042 . 2 1 1 A 97 97 GLU N N 97 121.010 123.875 -2.865 1
1 1043 . 2 1 1 A 98 98 PHE H H 98 9.304 9.171 0.133 1
1 1044 . 2 1 1 A 98 98 PHE HA H 98 5.337 5.124 0.213 1
1 1048 . 2 1 1 A 98 98 PHE C C 98 174.650 175.687 -1.037 1
1 1049 . 2 1 1 A 98 98 PHE CA C 98 57.363 57.836 -0.473 1
1 1050 . 2 1 1 A 98 98 PHE CB C 98 41.936 40.533 1.403 1
1 1051 . 2 1 1 A 98 98 PHE N N 98 128.658 126.376 2.282 1
1 1052 . 2 1 1 A 99 99 GLU H H 99 8.721 8.820 -0.099 1
1 1053 . 2 1 1 A 99 99 GLU HA H 99 5.457 4.758 0.699 1
1 1058 . 2 1 1 A 99 99 GLU C C 99 176.368 176.600 -0.232 1
1 1059 . 2 1 1 A 99 99 GLU CA C 99 54.401 55.519 -1.118 1
1 1060 . 2 1 1 A 99 99 GLU CB C 99 33.068 31.519 1.549 1
1 1062 . 2 1 1 A 99 99 GLU N N 99 122.759 124.059 -1.300 1
1 1063 . 2 1 1 A 100 100 THR H H 100 8.588 11.354 -2.766 1
1 1064 . 2 1 1 A 100 100 THR HA H 100 4.603 4.333 0.270 1
1 1069 . 2 1 1 A 100 100 THR C C 100 177.144 176.969 0.175 1
1 1070 . 2 1 1 A 100 100 THR CA C 100 60.774 63.611 -2.837 1
1 1071 . 2 1 1 A 100 100 THR CB C 100 70.136 69.644 0.492 1
1 1073 . 2 1 1 A 100 100 THR N N 100 116.191 121.298 -5.107 1
1 1074 . 2 1 1 A 101 101 TRP H H 101 9.287 9.053 0.234 1
1 1075 . 2 1 1 A 101 101 TRP HA H 101 4.591 4.392 0.199 1
1 1080 . 2 1 1 A 101 101 TRP C C 101 176.457 176.605 -0.148 1
1 1081 . 2 1 1 A 101 101 TRP CA C 101 60.045 59.111 0.934 1
1 1082 . 2 1 1 A 101 101 TRP CB C 101 28.578 28.308 0.270 1
1 1083 . 2 1 1 A 101 101 TRP N N 101 122.220 124.451 -2.231 1
1 1084 . 2 1 1 A 102 102 ASP H H 102 7.553 8.250 -0.697 1
1 1085 . 2 1 1 A 102 102 ASP HA H 102 4.129 4.456 -0.327 1
1 1088 . 2 1 1 A 102 102 ASP C C 102 176.714 176.178 0.536 1
1 1089 . 2 1 1 A 102 102 ASP CA C 102 52.775 53.219 -0.444 1
1 1090 . 2 1 1 A 102 102 ASP CB C 102 39.231 40.597 -1.366 1
1 1091 . 2 1 1 A 102 102 ASP N N 102 115.763 120.402 -4.639 1
1 1092 . 2 1 1 A 103 103 GLY H H 103 7.910 8.717 -0.807 1
1 1093 . 2 1 1 A 103 103 GLY HA2 H 103 4.216 3.948 0.268 1
1 1094 . 2 1 1 A 103 103 GLY HA3 H 103 3.686 3.979 -0.293 1
1 1095 . 2 1 1 A 103 103 GLY C C 103 174.566 174.361 0.205 1
1 1096 . 2 1 1 A 103 103 GLY CA C 103 45.179 45.858 -0.679 1
1 1097 . 2 1 1 A 103 103 GLY N N 103 108.311 108.595 -0.284 1
1 1098 . 2 1 1 A 104 104 THR H H 104 7.691 7.955 -0.264 1
1 1099 . 2 1 1 A 104 104 THR HA H 104 4.031 4.480 -0.449 1
1 1104 . 2 1 1 A 104 104 THR C C 104 173.405 173.349 0.056 1
1 1105 . 2 1 1 A 104 104 THR CA C 104 64.307 62.252 2.055 1
1 1106 . 2 1 1 A 104 104 THR CB C 104 68.354 70.364 -2.010 1
1 1108 . 2 1 1 A 104 104 THR N N 104 119.913 117.215 2.698 1
1 1109 . 2 1 1 A 105 105 LYS H H 105 8.297 8.524 -0.227 1
1 1110 . 2 1 1 A 105 105 LYS HA H 105 5.457 4.478 0.979 1
1 1116 . 2 1 1 A 105 105 LYS C C 105 177.055 176.258 0.797 1
1 1117 . 2 1 1 A 105 105 LYS CA C 105 54.401 56.193 -1.792 1
1 1118 . 2 1 1 A 105 105 LYS CB C 105 34.230 32.905 1.325 1
1 1122 . 2 1 1 A 105 105 LYS N N 105 125.597 125.956 -0.359 1
1 1123 . 2 1 1 A 106 106 ILE H H 106 9.238 9.551 -0.313 1
1 1124 . 2 1 1 A 106 106 ILE HA H 106 4.289 4.760 -0.471 1
1 1133 . 2 1 1 A 106 106 ILE C C 106 174.221 174.657 -0.436 1
1 1134 . 2 1 1 A 106 106 ILE CA C 106 60.631 59.927 0.704 1
1 1135 . 2 1 1 A 106 106 ILE CB C 106 41.927 39.995 1.932 1
1 1139 . 2 1 1 A 106 106 ILE N N 106 124.499 125.482 -0.983 1
1 1140 . 2 1 1 A 107 107 LYS H H 107 8.650 9.069 -0.419 1
1 1141 . 2 1 1 A 107 107 LYS HA H 107 5.608 4.986 0.622 1
1 1147 . 2 1 1 A 107 107 LYS C C 107 175.681 175.225 0.456 1
1 1148 . 2 1 1 A 107 107 LYS CA C 107 55.248 54.967 0.281 1
1 1149 . 2 1 1 A 107 107 LYS CB C 107 33.618 33.885 -0.267 1
1 1153 . 2 1 1 A 107 107 LYS N N 107 130.844 127.924 2.920 1
1 1154 . 2 1 1 A 108 108 ILE H H 108 9.448 8.434 1.014 1
1 1155 . 2 1 1 A 108 108 ILE HA H 108 4.741 4.855 -0.114 1
1 1164 . 2 1 1 A 108 108 ILE C C 108 172.670 174.240 -1.570 1
1 1165 . 2 1 1 A 108 108 ILE CA C 108 59.157 59.455 -0.298 1
1 1166 . 2 1 1 A 108 108 ILE CB C 108 42.241 42.112 0.129 1
1 1170 . 2 1 1 A 108 108 ILE N N 108 125.160 127.699 -2.539 1
1 1171 . 2 1 1 A 109 109 SER H H 109 8.490 9.015 -0.525 1
1 1172 . 2 1 1 A 109 109 SER HA H 109 4.437 4.661 -0.224 1
1 1175 . 2 1 1 A 109 109 SER C C 109 176.536 176.067 0.469 1
1 1176 . 2 1 1 A 109 109 SER CA C 109 58.850 59.185 -0.335 1
1 1177 . 2 1 1 A 109 109 SER CB C 109 63.010 63.729 -0.719 1
1 1178 . 2 1 1 A 109 109 SER N N 109 122.750 124.028 -1.278 1
1 1179 . 2 1 1 A 110 110 GLY H H 110 9.292 8.611 0.681 1
1 1180 . 2 1 1 A 110 110 GLY HA2 H 110 5.193 4.039 1.154 1
1 1181 . 2 1 1 A 110 110 GLY HA3 H 110 3.755 4.178 -0.423 1
1 1182 . 2 1 1 A 110 110 GLY C C 110 176.964 175.057 1.907 1
1 1183 . 2 1 1 A 110 110 GLY CA C 110 48.168 46.610 1.558 1
1 1184 . 2 1 1 A 110 110 GLY N N 110 116.628 113.431 3.197 1
1 1185 . 2 1 1 A 111 111 GLU H H 111 8.576 8.688 -0.112 1
1 1186 . 2 1 1 A 111 111 GLU HA H 111 4.080 4.180 -0.100 1
1 1191 . 2 1 1 A 111 111 GLU C C 111 178.867 178.541 0.326 1
1 1192 . 2 1 1 A 111 111 GLU CA C 111 59.150 58.500 0.650 1
1 1193 . 2 1 1 A 111 111 GLU CB C 111 28.831 29.196 -0.365 1
1 1195 . 2 1 1 A 111 111 GLU N N 111 120.564 118.288 2.276 1
1 1196 . 2 1 1 A 112 112 LYS H H 112 7.605 7.622 -0.017 1
1 1197 . 2 1 1 A 112 112 LYS HA H 112 4.229 4.057 0.172 1
1 1202 . 2 1 1 A 112 112 LYS C C 112 176.710 178.083 -1.373 1
1 1203 . 2 1 1 A 112 112 LYS CA C 112 57.083 59.385 -2.302 1
1 1204 . 2 1 1 A 112 112 LYS CB C 112 32.183 32.160 0.023 1
1 1208 . 2 1 1 A 112 112 LYS N N 112 116.628 118.896 -2.268 1
1 1209 . 2 1 1 A 113 113 LEU H H 113 7.784 7.796 -0.012 1
1 1210 . 2 1 1 A 113 113 LEU HA H 113 4.387 4.309 0.078 1
1 1220 . 2 1 1 A 113 113 LEU C C 113 176.195 176.517 -0.322 1
1 1221 . 2 1 1 A 113 113 LEU CA C 113 52.617 54.087 -1.470 1
1 1222 . 2 1 1 A 113 113 LEU CB C 113 42.820 41.035 1.785 1
1 1226 . 2 1 1 A 113 113 LEU N N 113 114.219 114.511 -0.292 1
1 1227 . 2 1 1 A 114 114 VAL H H 114 7.032 7.287 -0.255 1
1 1228 . 2 1 1 A 114 114 VAL HA H 114 3.723 3.797 -0.074 1
1 1236 . 2 1 1 A 114 114 VAL C C 114 175.430 177.237 -1.807 1
1 1237 . 2 1 1 A 114 114 VAL CA C 114 65.537 63.997 1.540 1
1 1238 . 2 1 1 A 114 114 VAL CB C 114 32.115 31.285 0.830 1
1 1241 . 2 1 1 A 114 114 VAL N N 114 121.773 120.987 0.786 1
1 1242 . 2 1 1 A 115 115 GLY H H 115 8.678 8.842 -0.164 1
1 1243 . 2 1 1 A 115 115 GLY HA2 H 115 4.313 3.930 0.383 1
1 1244 . 2 1 1 A 115 115 GLY HA3 H 115 3.846 3.931 -0.085 1
1 1245 . 2 1 1 A 115 115 GLY C C 115 172.462 173.876 -1.414 1
1 1246 . 2 1 1 A 115 115 GLY CA C 115 43.743 45.542 -1.799 1
1 1247 . 2 1 1 A 115 115 GLY N N 115 117.503 116.840 0.663 1
1 1248 . 2 1 1 A 116 116 ARG H H 116 8.701 8.392 0.309 1
1 1249 . 2 1 1 A 116 116 ARG HA H 116 3.926 4.617 -0.691 1
1 1254 . 2 1 1 A 116 116 ARG CA C 116 56.470 53.783 2.687 1
1 1255 . 2 1 1 A 116 116 ARG CB C 116 29.585 29.504 0.081 1
1 1257 . 2 1 1 A 116 116 ARG N N 116 123.504 120.609 2.895 1
1 1258 . 2 1 1 A 117 117 PRO HA H 117 4.242 4.221 0.021 1
1 1264 . 2 1 1 A 117 117 PRO C C 117 178.947 178.090 0.857 1
1 1265 . 2 1 1 A 117 117 PRO CA C 117 65.684 64.578 1.106 1
1 1266 . 2 1 1 A 117 117 PRO CB C 117 30.949 32.018 -1.069 1
1 1269 . 2 1 1 A 118 118 GLU H H 118 10.821 8.824 1.997 1
1 1270 . 2 1 1 A 118 118 GLU HA H 118 4.197 4.069 0.128 1
1 1271 . 2 1 1 A 118 118 GLU C C 118 176.627 178.885 -2.258 1
1 1272 . 2 1 1 A 118 118 GLU CA C 118 58.045 59.184 -1.139 1
1 1273 . 2 1 1 A 118 118 GLU CB C 118 27.101 29.242 -2.141 1
1 1274 . 2 1 1 A 118 118 GLU N N 118 119.242 116.438 2.804 1
1 1275 . 2 1 1 A 119 119 MET H H 119 7.226 8.097 -0.871 1
1 1276 . 2 1 1 A 119 119 MET HA H 119 4.591 3.984 0.607 1
1 1279 . 2 1 1 A 119 119 MET C C 119 180.024 178.631 1.393 1
1 1280 . 2 1 1 A 119 119 MET CA C 119 54.695 58.761 -4.066 1
1 1281 . 2 1 1 A 119 119 MET CB C 119 31.012 32.182 -1.170 1
1 1283 . 2 1 1 A 119 119 MET N N 119 119.475 119.524 -0.049 1
1 1284 . 2 1 1 A 120 120 ARG H H 120 7.877 7.864 0.013 1
1 1285 . 2 1 1 A 120 120 ARG HA H 120 3.988 4.053 -0.065 1
1 1292 . 2 1 1 A 120 120 ARG C C 120 177.705 178.565 -0.860 1
1 1293 . 2 1 1 A 120 120 ARG CA C 120 60.773 58.325 2.448 1
1 1294 . 2 1 1 A 120 120 ARG CB C 120 31.159 29.710 1.449 1
1 1295 . 2 1 1 A 120 120 ARG N N 120 122.099 119.631 2.468 1
1 1296 . 2 1 1 A 121 121 LEU H H 121 6.732 7.954 -1.222 1
1 1297 . 2 1 1 A 121 121 LEU HA H 121 4.170 4.012 0.158 1
1 1307 . 2 1 1 A 121 121 LEU C C 121 176.220 178.491 -2.271 1
1 1308 . 2 1 1 A 121 121 LEU CA C 121 57.370 58.006 -0.636 1
1 1309 . 2 1 1 A 121 121 LEU CB C 121 42.945 41.456 1.489 1
1 1312 . 2 1 1 A 121 121 LEU N N 121 114.436 119.593 -5.157 1
1 1313 . 2 1 1 A 122 122 LYS H H 122 7.555 8.711 -1.156 1
1 1314 . 2 1 1 A 122 122 LYS HA H 122 4.338 4.268 0.070 1
1 1321 . 2 1 1 A 122 122 LYS C C 122 176.969 176.590 0.379 1
1 1322 . 2 1 1 A 122 122 LYS CA C 122 55.621 55.602 0.019 1
1 1323 . 2 1 1 A 122 122 LYS CB C 122 32.414 31.665 0.749 1
1 1327 . 2 1 1 A 122 122 LYS N N 122 115.754 114.692 1.062 1
1 1328 . 2 1 1 A 123 123 LYS H H 123 7.688 7.798 -0.110 1
1 1329 . 2 1 1 A 123 123 LYS HA H 123 4.535 4.450 0.085 1
1 1330 . 2 1 1 A 123 123 LYS CA C 123 58.461 56.642 1.819 1
1 1331 . 2 1 1 A 123 123 LYS CB C 123 33.138 31.899 1.239 1
1 1332 . 2 1 1 A 123 123 LYS N N 123 120.843 120.085 0.758 1
1 1333 . 2 1 1 A 126 126 ARG HA H 126 4.347 4.749 -0.402 1
1 1338 . 2 1 1 A 126 126 ARG C C 126 174.573 175.925 -1.352 1
1 1339 . 2 1 1 A 126 126 ARG CA C 126 55.998 54.901 1.097 1
1 1340 . 2 1 1 A 126 126 ARG CB C 126 31.569 31.969 -0.400 1
1 128 . 3 1 1 A 18 18 GLY H H 18 8.343 8.030 0.313 1
1 129 . 3 1 1 A 18 18 GLY HA2 H 18 3.894 4.152 -0.258 1
1 130 . 3 1 1 A 18 18 GLY C C 18 177.743 174.968 2.775 1
1 131 . 3 1 1 A 18 18 GLY CA C 18 45.497 44.301 1.196 1
1 132 . 3 1 1 A 18 18 GLY N N 18 109.925 108.910 1.015 1
1 133 . 3 1 1 A 19 19 SER H H 19 8.005 8.874 -0.869 1
1 134 . 3 1 1 A 19 19 SER HA H 19 4.329 4.277 0.052 1
1 136 . 3 1 1 A 19 19 SER C C 19 175.168 176.381 -1.213 1
1 137 . 3 1 1 A 19 19 SER CA C 19 58.852 61.215 -2.363 1
1 138 . 3 1 1 A 19 19 SER CB C 19 63.604 63.198 0.406 1
1 139 . 3 1 1 A 19 19 SER N N 19 115.090 115.182 -0.092 1
1 140 . 3 1 1 A 20 20 TYR H H 20 8.040 7.530 0.510 1
1 141 . 3 1 1 A 20 20 TYR HA H 20 4.439 4.319 0.120 1
1 146 . 3 1 1 A 20 20 TYR C C 20 176.111 178.477 -2.366 1
1 147 . 3 1 1 A 20 20 TYR CA C 20 57.966 61.724 -3.758 1
1 148 . 3 1 1 A 20 20 TYR CB C 20 37.472 38.496 -1.024 1
1 149 . 3 1 1 A 20 20 TYR N N 20 118.675 120.436 -1.761 1
1 150 . 3 1 1 A 21 21 GLN H H 21 7.909 8.405 -0.496 1
1 151 . 3 1 1 A 21 21 GLN HA H 21 3.903 4.094 -0.191 1
1 155 . 3 1 1 A 21 21 GLN C C 21 178.003 177.463 0.540 1
1 156 . 3 1 1 A 21 21 GLN CA C 21 58.523 58.926 -0.403 1
1 157 . 3 1 1 A 21 21 GLN CB C 21 28.438 28.262 0.176 1
1 159 . 3 1 1 A 21 21 GLN N N 21 117.056 118.310 -1.254 1
1 160 . 3 1 1 A 22 22 GLU H H 22 8.965 8.808 0.157 1
1 161 . 3 1 1 A 22 22 GLU HA H 22 4.267 4.309 -0.042 1
1 165 . 3 1 1 A 22 22 GLU C C 22 176.451 177.887 -1.436 1
1 166 . 3 1 1 A 22 22 GLU CA C 22 58.273 58.426 -0.153 1
1 167 . 3 1 1 A 22 22 GLU CB C 22 29.412 30.163 -0.751 1
1 169 . 3 1 1 A 22 22 GLU N N 22 117.289 118.735 -1.446 1
1 170 . 3 1 1 A 23 23 ILE H H 23 7.596 8.017 -0.421 1
1 171 . 3 1 1 A 23 23 ILE HA H 23 4.161 4.492 -0.331 1
1 180 . 3 1 1 A 23 23 ILE C C 23 176.195 175.691 0.504 1
1 181 . 3 1 1 A 23 23 ILE CA C 23 58.120 60.902 -2.782 1
1 182 . 3 1 1 A 23 23 ILE CB C 23 38.461 37.919 0.542 1
1 186 . 3 1 1 A 23 23 ILE N N 23 114.005 117.165 -3.160 1
1 187 . 3 1 1 A 24 24 ILE H H 24 7.178 7.391 -0.213 1
1 188 . 3 1 1 A 24 24 ILE HA H 24 3.740 4.043 -0.303 1
1 197 . 3 1 1 A 24 24 ILE C C 24 177.831 176.774 1.057 1
1 198 . 3 1 1 A 24 24 ILE CA C 24 63.318 62.142 1.176 1
1 199 . 3 1 1 A 24 24 ILE CB C 24 36.590 38.400 -1.810 1
1 203 . 3 1 1 A 24 24 ILE N N 24 122.099 125.605 -3.506 1
1 204 . 3 1 1 A 25 25 GLY H H 25 8.618 8.923 -0.305 1
1 205 . 3 1 1 A 25 25 GLY HA2 H 25 4.390 3.974 0.416 1
1 206 . 3 1 1 A 25 25 GLY HA3 H 25 4.168 4.006 0.162 1
1 207 . 3 1 1 A 25 25 GLY C C 25 175.210 176.133 -0.923 1
1 208 . 3 1 1 A 25 25 GLY CA C 25 45.798 45.177 0.621 1
1 209 . 3 1 1 A 25 25 GLY N N 25 115.531 117.854 -2.323 1
1 210 . 3 1 1 A 26 26 ARG H H 26 8.277 8.156 0.121 1
1 211 . 3 1 1 A 26 26 ARG HA H 26 4.477 4.528 -0.051 1
1 218 . 3 1 1 A 26 26 ARG C C 26 175.944 177.806 -1.862 1
1 219 . 3 1 1 A 26 26 ARG CA C 26 54.408 56.931 -2.523 1
1 220 . 3 1 1 A 26 26 ARG CB C 26 29.501 30.268 -0.767 1
1 223 . 3 1 1 A 26 26 ARG N N 26 119.689 121.123 -1.434 1
1 224 . 3 1 1 A 27 27 THR H H 27 7.923 9.150 -1.227 1
1 225 . 3 1 1 A 27 27 THR HA H 27 3.792 4.101 -0.309 1
1 230 . 3 1 1 A 27 27 THR C C 27 175.251 176.566 -1.315 1
1 231 . 3 1 1 A 27 27 THR CA C 27 64.791 65.234 -0.443 1
1 232 . 3 1 1 A 27 27 THR CB C 27 68.354 68.077 0.277 1
1 234 . 3 1 1 A 27 27 THR N N 27 109.195 113.199 -4.004 1
1 235 . 3 1 1 A 28 28 TRP H H 28 7.389 8.087 -0.698 1
1 236 . 3 1 1 A 28 28 TRP HA H 28 4.441 4.361 0.080 1
1 240 . 3 1 1 A 28 28 TRP C C 28 178.519 178.450 0.069 1
1 241 . 3 1 1 A 28 28 TRP CA C 28 57.789 61.313 -3.524 1
1 242 . 3 1 1 A 28 28 TRP CB C 28 27.387 29.860 -2.473 1
1 243 . 3 1 1 A 28 28 TRP N N 28 120.127 124.953 -4.826 1
1 244 . 3 1 1 A 29 29 ILE H H 29 6.832 8.190 -1.358 1
1 245 . 3 1 1 A 29 29 ILE HA H 29 3.612 3.422 0.190 1
1 254 . 3 1 1 A 29 29 ILE C C 29 176.023 176.768 -0.745 1
1 255 . 3 1 1 A 29 29 ILE CA C 29 63.773 63.428 0.345 1
1 256 . 3 1 1 A 29 29 ILE CB C 29 37.567 37.431 0.136 1
1 260 . 3 1 1 A 29 29 ILE N N 29 119.913 117.875 2.038 1
1 261 . 3 1 1 A 30 30 PHE H H 30 7.329 7.842 -0.513 1
1 262 . 3 1 1 A 30 30 PHE HA H 30 3.912 4.430 -0.518 1
1 268 . 3 1 1 A 30 30 PHE C C 30 177.101 177.622 -0.521 1
1 269 . 3 1 1 A 30 30 PHE CA C 30 59.436 61.169 -1.733 1
1 270 . 3 1 1 A 30 30 PHE CB C 30 38.734 39.989 -1.255 1
1 271 . 3 1 1 A 30 30 PHE N N 30 116.638 120.386 -3.748 1
1 272 . 3 1 1 A 31 31 ARG H H 31 7.399 8.284 -0.885 1
1 273 . 3 1 1 A 31 31 ARG HA H 31 4.287 4.408 -0.121 1
1 278 . 3 1 1 A 31 31 ARG C C 31 176.539 177.888 -1.349 1
1 279 . 3 1 1 A 31 31 ARG CA C 31 58.852 58.972 -0.120 1
1 280 . 3 1 1 A 31 31 ARG CB C 31 29.461 30.913 -1.452 1
1 281 . 3 1 1 A 31 31 ARG N N 31 122.099 120.625 1.474 1
1 282 . 3 1 1 A 32 32 GLY H H 32 8.346 8.357 -0.011 1
1 283 . 3 1 1 A 32 32 GLY HA2 H 32 4.284 3.297 0.987 1
1 284 . 3 1 1 A 32 32 GLY HA3 H 32 3.629 3.708 -0.079 1
1 285 . 3 1 1 A 32 32 GLY C C 32 173.791 173.795 -0.004 1
1 286 . 3 1 1 A 32 32 GLY CA C 32 45.793 46.308 -0.515 1
1 287 . 3 1 1 A 32 32 GLY N N 32 109.964 106.597 3.367 1
1 288 . 3 1 1 A 33 33 ALA H H 33 7.510 8.187 -0.677 1
1 289 . 3 1 1 A 33 33 ALA HA H 33 4.193 4.423 -0.230 1
1 293 . 3 1 1 A 33 33 ALA C C 33 176.672 177.058 -0.386 1
1 294 . 3 1 1 A 33 33 ALA CA C 33 54.401 52.593 1.808 1
1 295 . 3 1 1 A 33 33 ALA CB C 33 19.368 21.575 -2.207 1
1 296 . 3 1 1 A 33 33 ALA N N 33 122.266 120.326 1.940 1
1 297 . 3 1 1 A 34 34 HIS H H 34 8.759 7.409 1.350 1
1 298 . 3 1 1 A 34 34 HIS HA H 34 4.529 4.622 -0.093 1
1 302 . 3 1 1 A 34 34 HIS C C 34 175.767 174.629 1.138 1
1 303 . 3 1 1 A 34 34 HIS CA C 34 54.997 57.383 -2.386 1
1 304 . 3 1 1 A 34 34 HIS CB C 34 31.089 29.968 1.121 1
1 305 . 3 1 1 A 34 34 HIS N N 34 119.038 117.636 1.402 1
1 306 . 3 1 1 A 35 35 ARG H H 35 8.142 8.800 -0.658 1
1 307 . 3 1 1 A 35 35 ARG HA H 35 4.700 4.653 0.047 1
1 314 . 3 1 1 A 35 35 ARG C C 35 177.572 176.469 1.103 1
1 315 . 3 1 1 A 35 35 ARG CA C 35 54.103 56.868 -2.765 1
1 316 . 3 1 1 A 35 35 ARG CB C 35 29.112 33.236 -4.124 1
1 319 . 3 1 1 A 35 35 ARG N N 35 127.785 126.278 1.507 1
1 320 . 3 1 1 A 36 36 GLY H H 36 9.352 7.880 1.472 1
1 321 . 3 1 1 A 36 36 GLY HA2 H 36 4.291 3.899 0.392 1
1 322 . 3 1 1 A 36 36 GLY HA3 H 36 3.247 3.974 -0.727 1
1 323 . 3 1 1 A 36 36 GLY C C 36 173.876 173.973 -0.097 1
1 324 . 3 1 1 A 36 36 GLY CA C 36 45.644 45.666 -0.022 1
1 325 . 3 1 1 A 36 36 GLY N N 36 109.626 106.991 2.635 1
1 326 . 3 1 1 A 37 37 ARG H H 37 9.384 8.473 0.911 1
1 327 . 3 1 1 A 37 37 ARG HA H 37 4.688 4.308 0.380 1
1 333 . 3 1 1 A 37 37 ARG C C 37 175.081 175.335 -0.254 1
1 334 . 3 1 1 A 37 37 ARG CA C 37 55.742 56.502 -0.760 1
1 335 . 3 1 1 A 37 37 ARG CB C 37 28.138 30.582 -2.444 1
1 338 . 3 1 1 A 37 37 ARG N N 37 127.132 123.107 4.025 1
1 339 . 3 1 1 A 38 38 VAL H H 38 7.605 6.560 1.045 1
1 340 . 3 1 1 A 38 38 VAL HA H 38 4.591 3.874 0.717 1
1 348 . 3 1 1 A 38 38 VAL C C 38 174.391 174.509 -0.118 1
1 349 . 3 1 1 A 38 38 VAL CA C 38 60.092 60.286 -0.194 1
1 350 . 3 1 1 A 38 38 VAL CB C 38 33.328 32.600 0.728 1
1 353 . 3 1 1 A 38 38 VAL N N 38 126.253 125.722 0.531 1
1 354 . 3 1 1 A 39 39 ASN H H 39 9.007 7.896 1.111 1
1 355 . 3 1 1 A 39 39 ASN HA H 39 4.736 4.835 -0.099 1
1 358 . 3 1 1 A 39 39 ASN C C 39 174.562 174.989 -0.427 1
1 359 . 3 1 1 A 39 39 ASN CA C 39 51.577 52.202 -0.625 1
1 360 . 3 1 1 A 39 39 ASN CB C 39 40.749 41.457 -0.708 1
1 361 . 3 1 1 A 39 39 ASN N N 39 123.411 122.152 1.259 1
1 362 . 3 1 1 A 40 40 LYS H H 40 8.510 8.686 -0.176 1
1 363 . 3 1 1 A 40 40 LYS HA H 40 3.909 3.923 -0.014 1
1 370 . 3 1 1 A 40 40 LYS C C 40 176.629 178.252 -1.623 1
1 371 . 3 1 1 A 40 40 LYS CA C 40 59.141 60.273 -1.132 1
1 372 . 3 1 1 A 40 40 LYS CB C 40 32.301 32.240 0.061 1
1 376 . 3 1 1 A 40 40 LYS N N 40 116.303 125.630 -9.327 1
1 377 . 3 1 1 A 41 41 LYS H H 41 7.907 8.473 -0.566 1
1 378 . 3 1 1 A 41 41 LYS HA H 41 4.172 3.901 0.271 1
1 384 . 3 1 1 A 41 41 LYS C C 41 177.229 175.757 1.472 1
1 385 . 3 1 1 A 41 41 LYS CA C 41 57.392 57.818 -0.426 1
1 386 . 3 1 1 A 41 41 LYS CB C 41 32.667 30.837 1.830 1
1 390 . 3 1 1 A 41 41 LYS N N 41 117.066 117.687 -0.621 1
1 391 . 3 1 1 A 42 42 ASN H H 42 7.962 8.414 -0.452 1
1 392 . 3 1 1 A 42 42 ASN HA H 42 4.392 4.606 -0.214 1
1 395 . 3 1 1 A 42 42 ASN C C 42 179.805 176.043 3.762 1
1 396 . 3 1 1 A 42 42 ASN CA C 42 52.335 52.729 -0.394 1
1 397 . 3 1 1 A 42 42 ASN CB C 42 39.348 39.132 0.216 1
1 398 . 3 1 1 A 42 42 ASN N N 42 114.442 116.667 -2.225 1
1 399 . 3 1 1 A 43 43 ILE H H 43 7.806 8.450 -0.644 1
1 400 . 3 1 1 A 43 43 ILE HA H 43 3.747 3.908 -0.161 1
1 409 . 3 1 1 A 43 43 ILE C C 43 174.219 177.356 -3.137 1
1 410 . 3 1 1 A 43 43 ILE CA C 43 64.505 63.463 1.042 1
1 411 . 3 1 1 A 43 43 ILE CB C 43 36.595 38.269 -1.674 1
1 415 . 3 1 1 A 43 43 ILE N N 43 121.001 120.577 0.424 1
1 416 . 3 1 1 A 44 44 VAL H H 44 6.154 7.685 -1.531 1
1 417 . 3 1 1 A 44 44 VAL HA H 44 3.497 3.873 -0.376 1
1 425 . 3 1 1 A 44 44 VAL C C 44 176.282 176.406 -0.124 1
1 426 . 3 1 1 A 44 44 VAL CA C 44 63.606 63.418 0.188 1
1 427 . 3 1 1 A 44 44 VAL CB C 44 30.614 31.762 -1.148 1
1 430 . 3 1 1 A 44 44 VAL N N 44 110.500 119.998 -9.498 1
1 431 . 3 1 1 A 45 45 TRP H H 45 7.419 8.222 -0.803 1
1 432 . 3 1 1 A 45 45 TRP HA H 45 4.716 4.739 -0.023 1
1 438 . 3 1 1 A 45 45 TRP C C 45 175.422 176.680 -1.258 1
1 439 . 3 1 1 A 45 45 TRP CA C 45 56.188 58.317 -2.129 1
1 440 . 3 1 1 A 45 45 TRP CB C 45 31.245 31.245 0.000 1
1 441 . 3 1 1 A 45 45 TRP N N 45 118.601 121.158 -2.557 1
1 442 . 3 1 1 A 46 46 HIS H H 46 7.582 8.247 -0.665 1
1 443 . 3 1 1 A 46 46 HIS HA H 46 4.227 4.501 -0.274 1
1 448 . 3 1 1 A 46 46 HIS C C 46 177.485 174.910 2.575 1
1 449 . 3 1 1 A 46 46 HIS CA C 46 56.799 56.845 -0.046 1
1 450 . 3 1 1 A 46 46 HIS CB C 46 32.017 30.480 1.537 1
1 451 . 3 1 1 A 46 46 HIS N N 46 122.648 117.248 5.400 1
1 452 . 3 1 1 A 47 47 GLU H H 47 7.948 8.325 -0.377 1
1 453 . 3 1 1 A 47 47 GLU HA H 47 4.098 4.156 -0.058 1
1 457 . 3 1 1 A 47 47 GLU C C 47 175.596 176.375 -0.779 1
1 458 . 3 1 1 A 47 47 GLU CA C 47 56.482 56.478 0.004 1
1 459 . 3 1 1 A 47 47 GLU CB C 47 31.839 29.297 2.542 1
1 461 . 3 1 1 A 47 47 GLU N N 47 120.485 122.045 -1.560 1
1 462 . 3 1 1 A 48 48 LEU H H 48 9.304 8.468 0.836 1
1 463 . 3 1 1 A 48 48 LEU HA H 48 4.218 4.386 -0.168 1
1 472 . 3 1 1 A 48 48 LEU C C 48 177.743 175.984 1.759 1
1 473 . 3 1 1 A 48 48 LEU CA C 48 55.043 54.638 0.405 1
1 474 . 3 1 1 A 48 48 LEU CB C 48 41.948 41.037 0.911 1
1 477 . 3 1 1 A 48 48 LEU N N 48 128.658 125.823 2.835 1
1 478 . 3 1 1 A 49 49 ILE H H 49 8.028 8.634 -0.606 1
1 479 . 3 1 1 A 49 49 ILE HA H 49 3.279 4.544 -1.265 1
1 488 . 3 1 1 A 49 49 ILE C C 49 174.821 176.178 -1.357 1
1 489 . 3 1 1 A 49 49 ILE CA C 49 63.901 59.940 3.961 1
1 490 . 3 1 1 A 49 49 ILE CB C 49 37.775 38.703 -0.928 1
1 494 . 3 1 1 A 49 49 ILE N N 49 120.341 125.739 -5.398 1
1 495 . 3 1 1 A 50 50 GLY H H 50 9.038 7.846 1.192 1
1 496 . 3 1 1 A 50 50 GLY HA2 H 50 4.717 4.385 0.332 1
1 497 . 3 1 1 A 50 50 GLY HA3 H 50 3.491 4.393 -0.902 1
1 498 . 3 1 1 A 50 50 GLY C C 50 175.084 174.686 0.398 1
1 499 . 3 1 1 A 50 50 GLY CA C 50 44.599 45.714 -1.115 1
1 500 . 3 1 1 A 50 50 GLY N N 50 110.284 109.985 0.299 1
1 501 . 3 1 1 A 51 51 LEU H H 51 8.400 7.959 0.441 1
1 502 . 3 1 1 A 51 51 LEU HA H 51 4.723 4.197 0.526 1
1 512 . 3 1 1 A 51 51 LEU C C 51 177.147 175.575 1.572 1
1 513 . 3 1 1 A 51 51 LEU CA C 51 54.350 55.871 -1.521 1
1 514 . 3 1 1 A 51 51 LEU CB C 51 42.985 43.235 -0.250 1
1 518 . 3 1 1 A 51 51 LEU N N 51 120.471 123.132 -2.661 1
1 519 . 3 1 1 A 52 52 LYS H H 52 7.505 8.386 -0.881 1
1 520 . 3 1 1 A 52 52 LYS HA H 52 4.250 4.119 0.131 1
1 527 . 3 1 1 A 52 52 LYS C C 52 174.995 175.252 -0.257 1
1 528 . 3 1 1 A 52 52 LYS CA C 52 55.589 55.668 -0.079 1
1 529 . 3 1 1 A 52 52 LYS CB C 52 33.025 32.876 0.149 1
1 533 . 3 1 1 A 52 52 LYS N N 52 122.406 125.974 -3.568 1
1 534 . 3 1 1 A 53 53 VAL H H 53 9.075 8.215 0.860 1
1 535 . 3 1 1 A 53 53 VAL HA H 53 5.071 5.041 0.030 1
1 543 . 3 1 1 A 53 53 VAL C C 53 171.170 173.710 -2.540 1
1 544 . 3 1 1 A 53 53 VAL CA C 53 58.523 59.203 -0.680 1
1 545 . 3 1 1 A 53 53 VAL CB C 53 35.698 35.455 0.243 1
1 548 . 3 1 1 A 53 53 VAL N N 53 124.509 124.688 -0.179 1
1 549 . 3 1 1 A 54 54 ARG H H 54 8.148 8.578 -0.430 1
1 550 . 3 1 1 A 54 54 ARG HA H 54 5.329 4.878 0.451 1
1 557 . 3 1 1 A 54 54 ARG C C 54 176.113 174.387 1.726 1
1 558 . 3 1 1 A 54 54 ARG CA C 54 53.817 53.955 -0.138 1
1 559 . 3 1 1 A 54 54 ARG CB C 54 34.511 33.835 0.676 1
1 562 . 3 1 1 A 54 54 ARG N N 54 123.625 121.738 1.887 1
1 563 . 3 1 1 A 55 55 VAL H H 55 8.659 9.769 -1.110 1
1 564 . 3 1 1 A 55 55 VAL HA H 55 4.085 4.133 -0.048 1
1 572 . 3 1 1 A 55 55 VAL C C 55 176.282 175.394 0.888 1
1 573 . 3 1 1 A 55 55 VAL CA C 55 62.814 62.158 0.656 1
1 574 . 3 1 1 A 55 55 VAL CB C 55 30.628 31.271 -0.643 1
1 577 . 3 1 1 A 55 55 VAL N N 55 125.383 122.658 2.725 1
1 578 . 3 1 1 A 56 56 VAL H H 56 8.057 8.522 -0.465 1
1 579 . 3 1 1 A 56 56 VAL HA H 56 4.123 3.967 0.156 1
1 587 . 3 1 1 A 56 56 VAL C C 56 175.426 176.234 -0.808 1
1 588 . 3 1 1 A 56 56 VAL CA C 56 62.786 64.222 -1.436 1
1 589 . 3 1 1 A 56 56 VAL CB C 56 32.267 32.561 -0.294 1
1 592 . 3 1 1 A 56 56 VAL N N 56 124.936 129.102 -4.166 1
1 593 . 3 1 1 A 57 57 ASN H H 57 7.527 8.217 -0.690 1
1 594 . 3 1 1 A 57 57 ASN HA H 57 4.817 5.243 -0.426 1
1 597 . 3 1 1 A 57 57 ASN C C 57 172.973 173.614 -0.641 1
1 598 . 3 1 1 A 57 57 ASN CA C 57 52.460 51.697 0.763 1
1 599 . 3 1 1 A 57 57 ASN CB C 57 42.070 41.231 0.839 1
1 600 . 3 1 1 A 57 57 ASN N N 57 114.777 117.162 -2.385 1
1 601 . 3 1 1 A 58 58 SER H H 58 8.193 8.938 -0.745 1
1 602 . 3 1 1 A 58 58 SER HA H 58 5.214 4.911 0.303 1
1 605 . 3 1 1 A 58 58 SER C C 58 174.221 172.349 1.872 1
1 606 . 3 1 1 A 58 58 SER CA C 58 56.778 56.413 0.365 1
1 607 . 3 1 1 A 58 58 SER CB C 58 63.906 65.197 -1.291 1
1 608 . 3 1 1 A 58 58 SER N N 58 115.531 119.779 -4.248 1
1 609 . 3 1 1 A 59 59 THR H H 59 8.053 8.426 -0.373 1
1 610 . 3 1 1 A 59 59 THR HA H 59 4.305 4.876 -0.571 1
1 615 . 3 1 1 A 59 59 THR C C 59 174.478 173.687 0.791 1
1 616 . 3 1 1 A 59 59 THR CA C 59 63.305 60.769 2.536 1
1 617 . 3 1 1 A 59 59 THR CB C 59 68.354 68.939 -0.585 1
1 619 . 3 1 1 A 59 59 THR N N 59 116.405 116.439 -0.034 1
1 620 . 3 1 1 A 60 60 HIS H H 60 8.359 8.245 0.114 1
1 621 . 3 1 1 A 60 60 HIS HA H 60 5.167 5.135 0.032 1
1 626 . 3 1 1 A 60 60 HIS CA C 60 52.792 53.083 -0.291 1
1 627 . 3 1 1 A 60 60 HIS CB C 60 32.142 30.592 1.550 1
1 628 . 3 1 1 A 60 60 HIS N N 60 123.625 124.568 -0.943 1
1 629 . 3 1 1 A 61 61 PRO HA H 61 4.277 4.350 -0.073 1
1 636 . 3 1 1 A 61 61 PRO C C 61 178.217 177.400 0.817 1
1 637 . 3 1 1 A 61 61 PRO CA C 61 64.375 64.404 -0.029 1
1 638 . 3 1 1 A 61 61 PRO CB C 61 32.007 32.118 -0.111 1
1 641 . 3 1 1 A 62 62 GLY H H 62 8.421 8.071 0.350 1
1 642 . 3 1 1 A 62 62 GLY HA2 H 62 3.889 3.788 0.101 1
1 643 . 3 1 1 A 62 62 GLY HA3 H 62 3.653 3.917 -0.264 1
1 644 . 3 1 1 A 62 62 GLY C C 62 174.994 173.974 1.020 1
1 645 . 3 1 1 A 62 62 GLY CA C 62 45.831 45.319 0.512 1
1 646 . 3 1 1 A 62 62 GLY N N 62 106.132 105.816 0.316 1
1 647 . 3 1 1 A 63 63 TYR H H 63 7.327 7.925 -0.598 1
1 648 . 3 1 1 A 63 63 TYR HA H 63 4.846 4.545 0.301 1
1 652 . 3 1 1 A 63 63 TYR C C 63 175.593 175.384 0.209 1
1 653 . 3 1 1 A 63 63 TYR CA C 63 56.071 58.249 -2.178 1
1 654 . 3 1 1 A 63 63 TYR CB C 63 38.962 40.162 -1.200 1
1 655 . 3 1 1 A 63 63 TYR N N 63 116.628 117.096 -0.468 1
1 656 . 3 1 1 A 64 64 VAL H H 64 7.296 7.063 0.233 1
1 657 . 3 1 1 A 64 64 VAL HA H 64 3.180 4.073 -0.893 1
1 665 . 3 1 1 A 64 64 VAL C C 64 177.312 176.549 0.763 1
1 666 . 3 1 1 A 64 64 VAL CA C 64 65.688 63.131 2.557 1
1 667 . 3 1 1 A 64 64 VAL CB C 64 30.957 31.655 -0.698 1
1 670 . 3 1 1 A 64 64 VAL N N 64 117.940 118.414 -0.474 1
1 671 . 3 1 1 A 65 65 GLY H H 65 8.449 9.905 -1.456 1
1 672 . 3 1 1 A 65 65 GLY HA2 H 65 4.320 3.952 0.368 1
1 673 . 3 1 1 A 65 65 GLY HA3 H 65 3.515 3.955 -0.440 1
1 674 . 3 1 1 A 65 65 GLY C C 65 174.821 173.322 1.499 1
1 675 . 3 1 1 A 65 65 GLY CA C 65 44.599 45.257 -0.658 1
1 676 . 3 1 1 A 65 65 GLY N N 65 115.317 114.226 1.091 1
1 677 . 3 1 1 A 66 66 ILE H H 66 7.095 7.491 -0.396 1
1 678 . 3 1 1 A 66 66 ILE HA H 66 3.193 4.709 -1.516 1
1 687 . 3 1 1 A 66 66 ILE C C 66 174.308 174.595 -0.287 1
1 688 . 3 1 1 A 66 66 ILE CA C 66 63.470 59.959 3.511 1
1 689 . 3 1 1 A 66 66 ILE CB C 66 37.775 40.952 -3.177 1
1 693 . 3 1 1 A 66 66 ILE N N 66 122.099 122.544 -0.445 1
1 694 . 3 1 1 A 67 67 GLU H H 67 7.126 9.168 -2.042 1
1 695 . 3 1 1 A 67 67 GLU HA H 67 5.343 5.285 0.058 1
1 699 . 3 1 1 A 67 67 GLU C C 67 174.652 175.297 -0.645 1
1 700 . 3 1 1 A 67 67 GLU CA C 67 54.109 54.378 -0.269 1
1 701 . 3 1 1 A 67 67 GLU CB C 67 33.619 33.079 0.540 1
1 703 . 3 1 1 A 67 67 GLU N N 67 125.164 128.256 -3.092 1
1 704 . 3 1 1 A 68 68 GLY H H 68 8.401 8.238 0.163 1
1 705 . 3 1 1 A 68 68 GLY HA2 H 68 4.364 2.743 1.621 1
1 706 . 3 1 1 A 68 68 GLY HA3 H 68 4.041 3.581 0.460 1
1 707 . 3 1 1 A 68 68 GLY C C 68 171.644 170.959 0.685 1
1 708 . 3 1 1 A 68 68 GLY CA C 68 45.680 44.169 1.511 1
1 709 . 3 1 1 A 68 68 GLY N N 68 109.626 111.965 -2.339 1
1 710 . 3 1 1 A 69 69 TYR H H 69 8.422 10.096 -1.674 1
1 711 . 3 1 1 A 69 69 TYR HA H 69 5.079 4.956 0.123 1
1 714 . 3 1 1 A 69 69 TYR C C 69 176.194 175.484 0.710 1
1 715 . 3 1 1 A 69 69 TYR CA C 69 57.681 57.522 0.159 1
1 716 . 3 1 1 A 69 69 TYR CB C 69 41.043 39.913 1.130 1
1 717 . 3 1 1 A 69 69 TYR N N 69 119.689 119.281 0.408 1
1 718 . 3 1 1 A 70 70 VAL H H 70 8.753 8.820 -0.067 1
1 719 . 3 1 1 A 70 70 VAL HA H 70 4.143 4.437 -0.294 1
1 727 . 3 1 1 A 70 70 VAL C C 70 176.540 175.803 0.737 1
1 728 . 3 1 1 A 70 70 VAL CA C 70 63.477 63.741 -0.264 1
1 729 . 3 1 1 A 70 70 VAL CB C 70 30.952 32.337 -1.385 1
1 732 . 3 1 1 A 70 70 VAL N N 70 123.420 125.532 -2.112 1
1 733 . 3 1 1 A 71 71 ILE H H 71 9.101 9.942 -0.841 1
1 734 . 3 1 1 A 71 71 ILE HA H 71 4.834 4.628 0.206 1
1 743 . 3 1 1 A 71 71 ILE C C 71 175.418 175.644 -0.226 1
1 744 . 3 1 1 A 71 71 ILE CA C 71 60.637 62.031 -1.394 1
1 745 . 3 1 1 A 71 71 ILE CB C 71 39.853 40.679 -0.826 1
1 749 . 3 1 1 A 71 71 ILE N N 71 119.913 125.034 -5.121 1
1 750 . 3 1 1 A 72 72 ASP H H 72 8.030 7.939 0.091 1
1 751 . 3 1 1 A 72 72 ASP HA H 72 4.964 5.200 -0.236 1
1 754 . 3 1 1 A 72 72 ASP C C 72 173.017 174.265 -1.248 1
1 755 . 3 1 1 A 72 72 ASP CA C 72 53.511 53.000 0.511 1
1 756 . 3 1 1 A 72 72 ASP CB C 72 41.932 44.818 -2.886 1
1 757 . 3 1 1 A 72 72 ASP N N 72 118.377 121.872 -3.495 1
1 758 . 3 1 1 A 73 73 GLU H H 73 9.349 8.856 0.493 1
1 759 . 3 1 1 A 73 73 GLU HA H 73 4.868 4.979 -0.111 1
1 762 . 3 1 1 A 73 73 GLU C C 73 173.793 174.467 -0.674 1
1 763 . 3 1 1 A 73 73 GLU CA C 73 55.521 56.681 -1.160 1
1 764 . 3 1 1 A 73 73 GLU CB C 73 33.138 31.832 1.306 1
1 766 . 3 1 1 A 73 73 GLU N N 73 123.848 124.088 -0.240 1
1 767 . 3 1 1 A 74 74 THR H H 74 8.748 8.547 0.201 1
1 768 . 3 1 1 A 74 74 THR HA H 74 4.992 4.767 0.225 1
1 773 . 3 1 1 A 74 74 THR CA C 74 59.450 60.613 -1.163 1
1 774 . 3 1 1 A 74 74 THR CB C 74 70.429 71.727 -1.298 1
1 776 . 3 1 1 A 74 74 THR N N 74 116.628 118.304 -1.676 1
1 777 . 3 1 1 A 75 75 ARG HA H 75 3.741 4.354 -0.613 1
1 782 . 3 1 1 A 75 75 ARG C C 75 177.140 177.123 0.017 1
1 783 . 3 1 1 A 75 75 ARG CA C 75 60.041 58.919 1.122 1
1 784 . 3 1 1 A 75 75 ARG CB C 75 29.930 30.050 -0.120 1
1 787 . 3 1 1 A 76 76 ASN H H 76 8.497 8.137 0.360 1
1 788 . 3 1 1 A 76 76 ASN HA H 76 5.310 5.005 0.305 1
1 791 . 3 1 1 A 76 76 ASN C C 76 175.509 174.043 1.466 1
1 792 . 3 1 1 A 76 76 ASN CA C 76 52.320 52.165 0.155 1
1 793 . 3 1 1 A 76 76 ASN CB C 76 40.744 39.608 1.136 1
1 794 . 3 1 1 A 76 76 ASN N N 76 111.053 116.706 -5.653 1
1 795 . 3 1 1 A 77 77 MET H H 77 7.528 7.387 0.141 1
1 796 . 3 1 1 A 77 77 MET HA H 77 5.392 5.029 0.363 1
1 801 . 3 1 1 A 77 77 MET C C 77 174.824 174.267 0.557 1
1 802 . 3 1 1 A 77 77 MET CA C 77 54.994 54.083 0.911 1
1 803 . 3 1 1 A 77 77 MET CB C 77 36.753 35.517 1.236 1
1 805 . 3 1 1 A 77 77 MET N N 77 119.913 116.850 3.063 1
1 806 . 3 1 1 A 78 78 LEU H H 78 8.977 8.536 0.441 1
1 807 . 3 1 1 A 78 78 LEU HA H 78 4.803 5.233 -0.430 1
1 817 . 3 1 1 A 78 78 LEU C C 78 174.563 174.716 -0.153 1
1 818 . 3 1 1 A 78 78 LEU CA C 78 53.964 54.555 -0.591 1
1 819 . 3 1 1 A 78 78 LEU CB C 78 44.903 45.339 -0.436 1
1 823 . 3 1 1 A 78 78 LEU N N 78 121.224 121.082 0.142 1
1 824 . 3 1 1 A 79 79 VAL H H 79 8.115 8.775 -0.660 1
1 825 . 3 1 1 A 79 79 VAL HA H 79 4.783 5.267 -0.484 1
1 833 . 3 1 1 A 79 79 VAL C C 79 175.297 175.053 0.244 1
1 834 . 3 1 1 A 79 79 VAL CA C 79 61.821 60.805 1.016 1
1 835 . 3 1 1 A 79 79 VAL CB C 79 31.146 34.929 -3.783 1
1 838 . 3 1 1 A 79 79 VAL N N 79 124.062 127.381 -3.319 1
1 839 . 3 1 1 A 80 80 ILE H H 80 9.342 8.711 0.631 1
1 840 . 3 1 1 A 80 80 ILE HA H 80 4.764 5.343 -0.579 1
1 849 . 3 1 1 A 80 80 ILE C C 80 174.127 174.855 -0.728 1
1 850 . 3 1 1 A 80 80 ILE CA C 80 59.897 59.874 0.023 1
1 851 . 3 1 1 A 80 80 ILE CB C 80 42.225 41.704 0.521 1
1 855 . 3 1 1 A 80 80 ILE N N 80 129.970 126.771 3.199 1
1 856 . 3 1 1 A 81 81 ALA H H 81 9.478 10.024 -0.546 1
1 857 . 3 1 1 A 81 81 ALA HA H 81 5.139 5.493 -0.354 1
1 861 . 3 1 1 A 81 81 ALA C C 81 176.970 176.238 0.732 1
1 862 . 3 1 1 A 81 81 ALA CA C 81 50.835 50.330 0.505 1
1 863 . 3 1 1 A 81 81 ALA CB C 81 21.451 22.066 -0.615 1
1 864 . 3 1 1 A 81 81 ALA N N 81 129.756 127.818 1.938 1
1 865 . 3 1 1 A 82 82 GLY H H 82 8.691 8.485 0.206 1
1 866 . 3 1 1 A 82 82 GLY HA2 H 82 5.110 4.117 0.993 1
1 867 . 3 1 1 A 82 82 GLY HA3 H 82 4.241 4.256 -0.015 1
1 868 . 3 1 1 A 82 82 GLY C C 82 173.017 174.385 -1.368 1
1 869 . 3 1 1 A 82 82 GLY CA C 82 44.166 45.079 -0.913 1
1 870 . 3 1 1 A 82 82 GLY N N 82 113.568 108.330 5.238 1
1 871 . 3 1 1 A 83 83 GLU H H 83 8.659 9.109 -0.450 1
1 872 . 3 1 1 A 83 83 GLU HA H 83 4.286 4.311 -0.025 1
1 876 . 3 1 1 A 83 83 GLU C C 83 177.570 176.067 1.503 1
1 877 . 3 1 1 A 83 83 GLU CA C 83 59.017 58.621 0.396 1
1 878 . 3 1 1 A 83 83 GLU CB C 83 29.762 29.098 0.664 1
1 880 . 3 1 1 A 83 83 GLU N N 83 120.019 123.727 -3.708 1
1 881 . 3 1 1 A 84 84 ASN H H 84 8.549 8.823 -0.274 1
1 882 . 3 1 1 A 84 84 ASN HA H 84 4.821 4.981 -0.160 1
1 884 . 3 1 1 A 84 84 ASN C C 84 173.878 174.194 -0.316 1
1 885 . 3 1 1 A 84 84 ASN CA C 84 52.919 52.932 -0.013 1
1 886 . 3 1 1 A 84 84 ASN CB C 84 40.150 39.195 0.955 1
1 887 . 3 1 1 A 84 84 ASN N N 84 112.778 125.279 -12.501 1
1 888 . 3 1 1 A 85 85 LYS H H 85 7.116 7.260 -0.144 1
1 889 . 3 1 1 A 85 85 LYS HA H 85 4.344 5.011 -0.667 1
1 895 . 3 1 1 A 85 85 LYS C C 85 173.278 174.690 -1.412 1
1 896 . 3 1 1 A 85 85 LYS CA C 85 55.292 55.245 0.047 1
1 897 . 3 1 1 A 85 85 LYS CB C 85 36.124 36.138 -0.014 1
1 901 . 3 1 1 A 85 85 LYS N N 85 118.377 120.399 -2.022 1
1 902 . 3 1 1 A 86 86 VAL H H 86 7.781 8.725 -0.944 1
1 903 . 3 1 1 A 86 86 VAL HA H 86 4.749 5.371 -0.622 1
1 911 . 3 1 1 A 86 86 VAL C C 86 174.739 174.355 0.384 1
1 912 . 3 1 1 A 86 86 VAL CA C 86 60.716 59.527 1.189 1
1 913 . 3 1 1 A 86 86 VAL CB C 86 33.619 35.496 -1.877 1
1 916 . 3 1 1 A 86 86 VAL N N 86 120.127 117.945 2.182 1
1 917 . 3 1 1 A 87 87 TRP H H 87 9.558 9.994 -0.436 1
1 918 . 3 1 1 A 87 87 TRP HA H 87 4.958 4.873 0.085 1
1 923 . 3 1 1 A 87 87 TRP C C 87 174.909 174.781 0.128 1
1 924 . 3 1 1 A 87 87 TRP CA C 87 57.073 55.963 1.110 1
1 925 . 3 1 1 A 87 87 TRP CB C 87 33.028 29.093 3.935 1
1 926 . 3 1 1 A 87 87 TRP N N 87 127.346 123.317 4.029 1
1 927 . 3 1 1 A 88 88 LYS H H 88 8.590 7.807 0.783 1
1 928 . 3 1 1 A 88 88 LYS HA H 88 4.856 4.462 0.394 1
1 935 . 3 1 1 A 88 88 LYS C C 88 175.382 174.820 0.562 1
1 936 . 3 1 1 A 88 88 LYS CA C 88 55.887 55.300 0.587 1
1 937 . 3 1 1 A 88 88 LYS CB C 88 32.434 33.329 -0.895 1
1 941 . 3 1 1 A 88 88 LYS N N 88 123.625 125.609 -1.984 1
1 942 . 3 1 1 A 89 89 VAL H H 89 8.829 8.039 0.790 1
1 943 . 3 1 1 A 89 89 VAL HA H 89 4.406 4.510 -0.104 1
1 951 . 3 1 1 A 89 89 VAL CA C 89 58.371 58.730 -0.359 1
1 952 . 3 1 1 A 89 89 VAL CB C 89 34.512 31.975 2.537 1
1 955 . 3 1 1 A 89 89 VAL N N 89 124.285 120.386 3.899 1
1 956 . 3 1 1 A 90 90 PRO HA H 90 5.073 4.627 0.446 1
1 961 . 3 1 1 A 90 90 PRO C C 90 177.231 177.844 -0.613 1
1 962 . 3 1 1 A 90 90 PRO CA C 90 61.795 63.485 -1.690 1
1 963 . 3 1 1 A 90 90 PRO CB C 90 31.660 32.281 -0.621 1
1 964 . 3 1 1 A 91 91 LYS H H 91 8.116 8.572 -0.456 1
1 965 . 3 1 1 A 91 91 LYS HA H 91 4.024 4.202 -0.178 1
1 969 . 3 1 1 A 91 91 LYS C C 91 178.518 177.254 1.264 1
1 970 . 3 1 1 A 91 91 LYS CA C 91 59.621 58.875 0.746 1
1 971 . 3 1 1 A 91 91 LYS CB C 91 34.217 31.781 2.436 1
1 973 . 3 1 1 A 91 91 LYS N N 91 121.224 123.407 -2.183 1
1 974 . 3 1 1 A 92 92 ASP H H 92 8.505 8.740 -0.235 1
1 975 . 3 1 1 A 92 92 ASP HA H 92 3.781 4.590 -0.809 1
1 978 . 3 1 1 A 92 92 ASP C C 92 176.975 176.617 0.358 1
1 979 . 3 1 1 A 92 92 ASP CA C 92 56.773 55.075 1.698 1
1 980 . 3 1 1 A 92 92 ASP CB C 92 39.590 39.831 -0.241 1
1 981 . 3 1 1 A 92 92 ASP N N 92 111.815 119.102 -7.287 1
1 982 . 3 1 1 A 93 93 VAL H H 93 6.691 8.786 -2.095 1
1 983 . 3 1 1 A 93 93 VAL HA H 93 4.678 4.480 0.198 1
1 991 . 3 1 1 A 93 93 VAL C C 93 176.537 174.720 1.817 1
1 992 . 3 1 1 A 93 93 VAL CA C 93 60.120 61.410 -1.290 1
1 993 . 3 1 1 A 93 93 VAL CB C 93 31.093 32.363 -1.270 1
1 996 . 3 1 1 A 93 93 VAL N N 93 107.879 118.316 -10.437 1
1 997 . 3 1 1 A 94 94 CYS H H 94 7.249 7.766 -0.517 1
1 998 . 3 1 1 A 94 94 CYS HA H 94 5.062 4.813 0.249 1
1 1001 . 3 1 1 A 94 94 CYS C C 94 173.103 172.414 0.689 1
1 1002 . 3 1 1 A 94 94 CYS CA C 94 58.001 57.183 0.818 1
1 1003 . 3 1 1 A 94 94 CYS CB C 94 31.418 31.264 0.154 1
1 1004 . 3 1 1 A 94 94 CYS N N 94 117.940 118.071 -0.131 1
1 1005 . 3 1 1 A 95 95 ILE H H 95 8.153 8.243 -0.090 1
1 1006 . 3 1 1 A 95 95 ILE HA H 95 4.159 5.073 -0.914 1
1 1016 . 3 1 1 A 95 95 ILE C C 95 174.736 174.989 -0.253 1
1 1017 . 3 1 1 A 95 95 ILE CA C 95 61.234 60.154 1.080 1
1 1018 . 3 1 1 A 95 95 ILE CB C 95 38.071 40.083 -2.012 1
1 1022 . 3 1 1 A 95 95 ILE N N 95 121.876 121.625 0.251 1
1 1023 . 3 1 1 A 96 96 PHE H H 96 8.400 9.054 -0.654 1
1 1024 . 3 1 1 A 96 96 PHE HA H 96 5.004 5.050 -0.046 1
1 1029 . 3 1 1 A 96 96 PHE C C 96 174.005 173.994 0.011 1
1 1030 . 3 1 1 A 96 96 PHE CA C 96 56.922 55.660 1.262 1
1 1031 . 3 1 1 A 96 96 PHE CB C 96 44.006 42.588 1.418 1
1 1032 . 3 1 1 A 96 96 PHE N N 96 125.820 124.964 0.856 1
1 1033 . 3 1 1 A 97 97 GLU H H 97 8.985 8.420 0.565 1
1 1034 . 3 1 1 A 97 97 GLU HA H 97 5.275 5.148 0.127 1
1 1038 . 3 1 1 A 97 97 GLU C C 97 175.596 174.982 0.614 1
1 1039 . 3 1 1 A 97 97 GLU CA C 97 55.070 54.623 0.447 1
1 1040 . 3 1 1 A 97 97 GLU CB C 97 33.628 31.319 2.309 1
1 1042 . 3 1 1 A 97 97 GLU N N 97 121.010 123.187 -2.177 1
1 1043 . 3 1 1 A 98 98 PHE H H 98 9.304 9.039 0.265 1
1 1044 . 3 1 1 A 98 98 PHE HA H 98 5.337 5.016 0.321 1
1 1048 . 3 1 1 A 98 98 PHE C C 98 174.650 175.720 -1.070 1
1 1049 . 3 1 1 A 98 98 PHE CA C 98 57.363 57.847 -0.484 1
1 1050 . 3 1 1 A 98 98 PHE CB C 98 41.936 40.317 1.619 1
1 1051 . 3 1 1 A 98 98 PHE N N 98 128.658 126.361 2.297 1
1 1052 . 3 1 1 A 99 99 GLU H H 99 8.721 9.060 -0.339 1
1 1053 . 3 1 1 A 99 99 GLU HA H 99 5.457 4.693 0.764 1
1 1058 . 3 1 1 A 99 99 GLU C C 99 176.368 176.595 -0.227 1
1 1059 . 3 1 1 A 99 99 GLU CA C 99 54.401 55.323 -0.922 1
1 1060 . 3 1 1 A 99 99 GLU CB C 99 33.068 31.264 1.804 1
1 1062 . 3 1 1 A 99 99 GLU N N 99 122.759 123.654 -0.895 1
1 1063 . 3 1 1 A 100 100 THR H H 100 8.588 10.173 -1.585 1
1 1064 . 3 1 1 A 100 100 THR HA H 100 4.603 4.436 0.167 1
1 1069 . 3 1 1 A 100 100 THR C C 100 177.144 176.737 0.407 1
1 1070 . 3 1 1 A 100 100 THR CA C 100 60.774 62.990 -2.216 1
1 1071 . 3 1 1 A 100 100 THR CB C 100 70.136 69.982 0.154 1
1 1073 . 3 1 1 A 100 100 THR N N 100 116.191 120.598 -4.407 1
1 1074 . 3 1 1 A 101 101 TRP H H 101 9.287 9.029 0.258 1
1 1075 . 3 1 1 A 101 101 TRP HA H 101 4.591 4.403 0.188 1
1 1080 . 3 1 1 A 101 101 TRP C C 101 176.457 176.563 -0.106 1
1 1081 . 3 1 1 A 101 101 TRP CA C 101 60.045 58.813 1.232 1
1 1082 . 3 1 1 A 101 101 TRP CB C 101 28.578 28.353 0.225 1
1 1083 . 3 1 1 A 101 101 TRP N N 101 122.220 124.255 -2.035 1
1 1084 . 3 1 1 A 102 102 ASP H H 102 7.553 8.200 -0.647 1
1 1085 . 3 1 1 A 102 102 ASP HA H 102 4.129 4.407 -0.278 1
1 1088 . 3 1 1 A 102 102 ASP C C 102 176.714 176.128 0.586 1
1 1089 . 3 1 1 A 102 102 ASP CA C 102 52.775 53.116 -0.341 1
1 1090 . 3 1 1 A 102 102 ASP CB C 102 39.231 40.435 -1.204 1
1 1091 . 3 1 1 A 102 102 ASP N N 102 115.763 120.193 -4.430 1
1 1092 . 3 1 1 A 103 103 GLY H H 103 7.910 8.536 -0.626 1
1 1093 . 3 1 1 A 103 103 GLY HA2 H 103 4.216 3.928 0.288 1
1 1094 . 3 1 1 A 103 103 GLY HA3 H 103 3.686 3.958 -0.272 1
1 1095 . 3 1 1 A 103 103 GLY C C 103 174.566 174.049 0.517 1
1 1096 . 3 1 1 A 103 103 GLY CA C 103 45.179 46.247 -1.068 1
1 1097 . 3 1 1 A 103 103 GLY N N 103 108.311 108.542 -0.231 1
1 1098 . 3 1 1 A 104 104 THR H H 104 7.691 7.587 0.104 1
1 1099 . 3 1 1 A 104 104 THR HA H 104 4.031 4.779 -0.748 1
1 1104 . 3 1 1 A 104 104 THR C C 104 173.405 173.611 -0.206 1
1 1105 . 3 1 1 A 104 104 THR CA C 104 64.307 60.093 4.214 1
1 1106 . 3 1 1 A 104 104 THR CB C 104 68.354 71.513 -3.159 1
1 1108 . 3 1 1 A 104 104 THR N N 104 119.913 113.885 6.028 1
1 1109 . 3 1 1 A 105 105 LYS H H 105 8.297 8.771 -0.474 1
1 1110 . 3 1 1 A 105 105 LYS HA H 105 5.457 4.787 0.670 1
1 1116 . 3 1 1 A 105 105 LYS C C 105 177.055 175.600 1.455 1
1 1117 . 3 1 1 A 105 105 LYS CA C 105 54.401 55.510 -1.109 1
1 1118 . 3 1 1 A 105 105 LYS CB C 105 34.230 34.147 0.083 1
1 1122 . 3 1 1 A 105 105 LYS N N 105 125.597 122.805 2.792 1
1 1123 . 3 1 1 A 106 106 ILE H H 106 9.238 9.012 0.226 1
1 1124 . 3 1 1 A 106 106 ILE HA H 106 4.289 4.827 -0.538 1
1 1133 . 3 1 1 A 106 106 ILE C C 106 174.221 174.449 -0.228 1
1 1134 . 3 1 1 A 106 106 ILE CA C 106 60.631 59.881 0.750 1
1 1135 . 3 1 1 A 106 106 ILE CB C 106 41.927 40.051 1.876 1
1 1139 . 3 1 1 A 106 106 ILE N N 106 124.499 126.181 -1.682 1
1 1140 . 3 1 1 A 107 107 LYS H H 107 8.650 9.038 -0.388 1
1 1141 . 3 1 1 A 107 107 LYS HA H 107 5.608 4.995 0.613 1
1 1147 . 3 1 1 A 107 107 LYS C C 107 175.681 175.141 0.540 1
1 1148 . 3 1 1 A 107 107 LYS CA C 107 55.248 54.956 0.292 1
1 1149 . 3 1 1 A 107 107 LYS CB C 107 33.618 34.235 -0.617 1
1 1153 . 3 1 1 A 107 107 LYS N N 107 130.844 128.422 2.422 1
1 1154 . 3 1 1 A 108 108 ILE H H 108 9.448 8.334 1.114 1
1 1155 . 3 1 1 A 108 108 ILE HA H 108 4.741 4.855 -0.114 1
1 1164 . 3 1 1 A 108 108 ILE C C 108 172.670 173.937 -1.267 1
1 1165 . 3 1 1 A 108 108 ILE CA C 108 59.157 59.526 -0.369 1
1 1166 . 3 1 1 A 108 108 ILE CB C 108 42.241 42.000 0.241 1
1 1170 . 3 1 1 A 108 108 ILE N N 108 125.160 127.033 -1.873 1
1 1171 . 3 1 1 A 109 109 SER H H 109 8.490 9.052 -0.562 1
1 1172 . 3 1 1 A 109 109 SER HA H 109 4.437 4.754 -0.317 1
1 1175 . 3 1 1 A 109 109 SER C C 109 176.536 176.180 0.356 1
1 1176 . 3 1 1 A 109 109 SER CA C 109 58.850 58.399 0.451 1
1 1177 . 3 1 1 A 109 109 SER CB C 109 63.010 63.887 -0.877 1
1 1178 . 3 1 1 A 109 109 SER N N 109 122.750 124.383 -1.633 1
1 1179 . 3 1 1 A 110 110 GLY H H 110 9.292 8.721 0.571 1
1 1180 . 3 1 1 A 110 110 GLY HA2 H 110 5.193 3.955 1.238 1
1 1181 . 3 1 1 A 110 110 GLY HA3 H 110 3.755 4.066 -0.311 1
1 1182 . 3 1 1 A 110 110 GLY C C 110 176.964 175.110 1.854 1
1 1183 . 3 1 1 A 110 110 GLY CA C 110 48.168 46.764 1.404 1
1 1184 . 3 1 1 A 110 110 GLY N N 110 116.628 112.763 3.865 1
1 1185 . 3 1 1 A 111 111 GLU H H 111 8.576 8.860 -0.284 1
1 1186 . 3 1 1 A 111 111 GLU HA H 111 4.080 4.121 -0.041 1
1 1191 . 3 1 1 A 111 111 GLU C C 111 178.867 178.804 0.063 1
1 1192 . 3 1 1 A 111 111 GLU CA C 111 59.150 58.701 0.449 1
1 1193 . 3 1 1 A 111 111 GLU CB C 111 28.831 28.505 0.326 1
1 1195 . 3 1 1 A 111 111 GLU N N 111 120.564 118.515 2.049 1
1 1196 . 3 1 1 A 112 112 LYS H H 112 7.605 7.845 -0.240 1
1 1197 . 3 1 1 A 112 112 LYS HA H 112 4.229 4.058 0.171 1
1 1202 . 3 1 1 A 112 112 LYS C C 112 176.710 178.208 -1.498 1
1 1203 . 3 1 1 A 112 112 LYS CA C 112 57.083 59.089 -2.006 1
1 1204 . 3 1 1 A 112 112 LYS CB C 112 32.183 32.678 -0.495 1
1 1208 . 3 1 1 A 112 112 LYS N N 112 116.628 119.354 -2.726 1
1 1209 . 3 1 1 A 113 113 LEU H H 113 7.784 7.758 0.026 1
1 1210 . 3 1 1 A 113 113 LEU HA H 113 4.387 4.325 0.062 1
1 1220 . 3 1 1 A 113 113 LEU C C 113 176.195 176.630 -0.435 1
1 1221 . 3 1 1 A 113 113 LEU CA C 113 52.617 54.127 -1.510 1
1 1222 . 3 1 1 A 113 113 LEU CB C 113 42.820 41.075 1.745 1
1 1226 . 3 1 1 A 113 113 LEU N N 113 114.219 114.868 -0.649 1
1 1227 . 3 1 1 A 114 114 VAL H H 114 7.032 7.576 -0.544 1
1 1228 . 3 1 1 A 114 114 VAL HA H 114 3.723 3.805 -0.082 1
1 1236 . 3 1 1 A 114 114 VAL C C 114 175.430 177.248 -1.818 1
1 1237 . 3 1 1 A 114 114 VAL CA C 114 65.537 64.010 1.527 1
1 1238 . 3 1 1 A 114 114 VAL CB C 114 32.115 31.225 0.890 1
1 1241 . 3 1 1 A 114 114 VAL N N 114 121.773 121.156 0.617 1
1 1242 . 3 1 1 A 115 115 GLY H H 115 8.678 8.852 -0.174 1
1 1243 . 3 1 1 A 115 115 GLY HA2 H 115 4.313 3.943 0.370 1
1 1244 . 3 1 1 A 115 115 GLY HA3 H 115 3.846 3.947 -0.101 1
1 1245 . 3 1 1 A 115 115 GLY C C 115 172.462 173.894 -1.432 1
1 1246 . 3 1 1 A 115 115 GLY CA C 115 43.743 45.548 -1.805 1
1 1247 . 3 1 1 A 115 115 GLY N N 115 117.503 117.037 0.466 1
1 1248 . 3 1 1 A 116 116 ARG H H 116 8.701 8.607 0.094 1
1 1249 . 3 1 1 A 116 116 ARG HA H 116 3.926 4.718 -0.792 1
1 1254 . 3 1 1 A 116 116 ARG CA C 116 56.470 53.608 2.862 1
1 1255 . 3 1 1 A 116 116 ARG CB C 116 29.585 29.515 0.070 1
1 1257 . 3 1 1 A 116 116 ARG N N 116 123.504 120.629 2.875 1
1 1258 . 3 1 1 A 117 117 PRO HA H 117 4.242 4.252 -0.010 1
1 1264 . 3 1 1 A 117 117 PRO C C 117 178.947 178.159 0.788 1
1 1265 . 3 1 1 A 117 117 PRO CA C 117 65.684 64.572 1.112 1
1 1266 . 3 1 1 A 117 117 PRO CB C 117 30.949 32.034 -1.085 1
1 1269 . 3 1 1 A 118 118 GLU H H 118 10.821 8.814 2.007 1
1 1270 . 3 1 1 A 118 118 GLU HA H 118 4.197 4.089 0.108 1
1 1271 . 3 1 1 A 118 118 GLU C C 118 176.627 178.833 -2.206 1
1 1272 . 3 1 1 A 118 118 GLU CA C 118 58.045 59.244 -1.199 1
1 1273 . 3 1 1 A 118 118 GLU CB C 118 27.101 29.179 -2.078 1
1 1274 . 3 1 1 A 118 118 GLU N N 118 119.242 116.403 2.839 1
1 1275 . 3 1 1 A 119 119 MET H H 119 7.226 8.107 -0.881 1
1 1276 . 3 1 1 A 119 119 MET HA H 119 4.591 4.034 0.557 1
1 1279 . 3 1 1 A 119 119 MET C C 119 180.024 178.197 1.827 1
1 1280 . 3 1 1 A 119 119 MET CA C 119 54.695 58.935 -4.240 1
1 1281 . 3 1 1 A 119 119 MET CB C 119 31.012 32.095 -1.083 1
1 1283 . 3 1 1 A 119 119 MET N N 119 119.475 119.910 -0.435 1
1 1284 . 3 1 1 A 120 120 ARG H H 120 7.877 7.705 0.172 1
1 1285 . 3 1 1 A 120 120 ARG HA H 120 3.988 3.944 0.044 1
1 1292 . 3 1 1 A 120 120 ARG C C 120 177.705 178.785 -1.080 1
1 1293 . 3 1 1 A 120 120 ARG CA C 120 60.773 58.378 2.395 1
1 1294 . 3 1 1 A 120 120 ARG CB C 120 31.159 29.734 1.425 1
1 1295 . 3 1 1 A 120 120 ARG N N 120 122.099 120.044 2.055 1
1 1296 . 3 1 1 A 121 121 LEU H H 121 6.732 8.235 -1.503 1
1 1297 . 3 1 1 A 121 121 LEU HA H 121 4.170 4.017 0.153 1
1 1307 . 3 1 1 A 121 121 LEU C C 121 176.220 178.202 -1.982 1
1 1308 . 3 1 1 A 121 121 LEU CA C 121 57.370 58.004 -0.634 1
1 1309 . 3 1 1 A 121 121 LEU CB C 121 42.945 41.586 1.359 1
1 1312 . 3 1 1 A 121 121 LEU N N 121 114.436 119.183 -4.747 1
1 1313 . 3 1 1 A 122 122 LYS H H 122 7.555 8.407 -0.852 1
1 1314 . 3 1 1 A 122 122 LYS HA H 122 4.338 4.265 0.073 1
1 1321 . 3 1 1 A 122 122 LYS C C 122 176.969 176.421 0.548 1
1 1322 . 3 1 1 A 122 122 LYS CA C 122 55.621 55.526 0.095 1
1 1323 . 3 1 1 A 122 122 LYS CB C 122 32.414 31.639 0.775 1
1 1327 . 3 1 1 A 122 122 LYS N N 122 115.754 116.131 -0.377 1
1 1328 . 3 1 1 A 123 123 LYS H H 123 7.688 7.862 -0.174 1
1 1329 . 3 1 1 A 123 123 LYS HA H 123 4.535 3.983 0.552 1
1 1330 . 3 1 1 A 123 123 LYS CA C 123 58.461 57.967 0.494 1
1 1331 . 3 1 1 A 123 123 LYS CB C 123 33.138 30.831 2.307 1
1 1332 . 3 1 1 A 123 123 LYS N N 123 120.843 115.005 5.838 1
1 1333 . 3 1 1 A 126 126 ARG HA H 126 4.347 4.300 0.047 1
1 1338 . 3 1 1 A 126 126 ARG C C 126 174.573 175.678 -1.105 1
1 1339 . 3 1 1 A 126 126 ARG CA C 126 55.998 56.288 -0.290 1
1 1340 . 3 1 1 A 126 126 ARG CB C 126 31.569 30.643 0.926 1
1 128 . 4 1 1 A 18 18 GLY H H 18 8.343 7.899 0.444 1
1 129 . 4 1 1 A 18 18 GLY HA2 H 18 3.894 3.646 0.248 1
1 130 . 4 1 1 A 18 18 GLY C C 18 177.743 174.339 3.404 1
1 131 . 4 1 1 A 18 18 GLY CA C 18 45.497 44.312 1.185 1
1 132 . 4 1 1 A 18 18 GLY N N 18 109.925 108.659 1.266 1
1 133 . 4 1 1 A 19 19 SER H H 19 8.005 8.486 -0.481 1
1 134 . 4 1 1 A 19 19 SER HA H 19 4.329 4.277 0.052 1
1 136 . 4 1 1 A 19 19 SER C C 19 175.168 176.237 -1.069 1
1 137 . 4 1 1 A 19 19 SER CA C 19 58.852 59.491 -0.639 1
1 138 . 4 1 1 A 19 19 SER CB C 19 63.604 63.215 0.389 1
1 139 . 4 1 1 A 19 19 SER N N 19 115.090 115.566 -0.476 1
1 140 . 4 1 1 A 20 20 TYR H H 20 8.040 6.776 1.264 1
1 141 . 4 1 1 A 20 20 TYR HA H 20 4.439 4.312 0.127 1
1 146 . 4 1 1 A 20 20 TYR C C 20 176.111 178.589 -2.478 1
1 147 . 4 1 1 A 20 20 TYR CA C 20 57.966 62.042 -4.076 1
1 148 . 4 1 1 A 20 20 TYR CB C 20 37.472 38.203 -0.731 1
1 149 . 4 1 1 A 20 20 TYR N N 20 118.675 120.482 -1.807 1
1 150 . 4 1 1 A 21 21 GLN H H 21 7.909 8.537 -0.628 1
1 151 . 4 1 1 A 21 21 GLN HA H 21 3.903 4.166 -0.263 1
1 155 . 4 1 1 A 21 21 GLN C C 21 178.003 177.539 0.464 1
1 156 . 4 1 1 A 21 21 GLN CA C 21 58.523 58.485 0.038 1
1 157 . 4 1 1 A 21 21 GLN CB C 21 28.438 28.004 0.434 1
1 159 . 4 1 1 A 21 21 GLN N N 21 117.056 117.263 -0.207 1
1 160 . 4 1 1 A 22 22 GLU H H 22 8.965 8.244 0.721 1
1 161 . 4 1 1 A 22 22 GLU HA H 22 4.267 4.355 -0.088 1
1 165 . 4 1 1 A 22 22 GLU C C 22 176.451 178.092 -1.641 1
1 166 . 4 1 1 A 22 22 GLU CA C 22 58.273 58.362 -0.089 1
1 167 . 4 1 1 A 22 22 GLU CB C 22 29.412 30.174 -0.762 1
1 169 . 4 1 1 A 22 22 GLU N N 22 117.289 119.214 -1.925 1
1 170 . 4 1 1 A 23 23 ILE H H 23 7.596 7.684 -0.088 1
1 171 . 4 1 1 A 23 23 ILE HA H 23 4.161 4.446 -0.285 1
1 180 . 4 1 1 A 23 23 ILE C C 23 176.195 175.876 0.319 1
1 181 . 4 1 1 A 23 23 ILE CA C 23 58.120 60.829 -2.709 1
1 182 . 4 1 1 A 23 23 ILE CB C 23 38.461 37.316 1.145 1
1 186 . 4 1 1 A 23 23 ILE N N 23 114.005 117.195 -3.190 1
1 187 . 4 1 1 A 24 24 ILE H H 24 7.178 7.396 -0.218 1
1 188 . 4 1 1 A 24 24 ILE HA H 24 3.740 4.048 -0.308 1
1 197 . 4 1 1 A 24 24 ILE C C 24 177.831 176.780 1.051 1
1 198 . 4 1 1 A 24 24 ILE CA C 24 63.318 62.269 1.049 1
1 199 . 4 1 1 A 24 24 ILE CB C 24 36.590 38.325 -1.735 1
1 203 . 4 1 1 A 24 24 ILE N N 24 122.099 125.734 -3.635 1
1 204 . 4 1 1 A 25 25 GLY H H 25 8.618 9.012 -0.394 1
1 205 . 4 1 1 A 25 25 GLY HA2 H 25 4.390 3.989 0.401 1
1 206 . 4 1 1 A 25 25 GLY HA3 H 25 4.168 4.014 0.154 1
1 207 . 4 1 1 A 25 25 GLY C C 25 175.210 176.219 -1.009 1
1 208 . 4 1 1 A 25 25 GLY CA C 25 45.798 45.138 0.660 1
1 209 . 4 1 1 A 25 25 GLY N N 25 115.531 118.278 -2.747 1
1 210 . 4 1 1 A 26 26 ARG H H 26 8.277 8.217 0.060 1
1 211 . 4 1 1 A 26 26 ARG HA H 26 4.477 4.531 -0.054 1
1 218 . 4 1 1 A 26 26 ARG C C 26 175.944 177.834 -1.890 1
1 219 . 4 1 1 A 26 26 ARG CA C 26 54.408 57.024 -2.616 1
1 220 . 4 1 1 A 26 26 ARG CB C 26 29.501 29.988 -0.487 1
1 223 . 4 1 1 A 26 26 ARG N N 26 119.689 121.312 -1.623 1
1 224 . 4 1 1 A 27 27 THR H H 27 7.923 9.113 -1.190 1
1 225 . 4 1 1 A 27 27 THR HA H 27 3.792 3.938 -0.146 1
1 230 . 4 1 1 A 27 27 THR C C 27 175.251 176.619 -1.368 1
1 231 . 4 1 1 A 27 27 THR CA C 27 64.791 65.261 -0.470 1
1 232 . 4 1 1 A 27 27 THR CB C 27 68.354 68.037 0.317 1
1 234 . 4 1 1 A 27 27 THR N N 27 109.195 113.189 -3.994 1
1 235 . 4 1 1 A 28 28 TRP H H 28 7.389 8.185 -0.796 1
1 236 . 4 1 1 A 28 28 TRP HA H 28 4.441 4.316 0.125 1
1 240 . 4 1 1 A 28 28 TRP C C 28 178.519 178.414 0.105 1
1 241 . 4 1 1 A 28 28 TRP CA C 28 57.789 61.397 -3.608 1
1 242 . 4 1 1 A 28 28 TRP CB C 28 27.387 30.074 -2.687 1
1 243 . 4 1 1 A 28 28 TRP N N 28 120.127 124.983 -4.856 1
1 244 . 4 1 1 A 29 29 ILE H H 29 6.832 8.038 -1.206 1
1 245 . 4 1 1 A 29 29 ILE HA H 29 3.612 3.315 0.297 1
1 254 . 4 1 1 A 29 29 ILE C C 29 176.023 176.886 -0.863 1
1 255 . 4 1 1 A 29 29 ILE CA C 29 63.773 63.186 0.587 1
1 256 . 4 1 1 A 29 29 ILE CB C 29 37.567 37.337 0.230 1
1 260 . 4 1 1 A 29 29 ILE N N 29 119.913 117.740 2.173 1
1 261 . 4 1 1 A 30 30 PHE H H 30 7.329 7.755 -0.426 1
1 262 . 4 1 1 A 30 30 PHE HA H 30 3.912 4.425 -0.513 1
1 268 . 4 1 1 A 30 30 PHE C C 30 177.101 178.053 -0.952 1
1 269 . 4 1 1 A 30 30 PHE CA C 30 59.436 60.720 -1.284 1
1 270 . 4 1 1 A 30 30 PHE CB C 30 38.734 40.131 -1.397 1
1 271 . 4 1 1 A 30 30 PHE N N 30 116.638 120.222 -3.584 1
1 272 . 4 1 1 A 31 31 ARG H H 31 7.399 8.506 -1.107 1
1 273 . 4 1 1 A 31 31 ARG HA H 31 4.287 4.310 -0.023 1
1 278 . 4 1 1 A 31 31 ARG C C 31 176.539 178.087 -1.548 1
1 279 . 4 1 1 A 31 31 ARG CA C 31 58.852 59.085 -0.233 1
1 280 . 4 1 1 A 31 31 ARG CB C 31 29.461 30.009 -0.548 1
1 281 . 4 1 1 A 31 31 ARG N N 31 122.099 120.232 1.867 1
1 282 . 4 1 1 A 32 32 GLY H H 32 8.346 8.089 0.257 1
1 283 . 4 1 1 A 32 32 GLY HA2 H 32 4.284 3.324 0.960 1
1 284 . 4 1 1 A 32 32 GLY HA3 H 32 3.629 3.762 -0.133 1
1 285 . 4 1 1 A 32 32 GLY C C 32 173.791 174.157 -0.366 1
1 286 . 4 1 1 A 32 32 GLY CA C 32 45.793 45.092 0.701 1
1 287 . 4 1 1 A 32 32 GLY N N 32 109.964 107.262 2.702 1
1 288 . 4 1 1 A 33 33 ALA H H 33 7.510 7.864 -0.354 1
1 289 . 4 1 1 A 33 33 ALA HA H 33 4.193 4.493 -0.300 1
1 293 . 4 1 1 A 33 33 ALA C C 33 176.672 175.928 0.744 1
1 294 . 4 1 1 A 33 33 ALA CA C 33 54.401 51.132 3.269 1
1 295 . 4 1 1 A 33 33 ALA CB C 33 19.368 20.323 -0.955 1
1 296 . 4 1 1 A 33 33 ALA N N 33 122.266 120.477 1.789 1
1 297 . 4 1 1 A 34 34 HIS H H 34 8.759 7.633 1.126 1
1 298 . 4 1 1 A 34 34 HIS HA H 34 4.529 5.004 -0.475 1
1 302 . 4 1 1 A 34 34 HIS C C 34 175.767 174.486 1.281 1
1 303 . 4 1 1 A 34 34 HIS CA C 34 54.997 54.563 0.434 1
1 304 . 4 1 1 A 34 34 HIS CB C 34 31.089 31.582 -0.493 1
1 305 . 4 1 1 A 34 34 HIS N N 34 119.038 118.037 1.001 1
1 306 . 4 1 1 A 35 35 ARG H H 35 8.142 8.516 -0.374 1
1 307 . 4 1 1 A 35 35 ARG HA H 35 4.700 4.345 0.355 1
1 314 . 4 1 1 A 35 35 ARG C C 35 177.572 176.181 1.391 1
1 315 . 4 1 1 A 35 35 ARG CA C 35 54.103 55.700 -1.597 1
1 316 . 4 1 1 A 35 35 ARG CB C 35 29.112 32.019 -2.907 1
1 319 . 4 1 1 A 35 35 ARG N N 35 127.785 127.283 0.502 1
1 320 . 4 1 1 A 36 36 GLY H H 36 9.352 7.890 1.462 1
1 321 . 4 1 1 A 36 36 GLY HA2 H 36 4.291 3.957 0.334 1
1 322 . 4 1 1 A 36 36 GLY HA3 H 36 3.247 3.991 -0.744 1
1 323 . 4 1 1 A 36 36 GLY C C 36 173.876 173.352 0.524 1
1 324 . 4 1 1 A 36 36 GLY CA C 36 45.644 45.540 0.104 1
1 325 . 4 1 1 A 36 36 GLY N N 36 109.626 107.752 1.874 1
1 326 . 4 1 1 A 37 37 ARG H H 37 9.384 8.413 0.971 1
1 327 . 4 1 1 A 37 37 ARG HA H 37 4.688 4.246 0.442 1
1 333 . 4 1 1 A 37 37 ARG C C 37 175.081 175.269 -0.188 1
1 334 . 4 1 1 A 37 37 ARG CA C 37 55.742 56.414 -0.672 1
1 335 . 4 1 1 A 37 37 ARG CB C 37 28.138 30.669 -2.531 1
1 338 . 4 1 1 A 37 37 ARG N N 37 127.132 123.228 3.904 1
1 339 . 4 1 1 A 38 38 VAL H H 38 7.605 6.501 1.104 1
1 340 . 4 1 1 A 38 38 VAL HA H 38 4.591 3.995 0.596 1
1 348 . 4 1 1 A 38 38 VAL C C 38 174.391 174.424 -0.033 1
1 349 . 4 1 1 A 38 38 VAL CA C 38 60.092 60.461 -0.369 1
1 350 . 4 1 1 A 38 38 VAL CB C 38 33.328 32.771 0.557 1
1 353 . 4 1 1 A 38 38 VAL N N 38 126.253 125.741 0.512 1
1 354 . 4 1 1 A 39 39 ASN H H 39 9.007 7.901 1.106 1
1 355 . 4 1 1 A 39 39 ASN HA H 39 4.736 4.857 -0.121 1
1 358 . 4 1 1 A 39 39 ASN C C 39 174.562 175.030 -0.468 1
1 359 . 4 1 1 A 39 39 ASN CA C 39 51.577 52.300 -0.723 1
1 360 . 4 1 1 A 39 39 ASN CB C 39 40.749 41.576 -0.827 1
1 361 . 4 1 1 A 39 39 ASN N N 39 123.411 122.128 1.283 1
1 362 . 4 1 1 A 40 40 LYS H H 40 8.510 8.726 -0.216 1
1 363 . 4 1 1 A 40 40 LYS HA H 40 3.909 3.865 0.044 1
1 370 . 4 1 1 A 40 40 LYS C C 40 176.629 178.360 -1.731 1
1 371 . 4 1 1 A 40 40 LYS CA C 40 59.141 60.326 -1.185 1
1 372 . 4 1 1 A 40 40 LYS CB C 40 32.301 32.394 -0.093 1
1 376 . 4 1 1 A 40 40 LYS N N 40 116.303 125.897 -9.594 1
1 377 . 4 1 1 A 41 41 LYS H H 41 7.907 8.094 -0.187 1
1 378 . 4 1 1 A 41 41 LYS HA H 41 4.172 3.587 0.585 1
1 384 . 4 1 1 A 41 41 LYS C C 41 177.229 175.754 1.475 1
1 385 . 4 1 1 A 41 41 LYS CA C 41 57.392 57.744 -0.352 1
1 386 . 4 1 1 A 41 41 LYS CB C 41 32.667 30.673 1.994 1
1 390 . 4 1 1 A 41 41 LYS N N 41 117.066 117.718 -0.652 1
1 391 . 4 1 1 A 42 42 ASN H H 42 7.962 8.575 -0.613 1
1 392 . 4 1 1 A 42 42 ASN HA H 42 4.392 4.655 -0.263 1
1 395 . 4 1 1 A 42 42 ASN C C 42 179.805 175.962 3.843 1
1 396 . 4 1 1 A 42 42 ASN CA C 42 52.335 52.666 -0.331 1
1 397 . 4 1 1 A 42 42 ASN CB C 42 39.348 39.164 0.184 1
1 398 . 4 1 1 A 42 42 ASN N N 42 114.442 116.798 -2.356 1
1 399 . 4 1 1 A 43 43 ILE H H 43 7.806 8.433 -0.627 1
1 400 . 4 1 1 A 43 43 ILE HA H 43 3.747 3.845 -0.098 1
1 409 . 4 1 1 A 43 43 ILE C C 43 174.219 177.102 -2.883 1
1 410 . 4 1 1 A 43 43 ILE CA C 43 64.505 63.435 1.070 1
1 411 . 4 1 1 A 43 43 ILE CB C 43 36.595 38.434 -1.839 1
1 415 . 4 1 1 A 43 43 ILE N N 43 121.001 120.516 0.485 1
1 416 . 4 1 1 A 44 44 VAL H H 44 6.154 7.631 -1.477 1
1 417 . 4 1 1 A 44 44 VAL HA H 44 3.497 3.919 -0.422 1
1 425 . 4 1 1 A 44 44 VAL C C 44 176.282 176.194 0.088 1
1 426 . 4 1 1 A 44 44 VAL CA C 44 63.606 62.677 0.929 1
1 427 . 4 1 1 A 44 44 VAL CB C 44 30.614 31.929 -1.315 1
1 430 . 4 1 1 A 44 44 VAL N N 44 110.500 119.221 -8.721 1
1 431 . 4 1 1 A 45 45 TRP H H 45 7.419 8.059 -0.640 1
1 432 . 4 1 1 A 45 45 TRP HA H 45 4.716 4.899 -0.183 1
1 438 . 4 1 1 A 45 45 TRP C C 45 175.422 175.547 -0.125 1
1 439 . 4 1 1 A 45 45 TRP CA C 45 56.188 57.145 -0.957 1
1 440 . 4 1 1 A 45 45 TRP CB C 45 31.245 30.891 0.354 1
1 441 . 4 1 1 A 45 45 TRP N N 45 118.601 121.829 -3.228 1
1 442 . 4 1 1 A 46 46 HIS H H 46 7.582 7.685 -0.103 1
1 443 . 4 1 1 A 46 46 HIS HA H 46 4.227 4.838 -0.611 1
1 448 . 4 1 1 A 46 46 HIS C C 46 177.485 174.192 3.293 1
1 449 . 4 1 1 A 46 46 HIS CA C 46 56.799 55.308 1.491 1
1 450 . 4 1 1 A 46 46 HIS CB C 46 32.017 33.144 -1.127 1
1 451 . 4 1 1 A 46 46 HIS N N 46 122.648 118.747 3.901 1
1 452 . 4 1 1 A 47 47 GLU H H 47 7.948 8.470 -0.522 1
1 453 . 4 1 1 A 47 47 GLU HA H 47 4.098 4.620 -0.522 1
1 457 . 4 1 1 A 47 47 GLU C C 47 175.596 175.704 -0.108 1
1 458 . 4 1 1 A 47 47 GLU CA C 47 56.482 55.514 0.968 1
1 459 . 4 1 1 A 47 47 GLU CB C 47 31.839 30.415 1.424 1
1 461 . 4 1 1 A 47 47 GLU N N 47 120.485 119.886 0.599 1
1 462 . 4 1 1 A 48 48 LEU H H 48 9.304 8.701 0.603 1
1 463 . 4 1 1 A 48 48 LEU HA H 48 4.218 4.324 -0.106 1
1 472 . 4 1 1 A 48 48 LEU C C 48 177.743 176.361 1.382 1
1 473 . 4 1 1 A 48 48 LEU CA C 48 55.043 54.786 0.257 1
1 474 . 4 1 1 A 48 48 LEU CB C 48 41.948 41.041 0.907 1
1 477 . 4 1 1 A 48 48 LEU N N 48 128.658 126.058 2.600 1
1 478 . 4 1 1 A 49 49 ILE H H 49 8.028 8.873 -0.845 1
1 479 . 4 1 1 A 49 49 ILE HA H 49 3.279 4.598 -1.319 1
1 488 . 4 1 1 A 49 49 ILE C C 49 174.821 177.224 -2.403 1
1 489 . 4 1 1 A 49 49 ILE CA C 49 63.901 62.207 1.694 1
1 490 . 4 1 1 A 49 49 ILE CB C 49 37.775 40.316 -2.541 1
1 494 . 4 1 1 A 49 49 ILE N N 49 120.341 123.569 -3.228 1
1 495 . 4 1 1 A 50 50 GLY H H 50 9.038 7.990 1.048 1
1 496 . 4 1 1 A 50 50 GLY HA2 H 50 4.717 4.335 0.382 1
1 497 . 4 1 1 A 50 50 GLY HA3 H 50 3.491 4.351 -0.860 1
1 498 . 4 1 1 A 50 50 GLY C C 50 175.084 172.987 2.097 1
1 499 . 4 1 1 A 50 50 GLY CA C 50 44.599 45.613 -1.014 1
1 500 . 4 1 1 A 50 50 GLY N N 50 110.284 109.410 0.874 1
1 501 . 4 1 1 A 51 51 LEU H H 51 8.400 7.343 1.057 1
1 502 . 4 1 1 A 51 51 LEU HA H 51 4.723 3.939 0.784 1
1 512 . 4 1 1 A 51 51 LEU C C 51 177.147 175.603 1.544 1
1 513 . 4 1 1 A 51 51 LEU CA C 51 54.350 54.342 0.008 1
1 514 . 4 1 1 A 51 51 LEU CB C 51 42.985 43.658 -0.673 1
1 518 . 4 1 1 A 51 51 LEU N N 51 120.471 122.253 -1.782 1
1 519 . 4 1 1 A 52 52 LYS H H 52 7.505 8.314 -0.809 1
1 520 . 4 1 1 A 52 52 LYS HA H 52 4.250 4.021 0.229 1
1 527 . 4 1 1 A 52 52 LYS C C 52 174.995 175.188 -0.193 1
1 528 . 4 1 1 A 52 52 LYS CA C 52 55.589 56.459 -0.870 1
1 529 . 4 1 1 A 52 52 LYS CB C 52 33.025 33.088 -0.063 1
1 533 . 4 1 1 A 52 52 LYS N N 52 122.406 126.243 -3.837 1
1 534 . 4 1 1 A 53 53 VAL H H 53 9.075 8.268 0.807 1
1 535 . 4 1 1 A 53 53 VAL HA H 53 5.071 4.825 0.246 1
1 543 . 4 1 1 A 53 53 VAL C C 53 171.170 173.580 -2.410 1
1 544 . 4 1 1 A 53 53 VAL CA C 53 58.523 59.253 -0.730 1
1 545 . 4 1 1 A 53 53 VAL CB C 53 35.698 35.349 0.349 1
1 548 . 4 1 1 A 53 53 VAL N N 53 124.509 123.930 0.579 1
1 549 . 4 1 1 A 54 54 ARG H H 54 8.148 8.509 -0.361 1
1 550 . 4 1 1 A 54 54 ARG HA H 54 5.329 4.986 0.343 1
1 557 . 4 1 1 A 54 54 ARG C C 54 176.113 174.042 2.071 1
1 558 . 4 1 1 A 54 54 ARG CA C 54 53.817 54.134 -0.317 1
1 559 . 4 1 1 A 54 54 ARG CB C 54 34.511 33.679 0.832 1
1 562 . 4 1 1 A 54 54 ARG N N 54 123.625 121.206 2.419 1
1 563 . 4 1 1 A 55 55 VAL H H 55 8.659 8.965 -0.306 1
1 564 . 4 1 1 A 55 55 VAL HA H 55 4.085 3.796 0.289 1
1 572 . 4 1 1 A 55 55 VAL C C 55 176.282 175.259 1.023 1
1 573 . 4 1 1 A 55 55 VAL CA C 55 62.814 62.568 0.246 1
1 574 . 4 1 1 A 55 55 VAL CB C 55 30.628 30.793 -0.165 1
1 577 . 4 1 1 A 55 55 VAL N N 55 125.383 123.212 2.171 1
1 578 . 4 1 1 A 56 56 VAL H H 56 8.057 8.468 -0.411 1
1 579 . 4 1 1 A 56 56 VAL HA H 56 4.123 3.937 0.186 1
1 587 . 4 1 1 A 56 56 VAL C C 56 175.426 176.112 -0.686 1
1 588 . 4 1 1 A 56 56 VAL CA C 56 62.786 64.272 -1.486 1
1 589 . 4 1 1 A 56 56 VAL CB C 56 32.267 32.461 -0.194 1
1 592 . 4 1 1 A 56 56 VAL N N 56 124.936 129.302 -4.366 1
1 593 . 4 1 1 A 57 57 ASN H H 57 7.527 7.807 -0.280 1
1 594 . 4 1 1 A 57 57 ASN HA H 57 4.817 5.289 -0.472 1
1 597 . 4 1 1 A 57 57 ASN C C 57 172.973 173.692 -0.719 1
1 598 . 4 1 1 A 57 57 ASN CA C 57 52.460 52.211 0.249 1
1 599 . 4 1 1 A 57 57 ASN CB C 57 42.070 41.603 0.467 1
1 600 . 4 1 1 A 57 57 ASN N N 57 114.777 116.612 -1.835 1
1 601 . 4 1 1 A 58 58 SER H H 58 8.193 8.900 -0.707 1
1 602 . 4 1 1 A 58 58 SER HA H 58 5.214 4.890 0.324 1
1 605 . 4 1 1 A 58 58 SER C C 58 174.221 172.423 1.798 1
1 606 . 4 1 1 A 58 58 SER CA C 58 56.778 56.353 0.425 1
1 607 . 4 1 1 A 58 58 SER CB C 58 63.906 65.382 -1.476 1
1 608 . 4 1 1 A 58 58 SER N N 58 115.531 118.275 -2.744 1
1 609 . 4 1 1 A 59 59 THR H H 59 8.053 8.159 -0.106 1
1 610 . 4 1 1 A 59 59 THR HA H 59 4.305 4.802 -0.497 1
1 615 . 4 1 1 A 59 59 THR C C 59 174.478 173.418 1.060 1
1 616 . 4 1 1 A 59 59 THR CA C 59 63.305 60.699 2.606 1
1 617 . 4 1 1 A 59 59 THR CB C 59 68.354 68.565 -0.211 1
1 619 . 4 1 1 A 59 59 THR N N 59 116.405 116.689 -0.284 1
1 620 . 4 1 1 A 60 60 HIS H H 60 8.359 7.662 0.697 1
1 621 . 4 1 1 A 60 60 HIS HA H 60 5.167 5.113 0.054 1
1 626 . 4 1 1 A 60 60 HIS CA C 60 52.792 53.228 -0.436 1
1 627 . 4 1 1 A 60 60 HIS CB C 60 32.142 32.752 -0.610 1
1 628 . 4 1 1 A 60 60 HIS N N 60 123.625 124.032 -0.407 1
1 629 . 4 1 1 A 61 61 PRO HA H 61 4.277 4.437 -0.160 1
1 636 . 4 1 1 A 61 61 PRO C C 61 178.217 177.274 0.943 1
1 637 . 4 1 1 A 61 61 PRO CA C 61 64.375 64.090 0.285 1
1 638 . 4 1 1 A 61 61 PRO CB C 61 32.007 31.793 0.214 1
1 641 . 4 1 1 A 62 62 GLY H H 62 8.421 7.970 0.451 1
1 642 . 4 1 1 A 62 62 GLY HA2 H 62 3.889 3.638 0.251 1
1 643 . 4 1 1 A 62 62 GLY HA3 H 62 3.653 3.856 -0.203 1
1 644 . 4 1 1 A 62 62 GLY C C 62 174.994 174.092 0.902 1
1 645 . 4 1 1 A 62 62 GLY CA C 62 45.831 44.880 0.951 1
1 646 . 4 1 1 A 62 62 GLY N N 62 106.132 106.124 0.008 1
1 647 . 4 1 1 A 63 63 TYR H H 63 7.327 7.346 -0.019 1
1 648 . 4 1 1 A 63 63 TYR HA H 63 4.846 4.709 0.137 1
1 652 . 4 1 1 A 63 63 TYR C C 63 175.593 175.562 0.031 1
1 653 . 4 1 1 A 63 63 TYR CA C 63 56.071 58.444 -2.373 1
1 654 . 4 1 1 A 63 63 TYR CB C 63 38.962 40.505 -1.543 1
1 655 . 4 1 1 A 63 63 TYR N N 63 116.628 117.303 -0.675 1
1 656 . 4 1 1 A 64 64 VAL H H 64 7.296 7.273 0.023 1
1 657 . 4 1 1 A 64 64 VAL HA H 64 3.180 4.085 -0.905 1
1 665 . 4 1 1 A 64 64 VAL C C 64 177.312 176.511 0.801 1
1 666 . 4 1 1 A 64 64 VAL CA C 64 65.688 62.667 3.021 1
1 667 . 4 1 1 A 64 64 VAL CB C 64 30.957 32.206 -1.249 1
1 670 . 4 1 1 A 64 64 VAL N N 64 117.940 118.489 -0.549 1
1 671 . 4 1 1 A 65 65 GLY H H 65 8.449 9.564 -1.115 1
1 672 . 4 1 1 A 65 65 GLY HA2 H 65 4.320 3.923 0.397 1
1 673 . 4 1 1 A 65 65 GLY HA3 H 65 3.515 3.947 -0.432 1
1 674 . 4 1 1 A 65 65 GLY C C 65 174.821 173.489 1.332 1
1 675 . 4 1 1 A 65 65 GLY CA C 65 44.599 45.261 -0.662 1
1 676 . 4 1 1 A 65 65 GLY N N 65 115.317 113.755 1.562 1
1 677 . 4 1 1 A 66 66 ILE H H 66 7.095 7.526 -0.431 1
1 678 . 4 1 1 A 66 66 ILE HA H 66 3.193 4.647 -1.454 1
1 687 . 4 1 1 A 66 66 ILE C C 66 174.308 174.360 -0.052 1
1 688 . 4 1 1 A 66 66 ILE CA C 66 63.470 59.583 3.887 1
1 689 . 4 1 1 A 66 66 ILE CB C 66 37.775 40.229 -2.454 1
1 693 . 4 1 1 A 66 66 ILE N N 66 122.099 122.545 -0.446 1
1 694 . 4 1 1 A 67 67 GLU H H 67 7.126 8.822 -1.696 1
1 695 . 4 1 1 A 67 67 GLU HA H 67 5.343 4.940 0.403 1
1 699 . 4 1 1 A 67 67 GLU C C 67 174.652 175.409 -0.757 1
1 700 . 4 1 1 A 67 67 GLU CA C 67 54.109 54.218 -0.109 1
1 701 . 4 1 1 A 67 67 GLU CB C 67 33.619 32.440 1.179 1
1 703 . 4 1 1 A 67 67 GLU N N 67 125.164 125.069 0.095 1
1 704 . 4 1 1 A 68 68 GLY H H 68 8.401 8.439 -0.038 1
1 705 . 4 1 1 A 68 68 GLY HA2 H 68 4.364 3.864 0.500 1
1 706 . 4 1 1 A 68 68 GLY HA3 H 68 4.041 4.121 -0.080 1
1 707 . 4 1 1 A 68 68 GLY C C 68 171.644 171.645 -0.001 1
1 708 . 4 1 1 A 68 68 GLY CA C 68 45.680 44.721 0.959 1
1 709 . 4 1 1 A 68 68 GLY N N 68 109.626 112.490 -2.864 1
1 710 . 4 1 1 A 69 69 TYR H H 69 8.422 9.229 -0.807 1
1 711 . 4 1 1 A 69 69 TYR HA H 69 5.079 4.834 0.245 1
1 714 . 4 1 1 A 69 69 TYR C C 69 176.194 175.619 0.575 1
1 715 . 4 1 1 A 69 69 TYR CA C 69 57.681 57.476 0.205 1
1 716 . 4 1 1 A 69 69 TYR CB C 69 41.043 39.859 1.184 1
1 717 . 4 1 1 A 69 69 TYR N N 69 119.689 121.520 -1.831 1
1 718 . 4 1 1 A 70 70 VAL H H 70 8.753 8.404 0.349 1
1 719 . 4 1 1 A 70 70 VAL HA H 70 4.143 4.379 -0.236 1
1 727 . 4 1 1 A 70 70 VAL C C 70 176.540 175.651 0.889 1
1 728 . 4 1 1 A 70 70 VAL CA C 70 63.477 63.276 0.201 1
1 729 . 4 1 1 A 70 70 VAL CB C 70 30.952 32.267 -1.315 1
1 732 . 4 1 1 A 70 70 VAL N N 70 123.420 126.109 -2.689 1
1 733 . 4 1 1 A 71 71 ILE H H 71 9.101 9.482 -0.381 1
1 734 . 4 1 1 A 71 71 ILE HA H 71 4.834 4.733 0.101 1
1 743 . 4 1 1 A 71 71 ILE C C 71 175.418 175.853 -0.435 1
1 744 . 4 1 1 A 71 71 ILE CA C 71 60.637 62.239 -1.602 1
1 745 . 4 1 1 A 71 71 ILE CB C 71 39.853 40.285 -0.432 1
1 749 . 4 1 1 A 71 71 ILE N N 71 119.913 124.319 -4.406 1
1 750 . 4 1 1 A 72 72 ASP H H 72 8.030 8.081 -0.051 1
1 751 . 4 1 1 A 72 72 ASP HA H 72 4.964 5.287 -0.323 1
1 754 . 4 1 1 A 72 72 ASP C C 72 173.017 174.749 -1.732 1
1 755 . 4 1 1 A 72 72 ASP CA C 72 53.511 53.098 0.413 1
1 756 . 4 1 1 A 72 72 ASP CB C 72 41.932 44.298 -2.366 1
1 757 . 4 1 1 A 72 72 ASP N N 72 118.377 120.103 -1.726 1
1 758 . 4 1 1 A 73 73 GLU H H 73 9.349 8.762 0.587 1
1 759 . 4 1 1 A 73 73 GLU HA H 73 4.868 5.020 -0.152 1
1 762 . 4 1 1 A 73 73 GLU C C 73 173.793 174.536 -0.743 1
1 763 . 4 1 1 A 73 73 GLU CA C 73 55.521 56.484 -0.963 1
1 764 . 4 1 1 A 73 73 GLU CB C 73 33.138 32.232 0.906 1
1 766 . 4 1 1 A 73 73 GLU N N 73 123.848 122.581 1.267 1
1 767 . 4 1 1 A 74 74 THR H H 74 8.748 8.624 0.124 1
1 768 . 4 1 1 A 74 74 THR HA H 74 4.992 4.822 0.170 1
1 773 . 4 1 1 A 74 74 THR CA C 74 59.450 60.180 -0.730 1
1 774 . 4 1 1 A 74 74 THR CB C 74 70.429 72.292 -1.863 1
1 776 . 4 1 1 A 74 74 THR N N 74 116.628 118.408 -1.780 1
1 777 . 4 1 1 A 75 75 ARG HA H 75 3.741 4.501 -0.760 1
1 782 . 4 1 1 A 75 75 ARG C C 75 177.140 177.170 -0.030 1
1 783 . 4 1 1 A 75 75 ARG CA C 75 60.041 59.000 1.041 1
1 784 . 4 1 1 A 75 75 ARG CB C 75 29.930 29.921 0.009 1
1 787 . 4 1 1 A 76 76 ASN H H 76 8.497 7.848 0.649 1
1 788 . 4 1 1 A 76 76 ASN HA H 76 5.310 4.991 0.319 1
1 791 . 4 1 1 A 76 76 ASN C C 76 175.509 173.806 1.703 1
1 792 . 4 1 1 A 76 76 ASN CA C 76 52.320 52.024 0.296 1
1 793 . 4 1 1 A 76 76 ASN CB C 76 40.744 39.671 1.073 1
1 794 . 4 1 1 A 76 76 ASN N N 76 111.053 116.520 -5.467 1
1 795 . 4 1 1 A 77 77 MET H H 77 7.528 7.411 0.117 1
1 796 . 4 1 1 A 77 77 MET HA H 77 5.392 5.104 0.288 1
1 801 . 4 1 1 A 77 77 MET C C 77 174.824 174.166 0.658 1
1 802 . 4 1 1 A 77 77 MET CA C 77 54.994 54.425 0.569 1
1 803 . 4 1 1 A 77 77 MET CB C 77 36.753 35.184 1.569 1
1 805 . 4 1 1 A 77 77 MET N N 77 119.913 117.853 2.060 1
1 806 . 4 1 1 A 78 78 LEU H H 78 8.977 8.483 0.494 1
1 807 . 4 1 1 A 78 78 LEU HA H 78 4.803 5.218 -0.415 1
1 817 . 4 1 1 A 78 78 LEU C C 78 174.563 174.581 -0.018 1
1 818 . 4 1 1 A 78 78 LEU CA C 78 53.964 54.504 -0.540 1
1 819 . 4 1 1 A 78 78 LEU CB C 78 44.903 45.088 -0.185 1
1 823 . 4 1 1 A 78 78 LEU N N 78 121.224 121.330 -0.106 1
1 824 . 4 1 1 A 79 79 VAL H H 79 8.115 9.131 -1.016 1
1 825 . 4 1 1 A 79 79 VAL HA H 79 4.783 4.702 0.081 1
1 833 . 4 1 1 A 79 79 VAL C C 79 175.297 175.209 0.088 1
1 834 . 4 1 1 A 79 79 VAL CA C 79 61.821 60.780 1.041 1
1 835 . 4 1 1 A 79 79 VAL CB C 79 31.146 33.562 -2.416 1
1 838 . 4 1 1 A 79 79 VAL N N 79 124.062 127.425 -3.363 1
1 839 . 4 1 1 A 80 80 ILE H H 80 9.342 8.813 0.529 1
1 840 . 4 1 1 A 80 80 ILE HA H 80 4.764 5.351 -0.587 1
1 849 . 4 1 1 A 80 80 ILE C C 80 174.127 174.552 -0.425 1
1 850 . 4 1 1 A 80 80 ILE CA C 80 59.897 59.564 0.333 1
1 851 . 4 1 1 A 80 80 ILE CB C 80 42.225 41.639 0.586 1
1 855 . 4 1 1 A 80 80 ILE N N 80 129.970 125.425 4.545 1
1 856 . 4 1 1 A 81 81 ALA H H 81 9.478 10.266 -0.788 1
1 857 . 4 1 1 A 81 81 ALA HA H 81 5.139 5.516 -0.377 1
1 861 . 4 1 1 A 81 81 ALA C C 81 176.970 176.543 0.427 1
1 862 . 4 1 1 A 81 81 ALA CA C 81 50.835 50.452 0.383 1
1 863 . 4 1 1 A 81 81 ALA CB C 81 21.451 21.911 -0.460 1
1 864 . 4 1 1 A 81 81 ALA N N 81 129.756 127.994 1.762 1
1 865 . 4 1 1 A 82 82 GLY H H 82 8.691 8.994 -0.303 1
1 866 . 4 1 1 A 82 82 GLY HA2 H 82 5.110 4.149 0.961 1
1 867 . 4 1 1 A 82 82 GLY HA3 H 82 4.241 4.323 -0.082 1
1 868 . 4 1 1 A 82 82 GLY C C 82 173.017 174.632 -1.615 1
1 869 . 4 1 1 A 82 82 GLY CA C 82 44.166 44.615 -0.449 1
1 870 . 4 1 1 A 82 82 GLY N N 82 113.568 109.246 4.322 1
1 871 . 4 1 1 A 83 83 GLU H H 83 8.659 8.972 -0.313 1
1 872 . 4 1 1 A 83 83 GLU HA H 83 4.286 4.273 0.013 1
1 876 . 4 1 1 A 83 83 GLU C C 83 177.570 176.703 0.867 1
1 877 . 4 1 1 A 83 83 GLU CA C 83 59.017 58.425 0.592 1
1 878 . 4 1 1 A 83 83 GLU CB C 83 29.762 29.057 0.705 1
1 880 . 4 1 1 A 83 83 GLU N N 83 120.019 122.150 -2.131 1
1 881 . 4 1 1 A 84 84 ASN H H 84 8.549 8.819 -0.270 1
1 882 . 4 1 1 A 84 84 ASN HA H 84 4.821 4.906 -0.085 1
1 884 . 4 1 1 A 84 84 ASN C C 84 173.878 174.337 -0.459 1
1 885 . 4 1 1 A 84 84 ASN CA C 84 52.919 52.389 0.530 1
1 886 . 4 1 1 A 84 84 ASN CB C 84 40.150 37.992 2.158 1
1 887 . 4 1 1 A 84 84 ASN N N 84 112.778 124.180 -11.402 1
1 888 . 4 1 1 A 85 85 LYS H H 85 7.116 7.520 -0.404 1
1 889 . 4 1 1 A 85 85 LYS HA H 85 4.344 4.978 -0.634 1
1 895 . 4 1 1 A 85 85 LYS C C 85 173.278 174.606 -1.328 1
1 896 . 4 1 1 A 85 85 LYS CA C 85 55.292 55.509 -0.217 1
1 897 . 4 1 1 A 85 85 LYS CB C 85 36.124 36.208 -0.084 1
1 901 . 4 1 1 A 85 85 LYS N N 85 118.377 120.388 -2.011 1
1 902 . 4 1 1 A 86 86 VAL H H 86 7.781 8.624 -0.843 1
1 903 . 4 1 1 A 86 86 VAL HA H 86 4.749 5.313 -0.564 1
1 911 . 4 1 1 A 86 86 VAL C C 86 174.739 174.149 0.590 1
1 912 . 4 1 1 A 86 86 VAL CA C 86 60.716 59.469 1.247 1
1 913 . 4 1 1 A 86 86 VAL CB C 86 33.619 35.144 -1.525 1
1 916 . 4 1 1 A 86 86 VAL N N 86 120.127 117.773 2.354 1
1 917 . 4 1 1 A 87 87 TRP H H 87 9.558 10.270 -0.712 1
1 918 . 4 1 1 A 87 87 TRP HA H 87 4.958 5.061 -0.103 1
1 923 . 4 1 1 A 87 87 TRP C C 87 174.909 174.602 0.307 1
1 924 . 4 1 1 A 87 87 TRP CA C 87 57.073 54.914 2.159 1
1 925 . 4 1 1 A 87 87 TRP CB C 87 33.028 31.492 1.536 1
1 926 . 4 1 1 A 87 87 TRP N N 87 127.346 122.545 4.801 1
1 927 . 4 1 1 A 88 88 LYS H H 88 8.590 7.189 1.401 1
1 928 . 4 1 1 A 88 88 LYS HA H 88 4.856 4.718 0.138 1
1 935 . 4 1 1 A 88 88 LYS C C 88 175.382 174.850 0.532 1
1 936 . 4 1 1 A 88 88 LYS CA C 88 55.887 54.619 1.268 1
1 937 . 4 1 1 A 88 88 LYS CB C 88 32.434 34.013 -1.579 1
1 941 . 4 1 1 A 88 88 LYS N N 88 123.625 124.024 -0.399 1
1 942 . 4 1 1 A 89 89 VAL H H 89 8.829 8.072 0.757 1
1 943 . 4 1 1 A 89 89 VAL HA H 89 4.406 4.412 -0.006 1
1 951 . 4 1 1 A 89 89 VAL CA C 89 58.371 59.060 -0.689 1
1 952 . 4 1 1 A 89 89 VAL CB C 89 34.512 34.212 0.300 1
1 955 . 4 1 1 A 89 89 VAL N N 89 124.285 126.092 -1.807 1
1 956 . 4 1 1 A 90 90 PRO HA H 90 5.073 4.537 0.536 1
1 961 . 4 1 1 A 90 90 PRO C C 90 177.231 177.760 -0.529 1
1 962 . 4 1 1 A 90 90 PRO CA C 90 61.795 63.295 -1.500 1
1 963 . 4 1 1 A 90 90 PRO CB C 90 31.660 32.658 -0.998 1
1 964 . 4 1 1 A 91 91 LYS H H 91 8.116 8.553 -0.437 1
1 965 . 4 1 1 A 91 91 LYS HA H 91 4.024 4.124 -0.100 1
1 969 . 4 1 1 A 91 91 LYS C C 91 178.518 176.996 1.522 1
1 970 . 4 1 1 A 91 91 LYS CA C 91 59.621 58.867 0.754 1
1 971 . 4 1 1 A 91 91 LYS CB C 91 34.217 31.800 2.417 1
1 973 . 4 1 1 A 91 91 LYS N N 91 121.224 122.288 -1.064 1
1 974 . 4 1 1 A 92 92 ASP H H 92 8.505 8.531 -0.026 1
1 975 . 4 1 1 A 92 92 ASP HA H 92 3.781 4.557 -0.776 1
1 978 . 4 1 1 A 92 92 ASP C C 92 176.975 176.752 0.223 1
1 979 . 4 1 1 A 92 92 ASP CA C 92 56.773 55.024 1.749 1
1 980 . 4 1 1 A 92 92 ASP CB C 92 39.590 39.757 -0.167 1
1 981 . 4 1 1 A 92 92 ASP N N 92 111.815 119.271 -7.456 1
1 982 . 4 1 1 A 93 93 VAL H H 93 6.691 8.119 -1.428 1
1 983 . 4 1 1 A 93 93 VAL HA H 93 4.678 4.667 0.011 1
1 991 . 4 1 1 A 93 93 VAL C C 93 176.537 175.252 1.285 1
1 992 . 4 1 1 A 93 93 VAL CA C 93 60.120 60.631 -0.511 1
1 993 . 4 1 1 A 93 93 VAL CB C 93 31.093 32.876 -1.783 1
1 996 . 4 1 1 A 93 93 VAL N N 93 107.879 112.163 -4.284 1
1 997 . 4 1 1 A 94 94 CYS H H 94 7.249 7.979 -0.730 1
1 998 . 4 1 1 A 94 94 CYS HA H 94 5.062 4.823 0.239 1
1 1001 . 4 1 1 A 94 94 CYS C C 94 173.103 172.980 0.123 1
1 1002 . 4 1 1 A 94 94 CYS CA C 94 58.001 57.693 0.308 1
1 1003 . 4 1 1 A 94 94 CYS CB C 94 31.418 30.803 0.615 1
1 1004 . 4 1 1 A 94 94 CYS N N 94 117.940 118.921 -0.981 1
1 1005 . 4 1 1 A 95 95 ILE H H 95 8.153 8.372 -0.219 1
1 1006 . 4 1 1 A 95 95 ILE HA H 95 4.159 4.627 -0.468 1
1 1016 . 4 1 1 A 95 95 ILE C C 95 174.736 175.380 -0.644 1
1 1017 . 4 1 1 A 95 95 ILE CA C 95 61.234 60.428 0.806 1
1 1018 . 4 1 1 A 95 95 ILE CB C 95 38.071 38.057 0.014 1
1 1022 . 4 1 1 A 95 95 ILE N N 95 121.876 125.729 -3.853 1
1 1023 . 4 1 1 A 96 96 PHE H H 96 8.400 8.786 -0.386 1
1 1024 . 4 1 1 A 96 96 PHE HA H 96 5.004 4.702 0.302 1
1 1029 . 4 1 1 A 96 96 PHE C C 96 174.005 174.479 -0.474 1
1 1030 . 4 1 1 A 96 96 PHE CA C 96 56.922 57.148 -0.226 1
1 1031 . 4 1 1 A 96 96 PHE CB C 96 44.006 40.662 3.344 1
1 1032 . 4 1 1 A 96 96 PHE N N 96 125.820 127.182 -1.362 1
1 1033 . 4 1 1 A 97 97 GLU H H 97 8.985 8.455 0.530 1
1 1034 . 4 1 1 A 97 97 GLU HA H 97 5.275 5.196 0.079 1
1 1038 . 4 1 1 A 97 97 GLU C C 97 175.596 174.792 0.804 1
1 1039 . 4 1 1 A 97 97 GLU CA C 97 55.070 54.578 0.492 1
1 1040 . 4 1 1 A 97 97 GLU CB C 97 33.628 30.915 2.713 1
1 1042 . 4 1 1 A 97 97 GLU N N 97 121.010 123.969 -2.959 1
1 1043 . 4 1 1 A 98 98 PHE H H 98 9.304 9.100 0.204 1
1 1044 . 4 1 1 A 98 98 PHE HA H 98 5.337 5.042 0.295 1
1 1048 . 4 1 1 A 98 98 PHE C C 98 174.650 175.737 -1.087 1
1 1049 . 4 1 1 A 98 98 PHE CA C 98 57.363 57.753 -0.390 1
1 1050 . 4 1 1 A 98 98 PHE CB C 98 41.936 40.562 1.374 1
1 1051 . 4 1 1 A 98 98 PHE N N 98 128.658 126.265 2.393 1
1 1052 . 4 1 1 A 99 99 GLU H H 99 8.721 8.821 -0.100 1
1 1053 . 4 1 1 A 99 99 GLU HA H 99 5.457 4.759 0.698 1
1 1058 . 4 1 1 A 99 99 GLU C C 99 176.368 176.551 -0.183 1
1 1059 . 4 1 1 A 99 99 GLU CA C 99 54.401 55.539 -1.138 1
1 1060 . 4 1 1 A 99 99 GLU CB C 99 33.068 31.470 1.598 1
1 1062 . 4 1 1 A 99 99 GLU N N 99 122.759 123.677 -0.918 1
1 1063 . 4 1 1 A 100 100 THR H H 100 8.588 10.143 -1.555 1
1 1064 . 4 1 1 A 100 100 THR HA H 100 4.603 4.496 0.107 1
1 1069 . 4 1 1 A 100 100 THR C C 100 177.144 176.741 0.403 1
1 1070 . 4 1 1 A 100 100 THR CA C 100 60.774 62.630 -1.856 1
1 1071 . 4 1 1 A 100 100 THR CB C 100 70.136 69.958 0.178 1
1 1073 . 4 1 1 A 100 100 THR N N 100 116.191 121.254 -5.063 1
1 1074 . 4 1 1 A 101 101 TRP H H 101 9.287 9.118 0.169 1
1 1075 . 4 1 1 A 101 101 TRP HA H 101 4.591 4.566 0.025 1
1 1080 . 4 1 1 A 101 101 TRP C C 101 176.457 176.623 -0.166 1
1 1081 . 4 1 1 A 101 101 TRP CA C 101 60.045 58.916 1.129 1
1 1082 . 4 1 1 A 101 101 TRP CB C 101 28.578 28.437 0.141 1
1 1083 . 4 1 1 A 101 101 TRP N N 101 122.220 124.131 -1.911 1
1 1084 . 4 1 1 A 102 102 ASP H H 102 7.553 8.146 -0.593 1
1 1085 . 4 1 1 A 102 102 ASP HA H 102 4.129 4.427 -0.298 1
1 1088 . 4 1 1 A 102 102 ASP C C 102 176.714 176.153 0.561 1
1 1089 . 4 1 1 A 102 102 ASP CA C 102 52.775 53.147 -0.372 1
1 1090 . 4 1 1 A 102 102 ASP CB C 102 39.231 40.465 -1.234 1
1 1091 . 4 1 1 A 102 102 ASP N N 102 115.763 120.234 -4.471 1
1 1092 . 4 1 1 A 103 103 GLY H H 103 7.910 8.517 -0.607 1
1 1093 . 4 1 1 A 103 103 GLY HA2 H 103 4.216 3.950 0.266 1
1 1094 . 4 1 1 A 103 103 GLY HA3 H 103 3.686 3.990 -0.304 1
1 1095 . 4 1 1 A 103 103 GLY C C 103 174.566 174.135 0.431 1
1 1096 . 4 1 1 A 103 103 GLY CA C 103 45.179 46.250 -1.071 1
1 1097 . 4 1 1 A 103 103 GLY N N 103 108.311 108.562 -0.251 1
1 1098 . 4 1 1 A 104 104 THR H H 104 7.691 7.612 0.079 1
1 1099 . 4 1 1 A 104 104 THR HA H 104 4.031 4.799 -0.768 1
1 1104 . 4 1 1 A 104 104 THR C C 104 173.405 173.980 -0.575 1
1 1105 . 4 1 1 A 104 104 THR CA C 104 64.307 59.930 4.377 1
1 1106 . 4 1 1 A 104 104 THR CB C 104 68.354 71.611 -3.257 1
1 1108 . 4 1 1 A 104 104 THR N N 104 119.913 113.606 6.307 1
1 1109 . 4 1 1 A 105 105 LYS H H 105 8.297 8.764 -0.467 1
1 1110 . 4 1 1 A 105 105 LYS HA H 105 5.457 4.805 0.652 1
1 1116 . 4 1 1 A 105 105 LYS C C 105 177.055 175.581 1.474 1
1 1117 . 4 1 1 A 105 105 LYS CA C 105 54.401 55.889 -1.488 1
1 1118 . 4 1 1 A 105 105 LYS CB C 105 34.230 33.967 0.263 1
1 1122 . 4 1 1 A 105 105 LYS N N 105 125.597 122.101 3.496 1
1 1123 . 4 1 1 A 106 106 ILE H H 106 9.238 9.174 0.064 1
1 1124 . 4 1 1 A 106 106 ILE HA H 106 4.289 4.817 -0.528 1
1 1133 . 4 1 1 A 106 106 ILE C C 106 174.221 174.487 -0.266 1
1 1134 . 4 1 1 A 106 106 ILE CA C 106 60.631 59.946 0.685 1
1 1135 . 4 1 1 A 106 106 ILE CB C 106 41.927 39.750 2.177 1
1 1139 . 4 1 1 A 106 106 ILE N N 106 124.499 124.760 -0.261 1
1 1140 . 4 1 1 A 107 107 LYS H H 107 8.650 9.043 -0.393 1
1 1141 . 4 1 1 A 107 107 LYS HA H 107 5.608 4.990 0.618 1
1 1147 . 4 1 1 A 107 107 LYS C C 107 175.681 175.062 0.619 1
1 1148 . 4 1 1 A 107 107 LYS CA C 107 55.248 54.932 0.316 1
1 1149 . 4 1 1 A 107 107 LYS CB C 107 33.618 33.920 -0.302 1
1 1153 . 4 1 1 A 107 107 LYS N N 107 130.844 128.108 2.736 1
1 1154 . 4 1 1 A 108 108 ILE H H 108 9.448 8.542 0.906 1
1 1155 . 4 1 1 A 108 108 ILE HA H 108 4.741 4.891 -0.150 1
1 1164 . 4 1 1 A 108 108 ILE C C 108 172.670 174.046 -1.376 1
1 1165 . 4 1 1 A 108 108 ILE CA C 108 59.157 59.380 -0.223 1
1 1166 . 4 1 1 A 108 108 ILE CB C 108 42.241 42.161 0.080 1
1 1170 . 4 1 1 A 108 108 ILE N N 108 125.160 127.944 -2.784 1
1 1171 . 4 1 1 A 109 109 SER H H 109 8.490 8.956 -0.466 1
1 1172 . 4 1 1 A 109 109 SER HA H 109 4.437 4.595 -0.158 1
1 1175 . 4 1 1 A 109 109 SER C C 109 176.536 175.882 0.654 1
1 1176 . 4 1 1 A 109 109 SER CA C 109 58.850 59.420 -0.570 1
1 1177 . 4 1 1 A 109 109 SER CB C 109 63.010 63.596 -0.586 1
1 1178 . 4 1 1 A 109 109 SER N N 109 122.750 124.282 -1.532 1
1 1179 . 4 1 1 A 110 110 GLY H H 110 9.292 8.995 0.297 1
1 1180 . 4 1 1 A 110 110 GLY HA2 H 110 5.193 4.005 1.188 1
1 1181 . 4 1 1 A 110 110 GLY HA3 H 110 3.755 4.145 -0.390 1
1 1182 . 4 1 1 A 110 110 GLY C C 110 176.964 174.919 2.045 1
1 1183 . 4 1 1 A 110 110 GLY CA C 110 48.168 46.805 1.363 1
1 1184 . 4 1 1 A 110 110 GLY N N 110 116.628 113.584 3.044 1
1 1185 . 4 1 1 A 111 111 GLU H H 111 8.576 8.618 -0.042 1
1 1186 . 4 1 1 A 111 111 GLU HA H 111 4.080 4.186 -0.106 1
1 1191 . 4 1 1 A 111 111 GLU C C 111 178.867 178.369 0.498 1
1 1192 . 4 1 1 A 111 111 GLU CA C 111 59.150 58.691 0.459 1
1 1193 . 4 1 1 A 111 111 GLU CB C 111 28.831 29.599 -0.768 1
1 1195 . 4 1 1 A 111 111 GLU N N 111 120.564 118.246 2.318 1
1 1196 . 4 1 1 A 112 112 LYS H H 112 7.605 7.972 -0.367 1
1 1197 . 4 1 1 A 112 112 LYS HA H 112 4.229 4.061 0.168 1
1 1202 . 4 1 1 A 112 112 LYS C C 112 176.710 177.925 -1.215 1
1 1203 . 4 1 1 A 112 112 LYS CA C 112 57.083 59.419 -2.336 1
1 1204 . 4 1 1 A 112 112 LYS CB C 112 32.183 32.299 -0.116 1
1 1208 . 4 1 1 A 112 112 LYS N N 112 116.628 118.859 -2.231 1
1 1209 . 4 1 1 A 113 113 LEU H H 113 7.784 7.763 0.021 1
1 1210 . 4 1 1 A 113 113 LEU HA H 113 4.387 4.323 0.064 1
1 1220 . 4 1 1 A 113 113 LEU C C 113 176.195 176.520 -0.325 1
1 1221 . 4 1 1 A 113 113 LEU CA C 113 52.617 54.086 -1.469 1
1 1222 . 4 1 1 A 113 113 LEU CB C 113 42.820 41.115 1.705 1
1 1226 . 4 1 1 A 113 113 LEU N N 113 114.219 114.475 -0.256 1
1 1227 . 4 1 1 A 114 114 VAL H H 114 7.032 7.421 -0.389 1
1 1228 . 4 1 1 A 114 114 VAL HA H 114 3.723 3.782 -0.059 1
1 1236 . 4 1 1 A 114 114 VAL C C 114 175.430 177.233 -1.803 1
1 1237 . 4 1 1 A 114 114 VAL CA C 114 65.537 63.823 1.714 1
1 1238 . 4 1 1 A 114 114 VAL CB C 114 32.115 31.256 0.859 1
1 1241 . 4 1 1 A 114 114 VAL N N 114 121.773 121.034 0.739 1
1 1242 . 4 1 1 A 115 115 GLY H H 115 8.678 8.807 -0.129 1
1 1243 . 4 1 1 A 115 115 GLY HA2 H 115 4.313 3.922 0.391 1
1 1244 . 4 1 1 A 115 115 GLY HA3 H 115 3.846 3.927 -0.081 1
1 1245 . 4 1 1 A 115 115 GLY C C 115 172.462 173.485 -1.023 1
1 1246 . 4 1 1 A 115 115 GLY CA C 115 43.743 45.548 -1.805 1
1 1247 . 4 1 1 A 115 115 GLY N N 115 117.503 116.799 0.704 1
1 1248 . 4 1 1 A 116 116 ARG H H 116 8.701 8.524 0.177 1
1 1249 . 4 1 1 A 116 116 ARG HA H 116 3.926 4.580 -0.654 1
1 1254 . 4 1 1 A 116 116 ARG CA C 116 56.470 52.955 3.515 1
1 1255 . 4 1 1 A 116 116 ARG CB C 116 29.585 29.863 -0.278 1
1 1257 . 4 1 1 A 116 116 ARG N N 116 123.504 121.015 2.489 1
1 1258 . 4 1 1 A 117 117 PRO HA H 117 4.242 4.195 0.047 1
1 1264 . 4 1 1 A 117 117 PRO C C 117 178.947 178.226 0.721 1
1 1265 . 4 1 1 A 117 117 PRO CA C 117 65.684 64.600 1.084 1
1 1266 . 4 1 1 A 117 117 PRO CB C 117 30.949 32.091 -1.142 1
1 1269 . 4 1 1 A 118 118 GLU H H 118 10.821 8.759 2.062 1
1 1270 . 4 1 1 A 118 118 GLU HA H 118 4.197 4.028 0.169 1
1 1271 . 4 1 1 A 118 118 GLU C C 118 176.627 179.333 -2.706 1
1 1272 . 4 1 1 A 118 118 GLU CA C 118 58.045 59.475 -1.430 1
1 1273 . 4 1 1 A 118 118 GLU CB C 118 27.101 29.305 -2.204 1
1 1274 . 4 1 1 A 118 118 GLU N N 118 119.242 116.928 2.314 1
1 1275 . 4 1 1 A 119 119 MET H H 119 7.226 8.101 -0.875 1
1 1276 . 4 1 1 A 119 119 MET HA H 119 4.591 4.016 0.575 1
1 1279 . 4 1 1 A 119 119 MET C C 119 180.024 178.317 1.707 1
1 1280 . 4 1 1 A 119 119 MET CA C 119 54.695 58.550 -3.855 1
1 1281 . 4 1 1 A 119 119 MET CB C 119 31.012 32.233 -1.221 1
1 1283 . 4 1 1 A 119 119 MET N N 119 119.475 119.778 -0.303 1
1 1284 . 4 1 1 A 120 120 ARG H H 120 7.877 7.537 0.340 1
1 1285 . 4 1 1 A 120 120 ARG HA H 120 3.988 3.937 0.051 1
1 1292 . 4 1 1 A 120 120 ARG C C 120 177.705 178.606 -0.901 1
1 1293 . 4 1 1 A 120 120 ARG CA C 120 60.773 58.303 2.470 1
1 1294 . 4 1 1 A 120 120 ARG CB C 120 31.159 30.029 1.130 1
1 1295 . 4 1 1 A 120 120 ARG N N 120 122.099 119.639 2.460 1
1 1296 . 4 1 1 A 121 121 LEU H H 121 6.732 7.895 -1.163 1
1 1297 . 4 1 1 A 121 121 LEU HA H 121 4.170 4.001 0.169 1
1 1307 . 4 1 1 A 121 121 LEU C C 121 176.220 178.656 -2.436 1
1 1308 . 4 1 1 A 121 121 LEU CA C 121 57.370 57.917 -0.547 1
1 1309 . 4 1 1 A 121 121 LEU CB C 121 42.945 41.675 1.270 1
1 1312 . 4 1 1 A 121 121 LEU N N 121 114.436 119.863 -5.427 1
1 1313 . 4 1 1 A 122 122 LYS H H 122 7.555 9.036 -1.481 1
1 1314 . 4 1 1 A 122 122 LYS HA H 122 4.338 4.302 0.036 1
1 1321 . 4 1 1 A 122 122 LYS C C 122 176.969 176.456 0.513 1
1 1322 . 4 1 1 A 122 122 LYS CA C 122 55.621 56.432 -0.811 1
1 1323 . 4 1 1 A 122 122 LYS CB C 122 32.414 32.846 -0.432 1
1 1327 . 4 1 1 A 122 122 LYS N N 122 115.754 116.956 -1.202 1
1 1328 . 4 1 1 A 123 123 LYS H H 123 7.688 8.229 -0.541 1
1 1329 . 4 1 1 A 123 123 LYS HA H 123 4.535 4.054 0.481 1
1 1330 . 4 1 1 A 123 123 LYS CA C 123 58.461 57.364 1.097 1
1 1331 . 4 1 1 A 123 123 LYS CB C 123 33.138 32.773 0.365 1
1 1332 . 4 1 1 A 123 123 LYS N N 123 120.843 121.255 -0.412 1
1 1333 . 4 1 1 A 126 126 ARG HA H 126 4.347 4.266 0.081 1
1 1338 . 4 1 1 A 126 126 ARG C C 126 174.573 177.101 -2.528 1
1 1339 . 4 1 1 A 126 126 ARG CA C 126 55.998 56.307 -0.309 1
1 1340 . 4 1 1 A 126 126 ARG CB C 126 31.569 30.660 0.909 1
1 128 . 5 1 1 A 18 18 GLY H H 18 8.343 7.664 0.679 1
1 129 . 5 1 1 A 18 18 GLY HA2 H 18 3.894 3.726 0.168 1
1 130 . 5 1 1 A 18 18 GLY C C 18 177.743 174.543 3.200 1
1 131 . 5 1 1 A 18 18 GLY CA C 18 45.497 44.287 1.210 1
1 132 . 5 1 1 A 18 18 GLY N N 18 109.925 109.481 0.444 1
1 133 . 5 1 1 A 19 19 SER H H 19 8.005 8.295 -0.290 1
1 134 . 5 1 1 A 19 19 SER HA H 19 4.329 4.483 -0.154 1
1 136 . 5 1 1 A 19 19 SER C C 19 175.168 175.226 -0.058 1
1 137 . 5 1 1 A 19 19 SER CA C 19 58.852 58.674 0.178 1
1 138 . 5 1 1 A 19 19 SER CB C 19 63.604 63.377 0.227 1
1 139 . 5 1 1 A 19 19 SER N N 19 115.090 116.023 -0.933 1
1 140 . 5 1 1 A 20 20 TYR H H 20 8.040 6.963 1.077 1
1 141 . 5 1 1 A 20 20 TYR HA H 20 4.439 4.273 0.166 1
1 146 . 5 1 1 A 20 20 TYR C C 20 176.111 178.455 -2.344 1
1 147 . 5 1 1 A 20 20 TYR CA C 20 57.966 61.751 -3.785 1
1 148 . 5 1 1 A 20 20 TYR CB C 20 37.472 38.569 -1.097 1
1 149 . 5 1 1 A 20 20 TYR N N 20 118.675 119.975 -1.300 1
1 150 . 5 1 1 A 21 21 GLN H H 21 7.909 8.610 -0.701 1
1 151 . 5 1 1 A 21 21 GLN HA H 21 3.903 4.195 -0.292 1
1 155 . 5 1 1 A 21 21 GLN C C 21 178.003 177.452 0.551 1
1 156 . 5 1 1 A 21 21 GLN CA C 21 58.523 58.382 0.141 1
1 157 . 5 1 1 A 21 21 GLN CB C 21 28.438 27.883 0.555 1
1 159 . 5 1 1 A 21 21 GLN N N 21 117.056 117.836 -0.780 1
1 160 . 5 1 1 A 22 22 GLU H H 22 8.965 8.484 0.481 1
1 161 . 5 1 1 A 22 22 GLU HA H 22 4.267 4.433 -0.166 1
1 165 . 5 1 1 A 22 22 GLU C C 22 176.451 178.067 -1.616 1
1 166 . 5 1 1 A 22 22 GLU CA C 22 58.273 58.204 0.069 1
1 167 . 5 1 1 A 22 22 GLU CB C 22 29.412 30.406 -0.994 1
1 169 . 5 1 1 A 22 22 GLU N N 22 117.289 119.246 -1.957 1
1 170 . 5 1 1 A 23 23 ILE H H 23 7.596 7.900 -0.304 1
1 171 . 5 1 1 A 23 23 ILE HA H 23 4.161 4.424 -0.263 1
1 180 . 5 1 1 A 23 23 ILE C C 23 176.195 175.927 0.268 1
1 181 . 5 1 1 A 23 23 ILE CA C 23 58.120 60.750 -2.630 1
1 182 . 5 1 1 A 23 23 ILE CB C 23 38.461 37.465 0.996 1
1 186 . 5 1 1 A 23 23 ILE N N 23 114.005 117.164 -3.159 1
1 187 . 5 1 1 A 24 24 ILE H H 24 7.178 7.734 -0.556 1
1 188 . 5 1 1 A 24 24 ILE HA H 24 3.740 4.008 -0.268 1
1 197 . 5 1 1 A 24 24 ILE C C 24 177.831 176.762 1.069 1
1 198 . 5 1 1 A 24 24 ILE CA C 24 63.318 62.231 1.087 1
1 199 . 5 1 1 A 24 24 ILE CB C 24 36.590 38.245 -1.655 1
1 203 . 5 1 1 A 24 24 ILE N N 24 122.099 125.418 -3.319 1
1 204 . 5 1 1 A 25 25 GLY H H 25 8.618 8.876 -0.258 1
1 205 . 5 1 1 A 25 25 GLY HA2 H 25 4.390 3.973 0.417 1
1 206 . 5 1 1 A 25 25 GLY HA3 H 25 4.168 3.999 0.169 1
1 207 . 5 1 1 A 25 25 GLY C C 25 175.210 176.297 -1.087 1
1 208 . 5 1 1 A 25 25 GLY CA C 25 45.798 45.175 0.623 1
1 209 . 5 1 1 A 25 25 GLY N N 25 115.531 117.842 -2.311 1
1 210 . 5 1 1 A 26 26 ARG H H 26 8.277 8.241 0.036 1
1 211 . 5 1 1 A 26 26 ARG HA H 26 4.477 4.515 -0.038 1
1 218 . 5 1 1 A 26 26 ARG C C 26 175.944 177.783 -1.839 1
1 219 . 5 1 1 A 26 26 ARG CA C 26 54.408 57.172 -2.764 1
1 220 . 5 1 1 A 26 26 ARG CB C 26 29.501 30.066 -0.565 1
1 223 . 5 1 1 A 26 26 ARG N N 26 119.689 121.682 -1.993 1
1 224 . 5 1 1 A 27 27 THR H H 27 7.923 8.965 -1.042 1
1 225 . 5 1 1 A 27 27 THR HA H 27 3.792 4.023 -0.231 1
1 230 . 5 1 1 A 27 27 THR C C 27 175.251 176.522 -1.271 1
1 231 . 5 1 1 A 27 27 THR CA C 27 64.791 65.271 -0.480 1
1 232 . 5 1 1 A 27 27 THR CB C 27 68.354 68.065 0.289 1
1 234 . 5 1 1 A 27 27 THR N N 27 109.195 113.141 -3.946 1
1 235 . 5 1 1 A 28 28 TRP H H 28 7.389 8.091 -0.702 1
1 236 . 5 1 1 A 28 28 TRP HA H 28 4.441 4.365 0.076 1
1 240 . 5 1 1 A 28 28 TRP C C 28 178.519 178.463 0.056 1
1 241 . 5 1 1 A 28 28 TRP CA C 28 57.789 61.336 -3.547 1
1 242 . 5 1 1 A 28 28 TRP CB C 28 27.387 29.822 -2.435 1
1 243 . 5 1 1 A 28 28 TRP N N 28 120.127 124.959 -4.832 1
1 244 . 5 1 1 A 29 29 ILE H H 29 6.832 8.239 -1.407 1
1 245 . 5 1 1 A 29 29 ILE HA H 29 3.612 3.486 0.126 1
1 254 . 5 1 1 A 29 29 ILE C C 29 176.023 176.602 -0.579 1
1 255 . 5 1 1 A 29 29 ILE CA C 29 63.773 63.423 0.350 1
1 256 . 5 1 1 A 29 29 ILE CB C 29 37.567 37.281 0.286 1
1 260 . 5 1 1 A 29 29 ILE N N 29 119.913 117.476 2.437 1
1 261 . 5 1 1 A 30 30 PHE H H 30 7.329 7.873 -0.544 1
1 262 . 5 1 1 A 30 30 PHE HA H 30 3.912 4.419 -0.507 1
1 268 . 5 1 1 A 30 30 PHE C C 30 177.101 177.606 -0.505 1
1 269 . 5 1 1 A 30 30 PHE CA C 30 59.436 59.642 -0.206 1
1 270 . 5 1 1 A 30 30 PHE CB C 30 38.734 39.508 -0.774 1
1 271 . 5 1 1 A 30 30 PHE N N 30 116.638 120.264 -3.626 1
1 272 . 5 1 1 A 31 31 ARG H H 31 7.399 8.323 -0.924 1
1 273 . 5 1 1 A 31 31 ARG HA H 31 4.287 4.351 -0.064 1
1 278 . 5 1 1 A 31 31 ARG C C 31 176.539 178.476 -1.937 1
1 279 . 5 1 1 A 31 31 ARG CA C 31 58.852 58.806 0.046 1
1 280 . 5 1 1 A 31 31 ARG CB C 31 29.461 31.101 -1.640 1
1 281 . 5 1 1 A 31 31 ARG N N 31 122.099 121.225 0.874 1
1 282 . 5 1 1 A 32 32 GLY H H 32 8.346 7.893 0.453 1
1 283 . 5 1 1 A 32 32 GLY HA2 H 32 4.284 3.455 0.829 1
1 284 . 5 1 1 A 32 32 GLY HA3 H 32 3.629 3.797 -0.168 1
1 285 . 5 1 1 A 32 32 GLY C C 32 173.791 173.670 0.121 1
1 286 . 5 1 1 A 32 32 GLY CA C 32 45.793 45.966 -0.173 1
1 287 . 5 1 1 A 32 32 GLY N N 32 109.964 106.941 3.023 1
1 288 . 5 1 1 A 33 33 ALA H H 33 7.510 8.416 -0.906 1
1 289 . 5 1 1 A 33 33 ALA HA H 33 4.193 4.511 -0.318 1
1 293 . 5 1 1 A 33 33 ALA C C 33 176.672 177.125 -0.453 1
1 294 . 5 1 1 A 33 33 ALA CA C 33 54.401 52.402 1.999 1
1 295 . 5 1 1 A 33 33 ALA CB C 33 19.368 21.991 -2.623 1
1 296 . 5 1 1 A 33 33 ALA N N 33 122.266 119.908 2.358 1
1 297 . 5 1 1 A 34 34 HIS H H 34 8.759 7.913 0.846 1
1 298 . 5 1 1 A 34 34 HIS HA H 34 4.529 4.826 -0.297 1
1 302 . 5 1 1 A 34 34 HIS C C 34 175.767 174.712 1.055 1
1 303 . 5 1 1 A 34 34 HIS CA C 34 54.997 54.999 -0.002 1
1 304 . 5 1 1 A 34 34 HIS CB C 34 31.089 30.389 0.700 1
1 305 . 5 1 1 A 34 34 HIS N N 34 119.038 117.814 1.224 1
1 306 . 5 1 1 A 35 35 ARG H H 35 8.142 8.473 -0.331 1
1 307 . 5 1 1 A 35 35 ARG HA H 35 4.700 4.552 0.148 1
1 314 . 5 1 1 A 35 35 ARG C C 35 177.572 176.208 1.364 1
1 315 . 5 1 1 A 35 35 ARG CA C 35 54.103 55.532 -1.429 1
1 316 . 5 1 1 A 35 35 ARG CB C 35 29.112 32.541 -3.429 1
1 319 . 5 1 1 A 35 35 ARG N N 35 127.785 126.851 0.934 1
1 320 . 5 1 1 A 36 36 GLY H H 36 9.352 7.762 1.590 1
1 321 . 5 1 1 A 36 36 GLY HA2 H 36 4.291 3.860 0.431 1
1 322 . 5 1 1 A 36 36 GLY HA3 H 36 3.247 3.977 -0.730 1
1 323 . 5 1 1 A 36 36 GLY C C 36 173.876 173.015 0.861 1
1 324 . 5 1 1 A 36 36 GLY CA C 36 45.644 45.444 0.200 1
1 325 . 5 1 1 A 36 36 GLY N N 36 109.626 107.851 1.775 1
1 326 . 5 1 1 A 37 37 ARG H H 37 9.384 8.455 0.929 1
1 327 . 5 1 1 A 37 37 ARG HA H 37 4.688 4.364 0.324 1
1 333 . 5 1 1 A 37 37 ARG C C 37 175.081 175.140 -0.059 1
1 334 . 5 1 1 A 37 37 ARG CA C 37 55.742 56.534 -0.792 1
1 335 . 5 1 1 A 37 37 ARG CB C 37 28.138 30.675 -2.537 1
1 338 . 5 1 1 A 37 37 ARG N N 37 127.132 122.864 4.268 1
1 339 . 5 1 1 A 38 38 VAL H H 38 7.605 6.620 0.985 1
1 340 . 5 1 1 A 38 38 VAL HA H 38 4.591 3.892 0.699 1
1 348 . 5 1 1 A 38 38 VAL C C 38 174.391 174.296 0.095 1
1 349 . 5 1 1 A 38 38 VAL CA C 38 60.092 60.340 -0.248 1
1 350 . 5 1 1 A 38 38 VAL CB C 38 33.328 32.738 0.590 1
1 353 . 5 1 1 A 38 38 VAL N N 38 126.253 125.896 0.357 1
1 354 . 5 1 1 A 39 39 ASN H H 39 9.007 7.906 1.101 1
1 355 . 5 1 1 A 39 39 ASN HA H 39 4.736 4.794 -0.058 1
1 358 . 5 1 1 A 39 39 ASN C C 39 174.562 175.019 -0.457 1
1 359 . 5 1 1 A 39 39 ASN CA C 39 51.577 52.279 -0.702 1
1 360 . 5 1 1 A 39 39 ASN CB C 39 40.749 41.591 -0.842 1
1 361 . 5 1 1 A 39 39 ASN N N 39 123.411 122.092 1.319 1
1 362 . 5 1 1 A 40 40 LYS H H 40 8.510 8.723 -0.213 1
1 363 . 5 1 1 A 40 40 LYS HA H 40 3.909 3.858 0.051 1
1 370 . 5 1 1 A 40 40 LYS C C 40 176.629 178.232 -1.603 1
1 371 . 5 1 1 A 40 40 LYS CA C 40 59.141 60.326 -1.185 1
1 372 . 5 1 1 A 40 40 LYS CB C 40 32.301 32.392 -0.091 1
1 376 . 5 1 1 A 40 40 LYS N N 40 116.303 125.893 -9.590 1
1 377 . 5 1 1 A 41 41 LYS H H 41 7.907 7.996 -0.089 1
1 378 . 5 1 1 A 41 41 LYS HA H 41 4.172 3.755 0.417 1
1 384 . 5 1 1 A 41 41 LYS C C 41 177.229 175.751 1.478 1
1 385 . 5 1 1 A 41 41 LYS CA C 41 57.392 57.785 -0.393 1
1 386 . 5 1 1 A 41 41 LYS CB C 41 32.667 30.817 1.850 1
1 390 . 5 1 1 A 41 41 LYS N N 41 117.066 117.493 -0.427 1
1 391 . 5 1 1 A 42 42 ASN H H 42 7.962 8.626 -0.664 1
1 392 . 5 1 1 A 42 42 ASN HA H 42 4.392 4.634 -0.242 1
1 395 . 5 1 1 A 42 42 ASN C C 42 179.805 175.994 3.811 1
1 396 . 5 1 1 A 42 42 ASN CA C 42 52.335 52.689 -0.354 1
1 397 . 5 1 1 A 42 42 ASN CB C 42 39.348 39.067 0.281 1
1 398 . 5 1 1 A 42 42 ASN N N 42 114.442 116.776 -2.334 1
1 399 . 5 1 1 A 43 43 ILE H H 43 7.806 8.525 -0.719 1
1 400 . 5 1 1 A 43 43 ILE HA H 43 3.747 3.904 -0.157 1
1 409 . 5 1 1 A 43 43 ILE C C 43 174.219 177.322 -3.103 1
1 410 . 5 1 1 A 43 43 ILE CA C 43 64.505 63.380 1.125 1
1 411 . 5 1 1 A 43 43 ILE CB C 43 36.595 38.302 -1.707 1
1 415 . 5 1 1 A 43 43 ILE N N 43 121.001 120.565 0.436 1
1 416 . 5 1 1 A 44 44 VAL H H 44 6.154 7.797 -1.643 1
1 417 . 5 1 1 A 44 44 VAL HA H 44 3.497 3.935 -0.438 1
1 425 . 5 1 1 A 44 44 VAL C C 44 176.282 176.229 0.053 1
1 426 . 5 1 1 A 44 44 VAL CA C 44 63.606 63.084 0.522 1
1 427 . 5 1 1 A 44 44 VAL CB C 44 30.614 31.808 -1.194 1
1 430 . 5 1 1 A 44 44 VAL N N 44 110.500 119.621 -9.121 1
1 431 . 5 1 1 A 45 45 TRP H H 45 7.419 8.128 -0.709 1
1 432 . 5 1 1 A 45 45 TRP HA H 45 4.716 4.848 -0.132 1
1 438 . 5 1 1 A 45 45 TRP C C 45 175.422 175.863 -0.441 1
1 439 . 5 1 1 A 45 45 TRP CA C 45 56.188 57.596 -1.408 1
1 440 . 5 1 1 A 45 45 TRP CB C 45 31.245 31.252 -0.007 1
1 441 . 5 1 1 A 45 45 TRP N N 45 118.601 121.514 -2.913 1
1 442 . 5 1 1 A 46 46 HIS H H 46 7.582 7.818 -0.236 1
1 443 . 5 1 1 A 46 46 HIS HA H 46 4.227 4.816 -0.589 1
1 448 . 5 1 1 A 46 46 HIS C C 46 177.485 174.582 2.903 1
1 449 . 5 1 1 A 46 46 HIS CA C 46 56.799 55.408 1.391 1
1 450 . 5 1 1 A 46 46 HIS CB C 46 32.017 31.657 0.360 1
1 451 . 5 1 1 A 46 46 HIS N N 46 122.648 118.580 4.068 1
1 452 . 5 1 1 A 47 47 GLU H H 47 7.948 8.240 -0.292 1
1 453 . 5 1 1 A 47 47 GLU HA H 47 4.098 4.307 -0.209 1
1 457 . 5 1 1 A 47 47 GLU C C 47 175.596 176.292 -0.696 1
1 458 . 5 1 1 A 47 47 GLU CA C 47 56.482 56.328 0.154 1
1 459 . 5 1 1 A 47 47 GLU CB C 47 31.839 29.520 2.319 1
1 461 . 5 1 1 A 47 47 GLU N N 47 120.485 121.271 -0.786 1
1 462 . 5 1 1 A 48 48 LEU H H 48 9.304 8.629 0.675 1
1 463 . 5 1 1 A 48 48 LEU HA H 48 4.218 4.315 -0.097 1
1 472 . 5 1 1 A 48 48 LEU C C 48 177.743 176.490 1.253 1
1 473 . 5 1 1 A 48 48 LEU CA C 48 55.043 55.095 -0.052 1
1 474 . 5 1 1 A 48 48 LEU CB C 48 41.948 41.034 0.914 1
1 477 . 5 1 1 A 48 48 LEU N N 48 128.658 125.757 2.901 1
1 478 . 5 1 1 A 49 49 ILE H H 49 8.028 8.839 -0.811 1
1 479 . 5 1 1 A 49 49 ILE HA H 49 3.279 4.516 -1.237 1
1 488 . 5 1 1 A 49 49 ILE C C 49 174.821 177.281 -2.460 1
1 489 . 5 1 1 A 49 49 ILE CA C 49 63.901 61.931 1.970 1
1 490 . 5 1 1 A 49 49 ILE CB C 49 37.775 40.938 -3.163 1
1 494 . 5 1 1 A 49 49 ILE N N 49 120.341 123.408 -3.067 1
1 495 . 5 1 1 A 50 50 GLY H H 50 9.038 7.602 1.436 1
1 496 . 5 1 1 A 50 50 GLY HA2 H 50 4.717 4.237 0.480 1
1 497 . 5 1 1 A 50 50 GLY HA3 H 50 3.491 4.331 -0.840 1
1 498 . 5 1 1 A 50 50 GLY C C 50 175.084 173.677 1.407 1
1 499 . 5 1 1 A 50 50 GLY CA C 50 44.599 45.432 -0.833 1
1 500 . 5 1 1 A 50 50 GLY N N 50 110.284 109.084 1.200 1
1 501 . 5 1 1 A 51 51 LEU H H 51 8.400 6.978 1.422 1
1 502 . 5 1 1 A 51 51 LEU HA H 51 4.723 3.779 0.944 1
1 512 . 5 1 1 A 51 51 LEU C C 51 177.147 175.185 1.962 1
1 513 . 5 1 1 A 51 51 LEU CA C 51 54.350 55.388 -1.038 1
1 514 . 5 1 1 A 51 51 LEU CB C 51 42.985 42.632 0.353 1
1 518 . 5 1 1 A 51 51 LEU N N 51 120.471 121.887 -1.416 1
1 519 . 5 1 1 A 52 52 LYS H H 52 7.505 8.313 -0.808 1
1 520 . 5 1 1 A 52 52 LYS HA H 52 4.250 4.383 -0.133 1
1 527 . 5 1 1 A 52 52 LYS C C 52 174.995 175.025 -0.030 1
1 528 . 5 1 1 A 52 52 LYS CA C 52 55.589 54.585 1.004 1
1 529 . 5 1 1 A 52 52 LYS CB C 52 33.025 33.994 -0.969 1
1 533 . 5 1 1 A 52 52 LYS N N 52 122.406 123.010 -0.604 1
1 534 . 5 1 1 A 53 53 VAL H H 53 9.075 8.269 0.806 1
1 535 . 5 1 1 A 53 53 VAL HA H 53 5.071 4.968 0.103 1
1 543 . 5 1 1 A 53 53 VAL C C 53 171.170 173.619 -2.449 1
1 544 . 5 1 1 A 53 53 VAL CA C 53 58.523 59.038 -0.515 1
1 545 . 5 1 1 A 53 53 VAL CB C 53 35.698 35.309 0.389 1
1 548 . 5 1 1 A 53 53 VAL N N 53 124.509 124.570 -0.061 1
1 549 . 5 1 1 A 54 54 ARG H H 54 8.148 8.173 -0.025 1
1 550 . 5 1 1 A 54 54 ARG HA H 54 5.329 4.841 0.488 1
1 557 . 5 1 1 A 54 54 ARG C C 54 176.113 174.454 1.659 1
1 558 . 5 1 1 A 54 54 ARG CA C 54 53.817 54.187 -0.370 1
1 559 . 5 1 1 A 54 54 ARG CB C 54 34.511 33.643 0.868 1
1 562 . 5 1 1 A 54 54 ARG N N 54 123.625 121.901 1.724 1
1 563 . 5 1 1 A 55 55 VAL H H 55 8.659 9.325 -0.666 1
1 564 . 5 1 1 A 55 55 VAL HA H 55 4.085 4.209 -0.124 1
1 572 . 5 1 1 A 55 55 VAL C C 55 176.282 175.485 0.797 1
1 573 . 5 1 1 A 55 55 VAL CA C 55 62.814 62.320 0.494 1
1 574 . 5 1 1 A 55 55 VAL CB C 55 30.628 31.509 -0.881 1
1 577 . 5 1 1 A 55 55 VAL N N 55 125.383 123.461 1.922 1
1 578 . 5 1 1 A 56 56 VAL H H 56 8.057 8.574 -0.517 1
1 579 . 5 1 1 A 56 56 VAL HA H 56 4.123 4.009 0.114 1
1 587 . 5 1 1 A 56 56 VAL C C 56 175.426 176.304 -0.878 1
1 588 . 5 1 1 A 56 56 VAL CA C 56 62.786 64.308 -1.522 1
1 589 . 5 1 1 A 56 56 VAL CB C 56 32.267 32.559 -0.292 1
1 592 . 5 1 1 A 56 56 VAL N N 56 124.936 129.313 -4.377 1
1 593 . 5 1 1 A 57 57 ASN H H 57 7.527 8.229 -0.702 1
1 594 . 5 1 1 A 57 57 ASN HA H 57 4.817 5.253 -0.436 1
1 597 . 5 1 1 A 57 57 ASN C C 57 172.973 173.501 -0.528 1
1 598 . 5 1 1 A 57 57 ASN CA C 57 52.460 51.638 0.822 1
1 599 . 5 1 1 A 57 57 ASN CB C 57 42.070 41.333 0.737 1
1 600 . 5 1 1 A 57 57 ASN N N 57 114.777 118.135 -3.358 1
1 601 . 5 1 1 A 58 58 SER H H 58 8.193 8.925 -0.732 1
1 602 . 5 1 1 A 58 58 SER HA H 58 5.214 5.262 -0.048 1
1 605 . 5 1 1 A 58 58 SER C C 58 174.221 172.671 1.550 1
1 606 . 5 1 1 A 58 58 SER CA C 58 56.778 57.125 -0.347 1
1 607 . 5 1 1 A 58 58 SER CB C 58 63.906 66.487 -2.581 1
1 608 . 5 1 1 A 58 58 SER N N 58 115.531 119.443 -3.912 1
1 609 . 5 1 1 A 59 59 THR H H 59 8.053 8.193 -0.140 1
1 610 . 5 1 1 A 59 59 THR HA H 59 4.305 4.379 -0.074 1
1 615 . 5 1 1 A 59 59 THR C C 59 174.478 172.870 1.608 1
1 616 . 5 1 1 A 59 59 THR CA C 59 63.305 60.332 2.973 1
1 617 . 5 1 1 A 59 59 THR CB C 59 68.354 67.269 1.085 1
1 619 . 5 1 1 A 59 59 THR N N 59 116.405 120.261 -3.856 1
1 620 . 5 1 1 A 60 60 HIS H H 60 8.359 8.433 -0.074 1
1 621 . 5 1 1 A 60 60 HIS HA H 60 5.167 5.067 0.100 1
1 626 . 5 1 1 A 60 60 HIS CA C 60 52.792 53.170 -0.378 1
1 627 . 5 1 1 A 60 60 HIS CB C 60 32.142 30.734 1.408 1
1 628 . 5 1 1 A 60 60 HIS N N 60 123.625 125.239 -1.614 1
1 629 . 5 1 1 A 61 61 PRO HA H 61 4.277 4.318 -0.041 1
1 636 . 5 1 1 A 61 61 PRO C C 61 178.217 177.482 0.735 1
1 637 . 5 1 1 A 61 61 PRO CA C 61 64.375 64.367 0.008 1
1 638 . 5 1 1 A 61 61 PRO CB C 61 32.007 32.135 -0.128 1
1 641 . 5 1 1 A 62 62 GLY H H 62 8.421 8.081 0.340 1
1 642 . 5 1 1 A 62 62 GLY HA2 H 62 3.889 3.753 0.136 1
1 643 . 5 1 1 A 62 62 GLY HA3 H 62 3.653 3.871 -0.218 1
1 644 . 5 1 1 A 62 62 GLY C C 62 174.994 174.008 0.986 1
1 645 . 5 1 1 A 62 62 GLY CA C 62 45.831 45.239 0.592 1
1 646 . 5 1 1 A 62 62 GLY N N 62 106.132 105.924 0.208 1
1 647 . 5 1 1 A 63 63 TYR H H 63 7.327 7.746 -0.419 1
1 648 . 5 1 1 A 63 63 TYR HA H 63 4.846 4.514 0.332 1
1 652 . 5 1 1 A 63 63 TYR C C 63 175.593 175.401 0.192 1
1 653 . 5 1 1 A 63 63 TYR CA C 63 56.071 58.326 -2.255 1
1 654 . 5 1 1 A 63 63 TYR CB C 63 38.962 40.527 -1.565 1
1 655 . 5 1 1 A 63 63 TYR N N 63 116.628 116.742 -0.114 1
1 656 . 5 1 1 A 64 64 VAL H H 64 7.296 7.027 0.269 1
1 657 . 5 1 1 A 64 64 VAL HA H 64 3.180 4.200 -1.020 1
1 665 . 5 1 1 A 64 64 VAL C C 64 177.312 176.493 0.819 1
1 666 . 5 1 1 A 64 64 VAL CA C 64 65.688 62.583 3.105 1
1 667 . 5 1 1 A 64 64 VAL CB C 64 30.957 32.198 -1.241 1
1 670 . 5 1 1 A 64 64 VAL N N 64 117.940 118.521 -0.581 1
1 671 . 5 1 1 A 65 65 GLY H H 65 8.449 9.304 -0.855 1
1 672 . 5 1 1 A 65 65 GLY HA2 H 65 4.320 3.952 0.368 1
1 673 . 5 1 1 A 65 65 GLY HA3 H 65 3.515 3.962 -0.447 1
1 674 . 5 1 1 A 65 65 GLY C C 65 174.821 173.479 1.342 1
1 675 . 5 1 1 A 65 65 GLY CA C 65 44.599 45.219 -0.620 1
1 676 . 5 1 1 A 65 65 GLY N N 65 115.317 114.063 1.254 1
1 677 . 5 1 1 A 66 66 ILE H H 66 7.095 7.662 -0.567 1
1 678 . 5 1 1 A 66 66 ILE HA H 66 3.193 4.670 -1.477 1
1 687 . 5 1 1 A 66 66 ILE C C 66 174.308 175.256 -0.948 1
1 688 . 5 1 1 A 66 66 ILE CA C 66 63.470 60.210 3.260 1
1 689 . 5 1 1 A 66 66 ILE CB C 66 37.775 39.592 -1.817 1
1 693 . 5 1 1 A 66 66 ILE N N 66 122.099 122.925 -0.826 1
1 694 . 5 1 1 A 67 67 GLU H H 67 7.126 9.201 -2.075 1
1 695 . 5 1 1 A 67 67 GLU HA H 67 5.343 5.225 0.118 1
1 699 . 5 1 1 A 67 67 GLU C C 67 174.652 175.587 -0.935 1
1 700 . 5 1 1 A 67 67 GLU CA C 67 54.109 54.513 -0.404 1
1 701 . 5 1 1 A 67 67 GLU CB C 67 33.619 32.911 0.708 1
1 703 . 5 1 1 A 67 67 GLU N N 67 125.164 127.705 -2.541 1
1 704 . 5 1 1 A 68 68 GLY H H 68 8.401 8.250 0.151 1
1 705 . 5 1 1 A 68 68 GLY HA2 H 68 4.364 3.002 1.362 1
1 706 . 5 1 1 A 68 68 GLY HA3 H 68 4.041 4.060 -0.019 1
1 707 . 5 1 1 A 68 68 GLY C C 68 171.644 171.094 0.550 1
1 708 . 5 1 1 A 68 68 GLY CA C 68 45.680 44.581 1.099 1
1 709 . 5 1 1 A 68 68 GLY N N 68 109.626 112.169 -2.543 1
1 710 . 5 1 1 A 69 69 TYR H H 69 8.422 10.210 -1.788 1
1 711 . 5 1 1 A 69 69 TYR HA H 69 5.079 4.906 0.173 1
1 714 . 5 1 1 A 69 69 TYR C C 69 176.194 175.370 0.824 1
1 715 . 5 1 1 A 69 69 TYR CA C 69 57.681 57.617 0.064 1
1 716 . 5 1 1 A 69 69 TYR CB C 69 41.043 39.944 1.099 1
1 717 . 5 1 1 A 69 69 TYR N N 69 119.689 119.278 0.411 1
1 718 . 5 1 1 A 70 70 VAL H H 70 8.753 8.822 -0.069 1
1 719 . 5 1 1 A 70 70 VAL HA H 70 4.143 4.156 -0.013 1
1 727 . 5 1 1 A 70 70 VAL C C 70 176.540 175.628 0.912 1
1 728 . 5 1 1 A 70 70 VAL CA C 70 63.477 63.691 -0.214 1
1 729 . 5 1 1 A 70 70 VAL CB C 70 30.952 32.075 -1.123 1
1 732 . 5 1 1 A 70 70 VAL N N 70 123.420 125.954 -2.534 1
1 733 . 5 1 1 A 71 71 ILE H H 71 9.101 10.665 -1.564 1
1 734 . 5 1 1 A 71 71 ILE HA H 71 4.834 4.666 0.168 1
1 743 . 5 1 1 A 71 71 ILE C C 71 175.418 175.614 -0.196 1
1 744 . 5 1 1 A 71 71 ILE CA C 71 60.637 62.055 -1.418 1
1 745 . 5 1 1 A 71 71 ILE CB C 71 39.853 40.453 -0.600 1
1 749 . 5 1 1 A 71 71 ILE N N 71 119.913 125.889 -5.976 1
1 750 . 5 1 1 A 72 72 ASP H H 72 8.030 7.841 0.189 1
1 751 . 5 1 1 A 72 72 ASP HA H 72 4.964 5.249 -0.285 1
1 754 . 5 1 1 A 72 72 ASP C C 72 173.017 174.204 -1.187 1
1 755 . 5 1 1 A 72 72 ASP CA C 72 53.511 52.981 0.530 1
1 756 . 5 1 1 A 72 72 ASP CB C 72 41.932 44.592 -2.660 1
1 757 . 5 1 1 A 72 72 ASP N N 72 118.377 122.238 -3.861 1
1 758 . 5 1 1 A 73 73 GLU H H 73 9.349 8.838 0.511 1
1 759 . 5 1 1 A 73 73 GLU HA H 73 4.868 4.959 -0.091 1
1 762 . 5 1 1 A 73 73 GLU C C 73 173.793 174.698 -0.905 1
1 763 . 5 1 1 A 73 73 GLU CA C 73 55.521 56.416 -0.895 1
1 764 . 5 1 1 A 73 73 GLU CB C 73 33.138 32.104 1.034 1
1 766 . 5 1 1 A 73 73 GLU N N 73 123.848 124.022 -0.174 1
1 767 . 5 1 1 A 74 74 THR H H 74 8.748 8.368 0.380 1
1 768 . 5 1 1 A 74 74 THR HA H 74 4.992 4.866 0.126 1
1 773 . 5 1 1 A 74 74 THR CA C 74 59.450 60.074 -0.624 1
1 774 . 5 1 1 A 74 74 THR CB C 74 70.429 72.155 -1.726 1
1 776 . 5 1 1 A 74 74 THR N N 74 116.628 118.248 -1.620 1
1 777 . 5 1 1 A 75 75 ARG HA H 75 3.741 4.450 -0.709 1
1 782 . 5 1 1 A 75 75 ARG C C 75 177.140 176.888 0.252 1
1 783 . 5 1 1 A 75 75 ARG CA C 75 60.041 58.562 1.479 1
1 784 . 5 1 1 A 75 75 ARG CB C 75 29.930 30.036 -0.106 1
1 787 . 5 1 1 A 76 76 ASN H H 76 8.497 8.118 0.379 1
1 788 . 5 1 1 A 76 76 ASN HA H 76 5.310 5.028 0.282 1
1 791 . 5 1 1 A 76 76 ASN C C 76 175.509 174.381 1.128 1
1 792 . 5 1 1 A 76 76 ASN CA C 76 52.320 52.118 0.202 1
1 793 . 5 1 1 A 76 76 ASN CB C 76 40.744 39.568 1.176 1
1 794 . 5 1 1 A 76 76 ASN N N 76 111.053 116.705 -5.652 1
1 795 . 5 1 1 A 77 77 MET H H 77 7.528 7.384 0.144 1
1 796 . 5 1 1 A 77 77 MET HA H 77 5.392 4.872 0.520 1
1 801 . 5 1 1 A 77 77 MET C C 77 174.824 174.395 0.429 1
1 802 . 5 1 1 A 77 77 MET CA C 77 54.994 53.897 1.097 1
1 803 . 5 1 1 A 77 77 MET CB C 77 36.753 35.373 1.380 1
1 805 . 5 1 1 A 77 77 MET N N 77 119.913 116.398 3.515 1
1 806 . 5 1 1 A 78 78 LEU H H 78 8.977 8.578 0.399 1
1 807 . 5 1 1 A 78 78 LEU HA H 78 4.803 5.263 -0.460 1
1 817 . 5 1 1 A 78 78 LEU C C 78 174.563 174.405 0.158 1
1 818 . 5 1 1 A 78 78 LEU CA C 78 53.964 54.496 -0.532 1
1 819 . 5 1 1 A 78 78 LEU CB C 78 44.903 45.520 -0.617 1
1 823 . 5 1 1 A 78 78 LEU N N 78 121.224 121.379 -0.155 1
1 824 . 5 1 1 A 79 79 VAL H H 79 8.115 8.990 -0.875 1
1 825 . 5 1 1 A 79 79 VAL HA H 79 4.783 4.934 -0.151 1
1 833 . 5 1 1 A 79 79 VAL C C 79 175.297 174.748 0.549 1
1 834 . 5 1 1 A 79 79 VAL CA C 79 61.821 60.420 1.401 1
1 835 . 5 1 1 A 79 79 VAL CB C 79 31.146 34.258 -3.112 1
1 838 . 5 1 1 A 79 79 VAL N N 79 124.062 127.175 -3.113 1
1 839 . 5 1 1 A 80 80 ILE H H 80 9.342 8.905 0.437 1
1 840 . 5 1 1 A 80 80 ILE HA H 80 4.764 5.232 -0.468 1
1 849 . 5 1 1 A 80 80 ILE C C 80 174.127 174.814 -0.687 1
1 850 . 5 1 1 A 80 80 ILE CA C 80 59.897 59.306 0.591 1
1 851 . 5 1 1 A 80 80 ILE CB C 80 42.225 40.281 1.944 1
1 855 . 5 1 1 A 80 80 ILE N N 80 129.970 126.718 3.252 1
1 856 . 5 1 1 A 81 81 ALA H H 81 9.478 9.596 -0.118 1
1 857 . 5 1 1 A 81 81 ALA HA H 81 5.139 5.431 -0.292 1
1 861 . 5 1 1 A 81 81 ALA C C 81 176.970 176.316 0.654 1
1 862 . 5 1 1 A 81 81 ALA CA C 81 50.835 50.441 0.394 1
1 863 . 5 1 1 A 81 81 ALA CB C 81 21.451 22.237 -0.786 1
1 864 . 5 1 1 A 81 81 ALA N N 81 129.756 126.507 3.249 1
1 865 . 5 1 1 A 82 82 GLY H H 82 8.691 8.502 0.189 1
1 866 . 5 1 1 A 82 82 GLY HA2 H 82 5.110 4.396 0.714 1
1 867 . 5 1 1 A 82 82 GLY HA3 H 82 4.241 4.566 -0.325 1
1 868 . 5 1 1 A 82 82 GLY C C 82 173.017 174.357 -1.340 1
1 869 . 5 1 1 A 82 82 GLY CA C 82 44.166 45.281 -1.115 1
1 870 . 5 1 1 A 82 82 GLY N N 82 113.568 108.548 5.020 1
1 871 . 5 1 1 A 83 83 GLU H H 83 8.659 9.186 -0.527 1
1 872 . 5 1 1 A 83 83 GLU HA H 83 4.286 4.299 -0.013 1
1 876 . 5 1 1 A 83 83 GLU C C 83 177.570 176.132 1.438 1
1 877 . 5 1 1 A 83 83 GLU CA C 83 59.017 58.591 0.426 1
1 878 . 5 1 1 A 83 83 GLU CB C 83 29.762 29.058 0.704 1
1 880 . 5 1 1 A 83 83 GLU N N 83 120.019 124.193 -4.174 1
1 881 . 5 1 1 A 84 84 ASN H H 84 8.549 8.565 -0.016 1
1 882 . 5 1 1 A 84 84 ASN HA H 84 4.821 4.917 -0.096 1
1 884 . 5 1 1 A 84 84 ASN C C 84 173.878 173.970 -0.092 1
1 885 . 5 1 1 A 84 84 ASN CA C 84 52.919 53.014 -0.095 1
1 886 . 5 1 1 A 84 84 ASN CB C 84 40.150 39.059 1.091 1
1 887 . 5 1 1 A 84 84 ASN N N 84 112.778 124.419 -11.641 1
1 888 . 5 1 1 A 85 85 LYS H H 85 7.116 7.224 -0.108 1
1 889 . 5 1 1 A 85 85 LYS HA H 85 4.344 5.084 -0.740 1
1 895 . 5 1 1 A 85 85 LYS C C 85 173.278 174.699 -1.421 1
1 896 . 5 1 1 A 85 85 LYS CA C 85 55.292 54.813 0.479 1
1 897 . 5 1 1 A 85 85 LYS CB C 85 36.124 35.786 0.338 1
1 901 . 5 1 1 A 85 85 LYS N N 85 118.377 120.828 -2.451 1
1 902 . 5 1 1 A 86 86 VAL H H 86 7.781 9.042 -1.261 1
1 903 . 5 1 1 A 86 86 VAL HA H 86 4.749 5.360 -0.611 1
1 911 . 5 1 1 A 86 86 VAL C C 86 174.739 174.411 0.328 1
1 912 . 5 1 1 A 86 86 VAL CA C 86 60.716 59.426 1.290 1
1 913 . 5 1 1 A 86 86 VAL CB C 86 33.619 35.071 -1.452 1
1 916 . 5 1 1 A 86 86 VAL N N 86 120.127 119.512 0.615 1
1 917 . 5 1 1 A 87 87 TRP H H 87 9.558 9.085 0.473 1
1 918 . 5 1 1 A 87 87 TRP HA H 87 4.958 5.438 -0.480 1
1 923 . 5 1 1 A 87 87 TRP C C 87 174.909 175.086 -0.177 1
1 924 . 5 1 1 A 87 87 TRP CA C 87 57.073 55.910 1.163 1
1 925 . 5 1 1 A 87 87 TRP CB C 87 33.028 31.180 1.848 1
1 926 . 5 1 1 A 87 87 TRP N N 87 127.346 123.309 4.037 1
1 927 . 5 1 1 A 88 88 LYS H H 88 8.590 7.638 0.952 1
1 928 . 5 1 1 A 88 88 LYS HA H 88 4.856 4.704 0.152 1
1 935 . 5 1 1 A 88 88 LYS C C 88 175.382 174.228 1.154 1
1 936 . 5 1 1 A 88 88 LYS CA C 88 55.887 54.604 1.283 1
1 937 . 5 1 1 A 88 88 LYS CB C 88 32.434 34.050 -1.616 1
1 941 . 5 1 1 A 88 88 LYS N N 88 123.625 122.962 0.663 1
1 942 . 5 1 1 A 89 89 VAL H H 89 8.829 8.105 0.724 1
1 943 . 5 1 1 A 89 89 VAL HA H 89 4.406 4.540 -0.134 1
1 951 . 5 1 1 A 89 89 VAL CA C 89 58.371 58.481 -0.110 1
1 952 . 5 1 1 A 89 89 VAL CB C 89 34.512 34.222 0.290 1
1 955 . 5 1 1 A 89 89 VAL N N 89 124.285 122.104 2.181 1
1 956 . 5 1 1 A 90 90 PRO HA H 90 5.073 4.612 0.461 1
1 961 . 5 1 1 A 90 90 PRO C C 90 177.231 176.718 0.513 1
1 962 . 5 1 1 A 90 90 PRO CA C 90 61.795 62.752 -0.957 1
1 963 . 5 1 1 A 90 90 PRO CB C 90 31.660 33.139 -1.479 1
1 964 . 5 1 1 A 91 91 LYS H H 91 8.116 8.677 -0.561 1
1 965 . 5 1 1 A 91 91 LYS HA H 91 4.024 4.344 -0.320 1
1 969 . 5 1 1 A 91 91 LYS C C 91 178.518 177.365 1.153 1
1 970 . 5 1 1 A 91 91 LYS CA C 91 59.621 58.921 0.700 1
1 971 . 5 1 1 A 91 91 LYS CB C 91 34.217 32.260 1.957 1
1 973 . 5 1 1 A 91 91 LYS N N 91 121.224 122.029 -0.805 1
1 974 . 5 1 1 A 92 92 ASP H H 92 8.505 8.448 0.057 1
1 975 . 5 1 1 A 92 92 ASP HA H 92 3.781 4.580 -0.799 1
1 978 . 5 1 1 A 92 92 ASP C C 92 176.975 176.734 0.241 1
1 979 . 5 1 1 A 92 92 ASP CA C 92 56.773 54.873 1.900 1
1 980 . 5 1 1 A 92 92 ASP CB C 92 39.590 39.844 -0.254 1
1 981 . 5 1 1 A 92 92 ASP N N 92 111.815 117.652 -5.837 1
1 982 . 5 1 1 A 93 93 VAL H H 93 6.691 7.144 -0.453 1
1 983 . 5 1 1 A 93 93 VAL HA H 93 4.678 4.647 0.031 1
1 991 . 5 1 1 A 93 93 VAL C C 93 176.537 174.626 1.911 1
1 992 . 5 1 1 A 93 93 VAL CA C 93 60.120 60.515 -0.395 1
1 993 . 5 1 1 A 93 93 VAL CB C 93 31.093 32.647 -1.554 1
1 996 . 5 1 1 A 93 93 VAL N N 93 107.879 112.555 -4.676 1
1 997 . 5 1 1 A 94 94 CYS H H 94 7.249 7.677 -0.428 1
1 998 . 5 1 1 A 94 94 CYS HA H 94 5.062 4.684 0.378 1
1 1001 . 5 1 1 A 94 94 CYS C C 94 173.103 171.961 1.142 1
1 1002 . 5 1 1 A 94 94 CYS CA C 94 58.001 56.847 1.154 1
1 1003 . 5 1 1 A 94 94 CYS CB C 94 31.418 30.686 0.732 1
1 1004 . 5 1 1 A 94 94 CYS N N 94 117.940 117.647 0.293 1
1 1005 . 5 1 1 A 95 95 ILE H H 95 8.153 8.033 0.120 1
1 1006 . 5 1 1 A 95 95 ILE HA H 95 4.159 4.771 -0.612 1
1 1016 . 5 1 1 A 95 95 ILE C C 95 174.736 174.450 0.286 1
1 1017 . 5 1 1 A 95 95 ILE CA C 95 61.234 60.052 1.182 1
1 1018 . 5 1 1 A 95 95 ILE CB C 95 38.071 40.351 -2.280 1
1 1022 . 5 1 1 A 95 95 ILE N N 95 121.876 119.752 2.124 1
1 1023 . 5 1 1 A 96 96 PHE H H 96 8.400 8.813 -0.413 1
1 1024 . 5 1 1 A 96 96 PHE HA H 96 5.004 4.952 0.052 1
1 1029 . 5 1 1 A 96 96 PHE C C 96 174.005 174.068 -0.063 1
1 1030 . 5 1 1 A 96 96 PHE CA C 96 56.922 55.896 1.026 1
1 1031 . 5 1 1 A 96 96 PHE CB C 96 44.006 41.966 2.040 1
1 1032 . 5 1 1 A 96 96 PHE N N 96 125.820 125.643 0.177 1
1 1033 . 5 1 1 A 97 97 GLU H H 97 8.985 8.530 0.455 1
1 1034 . 5 1 1 A 97 97 GLU HA H 97 5.275 5.161 0.114 1
1 1038 . 5 1 1 A 97 97 GLU C C 97 175.596 174.788 0.808 1
1 1039 . 5 1 1 A 97 97 GLU CA C 97 55.070 54.532 0.538 1
1 1040 . 5 1 1 A 97 97 GLU CB C 97 33.628 30.883 2.745 1
1 1042 . 5 1 1 A 97 97 GLU N N 97 121.010 124.047 -3.037 1
1 1043 . 5 1 1 A 98 98 PHE H H 98 9.304 9.066 0.238 1
1 1044 . 5 1 1 A 98 98 PHE HA H 98 5.337 4.995 0.342 1
1 1048 . 5 1 1 A 98 98 PHE C C 98 174.650 175.739 -1.089 1
1 1049 . 5 1 1 A 98 98 PHE CA C 98 57.363 57.917 -0.554 1
1 1050 . 5 1 1 A 98 98 PHE CB C 98 41.936 40.169 1.767 1
1 1051 . 5 1 1 A 98 98 PHE N N 98 128.658 126.315 2.343 1
1 1052 . 5 1 1 A 99 99 GLU H H 99 8.721 8.944 -0.223 1
1 1053 . 5 1 1 A 99 99 GLU HA H 99 5.457 4.728 0.729 1
1 1058 . 5 1 1 A 99 99 GLU C C 99 176.368 176.603 -0.235 1
1 1059 . 5 1 1 A 99 99 GLU CA C 99 54.401 55.496 -1.095 1
1 1060 . 5 1 1 A 99 99 GLU CB C 99 33.068 31.336 1.732 1
1 1062 . 5 1 1 A 99 99 GLU N N 99 122.759 123.658 -0.899 1
1 1063 . 5 1 1 A 100 100 THR H H 100 8.588 10.267 -1.679 1
1 1064 . 5 1 1 A 100 100 THR HA H 100 4.603 4.463 0.140 1
1 1069 . 5 1 1 A 100 100 THR C C 100 177.144 176.616 0.528 1
1 1070 . 5 1 1 A 100 100 THR CA C 100 60.774 62.347 -1.573 1
1 1071 . 5 1 1 A 100 100 THR CB C 100 70.136 69.901 0.235 1
1 1073 . 5 1 1 A 100 100 THR N N 100 116.191 120.748 -4.557 1
1 1074 . 5 1 1 A 101 101 TRP H H 101 9.287 9.088 0.199 1
1 1075 . 5 1 1 A 101 101 TRP HA H 101 4.591 4.502 0.089 1
1 1080 . 5 1 1 A 101 101 TRP C C 101 176.457 176.430 0.027 1
1 1081 . 5 1 1 A 101 101 TRP CA C 101 60.045 58.866 1.179 1
1 1082 . 5 1 1 A 101 101 TRP CB C 101 28.578 28.366 0.212 1
1 1083 . 5 1 1 A 101 101 TRP N N 101 122.220 124.069 -1.849 1
1 1084 . 5 1 1 A 102 102 ASP H H 102 7.553 8.230 -0.677 1
1 1085 . 5 1 1 A 102 102 ASP HA H 102 4.129 4.458 -0.329 1
1 1088 . 5 1 1 A 102 102 ASP C C 102 176.714 176.386 0.328 1
1 1089 . 5 1 1 A 102 102 ASP CA C 102 52.775 53.358 -0.583 1
1 1090 . 5 1 1 A 102 102 ASP CB C 102 39.231 41.078 -1.847 1
1 1091 . 5 1 1 A 102 102 ASP N N 102 115.763 119.794 -4.031 1
1 1092 . 5 1 1 A 103 103 GLY H H 103 7.910 8.511 -0.601 1
1 1093 . 5 1 1 A 103 103 GLY HA2 H 103 4.216 3.949 0.267 1
1 1094 . 5 1 1 A 103 103 GLY HA3 H 103 3.686 3.984 -0.298 1
1 1095 . 5 1 1 A 103 103 GLY C C 103 174.566 174.015 0.551 1
1 1096 . 5 1 1 A 103 103 GLY CA C 103 45.179 46.220 -1.041 1
1 1097 . 5 1 1 A 103 103 GLY N N 103 108.311 109.021 -0.710 1
1 1098 . 5 1 1 A 104 104 THR H H 104 7.691 7.602 0.089 1
1 1099 . 5 1 1 A 104 104 THR HA H 104 4.031 4.803 -0.772 1
1 1104 . 5 1 1 A 104 104 THR C C 104 173.405 173.901 -0.496 1
1 1105 . 5 1 1 A 104 104 THR CA C 104 64.307 59.914 4.393 1
1 1106 . 5 1 1 A 104 104 THR CB C 104 68.354 71.563 -3.209 1
1 1108 . 5 1 1 A 104 104 THR N N 104 119.913 113.787 6.126 1
1 1109 . 5 1 1 A 105 105 LYS H H 105 8.297 8.776 -0.479 1
1 1110 . 5 1 1 A 105 105 LYS HA H 105 5.457 4.825 0.632 1
1 1116 . 5 1 1 A 105 105 LYS C C 105 177.055 175.418 1.637 1
1 1117 . 5 1 1 A 105 105 LYS CA C 105 54.401 55.647 -1.246 1
1 1118 . 5 1 1 A 105 105 LYS CB C 105 34.230 33.945 0.285 1
1 1122 . 5 1 1 A 105 105 LYS N N 105 125.597 122.084 3.513 1
1 1123 . 5 1 1 A 106 106 ILE H H 106 9.238 9.128 0.110 1
1 1124 . 5 1 1 A 106 106 ILE HA H 106 4.289 4.856 -0.567 1
1 1133 . 5 1 1 A 106 106 ILE C C 106 174.221 174.418 -0.197 1
1 1134 . 5 1 1 A 106 106 ILE CA C 106 60.631 59.950 0.681 1
1 1135 . 5 1 1 A 106 106 ILE CB C 106 41.927 39.735 2.192 1
1 1139 . 5 1 1 A 106 106 ILE N N 106 124.499 124.604 -0.105 1
1 1140 . 5 1 1 A 107 107 LYS H H 107 8.650 9.111 -0.461 1
1 1141 . 5 1 1 A 107 107 LYS HA H 107 5.608 4.959 0.649 1
1 1147 . 5 1 1 A 107 107 LYS C C 107 175.681 175.059 0.622 1
1 1148 . 5 1 1 A 107 107 LYS CA C 107 55.248 54.953 0.295 1
1 1149 . 5 1 1 A 107 107 LYS CB C 107 33.618 34.223 -0.605 1
1 1153 . 5 1 1 A 107 107 LYS N N 107 130.844 128.700 2.144 1
1 1154 . 5 1 1 A 108 108 ILE H H 108 9.448 8.364 1.084 1
1 1155 . 5 1 1 A 108 108 ILE HA H 108 4.741 4.842 -0.101 1
1 1164 . 5 1 1 A 108 108 ILE C C 108 172.670 173.837 -1.167 1
1 1165 . 5 1 1 A 108 108 ILE CA C 108 59.157 59.477 -0.320 1
1 1166 . 5 1 1 A 108 108 ILE CB C 108 42.241 42.084 0.157 1
1 1170 . 5 1 1 A 108 108 ILE N N 108 125.160 127.361 -2.201 1
1 1171 . 5 1 1 A 109 109 SER H H 109 8.490 8.718 -0.228 1
1 1172 . 5 1 1 A 109 109 SER HA H 109 4.437 4.847 -0.410 1
1 1175 . 5 1 1 A 109 109 SER C C 109 176.536 176.967 -0.431 1
1 1176 . 5 1 1 A 109 109 SER CA C 109 58.850 56.972 1.878 1
1 1177 . 5 1 1 A 109 109 SER CB C 109 63.010 64.858 -1.848 1
1 1178 . 5 1 1 A 109 109 SER N N 109 122.750 120.048 2.702 1
1 1179 . 5 1 1 A 110 110 GLY H H 110 9.292 8.526 0.766 1
1 1180 . 5 1 1 A 110 110 GLY HA2 H 110 5.193 4.108 1.085 1
1 1181 . 5 1 1 A 110 110 GLY HA3 H 110 3.755 4.124 -0.369 1
1 1182 . 5 1 1 A 110 110 GLY C C 110 176.964 175.096 1.868 1
1 1183 . 5 1 1 A 110 110 GLY CA C 110 48.168 46.798 1.370 1
1 1184 . 5 1 1 A 110 110 GLY N N 110 116.628 109.750 6.878 1
1 1185 . 5 1 1 A 111 111 GLU H H 111 8.576 8.774 -0.198 1
1 1186 . 5 1 1 A 111 111 GLU HA H 111 4.080 4.148 -0.068 1
1 1191 . 5 1 1 A 111 111 GLU C C 111 178.867 178.568 0.299 1
1 1192 . 5 1 1 A 111 111 GLU CA C 111 59.150 58.527 0.623 1
1 1193 . 5 1 1 A 111 111 GLU CB C 111 28.831 28.586 0.245 1
1 1195 . 5 1 1 A 111 111 GLU N N 111 120.564 118.462 2.102 1
1 1196 . 5 1 1 A 112 112 LYS H H 112 7.605 7.879 -0.274 1
1 1197 . 5 1 1 A 112 112 LYS HA H 112 4.229 4.024 0.205 1
1 1202 . 5 1 1 A 112 112 LYS C C 112 176.710 178.131 -1.421 1
1 1203 . 5 1 1 A 112 112 LYS CA C 112 57.083 59.265 -2.182 1
1 1204 . 5 1 1 A 112 112 LYS CB C 112 32.183 32.575 -0.392 1
1 1208 . 5 1 1 A 112 112 LYS N N 112 116.628 118.879 -2.251 1
1 1209 . 5 1 1 A 113 113 LEU H H 113 7.784 7.732 0.052 1
1 1210 . 5 1 1 A 113 113 LEU HA H 113 4.387 4.297 0.090 1
1 1220 . 5 1 1 A 113 113 LEU C C 113 176.195 176.651 -0.456 1
1 1221 . 5 1 1 A 113 113 LEU CA C 113 52.617 54.175 -1.558 1
1 1222 . 5 1 1 A 113 113 LEU CB C 113 42.820 41.053 1.767 1
1 1226 . 5 1 1 A 113 113 LEU N N 113 114.219 114.459 -0.240 1
1 1227 . 5 1 1 A 114 114 VAL H H 114 7.032 7.576 -0.544 1
1 1228 . 5 1 1 A 114 114 VAL HA H 114 3.723 3.792 -0.069 1
1 1236 . 5 1 1 A 114 114 VAL C C 114 175.430 177.221 -1.791 1
1 1237 . 5 1 1 A 114 114 VAL CA C 114 65.537 63.977 1.560 1
1 1238 . 5 1 1 A 114 114 VAL CB C 114 32.115 31.300 0.815 1
1 1241 . 5 1 1 A 114 114 VAL N N 114 121.773 121.134 0.639 1
1 1242 . 5 1 1 A 115 115 GLY H H 115 8.678 8.838 -0.160 1
1 1243 . 5 1 1 A 115 115 GLY HA2 H 115 4.313 3.947 0.366 1
1 1244 . 5 1 1 A 115 115 GLY HA3 H 115 3.846 3.948 -0.102 1
1 1245 . 5 1 1 A 115 115 GLY C C 115 172.462 173.583 -1.121 1
1 1246 . 5 1 1 A 115 115 GLY CA C 115 43.743 45.547 -1.804 1
1 1247 . 5 1 1 A 115 115 GLY N N 115 117.503 116.905 0.598 1
1 1248 . 5 1 1 A 116 116 ARG H H 116 8.701 8.344 0.357 1
1 1249 . 5 1 1 A 116 116 ARG HA H 116 3.926 4.626 -0.700 1
1 1254 . 5 1 1 A 116 116 ARG CA C 116 56.470 53.483 2.987 1
1 1255 . 5 1 1 A 116 116 ARG CB C 116 29.585 29.622 -0.037 1
1 1257 . 5 1 1 A 116 116 ARG N N 116 123.504 120.821 2.683 1
1 1258 . 5 1 1 A 117 117 PRO HA H 117 4.242 4.251 -0.009 1
1 1264 . 5 1 1 A 117 117 PRO C C 117 178.947 178.162 0.785 1
1 1265 . 5 1 1 A 117 117 PRO CA C 117 65.684 64.551 1.133 1
1 1266 . 5 1 1 A 117 117 PRO CB C 117 30.949 32.085 -1.136 1
1 1269 . 5 1 1 A 118 118 GLU H H 118 10.821 8.970 1.851 1
1 1270 . 5 1 1 A 118 118 GLU HA H 118 4.197 4.079 0.118 1
1 1271 . 5 1 1 A 118 118 GLU C C 118 176.627 178.880 -2.253 1
1 1272 . 5 1 1 A 118 118 GLU CA C 118 58.045 59.341 -1.296 1
1 1273 . 5 1 1 A 118 118 GLU CB C 118 27.101 29.327 -2.226 1
1 1274 . 5 1 1 A 118 118 GLU N N 118 119.242 116.855 2.387 1
1 1275 . 5 1 1 A 119 119 MET H H 119 7.226 8.099 -0.873 1
1 1276 . 5 1 1 A 119 119 MET HA H 119 4.591 4.010 0.581 1
1 1279 . 5 1 1 A 119 119 MET C C 119 180.024 178.417 1.607 1
1 1280 . 5 1 1 A 119 119 MET CA C 119 54.695 58.939 -4.244 1
1 1281 . 5 1 1 A 119 119 MET CB C 119 31.012 32.153 -1.141 1
1 1283 . 5 1 1 A 119 119 MET N N 119 119.475 119.803 -0.328 1
1 1284 . 5 1 1 A 120 120 ARG H H 120 7.877 8.092 -0.215 1
1 1285 . 5 1 1 A 120 120 ARG HA H 120 3.988 4.079 -0.091 1
1 1292 . 5 1 1 A 120 120 ARG C C 120 177.705 178.634 -0.929 1
1 1293 . 5 1 1 A 120 120 ARG CA C 120 60.773 58.411 2.362 1
1 1294 . 5 1 1 A 120 120 ARG CB C 120 31.159 29.740 1.419 1
1 1295 . 5 1 1 A 120 120 ARG N N 120 122.099 119.310 2.789 1
1 1296 . 5 1 1 A 121 121 LEU H H 121 6.732 8.092 -1.360 1
1 1297 . 5 1 1 A 121 121 LEU HA H 121 4.170 4.009 0.161 1
1 1307 . 5 1 1 A 121 121 LEU C C 121 176.220 178.415 -2.195 1
1 1308 . 5 1 1 A 121 121 LEU CA C 121 57.370 57.843 -0.473 1
1 1309 . 5 1 1 A 121 121 LEU CB C 121 42.945 41.805 1.140 1
1 1312 . 5 1 1 A 121 121 LEU N N 121 114.436 120.106 -5.670 1
1 1313 . 5 1 1 A 122 122 LYS H H 122 7.555 7.546 0.009 1
1 1314 . 5 1 1 A 122 122 LYS HA H 122 4.338 4.372 -0.034 1
1 1321 . 5 1 1 A 122 122 LYS C C 122 176.969 176.634 0.335 1
1 1322 . 5 1 1 A 122 122 LYS CA C 122 55.621 55.645 -0.024 1
1 1323 . 5 1 1 A 122 122 LYS CB C 122 32.414 33.585 -1.171 1
1 1327 . 5 1 1 A 122 122 LYS N N 122 115.754 117.059 -1.305 1
1 1328 . 5 1 1 A 123 123 LYS H H 123 7.688 8.118 -0.430 1
1 1329 . 5 1 1 A 123 123 LYS HA H 123 4.535 4.373 0.162 1
1 1330 . 5 1 1 A 123 123 LYS CA C 123 58.461 56.748 1.713 1
1 1331 . 5 1 1 A 123 123 LYS CB C 123 33.138 31.664 1.474 1
1 1332 . 5 1 1 A 123 123 LYS N N 123 120.843 119.686 1.157 1
1 1333 . 5 1 1 A 126 126 ARG HA H 126 4.347 4.422 -0.075 1
1 1338 . 5 1 1 A 126 126 ARG C C 126 174.573 174.551 0.022 1
1 1339 . 5 1 1 A 126 126 ARG CA C 126 55.998 54.176 1.822 1
1 1340 . 5 1 1 A 126 126 ARG CB C 126 31.569 33.688 -2.119 1
1 128 . 6 1 1 A 18 18 GLY H H 18 8.343 7.999 0.344 1
1 129 . 6 1 1 A 18 18 GLY HA2 H 18 3.894 4.016 -0.122 1
1 130 . 6 1 1 A 18 18 GLY C C 18 177.743 174.879 2.864 1
1 131 . 6 1 1 A 18 18 GLY CA C 18 45.497 45.674 -0.177 1
1 132 . 6 1 1 A 18 18 GLY N N 18 109.925 108.398 1.527 1
1 133 . 6 1 1 A 19 19 SER H H 19 8.005 8.874 -0.869 1
1 134 . 6 1 1 A 19 19 SER HA H 19 4.329 4.427 -0.098 1
1 136 . 6 1 1 A 19 19 SER C C 19 175.168 176.118 -0.950 1
1 137 . 6 1 1 A 19 19 SER CA C 19 58.852 60.366 -1.514 1
1 138 . 6 1 1 A 19 19 SER CB C 19 63.604 63.620 -0.016 1
1 139 . 6 1 1 A 19 19 SER N N 19 115.090 119.158 -4.068 1
1 140 . 6 1 1 A 20 20 TYR H H 20 8.040 7.689 0.351 1
1 141 . 6 1 1 A 20 20 TYR HA H 20 4.439 4.331 0.108 1
1 146 . 6 1 1 A 20 20 TYR C C 20 176.111 178.646 -2.535 1
1 147 . 6 1 1 A 20 20 TYR CA C 20 57.966 61.376 -3.410 1
1 148 . 6 1 1 A 20 20 TYR CB C 20 37.472 38.413 -0.941 1
1 149 . 6 1 1 A 20 20 TYR N N 20 118.675 120.715 -2.040 1
1 150 . 6 1 1 A 21 21 GLN H H 21 7.909 8.565 -0.656 1
1 151 . 6 1 1 A 21 21 GLN HA H 21 3.903 4.231 -0.328 1
1 155 . 6 1 1 A 21 21 GLN C C 21 178.003 177.413 0.590 1
1 156 . 6 1 1 A 21 21 GLN CA C 21 58.523 58.433 0.090 1
1 157 . 6 1 1 A 21 21 GLN CB C 21 28.438 28.669 -0.231 1
1 159 . 6 1 1 A 21 21 GLN N N 21 117.056 118.516 -1.460 1
1 160 . 6 1 1 A 22 22 GLU H H 22 8.965 9.139 -0.174 1
1 161 . 6 1 1 A 22 22 GLU HA H 22 4.267 4.287 -0.020 1
1 165 . 6 1 1 A 22 22 GLU C C 22 176.451 178.032 -1.581 1
1 166 . 6 1 1 A 22 22 GLU CA C 22 58.273 58.485 -0.212 1
1 167 . 6 1 1 A 22 22 GLU CB C 22 29.412 30.128 -0.716 1
1 169 . 6 1 1 A 22 22 GLU N N 22 117.289 119.613 -2.324 1
1 170 . 6 1 1 A 23 23 ILE H H 23 7.596 7.644 -0.048 1
1 171 . 6 1 1 A 23 23 ILE HA H 23 4.161 4.425 -0.264 1
1 180 . 6 1 1 A 23 23 ILE C C 23 176.195 175.911 0.284 1
1 181 . 6 1 1 A 23 23 ILE CA C 23 58.120 60.825 -2.705 1
1 182 . 6 1 1 A 23 23 ILE CB C 23 38.461 37.752 0.709 1
1 186 . 6 1 1 A 23 23 ILE N N 23 114.005 117.139 -3.134 1
1 187 . 6 1 1 A 24 24 ILE H H 24 7.178 7.231 -0.053 1
1 188 . 6 1 1 A 24 24 ILE HA H 24 3.740 4.019 -0.279 1
1 197 . 6 1 1 A 24 24 ILE C C 24 177.831 176.793 1.038 1
1 198 . 6 1 1 A 24 24 ILE CA C 24 63.318 62.172 1.146 1
1 199 . 6 1 1 A 24 24 ILE CB C 24 36.590 38.350 -1.760 1
1 203 . 6 1 1 A 24 24 ILE N N 24 122.099 125.231 -3.132 1
1 204 . 6 1 1 A 25 25 GLY H H 25 8.618 8.798 -0.180 1
1 205 . 6 1 1 A 25 25 GLY HA2 H 25 4.390 3.960 0.430 1
1 206 . 6 1 1 A 25 25 GLY HA3 H 25 4.168 3.977 0.191 1
1 207 . 6 1 1 A 25 25 GLY C C 25 175.210 176.145 -0.935 1
1 208 . 6 1 1 A 25 25 GLY CA C 25 45.798 45.343 0.455 1
1 209 . 6 1 1 A 25 25 GLY N N 25 115.531 117.636 -2.105 1
1 210 . 6 1 1 A 26 26 ARG H H 26 8.277 8.177 0.100 1
1 211 . 6 1 1 A 26 26 ARG HA H 26 4.477 4.594 -0.117 1
1 218 . 6 1 1 A 26 26 ARG C C 26 175.944 177.743 -1.799 1
1 219 . 6 1 1 A 26 26 ARG CA C 26 54.408 56.809 -2.401 1
1 220 . 6 1 1 A 26 26 ARG CB C 26 29.501 30.227 -0.726 1
1 223 . 6 1 1 A 26 26 ARG N N 26 119.689 121.416 -1.727 1
1 224 . 6 1 1 A 27 27 THR H H 27 7.923 8.652 -0.729 1
1 225 . 6 1 1 A 27 27 THR HA H 27 3.792 4.091 -0.299 1
1 230 . 6 1 1 A 27 27 THR C C 27 175.251 176.435 -1.184 1
1 231 . 6 1 1 A 27 27 THR CA C 27 64.791 65.296 -0.505 1
1 232 . 6 1 1 A 27 27 THR CB C 27 68.354 68.144 0.210 1
1 234 . 6 1 1 A 27 27 THR N N 27 109.195 113.208 -4.013 1
1 235 . 6 1 1 A 28 28 TRP H H 28 7.389 8.033 -0.644 1
1 236 . 6 1 1 A 28 28 TRP HA H 28 4.441 4.303 0.138 1
1 240 . 6 1 1 A 28 28 TRP C C 28 178.519 178.390 0.129 1
1 241 . 6 1 1 A 28 28 TRP CA C 28 57.789 61.249 -3.460 1
1 242 . 6 1 1 A 28 28 TRP CB C 28 27.387 29.898 -2.511 1
1 243 . 6 1 1 A 28 28 TRP N N 28 120.127 124.926 -4.799 1
1 244 . 6 1 1 A 29 29 ILE H H 29 6.832 8.281 -1.449 1
1 245 . 6 1 1 A 29 29 ILE HA H 29 3.612 3.448 0.164 1
1 254 . 6 1 1 A 29 29 ILE C C 29 176.023 177.236 -1.213 1
1 255 . 6 1 1 A 29 29 ILE CA C 29 63.773 63.495 0.278 1
1 256 . 6 1 1 A 29 29 ILE CB C 29 37.567 37.224 0.343 1
1 260 . 6 1 1 A 29 29 ILE N N 29 119.913 117.882 2.031 1
1 261 . 6 1 1 A 30 30 PHE H H 30 7.329 7.607 -0.278 1
1 262 . 6 1 1 A 30 30 PHE HA H 30 3.912 4.397 -0.485 1
1 268 . 6 1 1 A 30 30 PHE C C 30 177.101 177.865 -0.764 1
1 269 . 6 1 1 A 30 30 PHE CA C 30 59.436 60.354 -0.918 1
1 270 . 6 1 1 A 30 30 PHE CB C 30 38.734 39.770 -1.036 1
1 271 . 6 1 1 A 30 30 PHE N N 30 116.638 120.662 -4.024 1
1 272 . 6 1 1 A 31 31 ARG H H 31 7.399 8.766 -1.367 1
1 273 . 6 1 1 A 31 31 ARG HA H 31 4.287 4.362 -0.075 1
1 278 . 6 1 1 A 31 31 ARG C C 31 176.539 177.438 -0.899 1
1 279 . 6 1 1 A 31 31 ARG CA C 31 58.852 58.247 0.605 1
1 280 . 6 1 1 A 31 31 ARG CB C 31 29.461 30.179 -0.718 1
1 281 . 6 1 1 A 31 31 ARG N N 31 122.099 117.795 4.304 1
1 282 . 6 1 1 A 32 32 GLY H H 32 8.346 9.029 -0.683 1
1 283 . 6 1 1 A 32 32 GLY HA2 H 32 4.284 3.053 1.231 1
1 284 . 6 1 1 A 32 32 GLY HA3 H 32 3.629 3.633 -0.004 1
1 285 . 6 1 1 A 32 32 GLY C C 32 173.791 174.072 -0.281 1
1 286 . 6 1 1 A 32 32 GLY CA C 32 45.793 45.100 0.693 1
1 287 . 6 1 1 A 32 32 GLY N N 32 109.964 107.156 2.808 1
1 288 . 6 1 1 A 33 33 ALA H H 33 7.510 7.843 -0.333 1
1 289 . 6 1 1 A 33 33 ALA HA H 33 4.193 4.413 -0.220 1
1 293 . 6 1 1 A 33 33 ALA C C 33 176.672 176.021 0.651 1
1 294 . 6 1 1 A 33 33 ALA CA C 33 54.401 51.433 2.968 1
1 295 . 6 1 1 A 33 33 ALA CB C 33 19.368 19.985 -0.617 1
1 296 . 6 1 1 A 33 33 ALA N N 33 122.266 121.173 1.093 1
1 297 . 6 1 1 A 34 34 HIS H H 34 8.759 7.237 1.522 1
1 298 . 6 1 1 A 34 34 HIS HA H 34 4.529 5.112 -0.583 1
1 302 . 6 1 1 A 34 34 HIS C C 34 175.767 174.531 1.236 1
1 303 . 6 1 1 A 34 34 HIS CA C 34 54.997 54.523 0.474 1
1 304 . 6 1 1 A 34 34 HIS CB C 34 31.089 31.702 -0.613 1
1 305 . 6 1 1 A 34 34 HIS N N 34 119.038 118.132 0.906 1
1 306 . 6 1 1 A 35 35 ARG H H 35 8.142 8.611 -0.469 1
1 307 . 6 1 1 A 35 35 ARG HA H 35 4.700 4.306 0.394 1
1 314 . 6 1 1 A 35 35 ARG C C 35 177.572 176.121 1.451 1
1 315 . 6 1 1 A 35 35 ARG CA C 35 54.103 55.424 -1.321 1
1 316 . 6 1 1 A 35 35 ARG CB C 35 29.112 31.776 -2.664 1
1 319 . 6 1 1 A 35 35 ARG N N 35 127.785 127.431 0.354 1
1 320 . 6 1 1 A 36 36 GLY H H 36 9.352 7.932 1.420 1
1 321 . 6 1 1 A 36 36 GLY HA2 H 36 4.291 4.069 0.222 1
1 322 . 6 1 1 A 36 36 GLY HA3 H 36 3.247 4.081 -0.834 1
1 323 . 6 1 1 A 36 36 GLY C C 36 173.876 172.834 1.042 1
1 324 . 6 1 1 A 36 36 GLY CA C 36 45.644 45.392 0.252 1
1 325 . 6 1 1 A 36 36 GLY N N 36 109.626 108.178 1.448 1
1 326 . 6 1 1 A 37 37 ARG H H 37 9.384 8.579 0.805 1
1 327 . 6 1 1 A 37 37 ARG HA H 37 4.688 4.257 0.431 1
1 333 . 6 1 1 A 37 37 ARG C C 37 175.081 174.707 0.374 1
1 334 . 6 1 1 A 37 37 ARG CA C 37 55.742 56.751 -1.009 1
1 335 . 6 1 1 A 37 37 ARG CB C 37 28.138 30.928 -2.790 1
1 338 . 6 1 1 A 37 37 ARG N N 37 127.132 123.291 3.841 1
1 339 . 6 1 1 A 38 38 VAL H H 38 7.605 5.790 1.815 1
1 340 . 6 1 1 A 38 38 VAL HA H 38 4.591 4.256 0.335 1
1 348 . 6 1 1 A 38 38 VAL C C 38 174.391 173.908 0.483 1
1 349 . 6 1 1 A 38 38 VAL CA C 38 60.092 59.778 0.314 1
1 350 . 6 1 1 A 38 38 VAL CB C 38 33.328 33.919 -0.591 1
1 353 . 6 1 1 A 38 38 VAL N N 38 126.253 124.670 1.583 1
1 354 . 6 1 1 A 39 39 ASN H H 39 9.007 7.935 1.072 1
1 355 . 6 1 1 A 39 39 ASN HA H 39 4.736 4.825 -0.089 1
1 358 . 6 1 1 A 39 39 ASN C C 39 174.562 174.994 -0.432 1
1 359 . 6 1 1 A 39 39 ASN CA C 39 51.577 52.283 -0.706 1
1 360 . 6 1 1 A 39 39 ASN CB C 39 40.749 41.697 -0.948 1
1 361 . 6 1 1 A 39 39 ASN N N 39 123.411 122.128 1.283 1
1 362 . 6 1 1 A 40 40 LYS H H 40 8.510 8.699 -0.189 1
1 363 . 6 1 1 A 40 40 LYS HA H 40 3.909 3.880 0.029 1
1 370 . 6 1 1 A 40 40 LYS C C 40 176.629 178.230 -1.601 1
1 371 . 6 1 1 A 40 40 LYS CA C 40 59.141 60.344 -1.203 1
1 372 . 6 1 1 A 40 40 LYS CB C 40 32.301 32.398 -0.097 1
1 376 . 6 1 1 A 40 40 LYS N N 40 116.303 124.845 -8.542 1
1 377 . 6 1 1 A 41 41 LYS H H 41 7.907 8.496 -0.589 1
1 378 . 6 1 1 A 41 41 LYS HA H 41 4.172 3.630 0.542 1
1 384 . 6 1 1 A 41 41 LYS C C 41 177.229 175.727 1.502 1
1 385 . 6 1 1 A 41 41 LYS CA C 41 57.392 57.724 -0.332 1
1 386 . 6 1 1 A 41 41 LYS CB C 41 32.667 30.866 1.801 1
1 390 . 6 1 1 A 41 41 LYS N N 41 117.066 117.506 -0.440 1
1 391 . 6 1 1 A 42 42 ASN H H 42 7.962 8.540 -0.578 1
1 392 . 6 1 1 A 42 42 ASN HA H 42 4.392 4.651 -0.259 1
1 395 . 6 1 1 A 42 42 ASN C C 42 179.805 175.960 3.845 1
1 396 . 6 1 1 A 42 42 ASN CA C 42 52.335 52.694 -0.359 1
1 397 . 6 1 1 A 42 42 ASN CB C 42 39.348 39.275 0.073 1
1 398 . 6 1 1 A 42 42 ASN N N 42 114.442 116.819 -2.377 1
1 399 . 6 1 1 A 43 43 ILE H H 43 7.806 8.536 -0.730 1
1 400 . 6 1 1 A 43 43 ILE HA H 43 3.747 3.925 -0.178 1
1 409 . 6 1 1 A 43 43 ILE C C 43 174.219 177.268 -3.049 1
1 410 . 6 1 1 A 43 43 ILE CA C 43 64.505 63.517 0.988 1
1 411 . 6 1 1 A 43 43 ILE CB C 43 36.595 38.471 -1.876 1
1 415 . 6 1 1 A 43 43 ILE N N 43 121.001 120.560 0.441 1
1 416 . 6 1 1 A 44 44 VAL H H 44 6.154 7.824 -1.670 1
1 417 . 6 1 1 A 44 44 VAL HA H 44 3.497 3.918 -0.421 1
1 425 . 6 1 1 A 44 44 VAL C C 44 176.282 176.400 -0.118 1
1 426 . 6 1 1 A 44 44 VAL CA C 44 63.606 63.382 0.224 1
1 427 . 6 1 1 A 44 44 VAL CB C 44 30.614 31.860 -1.246 1
1 430 . 6 1 1 A 44 44 VAL N N 44 110.500 119.483 -8.983 1
1 431 . 6 1 1 A 45 45 TRP H H 45 7.419 8.188 -0.769 1
1 432 . 6 1 1 A 45 45 TRP HA H 45 4.716 4.905 -0.189 1
1 438 . 6 1 1 A 45 45 TRP C C 45 175.422 175.630 -0.208 1
1 439 . 6 1 1 A 45 45 TRP CA C 45 56.188 56.909 -0.721 1
1 440 . 6 1 1 A 45 45 TRP CB C 45 31.245 30.091 1.154 1
1 441 . 6 1 1 A 45 45 TRP N N 45 118.601 120.866 -2.265 1
1 442 . 6 1 1 A 46 46 HIS H H 46 7.582 7.574 0.008 1
1 443 . 6 1 1 A 46 46 HIS HA H 46 4.227 5.079 -0.852 1
1 448 . 6 1 1 A 46 46 HIS C C 46 177.485 174.399 3.086 1
1 449 . 6 1 1 A 46 46 HIS CA C 46 56.799 54.360 2.439 1
1 450 . 6 1 1 A 46 46 HIS CB C 46 32.017 32.746 -0.729 1
1 451 . 6 1 1 A 46 46 HIS N N 46 122.648 118.287 4.361 1
1 452 . 6 1 1 A 47 47 GLU H H 47 7.948 8.431 -0.483 1
1 453 . 6 1 1 A 47 47 GLU HA H 47 4.098 4.297 -0.199 1
1 457 . 6 1 1 A 47 47 GLU C C 47 175.596 175.771 -0.175 1
1 458 . 6 1 1 A 47 47 GLU CA C 47 56.482 56.717 -0.235 1
1 459 . 6 1 1 A 47 47 GLU CB C 47 31.839 30.286 1.553 1
1 461 . 6 1 1 A 47 47 GLU N N 47 120.485 123.892 -3.407 1
1 462 . 6 1 1 A 48 48 LEU H H 48 9.304 8.828 0.476 1
1 463 . 6 1 1 A 48 48 LEU HA H 48 4.218 4.352 -0.134 1
1 472 . 6 1 1 A 48 48 LEU C C 48 177.743 176.390 1.353 1
1 473 . 6 1 1 A 48 48 LEU CA C 48 55.043 55.066 -0.023 1
1 474 . 6 1 1 A 48 48 LEU CB C 48 41.948 41.568 0.380 1
1 477 . 6 1 1 A 48 48 LEU N N 48 128.658 127.823 0.835 1
1 478 . 6 1 1 A 49 49 ILE H H 49 8.028 8.904 -0.876 1
1 479 . 6 1 1 A 49 49 ILE HA H 49 3.279 4.560 -1.281 1
1 488 . 6 1 1 A 49 49 ILE C C 49 174.821 177.502 -2.681 1
1 489 . 6 1 1 A 49 49 ILE CA C 49 63.901 62.372 1.529 1
1 490 . 6 1 1 A 49 49 ILE CB C 49 37.775 40.669 -2.894 1
1 494 . 6 1 1 A 49 49 ILE N N 49 120.341 123.430 -3.089 1
1 495 . 6 1 1 A 50 50 GLY H H 50 9.038 7.922 1.116 1
1 496 . 6 1 1 A 50 50 GLY HA2 H 50 4.717 4.266 0.451 1
1 497 . 6 1 1 A 50 50 GLY HA3 H 50 3.491 4.384 -0.893 1
1 498 . 6 1 1 A 50 50 GLY C C 50 175.084 173.835 1.249 1
1 499 . 6 1 1 A 50 50 GLY CA C 50 44.599 45.483 -0.884 1
1 500 . 6 1 1 A 50 50 GLY N N 50 110.284 110.014 0.270 1
1 501 . 6 1 1 A 51 51 LEU H H 51 8.400 7.478 0.922 1
1 502 . 6 1 1 A 51 51 LEU HA H 51 4.723 3.478 1.245 1
1 512 . 6 1 1 A 51 51 LEU C C 51 177.147 175.741 1.406 1
1 513 . 6 1 1 A 51 51 LEU CA C 51 54.350 55.553 -1.203 1
1 514 . 6 1 1 A 51 51 LEU CB C 51 42.985 43.038 -0.053 1
1 518 . 6 1 1 A 51 51 LEU N N 51 120.471 122.693 -2.222 1
1 519 . 6 1 1 A 52 52 LYS H H 52 7.505 8.207 -0.702 1
1 520 . 6 1 1 A 52 52 LYS HA H 52 4.250 3.921 0.329 1
1 527 . 6 1 1 A 52 52 LYS C C 52 174.995 175.126 -0.131 1
1 528 . 6 1 1 A 52 52 LYS CA C 52 55.589 55.999 -0.410 1
1 529 . 6 1 1 A 52 52 LYS CB C 52 33.025 32.744 0.281 1
1 533 . 6 1 1 A 52 52 LYS N N 52 122.406 125.258 -2.852 1
1 534 . 6 1 1 A 53 53 VAL H H 53 9.075 8.075 1.000 1
1 535 . 6 1 1 A 53 53 VAL HA H 53 5.071 4.842 0.229 1
1 543 . 6 1 1 A 53 53 VAL C C 53 171.170 173.566 -2.396 1
1 544 . 6 1 1 A 53 53 VAL CA C 53 58.523 59.111 -0.588 1
1 545 . 6 1 1 A 53 53 VAL CB C 53 35.698 35.170 0.528 1
1 548 . 6 1 1 A 53 53 VAL N N 53 124.509 123.867 0.642 1
1 549 . 6 1 1 A 54 54 ARG H H 54 8.148 8.252 -0.104 1
1 550 . 6 1 1 A 54 54 ARG HA H 54 5.329 5.151 0.178 1
1 557 . 6 1 1 A 54 54 ARG C C 54 176.113 174.184 1.929 1
1 558 . 6 1 1 A 54 54 ARG CA C 54 53.817 54.233 -0.416 1
1 559 . 6 1 1 A 54 54 ARG CB C 54 34.511 33.757 0.754 1
1 562 . 6 1 1 A 54 54 ARG N N 54 123.625 121.440 2.185 1
1 563 . 6 1 1 A 55 55 VAL H H 55 8.659 9.081 -0.422 1
1 564 . 6 1 1 A 55 55 VAL HA H 55 4.085 3.903 0.182 1
1 572 . 6 1 1 A 55 55 VAL C C 55 176.282 175.299 0.983 1
1 573 . 6 1 1 A 55 55 VAL CA C 55 62.814 62.954 -0.140 1
1 574 . 6 1 1 A 55 55 VAL CB C 55 30.628 30.960 -0.332 1
1 577 . 6 1 1 A 55 55 VAL N N 55 125.383 123.007 2.376 1
1 578 . 6 1 1 A 56 56 VAL H H 56 8.057 8.569 -0.512 1
1 579 . 6 1 1 A 56 56 VAL HA H 56 4.123 3.972 0.151 1
1 587 . 6 1 1 A 56 56 VAL C C 56 175.426 176.305 -0.879 1
1 588 . 6 1 1 A 56 56 VAL CA C 56 62.786 64.236 -1.450 1
1 589 . 6 1 1 A 56 56 VAL CB C 56 32.267 32.498 -0.231 1
1 592 . 6 1 1 A 56 56 VAL N N 56 124.936 129.557 -4.621 1
1 593 . 6 1 1 A 57 57 ASN H H 57 7.527 8.249 -0.722 1
1 594 . 6 1 1 A 57 57 ASN HA H 57 4.817 5.226 -0.409 1
1 597 . 6 1 1 A 57 57 ASN C C 57 172.973 173.535 -0.562 1
1 598 . 6 1 1 A 57 57 ASN CA C 57 52.460 52.207 0.253 1
1 599 . 6 1 1 A 57 57 ASN CB C 57 42.070 41.374 0.696 1
1 600 . 6 1 1 A 57 57 ASN N N 57 114.777 116.603 -1.826 1
1 601 . 6 1 1 A 58 58 SER H H 58 8.193 8.853 -0.660 1
1 602 . 6 1 1 A 58 58 SER HA H 58 5.214 4.816 0.398 1
1 605 . 6 1 1 A 58 58 SER C C 58 174.221 172.004 2.217 1
1 606 . 6 1 1 A 58 58 SER CA C 58 56.778 56.327 0.451 1
1 607 . 6 1 1 A 58 58 SER CB C 58 63.906 65.237 -1.331 1
1 608 . 6 1 1 A 58 58 SER N N 58 115.531 119.536 -4.005 1
1 609 . 6 1 1 A 59 59 THR H H 59 8.053 7.916 0.137 1
1 610 . 6 1 1 A 59 59 THR HA H 59 4.305 4.641 -0.336 1
1 615 . 6 1 1 A 59 59 THR C C 59 174.478 172.477 2.001 1
1 616 . 6 1 1 A 59 59 THR CA C 59 63.305 60.156 3.149 1
1 617 . 6 1 1 A 59 59 THR CB C 59 68.354 68.332 0.022 1
1 619 . 6 1 1 A 59 59 THR N N 59 116.405 116.471 -0.066 1
1 620 . 6 1 1 A 60 60 HIS H H 60 8.359 7.981 0.378 1
1 621 . 6 1 1 A 60 60 HIS HA H 60 5.167 5.070 0.097 1
1 626 . 6 1 1 A 60 60 HIS CA C 60 52.792 53.804 -1.012 1
1 627 . 6 1 1 A 60 60 HIS CB C 60 32.142 33.202 -1.060 1
1 628 . 6 1 1 A 60 60 HIS N N 60 123.625 125.003 -1.378 1
1 629 . 6 1 1 A 61 61 PRO HA H 61 4.277 4.418 -0.141 1
1 636 . 6 1 1 A 61 61 PRO C C 61 178.217 177.249 0.968 1
1 637 . 6 1 1 A 61 61 PRO CA C 61 64.375 64.087 0.288 1
1 638 . 6 1 1 A 61 61 PRO CB C 61 32.007 31.837 0.170 1
1 641 . 6 1 1 A 62 62 GLY H H 62 8.421 7.957 0.464 1
1 642 . 6 1 1 A 62 62 GLY HA2 H 62 3.889 3.636 0.253 1
1 643 . 6 1 1 A 62 62 GLY HA3 H 62 3.653 3.842 -0.189 1
1 644 . 6 1 1 A 62 62 GLY C C 62 174.994 173.917 1.077 1
1 645 . 6 1 1 A 62 62 GLY CA C 62 45.831 45.078 0.753 1
1 646 . 6 1 1 A 62 62 GLY N N 62 106.132 106.090 0.042 1
1 647 . 6 1 1 A 63 63 TYR H H 63 7.327 7.320 0.007 1
1 648 . 6 1 1 A 63 63 TYR HA H 63 4.846 4.637 0.209 1
1 652 . 6 1 1 A 63 63 TYR C C 63 175.593 175.510 0.083 1
1 653 . 6 1 1 A 63 63 TYR CA C 63 56.071 58.519 -2.448 1
1 654 . 6 1 1 A 63 63 TYR CB C 63 38.962 40.582 -1.620 1
1 655 . 6 1 1 A 63 63 TYR N N 63 116.628 116.845 -0.217 1
1 656 . 6 1 1 A 64 64 VAL H H 64 7.296 7.144 0.152 1
1 657 . 6 1 1 A 64 64 VAL HA H 64 3.180 4.095 -0.915 1
1 665 . 6 1 1 A 64 64 VAL C C 64 177.312 176.520 0.792 1
1 666 . 6 1 1 A 64 64 VAL CA C 64 65.688 62.674 3.014 1
1 667 . 6 1 1 A 64 64 VAL CB C 64 30.957 32.006 -1.049 1
1 670 . 6 1 1 A 64 64 VAL N N 64 117.940 118.485 -0.545 1
1 671 . 6 1 1 A 65 65 GLY H H 65 8.449 9.752 -1.303 1
1 672 . 6 1 1 A 65 65 GLY HA2 H 65 4.320 3.949 0.371 1
1 673 . 6 1 1 A 65 65 GLY HA3 H 65 3.515 3.963 -0.448 1
1 674 . 6 1 1 A 65 65 GLY C C 65 174.821 173.497 1.324 1
1 675 . 6 1 1 A 65 65 GLY CA C 65 44.599 45.286 -0.687 1
1 676 . 6 1 1 A 65 65 GLY N N 65 115.317 114.076 1.241 1
1 677 . 6 1 1 A 66 66 ILE H H 66 7.095 7.562 -0.467 1
1 678 . 6 1 1 A 66 66 ILE HA H 66 3.193 4.712 -1.519 1
1 687 . 6 1 1 A 66 66 ILE C C 66 174.308 174.914 -0.606 1
1 688 . 6 1 1 A 66 66 ILE CA C 66 63.470 59.969 3.501 1
1 689 . 6 1 1 A 66 66 ILE CB C 66 37.775 40.384 -2.609 1
1 693 . 6 1 1 A 66 66 ILE N N 66 122.099 122.603 -0.504 1
1 694 . 6 1 1 A 67 67 GLU H H 67 7.126 8.700 -1.574 1
1 695 . 6 1 1 A 67 67 GLU HA H 67 5.343 5.171 0.172 1
1 699 . 6 1 1 A 67 67 GLU C C 67 174.652 175.422 -0.770 1
1 700 . 6 1 1 A 67 67 GLU CA C 67 54.109 54.475 -0.366 1
1 701 . 6 1 1 A 67 67 GLU CB C 67 33.619 32.825 0.794 1
1 703 . 6 1 1 A 67 67 GLU N N 67 125.164 125.282 -0.118 1
1 704 . 6 1 1 A 68 68 GLY H H 68 8.401 8.433 -0.032 1
1 705 . 6 1 1 A 68 68 GLY HA2 H 68 4.364 3.810 0.554 1
1 706 . 6 1 1 A 68 68 GLY HA3 H 68 4.041 4.098 -0.057 1
1 707 . 6 1 1 A 68 68 GLY C C 68 171.644 171.254 0.390 1
1 708 . 6 1 1 A 68 68 GLY CA C 68 45.680 44.847 0.833 1
1 709 . 6 1 1 A 68 68 GLY N N 68 109.626 112.489 -2.863 1
1 710 . 6 1 1 A 69 69 TYR H H 69 8.422 8.574 -0.152 1
1 711 . 6 1 1 A 69 69 TYR HA H 69 5.079 4.801 0.278 1
1 714 . 6 1 1 A 69 69 TYR C C 69 176.194 175.444 0.750 1
1 715 . 6 1 1 A 69 69 TYR CA C 69 57.681 58.135 -0.454 1
1 716 . 6 1 1 A 69 69 TYR CB C 69 41.043 39.671 1.372 1
1 717 . 6 1 1 A 69 69 TYR N N 69 119.689 119.538 0.151 1
1 718 . 6 1 1 A 70 70 VAL H H 70 8.753 8.563 0.190 1
1 719 . 6 1 1 A 70 70 VAL HA H 70 4.143 4.367 -0.224 1
1 727 . 6 1 1 A 70 70 VAL C C 70 176.540 175.676 0.864 1
1 728 . 6 1 1 A 70 70 VAL CA C 70 63.477 63.623 -0.146 1
1 729 . 6 1 1 A 70 70 VAL CB C 70 30.952 32.143 -1.191 1
1 732 . 6 1 1 A 70 70 VAL N N 70 123.420 125.105 -1.685 1
1 733 . 6 1 1 A 71 71 ILE H H 71 9.101 9.739 -0.638 1
1 734 . 6 1 1 A 71 71 ILE HA H 71 4.834 4.610 0.224 1
1 743 . 6 1 1 A 71 71 ILE C C 71 175.418 175.961 -0.543 1
1 744 . 6 1 1 A 71 71 ILE CA C 71 60.637 62.338 -1.701 1
1 745 . 6 1 1 A 71 71 ILE CB C 71 39.853 40.386 -0.533 1
1 749 . 6 1 1 A 71 71 ILE N N 71 119.913 124.164 -4.251 1
1 750 . 6 1 1 A 72 72 ASP H H 72 8.030 8.287 -0.257 1
1 751 . 6 1 1 A 72 72 ASP HA H 72 4.964 5.174 -0.210 1
1 754 . 6 1 1 A 72 72 ASP C C 72 173.017 174.891 -1.874 1
1 755 . 6 1 1 A 72 72 ASP CA C 72 53.511 53.298 0.213 1
1 756 . 6 1 1 A 72 72 ASP CB C 72 41.932 43.995 -2.063 1
1 757 . 6 1 1 A 72 72 ASP N N 72 118.377 119.994 -1.617 1
1 758 . 6 1 1 A 73 73 GLU H H 73 9.349 8.891 0.458 1
1 759 . 6 1 1 A 73 73 GLU HA H 73 4.868 5.389 -0.521 1
1 762 . 6 1 1 A 73 73 GLU C C 73 173.793 174.778 -0.985 1
1 763 . 6 1 1 A 73 73 GLU CA C 73 55.521 54.959 0.562 1
1 764 . 6 1 1 A 73 73 GLU CB C 73 33.138 32.045 1.093 1
1 766 . 6 1 1 A 73 73 GLU N N 73 123.848 123.519 0.329 1
1 767 . 6 1 1 A 74 74 THR H H 74 8.748 8.743 0.005 1
1 768 . 6 1 1 A 74 74 THR HA H 74 4.992 4.856 0.136 1
1 773 . 6 1 1 A 74 74 THR CA C 74 59.450 60.094 -0.644 1
1 774 . 6 1 1 A 74 74 THR CB C 74 70.429 70.347 0.082 1
1 776 . 6 1 1 A 74 74 THR N N 74 116.628 116.644 -0.016 1
1 777 . 6 1 1 A 75 75 ARG HA H 75 3.741 3.973 -0.232 1
1 782 . 6 1 1 A 75 75 ARG C C 75 177.140 177.035 0.105 1
1 783 . 6 1 1 A 75 75 ARG CA C 75 60.041 58.310 1.731 1
1 784 . 6 1 1 A 75 75 ARG CB C 75 29.930 30.158 -0.228 1
1 787 . 6 1 1 A 76 76 ASN H H 76 8.497 8.040 0.457 1
1 788 . 6 1 1 A 76 76 ASN HA H 76 5.310 4.918 0.392 1
1 791 . 6 1 1 A 76 76 ASN C C 76 175.509 174.062 1.447 1
1 792 . 6 1 1 A 76 76 ASN CA C 76 52.320 53.058 -0.738 1
1 793 . 6 1 1 A 76 76 ASN CB C 76 40.744 40.333 0.411 1
1 794 . 6 1 1 A 76 76 ASN N N 76 111.053 116.124 -5.071 1
1 795 . 6 1 1 A 77 77 MET H H 77 7.528 7.480 0.048 1
1 796 . 6 1 1 A 77 77 MET HA H 77 5.392 4.855 0.537 1
1 801 . 6 1 1 A 77 77 MET C C 77 174.824 174.343 0.481 1
1 802 . 6 1 1 A 77 77 MET CA C 77 54.994 53.991 1.003 1
1 803 . 6 1 1 A 77 77 MET CB C 77 36.753 35.276 1.477 1
1 805 . 6 1 1 A 77 77 MET N N 77 119.913 116.014 3.899 1
1 806 . 6 1 1 A 78 78 LEU H H 78 8.977 8.593 0.384 1
1 807 . 6 1 1 A 78 78 LEU HA H 78 4.803 5.599 -0.796 1
1 817 . 6 1 1 A 78 78 LEU C C 78 174.563 174.680 -0.117 1
1 818 . 6 1 1 A 78 78 LEU CA C 78 53.964 54.630 -0.666 1
1 819 . 6 1 1 A 78 78 LEU CB C 78 44.903 45.213 -0.310 1
1 823 . 6 1 1 A 78 78 LEU N N 78 121.224 121.943 -0.719 1
1 824 . 6 1 1 A 79 79 VAL H H 79 8.115 8.974 -0.859 1
1 825 . 6 1 1 A 79 79 VAL HA H 79 4.783 5.178 -0.395 1
1 833 . 6 1 1 A 79 79 VAL C C 79 175.297 175.110 0.187 1
1 834 . 6 1 1 A 79 79 VAL CA C 79 61.821 60.784 1.037 1
1 835 . 6 1 1 A 79 79 VAL CB C 79 31.146 34.790 -3.644 1
1 838 . 6 1 1 A 79 79 VAL N N 79 124.062 127.517 -3.455 1
1 839 . 6 1 1 A 80 80 ILE H H 80 9.342 8.819 0.523 1
1 840 . 6 1 1 A 80 80 ILE HA H 80 4.764 5.264 -0.500 1
1 849 . 6 1 1 A 80 80 ILE C C 80 174.127 174.396 -0.269 1
1 850 . 6 1 1 A 80 80 ILE CA C 80 59.897 59.682 0.215 1
1 851 . 6 1 1 A 80 80 ILE CB C 80 42.225 41.630 0.595 1
1 855 . 6 1 1 A 80 80 ILE N N 80 129.970 126.273 3.697 1
1 856 . 6 1 1 A 81 81 ALA H H 81 9.478 9.536 -0.058 1
1 857 . 6 1 1 A 81 81 ALA HA H 81 5.139 5.589 -0.450 1
1 861 . 6 1 1 A 81 81 ALA C C 81 176.970 176.356 0.614 1
1 862 . 6 1 1 A 81 81 ALA CA C 81 50.835 50.220 0.615 1
1 863 . 6 1 1 A 81 81 ALA CB C 81 21.451 21.814 -0.363 1
1 864 . 6 1 1 A 81 81 ALA N N 81 129.756 129.188 0.568 1
1 865 . 6 1 1 A 82 82 GLY H H 82 8.691 8.749 -0.058 1
1 866 . 6 1 1 A 82 82 GLY HA2 H 82 5.110 3.983 1.127 1
1 867 . 6 1 1 A 82 82 GLY HA3 H 82 4.241 4.281 -0.040 1
1 868 . 6 1 1 A 82 82 GLY C C 82 173.017 174.617 -1.600 1
1 869 . 6 1 1 A 82 82 GLY CA C 82 44.166 44.875 -0.709 1
1 870 . 6 1 1 A 82 82 GLY N N 82 113.568 108.962 4.606 1
1 871 . 6 1 1 A 83 83 GLU H H 83 8.659 9.154 -0.495 1
1 872 . 6 1 1 A 83 83 GLU HA H 83 4.286 4.267 0.019 1
1 876 . 6 1 1 A 83 83 GLU C C 83 177.570 176.163 1.407 1
1 877 . 6 1 1 A 83 83 GLU CA C 83 59.017 58.726 0.291 1
1 878 . 6 1 1 A 83 83 GLU CB C 83 29.762 29.104 0.658 1
1 880 . 6 1 1 A 83 83 GLU N N 83 120.019 124.442 -4.423 1
1 881 . 6 1 1 A 84 84 ASN H H 84 8.549 8.638 -0.089 1
1 882 . 6 1 1 A 84 84 ASN HA H 84 4.821 4.910 -0.089 1
1 884 . 6 1 1 A 84 84 ASN C C 84 173.878 173.776 0.102 1
1 885 . 6 1 1 A 84 84 ASN CA C 84 52.919 53.141 -0.222 1
1 886 . 6 1 1 A 84 84 ASN CB C 84 40.150 39.234 0.916 1
1 887 . 6 1 1 A 84 84 ASN N N 84 112.778 124.452 -11.674 1
1 888 . 6 1 1 A 85 85 LYS H H 85 7.116 7.385 -0.269 1
1 889 . 6 1 1 A 85 85 LYS HA H 85 4.344 5.035 -0.691 1
1 895 . 6 1 1 A 85 85 LYS C C 85 173.278 174.542 -1.264 1
1 896 . 6 1 1 A 85 85 LYS CA C 85 55.292 54.830 0.462 1
1 897 . 6 1 1 A 85 85 LYS CB C 85 36.124 36.104 0.020 1
1 901 . 6 1 1 A 85 85 LYS N N 85 118.377 120.746 -2.369 1
1 902 . 6 1 1 A 86 86 VAL H H 86 7.781 8.751 -0.970 1
1 903 . 6 1 1 A 86 86 VAL HA H 86 4.749 5.330 -0.581 1
1 911 . 6 1 1 A 86 86 VAL C C 86 174.739 174.329 0.410 1
1 912 . 6 1 1 A 86 86 VAL CA C 86 60.716 59.454 1.262 1
1 913 . 6 1 1 A 86 86 VAL CB C 86 33.619 35.101 -1.482 1
1 916 . 6 1 1 A 86 86 VAL N N 86 120.127 118.000 2.127 1
1 917 . 6 1 1 A 87 87 TRP H H 87 9.558 9.963 -0.405 1
1 918 . 6 1 1 A 87 87 TRP HA H 87 4.958 5.172 -0.214 1
1 923 . 6 1 1 A 87 87 TRP C C 87 174.909 174.901 0.008 1
1 924 . 6 1 1 A 87 87 TRP CA C 87 57.073 55.717 1.356 1
1 925 . 6 1 1 A 87 87 TRP CB C 87 33.028 30.177 2.851 1
1 926 . 6 1 1 A 87 87 TRP N N 87 127.346 122.995 4.351 1
1 927 . 6 1 1 A 88 88 LYS H H 88 8.590 7.754 0.836 1
1 928 . 6 1 1 A 88 88 LYS HA H 88 4.856 4.560 0.296 1
1 935 . 6 1 1 A 88 88 LYS C C 88 175.382 174.372 1.010 1
1 936 . 6 1 1 A 88 88 LYS CA C 88 55.887 54.804 1.083 1
1 937 . 6 1 1 A 88 88 LYS CB C 88 32.434 33.521 -1.087 1
1 941 . 6 1 1 A 88 88 LYS N N 88 123.625 125.274 -1.649 1
1 942 . 6 1 1 A 89 89 VAL H H 89 8.829 8.046 0.783 1
1 943 . 6 1 1 A 89 89 VAL HA H 89 4.406 4.528 -0.122 1
1 951 . 6 1 1 A 89 89 VAL CA C 89 58.371 58.913 -0.542 1
1 952 . 6 1 1 A 89 89 VAL CB C 89 34.512 32.067 2.445 1
1 955 . 6 1 1 A 89 89 VAL N N 89 124.285 120.469 3.816 1
1 956 . 6 1 1 A 90 90 PRO HA H 90 5.073 4.596 0.477 1
1 961 . 6 1 1 A 90 90 PRO C C 90 177.231 177.854 -0.623 1
1 962 . 6 1 1 A 90 90 PRO CA C 90 61.795 63.025 -1.230 1
1 963 . 6 1 1 A 90 90 PRO CB C 90 31.660 32.590 -0.930 1
1 964 . 6 1 1 A 91 91 LYS H H 91 8.116 8.651 -0.535 1
1 965 . 6 1 1 A 91 91 LYS HA H 91 4.024 4.172 -0.148 1
1 969 . 6 1 1 A 91 91 LYS C C 91 178.518 177.464 1.054 1
1 970 . 6 1 1 A 91 91 LYS CA C 91 59.621 60.023 -0.402 1
1 971 . 6 1 1 A 91 91 LYS CB C 91 34.217 32.133 2.084 1
1 973 . 6 1 1 A 91 91 LYS N N 91 121.224 123.992 -2.768 1
1 974 . 6 1 1 A 92 92 ASP H H 92 8.505 8.578 -0.073 1
1 975 . 6 1 1 A 92 92 ASP HA H 92 3.781 4.634 -0.853 1
1 978 . 6 1 1 A 92 92 ASP C C 92 176.975 176.708 0.267 1
1 979 . 6 1 1 A 92 92 ASP CA C 92 56.773 55.167 1.606 1
1 980 . 6 1 1 A 92 92 ASP CB C 92 39.590 40.031 -0.441 1
1 981 . 6 1 1 A 92 92 ASP N N 92 111.815 115.749 -3.934 1
1 982 . 6 1 1 A 93 93 VAL H H 93 6.691 7.682 -0.991 1
1 983 . 6 1 1 A 93 93 VAL HA H 93 4.678 4.561 0.117 1
1 991 . 6 1 1 A 93 93 VAL C C 93 176.537 174.695 1.842 1
1 992 . 6 1 1 A 93 93 VAL CA C 93 60.120 60.374 -0.254 1
1 993 . 6 1 1 A 93 93 VAL CB C 93 31.093 32.555 -1.462 1
1 996 . 6 1 1 A 93 93 VAL N N 93 107.879 110.598 -2.719 1
1 997 . 6 1 1 A 94 94 CYS H H 94 7.249 7.683 -0.434 1
1 998 . 6 1 1 A 94 94 CYS HA H 94 5.062 4.759 0.303 1
1 1001 . 6 1 1 A 94 94 CYS C C 94 173.103 172.035 1.068 1
1 1002 . 6 1 1 A 94 94 CYS CA C 94 58.001 57.052 0.949 1
1 1003 . 6 1 1 A 94 94 CYS CB C 94 31.418 31.070 0.348 1
1 1004 . 6 1 1 A 94 94 CYS N N 94 117.940 117.356 0.584 1
1 1005 . 6 1 1 A 95 95 ILE H H 95 8.153 8.113 0.040 1
1 1006 . 6 1 1 A 95 95 ILE HA H 95 4.159 4.732 -0.573 1
1 1016 . 6 1 1 A 95 95 ILE C C 95 174.736 175.032 -0.296 1
1 1017 . 6 1 1 A 95 95 ILE CA C 95 61.234 60.187 1.047 1
1 1018 . 6 1 1 A 95 95 ILE CB C 95 38.071 39.733 -1.662 1
1 1022 . 6 1 1 A 95 95 ILE N N 95 121.876 121.845 0.031 1
1 1023 . 6 1 1 A 96 96 PHE H H 96 8.400 8.653 -0.253 1
1 1024 . 6 1 1 A 96 96 PHE HA H 96 5.004 4.885 0.119 1
1 1029 . 6 1 1 A 96 96 PHE C C 96 174.005 174.726 -0.721 1
1 1030 . 6 1 1 A 96 96 PHE CA C 96 56.922 56.879 0.043 1
1 1031 . 6 1 1 A 96 96 PHE CB C 96 44.006 41.530 2.476 1
1 1032 . 6 1 1 A 96 96 PHE N N 96 125.820 127.072 -1.252 1
1 1033 . 6 1 1 A 97 97 GLU H H 97 8.985 8.558 0.427 1
1 1034 . 6 1 1 A 97 97 GLU HA H 97 5.275 5.261 0.014 1
1 1038 . 6 1 1 A 97 97 GLU C C 97 175.596 175.183 0.413 1
1 1039 . 6 1 1 A 97 97 GLU CA C 97 55.070 55.099 -0.029 1
1 1040 . 6 1 1 A 97 97 GLU CB C 97 33.628 31.998 1.630 1
1 1042 . 6 1 1 A 97 97 GLU N N 97 121.010 121.683 -0.673 1
1 1043 . 6 1 1 A 98 98 PHE H H 98 9.304 9.263 0.041 1
1 1044 . 6 1 1 A 98 98 PHE HA H 98 5.337 5.029 0.308 1
1 1048 . 6 1 1 A 98 98 PHE C C 98 174.650 175.668 -1.018 1
1 1049 . 6 1 1 A 98 98 PHE CA C 98 57.363 57.763 -0.400 1
1 1050 . 6 1 1 A 98 98 PHE CB C 98 41.936 40.558 1.378 1
1 1051 . 6 1 1 A 98 98 PHE N N 98 128.658 126.310 2.348 1
1 1052 . 6 1 1 A 99 99 GLU H H 99 8.721 8.698 0.023 1
1 1053 . 6 1 1 A 99 99 GLU HA H 99 5.457 4.739 0.718 1
1 1058 . 6 1 1 A 99 99 GLU C C 99 176.368 176.643 -0.275 1
1 1059 . 6 1 1 A 99 99 GLU CA C 99 54.401 55.355 -0.954 1
1 1060 . 6 1 1 A 99 99 GLU CB C 99 33.068 31.287 1.781 1
1 1062 . 6 1 1 A 99 99 GLU N N 99 122.759 123.651 -0.892 1
1 1063 . 6 1 1 A 100 100 THR H H 100 8.588 10.401 -1.813 1
1 1064 . 6 1 1 A 100 100 THR HA H 100 4.603 4.494 0.109 1
1 1069 . 6 1 1 A 100 100 THR C C 100 177.144 176.739 0.405 1
1 1070 . 6 1 1 A 100 100 THR CA C 100 60.774 62.635 -1.861 1
1 1071 . 6 1 1 A 100 100 THR CB C 100 70.136 69.899 0.237 1
1 1073 . 6 1 1 A 100 100 THR N N 100 116.191 120.619 -4.428 1
1 1074 . 6 1 1 A 101 101 TRP H H 101 9.287 9.110 0.177 1
1 1075 . 6 1 1 A 101 101 TRP HA H 101 4.591 4.560 0.031 1
1 1080 . 6 1 1 A 101 101 TRP C C 101 176.457 176.710 -0.253 1
1 1081 . 6 1 1 A 101 101 TRP CA C 101 60.045 58.921 1.124 1
1 1082 . 6 1 1 A 101 101 TRP CB C 101 28.578 28.438 0.140 1
1 1083 . 6 1 1 A 101 101 TRP N N 101 122.220 124.134 -1.914 1
1 1084 . 6 1 1 A 102 102 ASP H H 102 7.553 8.257 -0.704 1
1 1085 . 6 1 1 A 102 102 ASP HA H 102 4.129 4.449 -0.320 1
1 1088 . 6 1 1 A 102 102 ASP C C 102 176.714 176.189 0.525 1
1 1089 . 6 1 1 A 102 102 ASP CA C 102 52.775 53.456 -0.681 1
1 1090 . 6 1 1 A 102 102 ASP CB C 102 39.231 40.679 -1.448 1
1 1091 . 6 1 1 A 102 102 ASP N N 102 115.763 120.203 -4.440 1
1 1092 . 6 1 1 A 103 103 GLY H H 103 7.910 8.966 -1.056 1
1 1093 . 6 1 1 A 103 103 GLY HA2 H 103 4.216 3.955 0.261 1
1 1094 . 6 1 1 A 103 103 GLY HA3 H 103 3.686 3.991 -0.305 1
1 1095 . 6 1 1 A 103 103 GLY C C 103 174.566 174.144 0.422 1
1 1096 . 6 1 1 A 103 103 GLY CA C 103 45.179 46.022 -0.843 1
1 1097 . 6 1 1 A 103 103 GLY N N 103 108.311 108.480 -0.169 1
1 1098 . 6 1 1 A 104 104 THR H H 104 7.691 7.590 0.101 1
1 1099 . 6 1 1 A 104 104 THR HA H 104 4.031 4.830 -0.799 1
1 1104 . 6 1 1 A 104 104 THR C C 104 173.405 174.011 -0.606 1
1 1105 . 6 1 1 A 104 104 THR CA C 104 64.307 59.965 4.342 1
1 1106 . 6 1 1 A 104 104 THR CB C 104 68.354 71.618 -3.264 1
1 1108 . 6 1 1 A 104 104 THR N N 104 119.913 113.375 6.538 1
1 1109 . 6 1 1 A 105 105 LYS H H 105 8.297 8.806 -0.509 1
1 1110 . 6 1 1 A 105 105 LYS HA H 105 5.457 4.792 0.665 1
1 1116 . 6 1 1 A 105 105 LYS C C 105 177.055 175.555 1.500 1
1 1117 . 6 1 1 A 105 105 LYS CA C 105 54.401 56.023 -1.622 1
1 1118 . 6 1 1 A 105 105 LYS CB C 105 34.230 33.825 0.405 1
1 1122 . 6 1 1 A 105 105 LYS N N 105 125.597 122.806 2.791 1
1 1123 . 6 1 1 A 106 106 ILE H H 106 9.238 9.133 0.105 1
1 1124 . 6 1 1 A 106 106 ILE HA H 106 4.289 4.766 -0.477 1
1 1133 . 6 1 1 A 106 106 ILE C C 106 174.221 174.464 -0.243 1
1 1134 . 6 1 1 A 106 106 ILE CA C 106 60.631 59.850 0.781 1
1 1135 . 6 1 1 A 106 106 ILE CB C 106 41.927 40.049 1.878 1
1 1139 . 6 1 1 A 106 106 ILE N N 106 124.499 124.852 -0.353 1
1 1140 . 6 1 1 A 107 107 LYS H H 107 8.650 9.088 -0.438 1
1 1141 . 6 1 1 A 107 107 LYS HA H 107 5.608 5.051 0.557 1
1 1147 . 6 1 1 A 107 107 LYS C C 107 175.681 174.974 0.707 1
1 1148 . 6 1 1 A 107 107 LYS CA C 107 55.248 54.910 0.338 1
1 1149 . 6 1 1 A 107 107 LYS CB C 107 33.618 34.252 -0.634 1
1 1153 . 6 1 1 A 107 107 LYS N N 107 130.844 128.423 2.421 1
1 1154 . 6 1 1 A 108 108 ILE H H 108 9.448 8.588 0.860 1
1 1155 . 6 1 1 A 108 108 ILE HA H 108 4.741 4.826 -0.085 1
1 1164 . 6 1 1 A 108 108 ILE C C 108 172.670 174.459 -1.789 1
1 1165 . 6 1 1 A 108 108 ILE CA C 108 59.157 59.463 -0.306 1
1 1166 . 6 1 1 A 108 108 ILE CB C 108 42.241 42.059 0.182 1
1 1170 . 6 1 1 A 108 108 ILE N N 108 125.160 127.881 -2.721 1
1 1171 . 6 1 1 A 109 109 SER H H 109 8.490 8.964 -0.474 1
1 1172 . 6 1 1 A 109 109 SER HA H 109 4.437 4.594 -0.157 1
1 1175 . 6 1 1 A 109 109 SER C C 109 176.536 176.301 0.235 1
1 1176 . 6 1 1 A 109 109 SER CA C 109 58.850 59.142 -0.292 1
1 1177 . 6 1 1 A 109 109 SER CB C 109 63.010 63.675 -0.665 1
1 1178 . 6 1 1 A 109 109 SER N N 109 122.750 124.189 -1.439 1
1 1179 . 6 1 1 A 110 110 GLY H H 110 9.292 8.478 0.814 1
1 1180 . 6 1 1 A 110 110 GLY HA2 H 110 5.193 4.121 1.072 1
1 1181 . 6 1 1 A 110 110 GLY HA3 H 110 3.755 4.135 -0.380 1
1 1182 . 6 1 1 A 110 110 GLY C C 110 176.964 175.081 1.883 1
1 1183 . 6 1 1 A 110 110 GLY CA C 110 48.168 46.828 1.340 1
1 1184 . 6 1 1 A 110 110 GLY N N 110 116.628 113.276 3.352 1
1 1185 . 6 1 1 A 111 111 GLU H H 111 8.576 8.670 -0.094 1
1 1186 . 6 1 1 A 111 111 GLU HA H 111 4.080 4.167 -0.087 1
1 1191 . 6 1 1 A 111 111 GLU C C 111 178.867 178.418 0.449 1
1 1192 . 6 1 1 A 111 111 GLU CA C 111 59.150 58.594 0.556 1
1 1193 . 6 1 1 A 111 111 GLU CB C 111 28.831 28.820 0.011 1
1 1195 . 6 1 1 A 111 111 GLU N N 111 120.564 118.315 2.249 1
1 1196 . 6 1 1 A 112 112 LYS H H 112 7.605 7.764 -0.159 1
1 1197 . 6 1 1 A 112 112 LYS HA H 112 4.229 4.048 0.181 1
1 1202 . 6 1 1 A 112 112 LYS C C 112 176.710 177.946 -1.236 1
1 1203 . 6 1 1 A 112 112 LYS CA C 112 57.083 59.521 -2.438 1
1 1204 . 6 1 1 A 112 112 LYS CB C 112 32.183 32.275 -0.092 1
1 1208 . 6 1 1 A 112 112 LYS N N 112 116.628 118.730 -2.102 1
1 1209 . 6 1 1 A 113 113 LEU H H 113 7.784 7.737 0.047 1
1 1210 . 6 1 1 A 113 113 LEU HA H 113 4.387 4.364 0.023 1
1 1220 . 6 1 1 A 113 113 LEU C C 113 176.195 176.589 -0.394 1
1 1221 . 6 1 1 A 113 113 LEU CA C 113 52.617 54.204 -1.587 1
1 1222 . 6 1 1 A 113 113 LEU CB C 113 42.820 41.254 1.566 1
1 1226 . 6 1 1 A 113 113 LEU N N 113 114.219 114.275 -0.056 1
1 1227 . 6 1 1 A 114 114 VAL H H 114 7.032 7.526 -0.494 1
1 1228 . 6 1 1 A 114 114 VAL HA H 114 3.723 3.794 -0.071 1
1 1236 . 6 1 1 A 114 114 VAL C C 114 175.430 177.217 -1.787 1
1 1237 . 6 1 1 A 114 114 VAL CA C 114 65.537 63.978 1.559 1
1 1238 . 6 1 1 A 114 114 VAL CB C 114 32.115 31.350 0.765 1
1 1241 . 6 1 1 A 114 114 VAL N N 114 121.773 121.139 0.634 1
1 1242 . 6 1 1 A 115 115 GLY H H 115 8.678 8.841 -0.163 1
1 1243 . 6 1 1 A 115 115 GLY HA2 H 115 4.313 3.943 0.370 1
1 1244 . 6 1 1 A 115 115 GLY HA3 H 115 3.846 3.948 -0.102 1
1 1245 . 6 1 1 A 115 115 GLY C C 115 172.462 173.610 -1.148 1
1 1246 . 6 1 1 A 115 115 GLY CA C 115 43.743 45.541 -1.798 1
1 1247 . 6 1 1 A 115 115 GLY N N 115 117.503 116.920 0.583 1
1 1248 . 6 1 1 A 116 116 ARG H H 116 8.701 8.248 0.453 1
1 1249 . 6 1 1 A 116 116 ARG HA H 116 3.926 4.612 -0.686 1
1 1254 . 6 1 1 A 116 116 ARG CA C 116 56.470 53.525 2.945 1
1 1255 . 6 1 1 A 116 116 ARG CB C 116 29.585 29.272 0.313 1
1 1257 . 6 1 1 A 116 116 ARG N N 116 123.504 120.827 2.677 1
1 1258 . 6 1 1 A 117 117 PRO HA H 117 4.242 4.254 -0.012 1
1 1264 . 6 1 1 A 117 117 PRO C C 117 178.947 178.123 0.824 1
1 1265 . 6 1 1 A 117 117 PRO CA C 117 65.684 64.713 0.971 1
1 1266 . 6 1 1 A 117 117 PRO CB C 117 30.949 32.084 -1.135 1
1 1269 . 6 1 1 A 118 118 GLU H H 118 10.821 8.742 2.079 1
1 1270 . 6 1 1 A 118 118 GLU HA H 118 4.197 4.087 0.110 1
1 1271 . 6 1 1 A 118 118 GLU C C 118 176.627 178.667 -2.040 1
1 1272 . 6 1 1 A 118 118 GLU CA C 118 58.045 59.218 -1.173 1
1 1273 . 6 1 1 A 118 118 GLU CB C 118 27.101 29.316 -2.215 1
1 1274 . 6 1 1 A 118 118 GLU N N 118 119.242 116.359 2.883 1
1 1275 . 6 1 1 A 119 119 MET H H 119 7.226 8.098 -0.872 1
1 1276 . 6 1 1 A 119 119 MET HA H 119 4.591 3.987 0.604 1
1 1279 . 6 1 1 A 119 119 MET C C 119 180.024 178.502 1.522 1
1 1280 . 6 1 1 A 119 119 MET CA C 119 54.695 58.884 -4.189 1
1 1281 . 6 1 1 A 119 119 MET CB C 119 31.012 32.332 -1.320 1
1 1283 . 6 1 1 A 119 119 MET N N 119 119.475 119.859 -0.384 1
1 1284 . 6 1 1 A 120 120 ARG H H 120 7.877 7.600 0.277 1
1 1285 . 6 1 1 A 120 120 ARG HA H 120 3.988 4.072 -0.084 1
1 1292 . 6 1 1 A 120 120 ARG C C 120 177.705 178.821 -1.116 1
1 1293 . 6 1 1 A 120 120 ARG CA C 120 60.773 58.349 2.424 1
1 1294 . 6 1 1 A 120 120 ARG CB C 120 31.159 29.870 1.289 1
1 1295 . 6 1 1 A 120 120 ARG N N 120 122.099 119.905 2.194 1
1 1296 . 6 1 1 A 121 121 LEU H H 121 6.732 8.017 -1.285 1
1 1297 . 6 1 1 A 121 121 LEU HA H 121 4.170 4.047 0.123 1
1 1307 . 6 1 1 A 121 121 LEU C C 121 176.220 179.339 -3.119 1
1 1308 . 6 1 1 A 121 121 LEU CA C 121 57.370 58.073 -0.703 1
1 1309 . 6 1 1 A 121 121 LEU CB C 121 42.945 41.827 1.118 1
1 1312 . 6 1 1 A 121 121 LEU N N 121 114.436 119.846 -5.410 1
1 1313 . 6 1 1 A 122 122 LYS H H 122 7.555 8.234 -0.679 1
1 1314 . 6 1 1 A 122 122 LYS HA H 122 4.338 4.296 0.042 1
1 1321 . 6 1 1 A 122 122 LYS C C 122 176.969 176.253 0.716 1
1 1322 . 6 1 1 A 122 122 LYS CA C 122 55.621 58.805 -3.184 1
1 1323 . 6 1 1 A 122 122 LYS CB C 122 32.414 33.445 -1.031 1
1 1327 . 6 1 1 A 122 122 LYS N N 122 115.754 115.068 0.686 1
1 1328 . 6 1 1 A 123 123 LYS H H 123 7.688 7.910 -0.222 1
1 1329 . 6 1 1 A 123 123 LYS HA H 123 4.535 4.256 0.279 1
1 1330 . 6 1 1 A 123 123 LYS CA C 123 58.461 56.729 1.732 1
1 1331 . 6 1 1 A 123 123 LYS CB C 123 33.138 31.785 1.353 1
1 1332 . 6 1 1 A 123 123 LYS N N 123 120.843 119.522 1.321 1
1 1333 . 6 1 1 A 126 126 ARG HA H 126 4.347 4.012 0.335 1
1 1338 . 6 1 1 A 126 126 ARG C C 126 174.573 175.359 -0.786 1
1 1339 . 6 1 1 A 126 126 ARG CA C 126 55.998 56.840 -0.842 1
1 1340 . 6 1 1 A 126 126 ARG CB C 126 31.569 28.782 2.787 1
1 128 . 7 1 1 A 18 18 GLY H H 18 8.343 7.935 0.408 1
1 129 . 7 1 1 A 18 18 GLY HA2 H 18 3.894 3.745 0.149 1
1 130 . 7 1 1 A 18 18 GLY C C 18 177.743 175.110 2.633 1
1 131 . 7 1 1 A 18 18 GLY CA C 18 45.497 46.115 -0.618 1
1 132 . 7 1 1 A 18 18 GLY N N 18 109.925 107.961 1.964 1
1 133 . 7 1 1 A 19 19 SER H H 19 8.005 8.238 -0.233 1
1 134 . 7 1 1 A 19 19 SER HA H 19 4.329 4.118 0.211 1
1 136 . 7 1 1 A 19 19 SER C C 19 175.168 176.355 -1.187 1
1 137 . 7 1 1 A 19 19 SER CA C 19 58.852 61.412 -2.560 1
1 138 . 7 1 1 A 19 19 SER CB C 19 63.604 62.817 0.787 1
1 139 . 7 1 1 A 19 19 SER N N 19 115.090 118.718 -3.628 1
1 140 . 7 1 1 A 20 20 TYR H H 20 8.040 7.264 0.776 1
1 141 . 7 1 1 A 20 20 TYR HA H 20 4.439 4.291 0.148 1
1 146 . 7 1 1 A 20 20 TYR C C 20 176.111 178.494 -2.383 1
1 147 . 7 1 1 A 20 20 TYR CA C 20 57.966 61.636 -3.670 1
1 148 . 7 1 1 A 20 20 TYR CB C 20 37.472 38.461 -0.989 1
1 149 . 7 1 1 A 20 20 TYR N N 20 118.675 120.144 -1.469 1
1 150 . 7 1 1 A 21 21 GLN H H 21 7.909 8.354 -0.445 1
1 151 . 7 1 1 A 21 21 GLN HA H 21 3.903 4.112 -0.209 1
1 155 . 7 1 1 A 21 21 GLN C C 21 178.003 177.466 0.537 1
1 156 . 7 1 1 A 21 21 GLN CA C 21 58.523 58.841 -0.318 1
1 157 . 7 1 1 A 21 21 GLN CB C 21 28.438 28.431 0.007 1
1 159 . 7 1 1 A 21 21 GLN N N 21 117.056 118.587 -1.531 1
1 160 . 7 1 1 A 22 22 GLU H H 22 8.965 9.065 -0.100 1
1 161 . 7 1 1 A 22 22 GLU HA H 22 4.267 4.435 -0.168 1
1 165 . 7 1 1 A 22 22 GLU C C 22 176.451 178.043 -1.592 1
1 166 . 7 1 1 A 22 22 GLU CA C 22 58.273 58.188 0.085 1
1 167 . 7 1 1 A 22 22 GLU CB C 22 29.412 30.447 -1.035 1
1 169 . 7 1 1 A 22 22 GLU N N 22 117.289 119.175 -1.886 1
1 170 . 7 1 1 A 23 23 ILE H H 23 7.596 7.948 -0.352 1
1 171 . 7 1 1 A 23 23 ILE HA H 23 4.161 4.414 -0.253 1
1 180 . 7 1 1 A 23 23 ILE C C 23 176.195 175.789 0.406 1
1 181 . 7 1 1 A 23 23 ILE CA C 23 58.120 60.715 -2.595 1
1 182 . 7 1 1 A 23 23 ILE CB C 23 38.461 37.430 1.031 1
1 186 . 7 1 1 A 23 23 ILE N N 23 114.005 117.148 -3.143 1
1 187 . 7 1 1 A 24 24 ILE H H 24 7.178 7.462 -0.284 1
1 188 . 7 1 1 A 24 24 ILE HA H 24 3.740 4.002 -0.262 1
1 197 . 7 1 1 A 24 24 ILE C C 24 177.831 176.749 1.082 1
1 198 . 7 1 1 A 24 24 ILE CA C 24 63.318 62.258 1.060 1
1 199 . 7 1 1 A 24 24 ILE CB C 24 36.590 38.240 -1.650 1
1 203 . 7 1 1 A 24 24 ILE N N 24 122.099 125.438 -3.339 1
1 204 . 7 1 1 A 25 25 GLY H H 25 8.618 8.872 -0.254 1
1 205 . 7 1 1 A 25 25 GLY HA2 H 25 4.390 3.937 0.453 1
1 206 . 7 1 1 A 25 25 GLY HA3 H 25 4.168 3.980 0.188 1
1 207 . 7 1 1 A 25 25 GLY C C 25 175.210 176.014 -0.804 1
1 208 . 7 1 1 A 25 25 GLY CA C 25 45.798 45.142 0.656 1
1 209 . 7 1 1 A 25 25 GLY N N 25 115.531 117.753 -2.222 1
1 210 . 7 1 1 A 26 26 ARG H H 26 8.277 8.115 0.162 1
1 211 . 7 1 1 A 26 26 ARG HA H 26 4.477 4.558 -0.081 1
1 218 . 7 1 1 A 26 26 ARG C C 26 175.944 177.616 -1.672 1
1 219 . 7 1 1 A 26 26 ARG CA C 26 54.408 56.532 -2.124 1
1 220 . 7 1 1 A 26 26 ARG CB C 26 29.501 30.274 -0.773 1
1 223 . 7 1 1 A 26 26 ARG N N 26 119.689 121.286 -1.597 1
1 224 . 7 1 1 A 27 27 THR H H 27 7.923 9.159 -1.236 1
1 225 . 7 1 1 A 27 27 THR HA H 27 3.792 3.905 -0.113 1
1 230 . 7 1 1 A 27 27 THR C C 27 175.251 176.514 -1.263 1
1 231 . 7 1 1 A 27 27 THR CA C 27 64.791 65.033 -0.242 1
1 232 . 7 1 1 A 27 27 THR CB C 27 68.354 67.945 0.409 1
1 234 . 7 1 1 A 27 27 THR N N 27 109.195 113.078 -3.883 1
1 235 . 7 1 1 A 28 28 TRP H H 28 7.389 8.101 -0.712 1
1 236 . 7 1 1 A 28 28 TRP HA H 28 4.441 4.330 0.111 1
1 240 . 7 1 1 A 28 28 TRP C C 28 178.519 178.494 0.025 1
1 241 . 7 1 1 A 28 28 TRP CA C 28 57.789 61.410 -3.621 1
1 242 . 7 1 1 A 28 28 TRP CB C 28 27.387 30.097 -2.710 1
1 243 . 7 1 1 A 28 28 TRP N N 28 120.127 124.932 -4.805 1
1 244 . 7 1 1 A 29 29 ILE H H 29 6.832 7.953 -1.121 1
1 245 . 7 1 1 A 29 29 ILE HA H 29 3.612 3.240 0.372 1
1 254 . 7 1 1 A 29 29 ILE C C 29 176.023 176.766 -0.743 1
1 255 . 7 1 1 A 29 29 ILE CA C 29 63.773 63.175 0.598 1
1 256 . 7 1 1 A 29 29 ILE CB C 29 37.567 37.391 0.176 1
1 260 . 7 1 1 A 29 29 ILE N N 29 119.913 117.739 2.174 1
1 261 . 7 1 1 A 30 30 PHE H H 30 7.329 7.704 -0.375 1
1 262 . 7 1 1 A 30 30 PHE HA H 30 3.912 4.425 -0.513 1
1 268 . 7 1 1 A 30 30 PHE C C 30 177.101 177.855 -0.754 1
1 269 . 7 1 1 A 30 30 PHE CA C 30 59.436 60.990 -1.554 1
1 270 . 7 1 1 A 30 30 PHE CB C 30 38.734 39.988 -1.254 1
1 271 . 7 1 1 A 30 30 PHE N N 30 116.638 119.921 -3.283 1
1 272 . 7 1 1 A 31 31 ARG H H 31 7.399 8.552 -1.153 1
1 273 . 7 1 1 A 31 31 ARG HA H 31 4.287 4.361 -0.074 1
1 278 . 7 1 1 A 31 31 ARG C C 31 176.539 178.501 -1.962 1
1 279 . 7 1 1 A 31 31 ARG CA C 31 58.852 59.104 -0.252 1
1 280 . 7 1 1 A 31 31 ARG CB C 31 29.461 30.684 -1.223 1
1 281 . 7 1 1 A 31 31 ARG N N 31 122.099 121.371 0.728 1
1 282 . 7 1 1 A 32 32 GLY H H 32 8.346 7.729 0.617 1
1 283 . 7 1 1 A 32 32 GLY HA2 H 32 4.284 3.533 0.751 1
1 284 . 7 1 1 A 32 32 GLY HA3 H 32 3.629 3.826 -0.197 1
1 285 . 7 1 1 A 32 32 GLY C C 32 173.791 173.811 -0.020 1
1 286 . 7 1 1 A 32 32 GLY CA C 32 45.793 46.447 -0.654 1
1 287 . 7 1 1 A 32 32 GLY N N 32 109.964 106.497 3.467 1
1 288 . 7 1 1 A 33 33 ALA H H 33 7.510 8.629 -1.119 1
1 289 . 7 1 1 A 33 33 ALA HA H 33 4.193 4.373 -0.180 1
1 293 . 7 1 1 A 33 33 ALA C C 33 176.672 176.496 0.176 1
1 294 . 7 1 1 A 33 33 ALA CA C 33 54.401 52.453 1.948 1
1 295 . 7 1 1 A 33 33 ALA CB C 33 19.368 21.768 -2.400 1
1 296 . 7 1 1 A 33 33 ALA N N 33 122.266 120.230 2.036 1
1 297 . 7 1 1 A 34 34 HIS H H 34 8.759 7.897 0.862 1
1 298 . 7 1 1 A 34 34 HIS HA H 34 4.529 4.909 -0.380 1
1 302 . 7 1 1 A 34 34 HIS C C 34 175.767 174.639 1.128 1
1 303 . 7 1 1 A 34 34 HIS CA C 34 54.997 54.087 0.910 1
1 304 . 7 1 1 A 34 34 HIS CB C 34 31.089 31.628 -0.539 1
1 305 . 7 1 1 A 34 34 HIS N N 34 119.038 118.213 0.825 1
1 306 . 7 1 1 A 35 35 ARG H H 35 8.142 8.374 -0.232 1
1 307 . 7 1 1 A 35 35 ARG HA H 35 4.700 4.595 0.105 1
1 314 . 7 1 1 A 35 35 ARG C C 35 177.572 176.793 0.779 1
1 315 . 7 1 1 A 35 35 ARG CA C 35 54.103 55.487 -1.384 1
1 316 . 7 1 1 A 35 35 ARG CB C 35 29.112 31.485 -2.373 1
1 319 . 7 1 1 A 35 35 ARG N N 35 127.785 123.220 4.565 1
1 320 . 7 1 1 A 36 36 GLY H H 36 9.352 7.924 1.428 1
1 321 . 7 1 1 A 36 36 GLY HA2 H 36 4.291 3.874 0.417 1
1 322 . 7 1 1 A 36 36 GLY HA3 H 36 3.247 4.014 -0.767 1
1 323 . 7 1 1 A 36 36 GLY C C 36 173.876 173.049 0.827 1
1 324 . 7 1 1 A 36 36 GLY CA C 36 45.644 45.184 0.460 1
1 325 . 7 1 1 A 36 36 GLY N N 36 109.626 109.179 0.447 1
1 326 . 7 1 1 A 37 37 ARG H H 37 9.384 8.417 0.967 1
1 327 . 7 1 1 A 37 37 ARG HA H 37 4.688 4.436 0.252 1
1 333 . 7 1 1 A 37 37 ARG C C 37 175.081 175.014 0.067 1
1 334 . 7 1 1 A 37 37 ARG CA C 37 55.742 56.386 -0.644 1
1 335 . 7 1 1 A 37 37 ARG CB C 37 28.138 30.620 -2.482 1
1 338 . 7 1 1 A 37 37 ARG N N 37 127.132 122.678 4.454 1
1 339 . 7 1 1 A 38 38 VAL H H 38 7.605 6.561 1.044 1
1 340 . 7 1 1 A 38 38 VAL HA H 38 4.591 3.819 0.772 1
1 348 . 7 1 1 A 38 38 VAL C C 38 174.391 174.282 0.109 1
1 349 . 7 1 1 A 38 38 VAL CA C 38 60.092 60.392 -0.300 1
1 350 . 7 1 1 A 38 38 VAL CB C 38 33.328 32.426 0.902 1
1 353 . 7 1 1 A 38 38 VAL N N 38 126.253 125.892 0.361 1
1 354 . 7 1 1 A 39 39 ASN H H 39 9.007 7.808 1.199 1
1 355 . 7 1 1 A 39 39 ASN HA H 39 4.736 4.704 0.032 1
1 358 . 7 1 1 A 39 39 ASN C C 39 174.562 175.163 -0.601 1
1 359 . 7 1 1 A 39 39 ASN CA C 39 51.577 52.371 -0.794 1
1 360 . 7 1 1 A 39 39 ASN CB C 39 40.749 41.976 -1.227 1
1 361 . 7 1 1 A 39 39 ASN N N 39 123.411 122.281 1.130 1
1 362 . 7 1 1 A 40 40 LYS H H 40 8.510 8.727 -0.217 1
1 363 . 7 1 1 A 40 40 LYS HA H 40 3.909 3.857 0.052 1
1 370 . 7 1 1 A 40 40 LYS C C 40 176.629 178.254 -1.625 1
1 371 . 7 1 1 A 40 40 LYS CA C 40 59.141 60.349 -1.208 1
1 372 . 7 1 1 A 40 40 LYS CB C 40 32.301 32.393 -0.092 1
1 376 . 7 1 1 A 40 40 LYS N N 40 116.303 124.554 -8.251 1
1 377 . 7 1 1 A 41 41 LYS H H 41 7.907 8.604 -0.697 1
1 378 . 7 1 1 A 41 41 LYS HA H 41 4.172 3.911 0.261 1
1 384 . 7 1 1 A 41 41 LYS C C 41 177.229 175.924 1.305 1
1 385 . 7 1 1 A 41 41 LYS CA C 41 57.392 57.859 -0.467 1
1 386 . 7 1 1 A 41 41 LYS CB C 41 32.667 30.807 1.860 1
1 390 . 7 1 1 A 41 41 LYS N N 41 117.066 117.673 -0.607 1
1 391 . 7 1 1 A 42 42 ASN H H 42 7.962 8.785 -0.823 1
1 392 . 7 1 1 A 42 42 ASN HA H 42 4.392 4.565 -0.173 1
1 395 . 7 1 1 A 42 42 ASN C C 42 179.805 176.080 3.725 1
1 396 . 7 1 1 A 42 42 ASN CA C 42 52.335 52.779 -0.444 1
1 397 . 7 1 1 A 42 42 ASN CB C 42 39.348 39.093 0.255 1
1 398 . 7 1 1 A 42 42 ASN N N 42 114.442 116.687 -2.245 1
1 399 . 7 1 1 A 43 43 ILE H H 43 7.806 8.320 -0.514 1
1 400 . 7 1 1 A 43 43 ILE HA H 43 3.747 3.912 -0.165 1
1 409 . 7 1 1 A 43 43 ILE C C 43 174.219 177.346 -3.127 1
1 410 . 7 1 1 A 43 43 ILE CA C 43 64.505 63.498 1.007 1
1 411 . 7 1 1 A 43 43 ILE CB C 43 36.595 38.270 -1.675 1
1 415 . 7 1 1 A 43 43 ILE N N 43 121.001 120.645 0.356 1
1 416 . 7 1 1 A 44 44 VAL H H 44 6.154 7.856 -1.702 1
1 417 . 7 1 1 A 44 44 VAL HA H 44 3.497 3.895 -0.398 1
1 425 . 7 1 1 A 44 44 VAL C C 44 176.282 176.169 0.113 1
1 426 . 7 1 1 A 44 44 VAL CA C 44 63.606 63.416 0.190 1
1 427 . 7 1 1 A 44 44 VAL CB C 44 30.614 31.626 -1.012 1
1 430 . 7 1 1 A 44 44 VAL N N 44 110.500 119.941 -9.441 1
1 431 . 7 1 1 A 45 45 TRP H H 45 7.419 8.055 -0.636 1
1 432 . 7 1 1 A 45 45 TRP HA H 45 4.716 4.736 -0.020 1
1 438 . 7 1 1 A 45 45 TRP C C 45 175.422 176.610 -1.188 1
1 439 . 7 1 1 A 45 45 TRP CA C 45 56.188 58.177 -1.989 1
1 440 . 7 1 1 A 45 45 TRP CB C 45 31.245 31.239 0.006 1
1 441 . 7 1 1 A 45 45 TRP N N 45 118.601 121.878 -3.277 1
1 442 . 7 1 1 A 46 46 HIS H H 46 7.582 8.102 -0.520 1
1 443 . 7 1 1 A 46 46 HIS HA H 46 4.227 4.557 -0.330 1
1 448 . 7 1 1 A 46 46 HIS C C 46 177.485 174.898 2.587 1
1 449 . 7 1 1 A 46 46 HIS CA C 46 56.799 56.524 0.275 1
1 450 . 7 1 1 A 46 46 HIS CB C 46 32.017 30.353 1.664 1
1 451 . 7 1 1 A 46 46 HIS N N 46 122.648 117.430 5.218 1
1 452 . 7 1 1 A 47 47 GLU H H 47 7.948 8.483 -0.535 1
1 453 . 7 1 1 A 47 47 GLU HA H 47 4.098 4.476 -0.378 1
1 457 . 7 1 1 A 47 47 GLU C C 47 175.596 175.105 0.491 1
1 458 . 7 1 1 A 47 47 GLU CA C 47 56.482 55.227 1.255 1
1 459 . 7 1 1 A 47 47 GLU CB C 47 31.839 30.598 1.241 1
1 461 . 7 1 1 A 47 47 GLU N N 47 120.485 122.057 -1.572 1
1 462 . 7 1 1 A 48 48 LEU H H 48 9.304 8.861 0.443 1
1 463 . 7 1 1 A 48 48 LEU HA H 48 4.218 4.628 -0.410 1
1 472 . 7 1 1 A 48 48 LEU C C 48 177.743 176.308 1.435 1
1 473 . 7 1 1 A 48 48 LEU CA C 48 55.043 54.713 0.330 1
1 474 . 7 1 1 A 48 48 LEU CB C 48 41.948 41.673 0.275 1
1 477 . 7 1 1 A 48 48 LEU N N 48 128.658 128.178 0.480 1
1 478 . 7 1 1 A 49 49 ILE H H 49 8.028 8.402 -0.374 1
1 479 . 7 1 1 A 49 49 ILE HA H 49 3.279 4.561 -1.282 1
1 488 . 7 1 1 A 49 49 ILE C C 49 174.821 176.121 -1.300 1
1 489 . 7 1 1 A 49 49 ILE CA C 49 63.901 60.035 3.866 1
1 490 . 7 1 1 A 49 49 ILE CB C 49 37.775 38.637 -0.862 1
1 494 . 7 1 1 A 49 49 ILE N N 49 120.341 125.370 -5.029 1
1 495 . 7 1 1 A 50 50 GLY H H 50 9.038 7.479 1.559 1
1 496 . 7 1 1 A 50 50 GLY HA2 H 50 4.717 4.172 0.545 1
1 497 . 7 1 1 A 50 50 GLY HA3 H 50 3.491 4.268 -0.777 1
1 498 . 7 1 1 A 50 50 GLY C C 50 175.084 174.397 0.687 1
1 499 . 7 1 1 A 50 50 GLY CA C 50 44.599 45.373 -0.774 1
1 500 . 7 1 1 A 50 50 GLY N N 50 110.284 109.241 1.043 1
1 501 . 7 1 1 A 51 51 LEU H H 51 8.400 6.641 1.759 1
1 502 . 7 1 1 A 51 51 LEU HA H 51 4.723 3.987 0.736 1
1 512 . 7 1 1 A 51 51 LEU C C 51 177.147 175.618 1.529 1
1 513 . 7 1 1 A 51 51 LEU CA C 51 54.350 55.801 -1.451 1
1 514 . 7 1 1 A 51 51 LEU CB C 51 42.985 42.787 0.198 1
1 518 . 7 1 1 A 51 51 LEU N N 51 120.471 122.237 -1.766 1
1 519 . 7 1 1 A 52 52 LYS H H 52 7.505 8.382 -0.877 1
1 520 . 7 1 1 A 52 52 LYS HA H 52 4.250 3.967 0.283 1
1 527 . 7 1 1 A 52 52 LYS C C 52 174.995 175.204 -0.209 1
1 528 . 7 1 1 A 52 52 LYS CA C 52 55.589 55.817 -0.228 1
1 529 . 7 1 1 A 52 52 LYS CB C 52 33.025 32.633 0.392 1
1 533 . 7 1 1 A 52 52 LYS N N 52 122.406 125.854 -3.448 1
1 534 . 7 1 1 A 53 53 VAL H H 53 9.075 8.276 0.799 1
1 535 . 7 1 1 A 53 53 VAL HA H 53 5.071 5.031 0.040 1
1 543 . 7 1 1 A 53 53 VAL C C 53 171.170 173.700 -2.530 1
1 544 . 7 1 1 A 53 53 VAL CA C 53 58.523 59.072 -0.549 1
1 545 . 7 1 1 A 53 53 VAL CB C 53 35.698 35.565 0.133 1
1 548 . 7 1 1 A 53 53 VAL N N 53 124.509 124.216 0.293 1
1 549 . 7 1 1 A 54 54 ARG H H 54 8.148 8.263 -0.115 1
1 550 . 7 1 1 A 54 54 ARG HA H 54 5.329 5.021 0.308 1
1 557 . 7 1 1 A 54 54 ARG C C 54 176.113 174.549 1.564 1
1 558 . 7 1 1 A 54 54 ARG CA C 54 53.817 54.076 -0.259 1
1 559 . 7 1 1 A 54 54 ARG CB C 54 34.511 33.798 0.713 1
1 562 . 7 1 1 A 54 54 ARG N N 54 123.625 121.947 1.678 1
1 563 . 7 1 1 A 55 55 VAL H H 55 8.659 9.545 -0.886 1
1 564 . 7 1 1 A 55 55 VAL HA H 55 4.085 4.158 -0.073 1
1 572 . 7 1 1 A 55 55 VAL C C 55 176.282 175.470 0.812 1
1 573 . 7 1 1 A 55 55 VAL CA C 55 62.814 62.450 0.364 1
1 574 . 7 1 1 A 55 55 VAL CB C 55 30.628 31.275 -0.647 1
1 577 . 7 1 1 A 55 55 VAL N N 55 125.383 123.552 1.831 1
1 578 . 7 1 1 A 56 56 VAL H H 56 8.057 8.633 -0.576 1
1 579 . 7 1 1 A 56 56 VAL HA H 56 4.123 4.030 0.093 1
1 587 . 7 1 1 A 56 56 VAL C C 56 175.426 176.111 -0.685 1
1 588 . 7 1 1 A 56 56 VAL CA C 56 62.786 64.112 -1.326 1
1 589 . 7 1 1 A 56 56 VAL CB C 56 32.267 32.522 -0.255 1
1 592 . 7 1 1 A 56 56 VAL N N 56 124.936 128.729 -3.793 1
1 593 . 7 1 1 A 57 57 ASN H H 57 7.527 8.201 -0.674 1
1 594 . 7 1 1 A 57 57 ASN HA H 57 4.817 5.257 -0.440 1
1 597 . 7 1 1 A 57 57 ASN C C 57 172.973 173.823 -0.850 1
1 598 . 7 1 1 A 57 57 ASN CA C 57 52.460 51.604 0.856 1
1 599 . 7 1 1 A 57 57 ASN CB C 57 42.070 41.127 0.943 1
1 600 . 7 1 1 A 57 57 ASN N N 57 114.777 117.659 -2.882 1
1 601 . 7 1 1 A 58 58 SER H H 58 8.193 8.902 -0.709 1
1 602 . 7 1 1 A 58 58 SER HA H 58 5.214 4.900 0.314 1
1 605 . 7 1 1 A 58 58 SER C C 58 174.221 172.460 1.761 1
1 606 . 7 1 1 A 58 58 SER CA C 58 56.778 57.084 -0.306 1
1 607 . 7 1 1 A 58 58 SER CB C 58 63.906 66.141 -2.235 1
1 608 . 7 1 1 A 58 58 SER N N 58 115.531 119.552 -4.021 1
1 609 . 7 1 1 A 59 59 THR H H 59 8.053 8.147 -0.094 1
1 610 . 7 1 1 A 59 59 THR HA H 59 4.305 4.720 -0.415 1
1 615 . 7 1 1 A 59 59 THR C C 59 174.478 173.208 1.270 1
1 616 . 7 1 1 A 59 59 THR CA C 59 63.305 60.330 2.975 1
1 617 . 7 1 1 A 59 59 THR CB C 59 68.354 67.981 0.373 1
1 619 . 7 1 1 A 59 59 THR N N 59 116.405 116.847 -0.442 1
1 620 . 7 1 1 A 60 60 HIS H H 60 8.359 7.839 0.520 1
1 621 . 7 1 1 A 60 60 HIS HA H 60 5.167 5.128 0.039 1
1 626 . 7 1 1 A 60 60 HIS CA C 60 52.792 53.457 -0.665 1
1 627 . 7 1 1 A 60 60 HIS CB C 60 32.142 33.155 -1.013 1
1 628 . 7 1 1 A 60 60 HIS N N 60 123.625 126.219 -2.594 1
1 629 . 7 1 1 A 61 61 PRO HA H 61 4.277 4.433 -0.156 1
1 636 . 7 1 1 A 61 61 PRO C C 61 178.217 177.183 1.034 1
1 637 . 7 1 1 A 61 61 PRO CA C 61 64.375 64.129 0.246 1
1 638 . 7 1 1 A 61 61 PRO CB C 61 32.007 31.793 0.214 1
1 641 . 7 1 1 A 62 62 GLY H H 62 8.421 8.025 0.396 1
1 642 . 7 1 1 A 62 62 GLY HA2 H 62 3.889 3.874 0.015 1
1 643 . 7 1 1 A 62 62 GLY HA3 H 62 3.653 3.985 -0.332 1
1 644 . 7 1 1 A 62 62 GLY C C 62 174.994 174.031 0.963 1
1 645 . 7 1 1 A 62 62 GLY CA C 62 45.831 45.435 0.396 1
1 646 . 7 1 1 A 62 62 GLY N N 62 106.132 106.308 -0.176 1
1 647 . 7 1 1 A 63 63 TYR H H 63 7.327 7.287 0.040 1
1 648 . 7 1 1 A 63 63 TYR HA H 63 4.846 4.592 0.254 1
1 652 . 7 1 1 A 63 63 TYR C C 63 175.593 175.412 0.181 1
1 653 . 7 1 1 A 63 63 TYR CA C 63 56.071 58.369 -2.298 1
1 654 . 7 1 1 A 63 63 TYR CB C 63 38.962 40.590 -1.628 1
1 655 . 7 1 1 A 63 63 TYR N N 63 116.628 117.732 -1.104 1
1 656 . 7 1 1 A 64 64 VAL H H 64 7.296 7.605 -0.309 1
1 657 . 7 1 1 A 64 64 VAL HA H 64 3.180 4.067 -0.887 1
1 665 . 7 1 1 A 64 64 VAL C C 64 177.312 176.531 0.781 1
1 666 . 7 1 1 A 64 64 VAL CA C 64 65.688 62.739 2.949 1
1 667 . 7 1 1 A 64 64 VAL CB C 64 30.957 31.880 -0.923 1
1 670 . 7 1 1 A 64 64 VAL N N 64 117.940 118.793 -0.853 1
1 671 . 7 1 1 A 65 65 GLY H H 65 8.449 10.247 -1.798 1
1 672 . 7 1 1 A 65 65 GLY HA2 H 65 4.320 3.972 0.348 1
1 673 . 7 1 1 A 65 65 GLY HA3 H 65 3.515 3.987 -0.472 1
1 674 . 7 1 1 A 65 65 GLY C C 65 174.821 173.701 1.120 1
1 675 . 7 1 1 A 65 65 GLY CA C 65 44.599 45.078 -0.479 1
1 676 . 7 1 1 A 65 65 GLY N N 65 115.317 114.311 1.006 1
1 677 . 7 1 1 A 66 66 ILE H H 66 7.095 7.616 -0.521 1
1 678 . 7 1 1 A 66 66 ILE HA H 66 3.193 4.836 -1.643 1
1 687 . 7 1 1 A 66 66 ILE C C 66 174.308 175.283 -0.975 1
1 688 . 7 1 1 A 66 66 ILE CA C 66 63.470 59.847 3.623 1
1 689 . 7 1 1 A 66 66 ILE CB C 66 37.775 40.163 -2.388 1
1 693 . 7 1 1 A 66 66 ILE N N 66 122.099 122.426 -0.327 1
1 694 . 7 1 1 A 67 67 GLU H H 67 7.126 9.349 -2.223 1
1 695 . 7 1 1 A 67 67 GLU HA H 67 5.343 5.354 -0.011 1
1 699 . 7 1 1 A 67 67 GLU C C 67 174.652 175.397 -0.745 1
1 700 . 7 1 1 A 67 67 GLU CA C 67 54.109 54.603 -0.494 1
1 701 . 7 1 1 A 67 67 GLU CB C 67 33.619 32.932 0.687 1
1 703 . 7 1 1 A 67 67 GLU N N 67 125.164 127.302 -2.138 1
1 704 . 7 1 1 A 68 68 GLY H H 68 8.401 8.283 0.118 1
1 705 . 7 1 1 A 68 68 GLY HA2 H 68 4.364 2.895 1.469 1
1 706 . 7 1 1 A 68 68 GLY HA3 H 68 4.041 3.826 0.215 1
1 707 . 7 1 1 A 68 68 GLY C C 68 171.644 171.212 0.432 1
1 708 . 7 1 1 A 68 68 GLY CA C 68 45.680 44.410 1.270 1
1 709 . 7 1 1 A 68 68 GLY N N 68 109.626 112.132 -2.506 1
1 710 . 7 1 1 A 69 69 TYR H H 69 8.422 10.522 -2.100 1
1 711 . 7 1 1 A 69 69 TYR HA H 69 5.079 4.913 0.166 1
1 714 . 7 1 1 A 69 69 TYR C C 69 176.194 175.375 0.819 1
1 715 . 7 1 1 A 69 69 TYR CA C 69 57.681 57.531 0.150 1
1 716 . 7 1 1 A 69 69 TYR CB C 69 41.043 39.789 1.254 1
1 717 . 7 1 1 A 69 69 TYR N N 69 119.689 118.946 0.743 1
1 718 . 7 1 1 A 70 70 VAL H H 70 8.753 8.725 0.028 1
1 719 . 7 1 1 A 70 70 VAL HA H 70 4.143 4.308 -0.165 1
1 727 . 7 1 1 A 70 70 VAL C C 70 176.540 175.607 0.933 1
1 728 . 7 1 1 A 70 70 VAL CA C 70 63.477 63.634 -0.157 1
1 729 . 7 1 1 A 70 70 VAL CB C 70 30.952 32.064 -1.112 1
1 732 . 7 1 1 A 70 70 VAL N N 70 123.420 124.928 -1.508 1
1 733 . 7 1 1 A 71 71 ILE H H 71 9.101 9.826 -0.725 1
1 734 . 7 1 1 A 71 71 ILE HA H 71 4.834 4.604 0.230 1
1 743 . 7 1 1 A 71 71 ILE C C 71 175.418 175.805 -0.387 1
1 744 . 7 1 1 A 71 71 ILE CA C 71 60.637 62.349 -1.712 1
1 745 . 7 1 1 A 71 71 ILE CB C 71 39.853 40.483 -0.630 1
1 749 . 7 1 1 A 71 71 ILE N N 71 119.913 124.674 -4.761 1
1 750 . 7 1 1 A 72 72 ASP H H 72 8.030 8.128 -0.098 1
1 751 . 7 1 1 A 72 72 ASP HA H 72 4.964 5.323 -0.359 1
1 754 . 7 1 1 A 72 72 ASP C C 72 173.017 174.704 -1.687 1
1 755 . 7 1 1 A 72 72 ASP CA C 72 53.511 53.057 0.454 1
1 756 . 7 1 1 A 72 72 ASP CB C 72 41.932 44.228 -2.296 1
1 757 . 7 1 1 A 72 72 ASP N N 72 118.377 120.136 -1.759 1
1 758 . 7 1 1 A 73 73 GLU H H 73 9.349 8.723 0.626 1
1 759 . 7 1 1 A 73 73 GLU HA H 73 4.868 5.324 -0.456 1
1 762 . 7 1 1 A 73 73 GLU C C 73 173.793 174.722 -0.929 1
1 763 . 7 1 1 A 73 73 GLU CA C 73 55.521 55.151 0.370 1
1 764 . 7 1 1 A 73 73 GLU CB C 73 33.138 32.080 1.058 1
1 766 . 7 1 1 A 73 73 GLU N N 73 123.848 125.097 -1.249 1
1 767 . 7 1 1 A 74 74 THR H H 74 8.748 8.473 0.275 1
1 768 . 7 1 1 A 74 74 THR HA H 74 4.992 4.865 0.127 1
1 773 . 7 1 1 A 74 74 THR CA C 74 59.450 60.054 -0.604 1
1 774 . 7 1 1 A 74 74 THR CB C 74 70.429 72.332 -1.903 1
1 776 . 7 1 1 A 74 74 THR N N 74 116.628 115.554 1.074 1
1 777 . 7 1 1 A 75 75 ARG HA H 75 3.741 4.301 -0.560 1
1 782 . 7 1 1 A 75 75 ARG C C 75 177.140 176.686 0.454 1
1 783 . 7 1 1 A 75 75 ARG CA C 75 60.041 58.892 1.149 1
1 784 . 7 1 1 A 75 75 ARG CB C 75 29.930 29.994 -0.064 1
1 787 . 7 1 1 A 76 76 ASN H H 76 8.497 7.913 0.584 1
1 788 . 7 1 1 A 76 76 ASN HA H 76 5.310 4.904 0.406 1
1 791 . 7 1 1 A 76 76 ASN C C 76 175.509 174.045 1.464 1
1 792 . 7 1 1 A 76 76 ASN CA C 76 52.320 52.938 -0.618 1
1 793 . 7 1 1 A 76 76 ASN CB C 76 40.744 39.697 1.047 1
1 794 . 7 1 1 A 76 76 ASN N N 76 111.053 115.088 -4.035 1
1 795 . 7 1 1 A 77 77 MET H H 77 7.528 7.412 0.116 1
1 796 . 7 1 1 A 77 77 MET HA H 77 5.392 5.180 0.212 1
1 801 . 7 1 1 A 77 77 MET C C 77 174.824 174.291 0.533 1
1 802 . 7 1 1 A 77 77 MET CA C 77 54.994 54.055 0.939 1
1 803 . 7 1 1 A 77 77 MET CB C 77 36.753 35.567 1.186 1
1 805 . 7 1 1 A 77 77 MET N N 77 119.913 115.637 4.276 1
1 806 . 7 1 1 A 78 78 LEU H H 78 8.977 8.576 0.401 1
1 807 . 7 1 1 A 78 78 LEU HA H 78 4.803 5.335 -0.532 1
1 817 . 7 1 1 A 78 78 LEU C C 78 174.563 174.681 -0.118 1
1 818 . 7 1 1 A 78 78 LEU CA C 78 53.964 54.715 -0.751 1
1 819 . 7 1 1 A 78 78 LEU CB C 78 44.903 45.176 -0.273 1
1 823 . 7 1 1 A 78 78 LEU N N 78 121.224 121.533 -0.309 1
1 824 . 7 1 1 A 79 79 VAL H H 79 8.115 9.091 -0.976 1
1 825 . 7 1 1 A 79 79 VAL HA H 79 4.783 4.864 -0.081 1
1 833 . 7 1 1 A 79 79 VAL C C 79 175.297 174.959 0.338 1
1 834 . 7 1 1 A 79 79 VAL CA C 79 61.821 60.817 1.004 1
1 835 . 7 1 1 A 79 79 VAL CB C 79 31.146 34.228 -3.082 1
1 838 . 7 1 1 A 79 79 VAL N N 79 124.062 127.382 -3.320 1
1 839 . 7 1 1 A 80 80 ILE H H 80 9.342 8.430 0.912 1
1 840 . 7 1 1 A 80 80 ILE HA H 80 4.764 5.142 -0.378 1
1 849 . 7 1 1 A 80 80 ILE C C 80 174.127 174.266 -0.139 1
1 850 . 7 1 1 A 80 80 ILE CA C 80 59.897 59.677 0.220 1
1 851 . 7 1 1 A 80 80 ILE CB C 80 42.225 41.818 0.407 1
1 855 . 7 1 1 A 80 80 ILE N N 80 129.970 126.522 3.448 1
1 856 . 7 1 1 A 81 81 ALA H H 81 9.478 9.979 -0.501 1
1 857 . 7 1 1 A 81 81 ALA HA H 81 5.139 5.571 -0.432 1
1 861 . 7 1 1 A 81 81 ALA C C 81 176.970 176.727 0.243 1
1 862 . 7 1 1 A 81 81 ALA CA C 81 50.835 50.186 0.649 1
1 863 . 7 1 1 A 81 81 ALA CB C 81 21.451 21.741 -0.290 1
1 864 . 7 1 1 A 81 81 ALA N N 81 129.756 128.849 0.907 1
1 865 . 7 1 1 A 82 82 GLY H H 82 8.691 9.005 -0.314 1
1 866 . 7 1 1 A 82 82 GLY HA2 H 82 5.110 4.270 0.840 1
1 867 . 7 1 1 A 82 82 GLY HA3 H 82 4.241 4.303 -0.062 1
1 868 . 7 1 1 A 82 82 GLY C C 82 173.017 174.662 -1.645 1
1 869 . 7 1 1 A 82 82 GLY CA C 82 44.166 44.469 -0.303 1
1 870 . 7 1 1 A 82 82 GLY N N 82 113.568 108.806 4.762 1
1 871 . 7 1 1 A 83 83 GLU H H 83 8.659 8.834 -0.175 1
1 872 . 7 1 1 A 83 83 GLU HA H 83 4.286 4.298 -0.012 1
1 876 . 7 1 1 A 83 83 GLU C C 83 177.570 176.188 1.382 1
1 877 . 7 1 1 A 83 83 GLU CA C 83 59.017 58.521 0.496 1
1 878 . 7 1 1 A 83 83 GLU CB C 83 29.762 29.240 0.522 1
1 880 . 7 1 1 A 83 83 GLU N N 83 120.019 121.317 -1.298 1
1 881 . 7 1 1 A 84 84 ASN H H 84 8.549 8.636 -0.087 1
1 882 . 7 1 1 A 84 84 ASN HA H 84 4.821 4.861 -0.040 1
1 884 . 7 1 1 A 84 84 ASN C C 84 173.878 173.575 0.303 1
1 885 . 7 1 1 A 84 84 ASN CA C 84 52.919 53.048 -0.129 1
1 886 . 7 1 1 A 84 84 ASN CB C 84 40.150 39.481 0.669 1
1 887 . 7 1 1 A 84 84 ASN N N 84 112.778 123.729 -10.951 1
1 888 . 7 1 1 A 85 85 LYS H H 85 7.116 7.915 -0.799 1
1 889 . 7 1 1 A 85 85 LYS HA H 85 4.344 5.063 -0.719 1
1 895 . 7 1 1 A 85 85 LYS C C 85 173.278 174.569 -1.291 1
1 896 . 7 1 1 A 85 85 LYS CA C 85 55.292 55.525 -0.233 1
1 897 . 7 1 1 A 85 85 LYS CB C 85 36.124 36.263 -0.139 1
1 901 . 7 1 1 A 85 85 LYS N N 85 118.377 120.332 -1.955 1
1 902 . 7 1 1 A 86 86 VAL H H 86 7.781 8.716 -0.935 1
1 903 . 7 1 1 A 86 86 VAL HA H 86 4.749 5.354 -0.605 1
1 911 . 7 1 1 A 86 86 VAL C C 86 174.739 174.597 0.142 1
1 912 . 7 1 1 A 86 86 VAL CA C 86 60.716 59.671 1.045 1
1 913 . 7 1 1 A 86 86 VAL CB C 86 33.619 34.853 -1.234 1
1 916 . 7 1 1 A 86 86 VAL N N 86 120.127 118.142 1.985 1
1 917 . 7 1 1 A 87 87 TRP H H 87 9.558 10.049 -0.491 1
1 918 . 7 1 1 A 87 87 TRP HA H 87 4.958 5.439 -0.481 1
1 923 . 7 1 1 A 87 87 TRP C C 87 174.909 175.351 -0.442 1
1 924 . 7 1 1 A 87 87 TRP CA C 87 57.073 56.003 1.070 1
1 925 . 7 1 1 A 87 87 TRP CB C 87 33.028 30.779 2.249 1
1 926 . 7 1 1 A 87 87 TRP N N 87 127.346 123.554 3.792 1
1 927 . 7 1 1 A 88 88 LYS H H 88 8.590 8.355 0.235 1
1 928 . 7 1 1 A 88 88 LYS HA H 88 4.856 4.730 0.126 1
1 935 . 7 1 1 A 88 88 LYS C C 88 175.382 174.291 1.091 1
1 936 . 7 1 1 A 88 88 LYS CA C 88 55.887 54.792 1.095 1
1 937 . 7 1 1 A 88 88 LYS CB C 88 32.434 34.046 -1.612 1
1 941 . 7 1 1 A 88 88 LYS N N 88 123.625 123.364 0.261 1
1 942 . 7 1 1 A 89 89 VAL H H 89 8.829 8.115 0.714 1
1 943 . 7 1 1 A 89 89 VAL HA H 89 4.406 4.803 -0.397 1
1 951 . 7 1 1 A 89 89 VAL CA C 89 58.371 58.738 -0.367 1
1 952 . 7 1 1 A 89 89 VAL CB C 89 34.512 33.002 1.510 1
1 955 . 7 1 1 A 89 89 VAL N N 89 124.285 121.683 2.602 1
1 956 . 7 1 1 A 90 90 PRO HA H 90 5.073 4.579 0.494 1
1 961 . 7 1 1 A 90 90 PRO C C 90 177.231 177.870 -0.639 1
1 962 . 7 1 1 A 90 90 PRO CA C 90 61.795 62.992 -1.197 1
1 963 . 7 1 1 A 90 90 PRO CB C 90 31.660 32.554 -0.894 1
1 964 . 7 1 1 A 91 91 LYS H H 91 8.116 8.633 -0.517 1
1 965 . 7 1 1 A 91 91 LYS HA H 91 4.024 4.269 -0.245 1
1 969 . 7 1 1 A 91 91 LYS C C 91 178.518 177.633 0.885 1
1 970 . 7 1 1 A 91 91 LYS CA C 91 59.621 59.309 0.312 1
1 971 . 7 1 1 A 91 91 LYS CB C 91 34.217 31.985 2.232 1
1 973 . 7 1 1 A 91 91 LYS N N 91 121.224 122.452 -1.228 1
1 974 . 7 1 1 A 92 92 ASP H H 92 8.505 8.737 -0.232 1
1 975 . 7 1 1 A 92 92 ASP HA H 92 3.781 4.490 -0.709 1
1 978 . 7 1 1 A 92 92 ASP C C 92 176.975 176.427 0.548 1
1 979 . 7 1 1 A 92 92 ASP CA C 92 56.773 55.121 1.652 1
1 980 . 7 1 1 A 92 92 ASP CB C 92 39.590 39.613 -0.023 1
1 981 . 7 1 1 A 92 92 ASP N N 92 111.815 118.756 -6.941 1
1 982 . 7 1 1 A 93 93 VAL H H 93 6.691 7.745 -1.054 1
1 983 . 7 1 1 A 93 93 VAL HA H 93 4.678 4.244 0.434 1
1 991 . 7 1 1 A 93 93 VAL C C 93 176.537 174.349 2.188 1
1 992 . 7 1 1 A 93 93 VAL CA C 93 60.120 61.231 -1.111 1
1 993 . 7 1 1 A 93 93 VAL CB C 93 31.093 32.217 -1.124 1
1 996 . 7 1 1 A 93 93 VAL N N 93 107.879 117.747 -9.868 1
1 997 . 7 1 1 A 94 94 CYS H H 94 7.249 7.552 -0.303 1
1 998 . 7 1 1 A 94 94 CYS HA H 94 5.062 4.537 0.525 1
1 1001 . 7 1 1 A 94 94 CYS C C 94 173.103 171.834 1.269 1
1 1002 . 7 1 1 A 94 94 CYS CA C 94 58.001 57.108 0.893 1
1 1003 . 7 1 1 A 94 94 CYS CB C 94 31.418 30.695 0.723 1
1 1004 . 7 1 1 A 94 94 CYS N N 94 117.940 117.754 0.186 1
1 1005 . 7 1 1 A 95 95 ILE H H 95 8.153 7.765 0.388 1
1 1006 . 7 1 1 A 95 95 ILE HA H 95 4.159 4.626 -0.467 1
1 1016 . 7 1 1 A 95 95 ILE C C 95 174.736 174.628 0.108 1
1 1017 . 7 1 1 A 95 95 ILE CA C 95 61.234 60.070 1.164 1
1 1018 . 7 1 1 A 95 95 ILE CB C 95 38.071 40.087 -2.016 1
1 1022 . 7 1 1 A 95 95 ILE N N 95 121.876 120.459 1.417 1
1 1023 . 7 1 1 A 96 96 PHE H H 96 8.400 8.662 -0.262 1
1 1024 . 7 1 1 A 96 96 PHE HA H 96 5.004 4.979 0.025 1
1 1029 . 7 1 1 A 96 96 PHE C C 96 174.005 174.117 -0.112 1
1 1030 . 7 1 1 A 96 96 PHE CA C 96 56.922 56.031 0.891 1
1 1031 . 7 1 1 A 96 96 PHE CB C 96 44.006 41.629 2.377 1
1 1032 . 7 1 1 A 96 96 PHE N N 96 125.820 125.874 -0.054 1
1 1033 . 7 1 1 A 97 97 GLU H H 97 8.985 8.541 0.444 1
1 1034 . 7 1 1 A 97 97 GLU HA H 97 5.275 5.169 0.106 1
1 1038 . 7 1 1 A 97 97 GLU C C 97 175.596 174.902 0.694 1
1 1039 . 7 1 1 A 97 97 GLU CA C 97 55.070 54.666 0.404 1
1 1040 . 7 1 1 A 97 97 GLU CB C 97 33.628 31.229 2.399 1
1 1042 . 7 1 1 A 97 97 GLU N N 97 121.010 124.072 -3.062 1
1 1043 . 7 1 1 A 98 98 PHE H H 98 9.304 9.130 0.174 1
1 1044 . 7 1 1 A 98 98 PHE HA H 98 5.337 4.979 0.358 1
1 1048 . 7 1 1 A 98 98 PHE C C 98 174.650 175.678 -1.028 1
1 1049 . 7 1 1 A 98 98 PHE CA C 98 57.363 57.736 -0.373 1
1 1050 . 7 1 1 A 98 98 PHE CB C 98 41.936 40.462 1.474 1
1 1051 . 7 1 1 A 98 98 PHE N N 98 128.658 126.325 2.333 1
1 1052 . 7 1 1 A 99 99 GLU H H 99 8.721 9.204 -0.483 1
1 1053 . 7 1 1 A 99 99 GLU HA H 99 5.457 4.658 0.799 1
1 1058 . 7 1 1 A 99 99 GLU C C 99 176.368 176.642 -0.274 1
1 1059 . 7 1 1 A 99 99 GLU CA C 99 54.401 55.639 -1.238 1
1 1060 . 7 1 1 A 99 99 GLU CB C 99 33.068 31.193 1.875 1
1 1062 . 7 1 1 A 99 99 GLU N N 99 122.759 123.553 -0.794 1
1 1063 . 7 1 1 A 100 100 THR H H 100 8.588 9.887 -1.299 1
1 1064 . 7 1 1 A 100 100 THR HA H 100 4.603 4.356 0.247 1
1 1069 . 7 1 1 A 100 100 THR C C 100 177.144 176.637 0.507 1
1 1070 . 7 1 1 A 100 100 THR CA C 100 60.774 63.204 -2.430 1
1 1071 . 7 1 1 A 100 100 THR CB C 100 70.136 69.817 0.319 1
1 1073 . 7 1 1 A 100 100 THR N N 100 116.191 121.091 -4.900 1
1 1074 . 7 1 1 A 101 101 TRP H H 101 9.287 9.051 0.236 1
1 1075 . 7 1 1 A 101 101 TRP HA H 101 4.591 4.489 0.102 1
1 1080 . 7 1 1 A 101 101 TRP C C 101 176.457 176.394 0.063 1
1 1081 . 7 1 1 A 101 101 TRP CA C 101 60.045 58.840 1.205 1
1 1082 . 7 1 1 A 101 101 TRP CB C 101 28.578 28.268 0.310 1
1 1083 . 7 1 1 A 101 101 TRP N N 101 122.220 124.200 -1.980 1
1 1084 . 7 1 1 A 102 102 ASP H H 102 7.553 8.275 -0.722 1
1 1085 . 7 1 1 A 102 102 ASP HA H 102 4.129 4.442 -0.313 1
1 1088 . 7 1 1 A 102 102 ASP C C 102 176.714 176.334 0.380 1
1 1089 . 7 1 1 A 102 102 ASP CA C 102 52.775 53.388 -0.613 1
1 1090 . 7 1 1 A 102 102 ASP CB C 102 39.231 41.033 -1.802 1
1 1091 . 7 1 1 A 102 102 ASP N N 102 115.763 119.797 -4.034 1
1 1092 . 7 1 1 A 103 103 GLY H H 103 7.910 8.327 -0.417 1
1 1093 . 7 1 1 A 103 103 GLY HA2 H 103 4.216 3.979 0.237 1
1 1094 . 7 1 1 A 103 103 GLY HA3 H 103 3.686 4.011 -0.325 1
1 1095 . 7 1 1 A 103 103 GLY C C 103 174.566 174.019 0.547 1
1 1096 . 7 1 1 A 103 103 GLY CA C 103 45.179 46.273 -1.094 1
1 1097 . 7 1 1 A 103 103 GLY N N 103 108.311 109.097 -0.786 1
1 1098 . 7 1 1 A 104 104 THR H H 104 7.691 7.447 0.244 1
1 1099 . 7 1 1 A 104 104 THR HA H 104 4.031 4.799 -0.768 1
1 1104 . 7 1 1 A 104 104 THR C C 104 173.405 173.930 -0.525 1
1 1105 . 7 1 1 A 104 104 THR CA C 104 64.307 60.101 4.206 1
1 1106 . 7 1 1 A 104 104 THR CB C 104 68.354 71.476 -3.122 1
1 1108 . 7 1 1 A 104 104 THR N N 104 119.913 113.801 6.112 1
1 1109 . 7 1 1 A 105 105 LYS H H 105 8.297 8.778 -0.481 1
1 1110 . 7 1 1 A 105 105 LYS HA H 105 5.457 4.807 0.650 1
1 1116 . 7 1 1 A 105 105 LYS C C 105 177.055 175.417 1.638 1
1 1117 . 7 1 1 A 105 105 LYS CA C 105 54.401 55.743 -1.342 1
1 1118 . 7 1 1 A 105 105 LYS CB C 105 34.230 34.029 0.201 1
1 1122 . 7 1 1 A 105 105 LYS N N 105 125.597 123.598 1.999 1
1 1123 . 7 1 1 A 106 106 ILE H H 106 9.238 8.886 0.352 1
1 1124 . 7 1 1 A 106 106 ILE HA H 106 4.289 4.847 -0.558 1
1 1133 . 7 1 1 A 106 106 ILE C C 106 174.221 174.477 -0.256 1
1 1134 . 7 1 1 A 106 106 ILE CA C 106 60.631 59.874 0.757 1
1 1135 . 7 1 1 A 106 106 ILE CB C 106 41.927 40.063 1.864 1
1 1139 . 7 1 1 A 106 106 ILE N N 106 124.499 124.694 -0.195 1
1 1140 . 7 1 1 A 107 107 LYS H H 107 8.650 9.104 -0.454 1
1 1141 . 7 1 1 A 107 107 LYS HA H 107 5.608 5.002 0.606 1
1 1147 . 7 1 1 A 107 107 LYS C C 107 175.681 174.948 0.733 1
1 1148 . 7 1 1 A 107 107 LYS CA C 107 55.248 54.915 0.333 1
1 1149 . 7 1 1 A 107 107 LYS CB C 107 33.618 34.178 -0.560 1
1 1153 . 7 1 1 A 107 107 LYS N N 107 130.844 128.285 2.559 1
1 1154 . 7 1 1 A 108 108 ILE H H 108 9.448 8.569 0.879 1
1 1155 . 7 1 1 A 108 108 ILE HA H 108 4.741 4.891 -0.150 1
1 1164 . 7 1 1 A 108 108 ILE C C 108 172.670 174.378 -1.708 1
1 1165 . 7 1 1 A 108 108 ILE CA C 108 59.157 59.403 -0.246 1
1 1166 . 7 1 1 A 108 108 ILE CB C 108 42.241 42.055 0.186 1
1 1170 . 7 1 1 A 108 108 ILE N N 108 125.160 127.933 -2.773 1
1 1171 . 7 1 1 A 109 109 SER H H 109 8.490 8.862 -0.372 1
1 1172 . 7 1 1 A 109 109 SER HA H 109 4.437 4.758 -0.321 1
1 1175 . 7 1 1 A 109 109 SER C C 109 176.536 176.768 -0.232 1
1 1176 . 7 1 1 A 109 109 SER CA C 109 58.850 57.309 1.541 1
1 1177 . 7 1 1 A 109 109 SER CB C 109 63.010 64.380 -1.370 1
1 1178 . 7 1 1 A 109 109 SER N N 109 122.750 120.341 2.409 1
1 1179 . 7 1 1 A 110 110 GLY H H 110 9.292 8.265 1.027 1
1 1180 . 7 1 1 A 110 110 GLY HA2 H 110 5.193 3.972 1.221 1
1 1181 . 7 1 1 A 110 110 GLY HA3 H 110 3.755 4.108 -0.353 1
1 1182 . 7 1 1 A 110 110 GLY C C 110 176.964 174.985 1.979 1
1 1183 . 7 1 1 A 110 110 GLY CA C 110 48.168 46.528 1.640 1
1 1184 . 7 1 1 A 110 110 GLY N N 110 116.628 109.705 6.923 1
1 1185 . 7 1 1 A 111 111 GLU H H 111 8.576 8.566 0.010 1
1 1186 . 7 1 1 A 111 111 GLU HA H 111 4.080 4.161 -0.081 1
1 1191 . 7 1 1 A 111 111 GLU C C 111 178.867 178.575 0.292 1
1 1192 . 7 1 1 A 111 111 GLU CA C 111 59.150 58.639 0.511 1
1 1193 . 7 1 1 A 111 111 GLU CB C 111 28.831 29.621 -0.790 1
1 1195 . 7 1 1 A 111 111 GLU N N 111 120.564 118.210 2.354 1
1 1196 . 7 1 1 A 112 112 LYS H H 112 7.605 7.556 0.049 1
1 1197 . 7 1 1 A 112 112 LYS HA H 112 4.229 4.033 0.196 1
1 1202 . 7 1 1 A 112 112 LYS C C 112 176.710 177.995 -1.285 1
1 1203 . 7 1 1 A 112 112 LYS CA C 112 57.083 59.375 -2.292 1
1 1204 . 7 1 1 A 112 112 LYS CB C 112 32.183 32.282 -0.099 1
1 1208 . 7 1 1 A 112 112 LYS N N 112 116.628 119.030 -2.402 1
1 1209 . 7 1 1 A 113 113 LEU H H 113 7.784 7.811 -0.027 1
1 1210 . 7 1 1 A 113 113 LEU HA H 113 4.387 4.344 0.043 1
1 1220 . 7 1 1 A 113 113 LEU C C 113 176.195 176.527 -0.332 1
1 1221 . 7 1 1 A 113 113 LEU CA C 113 52.617 54.123 -1.506 1
1 1222 . 7 1 1 A 113 113 LEU CB C 113 42.820 41.117 1.703 1
1 1226 . 7 1 1 A 113 113 LEU N N 113 114.219 114.319 -0.100 1
1 1227 . 7 1 1 A 114 114 VAL H H 114 7.032 7.363 -0.331 1
1 1228 . 7 1 1 A 114 114 VAL HA H 114 3.723 3.790 -0.067 1
1 1236 . 7 1 1 A 114 114 VAL C C 114 175.430 177.218 -1.788 1
1 1237 . 7 1 1 A 114 114 VAL CA C 114 65.537 63.978 1.559 1
1 1238 . 7 1 1 A 114 114 VAL CB C 114 32.115 31.344 0.771 1
1 1241 . 7 1 1 A 114 114 VAL N N 114 121.773 121.142 0.631 1
1 1242 . 7 1 1 A 115 115 GLY H H 115 8.678 8.846 -0.168 1
1 1243 . 7 1 1 A 115 115 GLY HA2 H 115 4.313 3.948 0.365 1
1 1244 . 7 1 1 A 115 115 GLY HA3 H 115 3.846 3.954 -0.108 1
1 1245 . 7 1 1 A 115 115 GLY C C 115 172.462 173.590 -1.128 1
1 1246 . 7 1 1 A 115 115 GLY CA C 115 43.743 45.568 -1.825 1
1 1247 . 7 1 1 A 115 115 GLY N N 115 117.503 116.918 0.585 1
1 1248 . 7 1 1 A 116 116 ARG H H 116 8.701 8.452 0.249 1
1 1249 . 7 1 1 A 116 116 ARG HA H 116 3.926 4.628 -0.702 1
1 1254 . 7 1 1 A 116 116 ARG CA C 116 56.470 53.380 3.090 1
1 1255 . 7 1 1 A 116 116 ARG CB C 116 29.585 29.622 -0.037 1
1 1257 . 7 1 1 A 116 116 ARG N N 116 123.504 120.826 2.678 1
1 1258 . 7 1 1 A 117 117 PRO HA H 117 4.242 4.234 0.008 1
1 1264 . 7 1 1 A 117 117 PRO C C 117 178.947 178.169 0.778 1
1 1265 . 7 1 1 A 117 117 PRO CA C 117 65.684 64.551 1.133 1
1 1266 . 7 1 1 A 117 117 PRO CB C 117 30.949 32.056 -1.107 1
1 1269 . 7 1 1 A 118 118 GLU H H 118 10.821 8.805 2.016 1
1 1270 . 7 1 1 A 118 118 GLU HA H 118 4.197 4.085 0.112 1
1 1271 . 7 1 1 A 118 118 GLU C C 118 176.627 178.792 -2.165 1
1 1272 . 7 1 1 A 118 118 GLU CA C 118 58.045 59.258 -1.213 1
1 1273 . 7 1 1 A 118 118 GLU CB C 118 27.101 29.274 -2.173 1
1 1274 . 7 1 1 A 118 118 GLU N N 118 119.242 116.465 2.777 1
1 1275 . 7 1 1 A 119 119 MET H H 119 7.226 8.108 -0.882 1
1 1276 . 7 1 1 A 119 119 MET HA H 119 4.591 4.008 0.583 1
1 1279 . 7 1 1 A 119 119 MET C C 119 180.024 178.365 1.659 1
1 1280 . 7 1 1 A 119 119 MET CA C 119 54.695 59.120 -4.425 1
1 1281 . 7 1 1 A 119 119 MET CB C 119 31.012 32.295 -1.283 1
1 1283 . 7 1 1 A 119 119 MET N N 119 119.475 119.391 0.084 1
1 1284 . 7 1 1 A 120 120 ARG H H 120 7.877 7.680 0.197 1
1 1285 . 7 1 1 A 120 120 ARG HA H 120 3.988 4.076 -0.088 1
1 1292 . 7 1 1 A 120 120 ARG C C 120 177.705 178.443 -0.738 1
1 1293 . 7 1 1 A 120 120 ARG CA C 120 60.773 58.389 2.384 1
1 1294 . 7 1 1 A 120 120 ARG CB C 120 31.159 29.782 1.377 1
1 1295 . 7 1 1 A 120 120 ARG N N 120 122.099 119.442 2.657 1
1 1296 . 7 1 1 A 121 121 LEU H H 121 6.732 8.328 -1.596 1
1 1297 . 7 1 1 A 121 121 LEU HA H 121 4.170 4.017 0.153 1
1 1307 . 7 1 1 A 121 121 LEU C C 121 176.220 179.394 -3.174 1
1 1308 . 7 1 1 A 121 121 LEU CA C 121 57.370 57.984 -0.614 1
1 1309 . 7 1 1 A 121 121 LEU CB C 121 42.945 41.572 1.373 1
1 1312 . 7 1 1 A 121 121 LEU N N 121 114.436 120.029 -5.593 1
1 1313 . 7 1 1 A 122 122 LYS H H 122 7.555 8.313 -0.758 1
1 1314 . 7 1 1 A 122 122 LYS HA H 122 4.338 4.230 0.108 1
1 1321 . 7 1 1 A 122 122 LYS C C 122 176.969 176.862 0.107 1
1 1322 . 7 1 1 A 122 122 LYS CA C 122 55.621 58.685 -3.064 1
1 1323 . 7 1 1 A 122 122 LYS CB C 122 32.414 32.970 -0.556 1
1 1327 . 7 1 1 A 122 122 LYS N N 122 115.754 118.129 -2.375 1
1 1328 . 7 1 1 A 123 123 LYS H H 123 7.688 8.175 -0.487 1
1 1329 . 7 1 1 A 123 123 LYS HA H 123 4.535 4.175 0.360 1
1 1330 . 7 1 1 A 123 123 LYS CA C 123 58.461 57.075 1.386 1
1 1331 . 7 1 1 A 123 123 LYS CB C 123 33.138 31.023 2.115 1
1 1332 . 7 1 1 A 123 123 LYS N N 123 120.843 119.368 1.475 1
1 1333 . 7 1 1 A 126 126 ARG HA H 126 4.347 3.934 0.413 1
1 1338 . 7 1 1 A 126 126 ARG C C 126 174.573 177.140 -2.567 1
1 1339 . 7 1 1 A 126 126 ARG CA C 126 55.998 57.078 -1.080 1
1 1340 . 7 1 1 A 126 126 ARG CB C 126 31.569 30.110 1.459 1
1 128 . 8 1 1 A 18 18 GLY H H 18 8.343 7.938 0.405 1
1 129 . 8 1 1 A 18 18 GLY HA2 H 18 3.894 3.967 -0.073 1
1 130 . 8 1 1 A 18 18 GLY C C 18 177.743 175.297 2.446 1
1 131 . 8 1 1 A 18 18 GLY CA C 18 45.497 46.715 -1.218 1
1 132 . 8 1 1 A 18 18 GLY N N 18 109.925 108.673 1.252 1
1 133 . 8 1 1 A 19 19 SER H H 19 8.005 8.324 -0.319 1
1 134 . 8 1 1 A 19 19 SER HA H 19 4.329 4.121 0.208 1
1 136 . 8 1 1 A 19 19 SER C C 19 175.168 176.237 -1.069 1
1 137 . 8 1 1 A 19 19 SER CA C 19 58.852 61.382 -2.530 1
1 138 . 8 1 1 A 19 19 SER CB C 19 63.604 62.564 1.040 1
1 139 . 8 1 1 A 19 19 SER N N 19 115.090 118.773 -3.683 1
1 140 . 8 1 1 A 20 20 TYR H H 20 8.040 8.251 -0.211 1
1 141 . 8 1 1 A 20 20 TYR HA H 20 4.439 4.351 0.088 1
1 146 . 8 1 1 A 20 20 TYR C C 20 176.111 178.499 -2.388 1
1 147 . 8 1 1 A 20 20 TYR CA C 20 57.966 61.700 -3.734 1
1 148 . 8 1 1 A 20 20 TYR CB C 20 37.472 38.430 -0.958 1
1 149 . 8 1 1 A 20 20 TYR N N 20 118.675 119.791 -1.116 1
1 150 . 8 1 1 A 21 21 GLN H H 21 7.909 8.287 -0.378 1
1 151 . 8 1 1 A 21 21 GLN HA H 21 3.903 4.099 -0.196 1
1 155 . 8 1 1 A 21 21 GLN C C 21 178.003 177.269 0.734 1
1 156 . 8 1 1 A 21 21 GLN CA C 21 58.523 59.071 -0.548 1
1 157 . 8 1 1 A 21 21 GLN CB C 21 28.438 28.552 -0.114 1
1 159 . 8 1 1 A 21 21 GLN N N 21 117.056 117.905 -0.849 1
1 160 . 8 1 1 A 22 22 GLU H H 22 8.965 9.546 -0.581 1
1 161 . 8 1 1 A 22 22 GLU HA H 22 4.267 4.448 -0.181 1
1 165 . 8 1 1 A 22 22 GLU C C 22 176.451 178.163 -1.712 1
1 166 . 8 1 1 A 22 22 GLU CA C 22 58.273 58.319 -0.046 1
1 167 . 8 1 1 A 22 22 GLU CB C 22 29.412 30.600 -1.188 1
1 169 . 8 1 1 A 22 22 GLU N N 22 117.289 118.934 -1.645 1
1 170 . 8 1 1 A 23 23 ILE H H 23 7.596 7.864 -0.268 1
1 171 . 8 1 1 A 23 23 ILE HA H 23 4.161 4.376 -0.215 1
1 180 . 8 1 1 A 23 23 ILE C C 23 176.195 175.623 0.572 1
1 181 . 8 1 1 A 23 23 ILE CA C 23 58.120 60.886 -2.766 1
1 182 . 8 1 1 A 23 23 ILE CB C 23 38.461 37.538 0.923 1
1 186 . 8 1 1 A 23 23 ILE N N 23 114.005 117.256 -3.251 1
1 187 . 8 1 1 A 24 24 ILE H H 24 7.178 7.679 -0.501 1
1 188 . 8 1 1 A 24 24 ILE HA H 24 3.740 3.992 -0.252 1
1 197 . 8 1 1 A 24 24 ILE C C 24 177.831 177.086 0.745 1
1 198 . 8 1 1 A 24 24 ILE CA C 24 63.318 62.349 0.969 1
1 199 . 8 1 1 A 24 24 ILE CB C 24 36.590 38.235 -1.645 1
1 203 . 8 1 1 A 24 24 ILE N N 24 122.099 124.781 -2.682 1
1 204 . 8 1 1 A 25 25 GLY H H 25 8.618 9.216 -0.598 1
1 205 . 8 1 1 A 25 25 GLY HA2 H 25 4.390 3.994 0.396 1
1 206 . 8 1 1 A 25 25 GLY HA3 H 25 4.168 4.029 0.139 1
1 207 . 8 1 1 A 25 25 GLY C C 25 175.210 175.719 -0.509 1
1 208 . 8 1 1 A 25 25 GLY CA C 25 45.798 45.200 0.598 1
1 209 . 8 1 1 A 25 25 GLY N N 25 115.531 118.810 -3.279 1
1 210 . 8 1 1 A 26 26 ARG H H 26 8.277 8.312 -0.035 1
1 211 . 8 1 1 A 26 26 ARG HA H 26 4.477 4.516 -0.039 1
1 218 . 8 1 1 A 26 26 ARG C C 26 175.944 177.859 -1.915 1
1 219 . 8 1 1 A 26 26 ARG CA C 26 54.408 57.239 -2.831 1
1 220 . 8 1 1 A 26 26 ARG CB C 26 29.501 30.046 -0.545 1
1 223 . 8 1 1 A 26 26 ARG N N 26 119.689 120.988 -1.299 1
1 224 . 8 1 1 A 27 27 THR H H 27 7.923 8.449 -0.526 1
1 225 . 8 1 1 A 27 27 THR HA H 27 3.792 4.137 -0.345 1
1 230 . 8 1 1 A 27 27 THR C C 27 175.251 176.576 -1.325 1
1 231 . 8 1 1 A 27 27 THR CA C 27 64.791 65.405 -0.614 1
1 232 . 8 1 1 A 27 27 THR CB C 27 68.354 67.955 0.399 1
1 234 . 8 1 1 A 27 27 THR N N 27 109.195 112.953 -3.758 1
1 235 . 8 1 1 A 28 28 TRP H H 28 7.389 8.125 -0.736 1
1 236 . 8 1 1 A 28 28 TRP HA H 28 4.441 4.329 0.112 1
1 240 . 8 1 1 A 28 28 TRP C C 28 178.519 178.361 0.158 1
1 241 . 8 1 1 A 28 28 TRP CA C 28 57.789 61.378 -3.589 1
1 242 . 8 1 1 A 28 28 TRP CB C 28 27.387 29.817 -2.430 1
1 243 . 8 1 1 A 28 28 TRP N N 28 120.127 124.793 -4.666 1
1 244 . 8 1 1 A 29 29 ILE H H 29 6.832 8.102 -1.270 1
1 245 . 8 1 1 A 29 29 ILE HA H 29 3.612 3.197 0.415 1
1 254 . 8 1 1 A 29 29 ILE C C 29 176.023 177.070 -1.047 1
1 255 . 8 1 1 A 29 29 ILE CA C 29 63.773 63.183 0.590 1
1 256 . 8 1 1 A 29 29 ILE CB C 29 37.567 37.287 0.280 1
1 260 . 8 1 1 A 29 29 ILE N N 29 119.913 117.732 2.181 1
1 261 . 8 1 1 A 30 30 PHE H H 30 7.329 7.662 -0.333 1
1 262 . 8 1 1 A 30 30 PHE HA H 30 3.912 4.486 -0.574 1
1 268 . 8 1 1 A 30 30 PHE C C 30 177.101 177.655 -0.554 1
1 269 . 8 1 1 A 30 30 PHE CA C 30 59.436 60.214 -0.778 1
1 270 . 8 1 1 A 30 30 PHE CB C 30 38.734 40.259 -1.525 1
1 271 . 8 1 1 A 30 30 PHE N N 30 116.638 120.365 -3.727 1
1 272 . 8 1 1 A 31 31 ARG H H 31 7.399 9.705 -2.306 1
1 273 . 8 1 1 A 31 31 ARG HA H 31 4.287 4.316 -0.029 1
1 278 . 8 1 1 A 31 31 ARG C C 31 176.539 178.575 -2.036 1
1 279 . 8 1 1 A 31 31 ARG CA C 31 58.852 59.238 -0.386 1
1 280 . 8 1 1 A 31 31 ARG CB C 31 29.461 30.110 -0.649 1
1 281 . 8 1 1 A 31 31 ARG N N 31 122.099 119.316 2.783 1
1 282 . 8 1 1 A 32 32 GLY H H 32 8.346 8.012 0.334 1
1 283 . 8 1 1 A 32 32 GLY HA2 H 32 4.284 3.571 0.713 1
1 284 . 8 1 1 A 32 32 GLY HA3 H 32 3.629 3.845 -0.216 1
1 285 . 8 1 1 A 32 32 GLY C C 32 173.791 174.140 -0.349 1
1 286 . 8 1 1 A 32 32 GLY CA C 32 45.793 46.730 -0.937 1
1 287 . 8 1 1 A 32 32 GLY N N 32 109.964 106.385 3.579 1
1 288 . 8 1 1 A 33 33 ALA H H 33 7.510 8.902 -1.392 1
1 289 . 8 1 1 A 33 33 ALA HA H 33 4.193 4.473 -0.280 1
1 293 . 8 1 1 A 33 33 ALA C C 33 176.672 176.482 0.190 1
1 294 . 8 1 1 A 33 33 ALA CA C 33 54.401 52.584 1.817 1
1 295 . 8 1 1 A 33 33 ALA CB C 33 19.368 21.822 -2.454 1
1 296 . 8 1 1 A 33 33 ALA N N 33 122.266 120.528 1.738 1
1 297 . 8 1 1 A 34 34 HIS H H 34 8.759 8.081 0.678 1
1 298 . 8 1 1 A 34 34 HIS HA H 34 4.529 4.798 -0.269 1
1 302 . 8 1 1 A 34 34 HIS C C 34 175.767 174.751 1.016 1
1 303 . 8 1 1 A 34 34 HIS CA C 34 54.997 55.351 -0.354 1
1 304 . 8 1 1 A 34 34 HIS CB C 34 31.089 29.545 1.544 1
1 305 . 8 1 1 A 34 34 HIS N N 34 119.038 115.963 3.075 1
1 306 . 8 1 1 A 35 35 ARG H H 35 8.142 8.558 -0.416 1
1 307 . 8 1 1 A 35 35 ARG HA H 35 4.700 4.595 0.105 1
1 314 . 8 1 1 A 35 35 ARG C C 35 177.572 176.601 0.971 1
1 315 . 8 1 1 A 35 35 ARG CA C 35 54.103 56.092 -1.989 1
1 316 . 8 1 1 A 35 35 ARG CB C 35 29.112 32.748 -3.636 1
1 319 . 8 1 1 A 35 35 ARG N N 35 127.785 124.267 3.518 1
1 320 . 8 1 1 A 36 36 GLY H H 36 9.352 7.882 1.470 1
1 321 . 8 1 1 A 36 36 GLY HA2 H 36 4.291 3.942 0.349 1
1 322 . 8 1 1 A 36 36 GLY HA3 H 36 3.247 3.982 -0.735 1
1 323 . 8 1 1 A 36 36 GLY C C 36 173.876 173.480 0.396 1
1 324 . 8 1 1 A 36 36 GLY CA C 36 45.644 45.589 0.055 1
1 325 . 8 1 1 A 36 36 GLY N N 36 109.626 107.474 2.152 1
1 326 . 8 1 1 A 37 37 ARG H H 37 9.384 8.439 0.945 1
1 327 . 8 1 1 A 37 37 ARG HA H 37 4.688 4.351 0.337 1
1 333 . 8 1 1 A 37 37 ARG C C 37 175.081 175.354 -0.273 1
1 334 . 8 1 1 A 37 37 ARG CA C 37 55.742 56.470 -0.728 1
1 335 . 8 1 1 A 37 37 ARG CB C 37 28.138 30.695 -2.557 1
1 338 . 8 1 1 A 37 37 ARG N N 37 127.132 122.933 4.199 1
1 339 . 8 1 1 A 38 38 VAL H H 38 7.605 6.582 1.023 1
1 340 . 8 1 1 A 38 38 VAL HA H 38 4.591 4.002 0.589 1
1 348 . 8 1 1 A 38 38 VAL C C 38 174.391 174.367 0.024 1
1 349 . 8 1 1 A 38 38 VAL CA C 38 60.092 60.323 -0.231 1
1 350 . 8 1 1 A 38 38 VAL CB C 38 33.328 32.719 0.609 1
1 353 . 8 1 1 A 38 38 VAL N N 38 126.253 125.760 0.493 1
1 354 . 8 1 1 A 39 39 ASN H H 39 9.007 7.809 1.198 1
1 355 . 8 1 1 A 39 39 ASN HA H 39 4.736 4.775 -0.039 1
1 358 . 8 1 1 A 39 39 ASN C C 39 174.562 174.905 -0.343 1
1 359 . 8 1 1 A 39 39 ASN CA C 39 51.577 52.277 -0.700 1
1 360 . 8 1 1 A 39 39 ASN CB C 39 40.749 41.964 -1.215 1
1 361 . 8 1 1 A 39 39 ASN N N 39 123.411 122.409 1.002 1
1 362 . 8 1 1 A 40 40 LYS H H 40 8.510 8.727 -0.217 1
1 363 . 8 1 1 A 40 40 LYS HA H 40 3.909 3.851 0.058 1
1 370 . 8 1 1 A 40 40 LYS C C 40 176.629 178.215 -1.586 1
1 371 . 8 1 1 A 40 40 LYS CA C 40 59.141 60.319 -1.178 1
1 372 . 8 1 1 A 40 40 LYS CB C 40 32.301 32.384 -0.083 1
1 376 . 8 1 1 A 40 40 LYS N N 40 116.303 124.085 -7.782 1
1 377 . 8 1 1 A 41 41 LYS H H 41 7.907 8.525 -0.618 1
1 378 . 8 1 1 A 41 41 LYS HA H 41 4.172 3.790 0.382 1
1 384 . 8 1 1 A 41 41 LYS C C 41 177.229 175.713 1.516 1
1 385 . 8 1 1 A 41 41 LYS CA C 41 57.392 57.816 -0.424 1
1 386 . 8 1 1 A 41 41 LYS CB C 41 32.667 30.829 1.838 1
1 390 . 8 1 1 A 41 41 LYS N N 41 117.066 117.471 -0.405 1
1 391 . 8 1 1 A 42 42 ASN H H 42 7.962 8.495 -0.533 1
1 392 . 8 1 1 A 42 42 ASN HA H 42 4.392 4.632 -0.240 1
1 395 . 8 1 1 A 42 42 ASN C C 42 179.805 175.908 3.897 1
1 396 . 8 1 1 A 42 42 ASN CA C 42 52.335 52.629 -0.294 1
1 397 . 8 1 1 A 42 42 ASN CB C 42 39.348 39.175 0.173 1
1 398 . 8 1 1 A 42 42 ASN N N 42 114.442 116.792 -2.350 1
1 399 . 8 1 1 A 43 43 ILE H H 43 7.806 8.571 -0.765 1
1 400 . 8 1 1 A 43 43 ILE HA H 43 3.747 3.882 -0.135 1
1 409 . 8 1 1 A 43 43 ILE C C 43 174.219 177.254 -3.035 1
1 410 . 8 1 1 A 43 43 ILE CA C 43 64.505 63.372 1.133 1
1 411 . 8 1 1 A 43 43 ILE CB C 43 36.595 38.389 -1.794 1
1 415 . 8 1 1 A 43 43 ILE N N 43 121.001 120.532 0.469 1
1 416 . 8 1 1 A 44 44 VAL H H 44 6.154 7.681 -1.527 1
1 417 . 8 1 1 A 44 44 VAL HA H 44 3.497 3.842 -0.345 1
1 425 . 8 1 1 A 44 44 VAL C C 44 176.282 176.367 -0.085 1
1 426 . 8 1 1 A 44 44 VAL CA C 44 63.606 63.096 0.510 1
1 427 . 8 1 1 A 44 44 VAL CB C 44 30.614 31.869 -1.255 1
1 430 . 8 1 1 A 44 44 VAL N N 44 110.500 119.459 -8.959 1
1 431 . 8 1 1 A 45 45 TRP H H 45 7.419 8.189 -0.770 1
1 432 . 8 1 1 A 45 45 TRP HA H 45 4.716 4.896 -0.180 1
1 438 . 8 1 1 A 45 45 TRP C C 45 175.422 175.501 -0.079 1
1 439 . 8 1 1 A 45 45 TRP CA C 45 56.188 56.888 -0.700 1
1 440 . 8 1 1 A 45 45 TRP CB C 45 31.245 30.381 0.864 1
1 441 . 8 1 1 A 45 45 TRP N N 45 118.601 120.682 -2.081 1
1 442 . 8 1 1 A 46 46 HIS H H 46 7.582 7.643 -0.061 1
1 443 . 8 1 1 A 46 46 HIS HA H 46 4.227 4.989 -0.762 1
1 448 . 8 1 1 A 46 46 HIS C C 46 177.485 174.936 2.549 1
1 449 . 8 1 1 A 46 46 HIS CA C 46 56.799 54.614 2.185 1
1 450 . 8 1 1 A 46 46 HIS CB C 46 32.017 32.491 -0.474 1
1 451 . 8 1 1 A 46 46 HIS N N 46 122.648 118.679 3.969 1
1 452 . 8 1 1 A 47 47 GLU H H 47 7.948 8.230 -0.282 1
1 453 . 8 1 1 A 47 47 GLU HA H 47 4.098 4.158 -0.060 1
1 457 . 8 1 1 A 47 47 GLU C C 47 175.596 176.492 -0.896 1
1 458 . 8 1 1 A 47 47 GLU CA C 47 56.482 56.738 -0.256 1
1 459 . 8 1 1 A 47 47 GLU CB C 47 31.839 29.504 2.335 1
1 461 . 8 1 1 A 47 47 GLU N N 47 120.485 122.435 -1.950 1
1 462 . 8 1 1 A 48 48 LEU H H 48 9.304 8.704 0.600 1
1 463 . 8 1 1 A 48 48 LEU HA H 48 4.218 4.506 -0.288 1
1 472 . 8 1 1 A 48 48 LEU C C 48 177.743 176.524 1.219 1
1 473 . 8 1 1 A 48 48 LEU CA C 48 55.043 55.016 0.027 1
1 474 . 8 1 1 A 48 48 LEU CB C 48 41.948 41.114 0.834 1
1 477 . 8 1 1 A 48 48 LEU N N 48 128.658 125.589 3.069 1
1 478 . 8 1 1 A 49 49 ILE H H 49 8.028 9.087 -1.059 1
1 479 . 8 1 1 A 49 49 ILE HA H 49 3.279 4.627 -1.348 1
1 488 . 8 1 1 A 49 49 ILE C C 49 174.821 177.273 -2.452 1
1 489 . 8 1 1 A 49 49 ILE CA C 49 63.901 62.190 1.711 1
1 490 . 8 1 1 A 49 49 ILE CB C 49 37.775 40.897 -3.122 1
1 494 . 8 1 1 A 49 49 ILE N N 49 120.341 123.960 -3.619 1
1 495 . 8 1 1 A 50 50 GLY H H 50 9.038 7.670 1.368 1
1 496 . 8 1 1 A 50 50 GLY HA2 H 50 4.717 3.761 0.956 1
1 497 . 8 1 1 A 50 50 GLY HA3 H 50 3.491 4.167 -0.676 1
1 498 . 8 1 1 A 50 50 GLY C C 50 175.084 173.643 1.441 1
1 499 . 8 1 1 A 50 50 GLY CA C 50 44.599 45.120 -0.521 1
1 500 . 8 1 1 A 50 50 GLY N N 50 110.284 109.224 1.060 1
1 501 . 8 1 1 A 51 51 LEU H H 51 8.400 6.778 1.622 1
1 502 . 8 1 1 A 51 51 LEU HA H 51 4.723 4.076 0.647 1
1 512 . 8 1 1 A 51 51 LEU C C 51 177.147 175.467 1.680 1
1 513 . 8 1 1 A 51 51 LEU CA C 51 54.350 55.683 -1.333 1
1 514 . 8 1 1 A 51 51 LEU CB C 51 42.985 43.034 -0.049 1
1 518 . 8 1 1 A 51 51 LEU N N 51 120.471 122.039 -1.568 1
1 519 . 8 1 1 A 52 52 LYS H H 52 7.505 8.393 -0.888 1
1 520 . 8 1 1 A 52 52 LYS HA H 52 4.250 4.160 0.090 1
1 527 . 8 1 1 A 52 52 LYS C C 52 174.995 175.014 -0.019 1
1 528 . 8 1 1 A 52 52 LYS CA C 52 55.589 55.002 0.587 1
1 529 . 8 1 1 A 52 52 LYS CB C 52 33.025 33.055 -0.030 1
1 533 . 8 1 1 A 52 52 LYS N N 52 122.406 125.725 -3.319 1
1 534 . 8 1 1 A 53 53 VAL H H 53 9.075 7.900 1.175 1
1 535 . 8 1 1 A 53 53 VAL HA H 53 5.071 4.983 0.088 1
1 543 . 8 1 1 A 53 53 VAL C C 53 171.170 173.568 -2.398 1
1 544 . 8 1 1 A 53 53 VAL CA C 53 58.523 58.754 -0.231 1
1 545 . 8 1 1 A 53 53 VAL CB C 53 35.698 34.932 0.766 1
1 548 . 8 1 1 A 53 53 VAL N N 53 124.509 123.893 0.616 1
1 549 . 8 1 1 A 54 54 ARG H H 54 8.148 8.241 -0.093 1
1 550 . 8 1 1 A 54 54 ARG HA H 54 5.329 4.888 0.441 1
1 557 . 8 1 1 A 54 54 ARG C C 54 176.113 174.573 1.540 1
1 558 . 8 1 1 A 54 54 ARG CA C 54 53.817 54.096 -0.279 1
1 559 . 8 1 1 A 54 54 ARG CB C 54 34.511 33.787 0.724 1
1 562 . 8 1 1 A 54 54 ARG N N 54 123.625 122.068 1.557 1
1 563 . 8 1 1 A 55 55 VAL H H 55 8.659 9.190 -0.531 1
1 564 . 8 1 1 A 55 55 VAL HA H 55 4.085 4.050 0.035 1
1 572 . 8 1 1 A 55 55 VAL C C 55 176.282 175.440 0.842 1
1 573 . 8 1 1 A 55 55 VAL CA C 55 62.814 62.517 0.297 1
1 574 . 8 1 1 A 55 55 VAL CB C 55 30.628 31.041 -0.413 1
1 577 . 8 1 1 A 55 55 VAL N N 55 125.383 123.603 1.780 1
1 578 . 8 1 1 A 56 56 VAL H H 56 8.057 8.582 -0.525 1
1 579 . 8 1 1 A 56 56 VAL HA H 56 4.123 4.012 0.111 1
1 587 . 8 1 1 A 56 56 VAL C C 56 175.426 176.318 -0.892 1
1 588 . 8 1 1 A 56 56 VAL CA C 56 62.786 64.321 -1.535 1
1 589 . 8 1 1 A 56 56 VAL CB C 56 32.267 32.587 -0.320 1
1 592 . 8 1 1 A 56 56 VAL N N 56 124.936 129.320 -4.384 1
1 593 . 8 1 1 A 57 57 ASN H H 57 7.527 8.267 -0.740 1
1 594 . 8 1 1 A 57 57 ASN HA H 57 4.817 5.270 -0.453 1
1 597 . 8 1 1 A 57 57 ASN C C 57 172.973 173.776 -0.803 1
1 598 . 8 1 1 A 57 57 ASN CA C 57 52.460 51.880 0.580 1
1 599 . 8 1 1 A 57 57 ASN CB C 57 42.070 41.516 0.554 1
1 600 . 8 1 1 A 57 57 ASN N N 57 114.777 117.214 -2.437 1
1 601 . 8 1 1 A 58 58 SER H H 58 8.193 8.973 -0.780 1
1 602 . 8 1 1 A 58 58 SER HA H 58 5.214 4.942 0.272 1
1 605 . 8 1 1 A 58 58 SER C C 58 174.221 172.282 1.939 1
1 606 . 8 1 1 A 58 58 SER CA C 58 56.778 57.471 -0.693 1
1 607 . 8 1 1 A 58 58 SER CB C 58 63.906 66.665 -2.759 1
1 608 . 8 1 1 A 58 58 SER N N 58 115.531 119.047 -3.516 1
1 609 . 8 1 1 A 59 59 THR H H 59 8.053 8.009 0.044 1
1 610 . 8 1 1 A 59 59 THR HA H 59 4.305 4.654 -0.349 1
1 615 . 8 1 1 A 59 59 THR C C 59 174.478 172.387 2.091 1
1 616 . 8 1 1 A 59 59 THR CA C 59 63.305 60.119 3.186 1
1 617 . 8 1 1 A 59 59 THR CB C 59 68.354 68.246 0.108 1
1 619 . 8 1 1 A 59 59 THR N N 59 116.405 116.054 0.351 1
1 620 . 8 1 1 A 60 60 HIS H H 60 8.359 8.169 0.190 1
1 621 . 8 1 1 A 60 60 HIS HA H 60 5.167 5.089 0.078 1
1 626 . 8 1 1 A 60 60 HIS CA C 60 52.792 53.180 -0.388 1
1 627 . 8 1 1 A 60 60 HIS CB C 60 32.142 30.707 1.435 1
1 628 . 8 1 1 A 60 60 HIS N N 60 123.625 124.899 -1.274 1
1 629 . 8 1 1 A 61 61 PRO HA H 61 4.277 4.323 -0.046 1
1 636 . 8 1 1 A 61 61 PRO C C 61 178.217 177.497 0.720 1
1 637 . 8 1 1 A 61 61 PRO CA C 61 64.375 64.496 -0.121 1
1 638 . 8 1 1 A 61 61 PRO CB C 61 32.007 32.142 -0.135 1
1 641 . 8 1 1 A 62 62 GLY H H 62 8.421 8.131 0.290 1
1 642 . 8 1 1 A 62 62 GLY HA2 H 62 3.889 3.764 0.125 1
1 643 . 8 1 1 A 62 62 GLY HA3 H 62 3.653 3.859 -0.206 1
1 644 . 8 1 1 A 62 62 GLY C C 62 174.994 173.983 1.011 1
1 645 . 8 1 1 A 62 62 GLY CA C 62 45.831 44.971 0.860 1
1 646 . 8 1 1 A 62 62 GLY N N 62 106.132 106.204 -0.072 1
1 647 . 8 1 1 A 63 63 TYR H H 63 7.327 7.893 -0.566 1
1 648 . 8 1 1 A 63 63 TYR HA H 63 4.846 4.505 0.341 1
1 652 . 8 1 1 A 63 63 TYR C C 63 175.593 175.571 0.022 1
1 653 . 8 1 1 A 63 63 TYR CA C 63 56.071 58.433 -2.362 1
1 654 . 8 1 1 A 63 63 TYR CB C 63 38.962 40.600 -1.638 1
1 655 . 8 1 1 A 63 63 TYR N N 63 116.628 116.825 -0.197 1
1 656 . 8 1 1 A 64 64 VAL H H 64 7.296 7.227 0.069 1
1 657 . 8 1 1 A 64 64 VAL HA H 64 3.180 4.095 -0.915 1
1 665 . 8 1 1 A 64 64 VAL C C 64 177.312 176.871 0.441 1
1 666 . 8 1 1 A 64 64 VAL CA C 64 65.688 63.069 2.619 1
1 667 . 8 1 1 A 64 64 VAL CB C 64 30.957 32.020 -1.063 1
1 670 . 8 1 1 A 64 64 VAL N N 64 117.940 119.466 -1.526 1
1 671 . 8 1 1 A 65 65 GLY H H 65 8.449 9.421 -0.972 1
1 672 . 8 1 1 A 65 65 GLY HA2 H 65 4.320 3.975 0.345 1
1 673 . 8 1 1 A 65 65 GLY HA3 H 65 3.515 3.987 -0.472 1
1 674 . 8 1 1 A 65 65 GLY C C 65 174.821 173.591 1.230 1
1 675 . 8 1 1 A 65 65 GLY CA C 65 44.599 45.270 -0.671 1
1 676 . 8 1 1 A 65 65 GLY N N 65 115.317 114.196 1.121 1
1 677 . 8 1 1 A 66 66 ILE H H 66 7.095 7.641 -0.546 1
1 678 . 8 1 1 A 66 66 ILE HA H 66 3.193 4.738 -1.545 1
1 687 . 8 1 1 A 66 66 ILE C C 66 174.308 175.124 -0.816 1
1 688 . 8 1 1 A 66 66 ILE CA C 66 63.470 60.230 3.240 1
1 689 . 8 1 1 A 66 66 ILE CB C 66 37.775 40.014 -2.239 1
1 693 . 8 1 1 A 66 66 ILE N N 66 122.099 122.727 -0.628 1
1 694 . 8 1 1 A 67 67 GLU H H 67 7.126 9.273 -2.147 1
1 695 . 8 1 1 A 67 67 GLU HA H 67 5.343 5.246 0.097 1
1 699 . 8 1 1 A 67 67 GLU C C 67 174.652 175.492 -0.840 1
1 700 . 8 1 1 A 67 67 GLU CA C 67 54.109 54.569 -0.460 1
1 701 . 8 1 1 A 67 67 GLU CB C 67 33.619 33.221 0.398 1
1 703 . 8 1 1 A 67 67 GLU N N 67 125.164 128.055 -2.891 1
1 704 . 8 1 1 A 68 68 GLY H H 68 8.401 7.935 0.466 1
1 705 . 8 1 1 A 68 68 GLY HA2 H 68 4.364 2.866 1.498 1
1 706 . 8 1 1 A 68 68 GLY HA3 H 68 4.041 4.003 0.038 1
1 707 . 8 1 1 A 68 68 GLY C C 68 171.644 170.922 0.722 1
1 708 . 8 1 1 A 68 68 GLY CA C 68 45.680 44.499 1.181 1
1 709 . 8 1 1 A 68 68 GLY N N 68 109.626 112.018 -2.392 1
1 710 . 8 1 1 A 69 69 TYR H H 69 8.422 10.318 -1.896 1
1 711 . 8 1 1 A 69 69 TYR HA H 69 5.079 4.872 0.207 1
1 714 . 8 1 1 A 69 69 TYR C C 69 176.194 175.275 0.919 1
1 715 . 8 1 1 A 69 69 TYR CA C 69 57.681 57.471 0.210 1
1 716 . 8 1 1 A 69 69 TYR CB C 69 41.043 39.711 1.332 1
1 717 . 8 1 1 A 69 69 TYR N N 69 119.689 118.994 0.695 1
1 718 . 8 1 1 A 70 70 VAL H H 70 8.753 8.374 0.379 1
1 719 . 8 1 1 A 70 70 VAL HA H 70 4.143 4.220 -0.077 1
1 727 . 8 1 1 A 70 70 VAL C C 70 176.540 175.583 0.957 1
1 728 . 8 1 1 A 70 70 VAL CA C 70 63.477 63.717 -0.240 1
1 729 . 8 1 1 A 70 70 VAL CB C 70 30.952 32.083 -1.131 1
1 732 . 8 1 1 A 70 70 VAL N N 70 123.420 124.861 -1.441 1
1 733 . 8 1 1 A 71 71 ILE H H 71 9.101 10.156 -1.055 1
1 734 . 8 1 1 A 71 71 ILE HA H 71 4.834 4.788 0.046 1
1 743 . 8 1 1 A 71 71 ILE C C 71 175.418 175.893 -0.475 1
1 744 . 8 1 1 A 71 71 ILE CA C 71 60.637 62.231 -1.594 1
1 745 . 8 1 1 A 71 71 ILE CB C 71 39.853 40.398 -0.545 1
1 749 . 8 1 1 A 71 71 ILE N N 71 119.913 124.984 -5.071 1
1 750 . 8 1 1 A 72 72 ASP H H 72 8.030 8.252 -0.222 1
1 751 . 8 1 1 A 72 72 ASP HA H 72 4.964 5.301 -0.337 1
1 754 . 8 1 1 A 72 72 ASP C C 72 173.017 174.808 -1.791 1
1 755 . 8 1 1 A 72 72 ASP CA C 72 53.511 53.085 0.426 1
1 756 . 8 1 1 A 72 72 ASP CB C 72 41.932 44.188 -2.256 1
1 757 . 8 1 1 A 72 72 ASP N N 72 118.377 120.163 -1.786 1
1 758 . 8 1 1 A 73 73 GLU H H 73 9.349 8.964 0.385 1
1 759 . 8 1 1 A 73 73 GLU HA H 73 4.868 5.417 -0.549 1
1 762 . 8 1 1 A 73 73 GLU C C 73 173.793 174.594 -0.801 1
1 763 . 8 1 1 A 73 73 GLU CA C 73 55.521 55.022 0.499 1
1 764 . 8 1 1 A 73 73 GLU CB C 73 33.138 31.683 1.455 1
1 766 . 8 1 1 A 73 73 GLU N N 73 123.848 123.140 0.708 1
1 767 . 8 1 1 A 74 74 THR H H 74 8.748 8.347 0.401 1
1 768 . 8 1 1 A 74 74 THR HA H 74 4.992 4.914 0.078 1
1 773 . 8 1 1 A 74 74 THR CA C 74 59.450 60.131 -0.681 1
1 774 . 8 1 1 A 74 74 THR CB C 74 70.429 72.148 -1.719 1
1 776 . 8 1 1 A 74 74 THR N N 74 116.628 116.426 0.202 1
1 777 . 8 1 1 A 75 75 ARG HA H 75 3.741 4.018 -0.277 1
1 782 . 8 1 1 A 75 75 ARG C C 75 177.140 176.970 0.170 1
1 783 . 8 1 1 A 75 75 ARG CA C 75 60.041 58.910 1.131 1
1 784 . 8 1 1 A 75 75 ARG CB C 75 29.930 29.971 -0.041 1
1 787 . 8 1 1 A 76 76 ASN H H 76 8.497 7.782 0.715 1
1 788 . 8 1 1 A 76 76 ASN HA H 76 5.310 4.906 0.404 1
1 791 . 8 1 1 A 76 76 ASN C C 76 175.509 174.099 1.410 1
1 792 . 8 1 1 A 76 76 ASN CA C 76 52.320 52.322 -0.002 1
1 793 . 8 1 1 A 76 76 ASN CB C 76 40.744 39.461 1.283 1
1 794 . 8 1 1 A 76 76 ASN N N 76 111.053 116.410 -5.357 1
1 795 . 8 1 1 A 77 77 MET H H 77 7.528 7.454 0.074 1
1 796 . 8 1 1 A 77 77 MET HA H 77 5.392 5.054 0.338 1
1 801 . 8 1 1 A 77 77 MET C C 77 174.824 174.499 0.325 1
1 802 . 8 1 1 A 77 77 MET CA C 77 54.994 53.781 1.213 1
1 803 . 8 1 1 A 77 77 MET CB C 77 36.753 35.690 1.063 1
1 805 . 8 1 1 A 77 77 MET N N 77 119.913 116.187 3.726 1
1 806 . 8 1 1 A 78 78 LEU H H 78 8.977 8.516 0.461 1
1 807 . 8 1 1 A 78 78 LEU HA H 78 4.803 5.472 -0.669 1
1 817 . 8 1 1 A 78 78 LEU C C 78 174.563 174.468 0.095 1
1 818 . 8 1 1 A 78 78 LEU CA C 78 53.964 54.523 -0.559 1
1 819 . 8 1 1 A 78 78 LEU CB C 78 44.903 45.282 -0.379 1
1 823 . 8 1 1 A 78 78 LEU N N 78 121.224 121.565 -0.341 1
1 824 . 8 1 1 A 79 79 VAL H H 79 8.115 9.466 -1.351 1
1 825 . 8 1 1 A 79 79 VAL HA H 79 4.783 4.995 -0.212 1
1 833 . 8 1 1 A 79 79 VAL C C 79 175.297 174.893 0.404 1
1 834 . 8 1 1 A 79 79 VAL CA C 79 61.821 60.597 1.224 1
1 835 . 8 1 1 A 79 79 VAL CB C 79 31.146 34.407 -3.261 1
1 838 . 8 1 1 A 79 79 VAL N N 79 124.062 127.350 -3.288 1
1 839 . 8 1 1 A 80 80 ILE H H 80 9.342 9.081 0.261 1
1 840 . 8 1 1 A 80 80 ILE HA H 80 4.764 5.266 -0.502 1
1 849 . 8 1 1 A 80 80 ILE C C 80 174.127 174.918 -0.791 1
1 850 . 8 1 1 A 80 80 ILE CA C 80 59.897 59.445 0.452 1
1 851 . 8 1 1 A 80 80 ILE CB C 80 42.225 40.411 1.814 1
1 855 . 8 1 1 A 80 80 ILE N N 80 129.970 126.956 3.014 1
1 856 . 8 1 1 A 81 81 ALA H H 81 9.478 9.460 0.018 1
1 857 . 8 1 1 A 81 81 ALA HA H 81 5.139 5.502 -0.363 1
1 861 . 8 1 1 A 81 81 ALA C C 81 176.970 176.802 0.168 1
1 862 . 8 1 1 A 81 81 ALA CA C 81 50.835 50.568 0.267 1
1 863 . 8 1 1 A 81 81 ALA CB C 81 21.451 22.374 -0.923 1
1 864 . 8 1 1 A 81 81 ALA N N 81 129.756 126.201 3.555 1
1 865 . 8 1 1 A 82 82 GLY H H 82 8.691 8.920 -0.229 1
1 866 . 8 1 1 A 82 82 GLY HA2 H 82 5.110 4.332 0.778 1
1 867 . 8 1 1 A 82 82 GLY HA3 H 82 4.241 4.530 -0.289 1
1 868 . 8 1 1 A 82 82 GLY C C 82 173.017 174.527 -1.510 1
1 869 . 8 1 1 A 82 82 GLY CA C 82 44.166 44.839 -0.673 1
1 870 . 8 1 1 A 82 82 GLY N N 82 113.568 109.295 4.273 1
1 871 . 8 1 1 A 83 83 GLU H H 83 8.659 8.847 -0.188 1
1 872 . 8 1 1 A 83 83 GLU HA H 83 4.286 4.313 -0.027 1
1 876 . 8 1 1 A 83 83 GLU C C 83 177.570 176.225 1.345 1
1 877 . 8 1 1 A 83 83 GLU CA C 83 59.017 58.298 0.719 1
1 878 . 8 1 1 A 83 83 GLU CB C 83 29.762 29.094 0.668 1
1 880 . 8 1 1 A 83 83 GLU N N 83 120.019 121.278 -1.259 1
1 881 . 8 1 1 A 84 84 ASN H H 84 8.549 8.561 -0.012 1
1 882 . 8 1 1 A 84 84 ASN HA H 84 4.821 4.931 -0.110 1
1 884 . 8 1 1 A 84 84 ASN C C 84 173.878 173.929 -0.051 1
1 885 . 8 1 1 A 84 84 ASN CA C 84 52.919 53.081 -0.162 1
1 886 . 8 1 1 A 84 84 ASN CB C 84 40.150 39.209 0.941 1
1 887 . 8 1 1 A 84 84 ASN N N 84 112.778 124.463 -11.685 1
1 888 . 8 1 1 A 85 85 LYS H H 85 7.116 7.613 -0.497 1
1 889 . 8 1 1 A 85 85 LYS HA H 85 4.344 4.973 -0.629 1
1 895 . 8 1 1 A 85 85 LYS C C 85 173.278 174.692 -1.414 1
1 896 . 8 1 1 A 85 85 LYS CA C 85 55.292 55.441 -0.149 1
1 897 . 8 1 1 A 85 85 LYS CB C 85 36.124 36.067 0.057 1
1 901 . 8 1 1 A 85 85 LYS N N 85 118.377 120.671 -2.294 1
1 902 . 8 1 1 A 86 86 VAL H H 86 7.781 8.867 -1.086 1
1 903 . 8 1 1 A 86 86 VAL HA H 86 4.749 5.401 -0.652 1
1 911 . 8 1 1 A 86 86 VAL C C 86 174.739 174.580 0.159 1
1 912 . 8 1 1 A 86 86 VAL CA C 86 60.716 59.503 1.213 1
1 913 . 8 1 1 A 86 86 VAL CB C 86 33.619 35.011 -1.392 1
1 916 . 8 1 1 A 86 86 VAL N N 86 120.127 118.613 1.514 1
1 917 . 8 1 1 A 87 87 TRP H H 87 9.558 9.429 0.129 1
1 918 . 8 1 1 A 87 87 TRP HA H 87 4.958 5.487 -0.529 1
1 923 . 8 1 1 A 87 87 TRP C C 87 174.909 175.214 -0.305 1
1 924 . 8 1 1 A 87 87 TRP CA C 87 57.073 56.148 0.925 1
1 925 . 8 1 1 A 87 87 TRP CB C 87 33.028 31.393 1.635 1
1 926 . 8 1 1 A 87 87 TRP N N 87 127.346 123.544 3.802 1
1 927 . 8 1 1 A 88 88 LYS H H 88 8.590 8.016 0.574 1
1 928 . 8 1 1 A 88 88 LYS HA H 88 4.856 4.668 0.188 1
1 935 . 8 1 1 A 88 88 LYS C C 88 175.382 174.589 0.793 1
1 936 . 8 1 1 A 88 88 LYS CA C 88 55.887 54.657 1.230 1
1 937 . 8 1 1 A 88 88 LYS CB C 88 32.434 33.863 -1.429 1
1 941 . 8 1 1 A 88 88 LYS N N 88 123.625 123.083 0.542 1
1 942 . 8 1 1 A 89 89 VAL H H 89 8.829 8.039 0.790 1
1 943 . 8 1 1 A 89 89 VAL HA H 89 4.406 4.311 0.095 1
1 951 . 8 1 1 A 89 89 VAL CA C 89 58.371 58.930 -0.559 1
1 952 . 8 1 1 A 89 89 VAL CB C 89 34.512 34.710 -0.198 1
1 955 . 8 1 1 A 89 89 VAL N N 89 124.285 125.555 -1.270 1
1 956 . 8 1 1 A 90 90 PRO HA H 90 5.073 4.587 0.486 1
1 961 . 8 1 1 A 90 90 PRO C C 90 177.231 177.241 -0.010 1
1 962 . 8 1 1 A 90 90 PRO CA C 90 61.795 62.689 -0.894 1
1 963 . 8 1 1 A 90 90 PRO CB C 90 31.660 32.974 -1.314 1
1 964 . 8 1 1 A 91 91 LYS H H 91 8.116 8.622 -0.506 1
1 965 . 8 1 1 A 91 91 LYS HA H 91 4.024 4.281 -0.257 1
1 969 . 8 1 1 A 91 91 LYS C C 91 178.518 177.237 1.281 1
1 970 . 8 1 1 A 91 91 LYS CA C 91 59.621 59.357 0.264 1
1 971 . 8 1 1 A 91 91 LYS CB C 91 34.217 32.057 2.160 1
1 973 . 8 1 1 A 91 91 LYS N N 91 121.224 122.013 -0.789 1
1 974 . 8 1 1 A 92 92 ASP H H 92 8.505 8.395 0.110 1
1 975 . 8 1 1 A 92 92 ASP HA H 92 3.781 4.598 -0.817 1
1 978 . 8 1 1 A 92 92 ASP C C 92 176.975 176.671 0.304 1
1 979 . 8 1 1 A 92 92 ASP CA C 92 56.773 54.538 2.235 1
1 980 . 8 1 1 A 92 92 ASP CB C 92 39.590 40.166 -0.576 1
1 981 . 8 1 1 A 92 92 ASP N N 92 111.815 116.484 -4.669 1
1 982 . 8 1 1 A 93 93 VAL H H 93 6.691 7.563 -0.872 1
1 983 . 8 1 1 A 93 93 VAL HA H 93 4.678 4.674 0.004 1
1 991 . 8 1 1 A 93 93 VAL C C 93 176.537 174.758 1.779 1
1 992 . 8 1 1 A 93 93 VAL CA C 93 60.120 60.732 -0.612 1
1 993 . 8 1 1 A 93 93 VAL CB C 93 31.093 32.313 -1.220 1
1 996 . 8 1 1 A 93 93 VAL N N 93 107.879 113.374 -5.495 1
1 997 . 8 1 1 A 94 94 CYS H H 94 7.249 7.713 -0.464 1
1 998 . 8 1 1 A 94 94 CYS HA H 94 5.062 4.694 0.368 1
1 1001 . 8 1 1 A 94 94 CYS C C 94 173.103 172.046 1.057 1
1 1002 . 8 1 1 A 94 94 CYS CA C 94 58.001 56.965 1.036 1
1 1003 . 8 1 1 A 94 94 CYS CB C 94 31.418 30.728 0.690 1
1 1004 . 8 1 1 A 94 94 CYS N N 94 117.940 116.805 1.135 1
1 1005 . 8 1 1 A 95 95 ILE H H 95 8.153 7.978 0.175 1
1 1006 . 8 1 1 A 95 95 ILE HA H 95 4.159 4.707 -0.548 1
1 1016 . 8 1 1 A 95 95 ILE C C 95 174.736 174.707 0.029 1
1 1017 . 8 1 1 A 95 95 ILE CA C 95 61.234 60.258 0.976 1
1 1018 . 8 1 1 A 95 95 ILE CB C 95 38.071 39.678 -1.607 1
1 1022 . 8 1 1 A 95 95 ILE N N 95 121.876 119.824 2.052 1
1 1023 . 8 1 1 A 96 96 PHE H H 96 8.400 8.680 -0.280 1
1 1024 . 8 1 1 A 96 96 PHE HA H 96 5.004 5.083 -0.079 1
1 1029 . 8 1 1 A 96 96 PHE C C 96 174.005 174.460 -0.455 1
1 1030 . 8 1 1 A 96 96 PHE CA C 96 56.922 56.811 0.111 1
1 1031 . 8 1 1 A 96 96 PHE CB C 96 44.006 41.310 2.696 1
1 1032 . 8 1 1 A 96 96 PHE N N 96 125.820 126.702 -0.882 1
1 1033 . 8 1 1 A 97 97 GLU H H 97 8.985 8.710 0.275 1
1 1034 . 8 1 1 A 97 97 GLU HA H 97 5.275 5.182 0.093 1
1 1038 . 8 1 1 A 97 97 GLU C C 97 175.596 175.088 0.508 1
1 1039 . 8 1 1 A 97 97 GLU CA C 97 55.070 54.759 0.311 1
1 1040 . 8 1 1 A 97 97 GLU CB C 97 33.628 30.614 3.014 1
1 1042 . 8 1 1 A 97 97 GLU N N 97 121.010 124.795 -3.785 1
1 1043 . 8 1 1 A 98 98 PHE H H 98 9.304 9.101 0.203 1
1 1044 . 8 1 1 A 98 98 PHE HA H 98 5.337 4.868 0.469 1
1 1048 . 8 1 1 A 98 98 PHE C C 98 174.650 175.720 -1.070 1
1 1049 . 8 1 1 A 98 98 PHE CA C 98 57.363 58.627 -1.264 1
1 1050 . 8 1 1 A 98 98 PHE CB C 98 41.936 40.042 1.894 1
1 1051 . 8 1 1 A 98 98 PHE N N 98 128.658 126.169 2.489 1
1 1052 . 8 1 1 A 99 99 GLU H H 99 8.721 9.501 -0.780 1
1 1053 . 8 1 1 A 99 99 GLU HA H 99 5.457 4.799 0.658 1
1 1058 . 8 1 1 A 99 99 GLU C C 99 176.368 176.328 0.040 1
1 1059 . 8 1 1 A 99 99 GLU CA C 99 54.401 55.268 -0.867 1
1 1060 . 8 1 1 A 99 99 GLU CB C 99 33.068 31.534 1.534 1
1 1062 . 8 1 1 A 99 99 GLU N N 99 122.759 124.256 -1.497 1
1 1063 . 8 1 1 A 100 100 THR H H 100 8.588 10.126 -1.538 1
1 1064 . 8 1 1 A 100 100 THR HA H 100 4.603 4.634 -0.031 1
1 1069 . 8 1 1 A 100 100 THR C C 100 177.144 176.482 0.662 1
1 1070 . 8 1 1 A 100 100 THR CA C 100 60.774 62.183 -1.409 1
1 1071 . 8 1 1 A 100 100 THR CB C 100 70.136 69.917 0.219 1
1 1073 . 8 1 1 A 100 100 THR N N 100 116.191 120.151 -3.960 1
1 1074 . 8 1 1 A 101 101 TRP H H 101 9.287 9.202 0.085 1
1 1075 . 8 1 1 A 101 101 TRP HA H 101 4.591 4.508 0.083 1
1 1080 . 8 1 1 A 101 101 TRP C C 101 176.457 176.580 -0.123 1
1 1081 . 8 1 1 A 101 101 TRP CA C 101 60.045 58.870 1.175 1
1 1082 . 8 1 1 A 101 101 TRP CB C 101 28.578 28.437 0.141 1
1 1083 . 8 1 1 A 101 101 TRP N N 101 122.220 123.595 -1.375 1
1 1084 . 8 1 1 A 102 102 ASP H H 102 7.553 8.120 -0.567 1
1 1085 . 8 1 1 A 102 102 ASP HA H 102 4.129 4.442 -0.313 1
1 1088 . 8 1 1 A 102 102 ASP C C 102 176.714 176.042 0.672 1
1 1089 . 8 1 1 A 102 102 ASP CA C 102 52.775 52.994 -0.219 1
1 1090 . 8 1 1 A 102 102 ASP CB C 102 39.231 40.376 -1.145 1
1 1091 . 8 1 1 A 102 102 ASP N N 102 115.763 120.387 -4.624 1
1 1092 . 8 1 1 A 103 103 GLY H H 103 7.910 8.163 -0.253 1
1 1093 . 8 1 1 A 103 103 GLY HA2 H 103 4.216 3.974 0.242 1
1 1094 . 8 1 1 A 103 103 GLY HA3 H 103 3.686 4.010 -0.324 1
1 1095 . 8 1 1 A 103 103 GLY C C 103 174.566 174.166 0.400 1
1 1096 . 8 1 1 A 103 103 GLY CA C 103 45.179 46.293 -1.114 1
1 1097 . 8 1 1 A 103 103 GLY N N 103 108.311 108.414 -0.103 1
1 1098 . 8 1 1 A 104 104 THR H H 104 7.691 7.610 0.081 1
1 1099 . 8 1 1 A 104 104 THR HA H 104 4.031 4.801 -0.770 1
1 1104 . 8 1 1 A 104 104 THR C C 104 173.405 173.970 -0.565 1
1 1105 . 8 1 1 A 104 104 THR CA C 104 64.307 60.090 4.217 1
1 1106 . 8 1 1 A 104 104 THR CB C 104 68.354 71.646 -3.292 1
1 1108 . 8 1 1 A 104 104 THR N N 104 119.913 113.669 6.244 1
1 1109 . 8 1 1 A 105 105 LYS H H 105 8.297 8.814 -0.517 1
1 1110 . 8 1 1 A 105 105 LYS HA H 105 5.457 4.815 0.642 1
1 1116 . 8 1 1 A 105 105 LYS C C 105 177.055 175.310 1.745 1
1 1117 . 8 1 1 A 105 105 LYS CA C 105 54.401 55.711 -1.310 1
1 1118 . 8 1 1 A 105 105 LYS CB C 105 34.230 34.009 0.221 1
1 1122 . 8 1 1 A 105 105 LYS N N 105 125.597 122.118 3.479 1
1 1123 . 8 1 1 A 106 106 ILE H H 106 9.238 9.340 -0.102 1
1 1124 . 8 1 1 A 106 106 ILE HA H 106 4.289 4.796 -0.507 1
1 1133 . 8 1 1 A 106 106 ILE C C 106 174.221 174.555 -0.334 1
1 1134 . 8 1 1 A 106 106 ILE CA C 106 60.631 59.935 0.696 1
1 1135 . 8 1 1 A 106 106 ILE CB C 106 41.927 39.806 2.121 1
1 1139 . 8 1 1 A 106 106 ILE N N 106 124.499 124.843 -0.344 1
1 1140 . 8 1 1 A 107 107 LYS H H 107 8.650 9.077 -0.427 1
1 1141 . 8 1 1 A 107 107 LYS HA H 107 5.608 5.016 0.592 1
1 1147 . 8 1 1 A 107 107 LYS C C 107 175.681 175.150 0.531 1
1 1148 . 8 1 1 A 107 107 LYS CA C 107 55.248 54.917 0.331 1
1 1149 . 8 1 1 A 107 107 LYS CB C 107 33.618 34.145 -0.527 1
1 1153 . 8 1 1 A 107 107 LYS N N 107 130.844 128.585 2.259 1
1 1154 . 8 1 1 A 108 108 ILE H H 108 9.448 8.459 0.989 1
1 1155 . 8 1 1 A 108 108 ILE HA H 108 4.741 4.808 -0.067 1
1 1164 . 8 1 1 A 108 108 ILE C C 108 172.670 174.533 -1.863 1
1 1165 . 8 1 1 A 108 108 ILE CA C 108 59.157 59.548 -0.391 1
1 1166 . 8 1 1 A 108 108 ILE CB C 108 42.241 41.903 0.338 1
1 1170 . 8 1 1 A 108 108 ILE N N 108 125.160 127.501 -2.341 1
1 1171 . 8 1 1 A 109 109 SER H H 109 8.490 8.855 -0.365 1
1 1172 . 8 1 1 A 109 109 SER HA H 109 4.437 4.827 -0.390 1
1 1175 . 8 1 1 A 109 109 SER C C 109 176.536 176.576 -0.040 1
1 1176 . 8 1 1 A 109 109 SER CA C 109 58.850 57.344 1.506 1
1 1177 . 8 1 1 A 109 109 SER CB C 109 63.010 64.314 -1.304 1
1 1178 . 8 1 1 A 109 109 SER N N 109 122.750 120.366 2.384 1
1 1179 . 8 1 1 A 110 110 GLY H H 110 9.292 8.525 0.767 1
1 1180 . 8 1 1 A 110 110 GLY HA2 H 110 5.193 4.094 1.099 1
1 1181 . 8 1 1 A 110 110 GLY HA3 H 110 3.755 4.252 -0.497 1
1 1182 . 8 1 1 A 110 110 GLY C C 110 176.964 175.098 1.866 1
1 1183 . 8 1 1 A 110 110 GLY CA C 110 48.168 46.849 1.319 1
1 1184 . 8 1 1 A 110 110 GLY N N 110 116.628 110.056 6.572 1
1 1185 . 8 1 1 A 111 111 GLU H H 111 8.576 8.740 -0.164 1
1 1186 . 8 1 1 A 111 111 GLU HA H 111 4.080 4.159 -0.079 1
1 1191 . 8 1 1 A 111 111 GLU C C 111 178.867 178.949 -0.082 1
1 1192 . 8 1 1 A 111 111 GLU CA C 111 59.150 58.559 0.591 1
1 1193 . 8 1 1 A 111 111 GLU CB C 111 28.831 28.792 0.039 1
1 1195 . 8 1 1 A 111 111 GLU N N 111 120.564 118.322 2.242 1
1 1196 . 8 1 1 A 112 112 LYS H H 112 7.605 7.797 -0.192 1
1 1197 . 8 1 1 A 112 112 LYS HA H 112 4.229 4.020 0.209 1
1 1202 . 8 1 1 A 112 112 LYS C C 112 176.710 178.396 -1.686 1
1 1203 . 8 1 1 A 112 112 LYS CA C 112 57.083 59.197 -2.114 1
1 1204 . 8 1 1 A 112 112 LYS CB C 112 32.183 32.465 -0.282 1
1 1208 . 8 1 1 A 112 112 LYS N N 112 116.628 120.334 -3.706 1
1 1209 . 8 1 1 A 113 113 LEU H H 113 7.784 7.741 0.043 1
1 1210 . 8 1 1 A 113 113 LEU HA H 113 4.387 4.329 0.058 1
1 1220 . 8 1 1 A 113 113 LEU C C 113 176.195 176.575 -0.380 1
1 1221 . 8 1 1 A 113 113 LEU CA C 113 52.617 54.092 -1.475 1
1 1222 . 8 1 1 A 113 113 LEU CB C 113 42.820 41.120 1.700 1
1 1226 . 8 1 1 A 113 113 LEU N N 113 114.219 113.876 0.343 1
1 1227 . 8 1 1 A 114 114 VAL H H 114 7.032 7.563 -0.531 1
1 1228 . 8 1 1 A 114 114 VAL HA H 114 3.723 3.919 -0.196 1
1 1236 . 8 1 1 A 114 114 VAL C C 114 175.430 177.157 -1.727 1
1 1237 . 8 1 1 A 114 114 VAL CA C 114 65.537 63.881 1.656 1
1 1238 . 8 1 1 A 114 114 VAL CB C 114 32.115 31.261 0.854 1
1 1241 . 8 1 1 A 114 114 VAL N N 114 121.773 121.051 0.722 1
1 1242 . 8 1 1 A 115 115 GLY H H 115 8.678 8.790 -0.112 1
1 1243 . 8 1 1 A 115 115 GLY HA2 H 115 4.313 3.935 0.378 1
1 1244 . 8 1 1 A 115 115 GLY HA3 H 115 3.846 3.937 -0.091 1
1 1245 . 8 1 1 A 115 115 GLY C C 115 172.462 173.456 -0.994 1
1 1246 . 8 1 1 A 115 115 GLY CA C 115 43.743 45.553 -1.810 1
1 1247 . 8 1 1 A 115 115 GLY N N 115 117.503 116.919 0.584 1
1 1248 . 8 1 1 A 116 116 ARG H H 116 8.701 8.610 0.091 1
1 1249 . 8 1 1 A 116 116 ARG HA H 116 3.926 4.579 -0.653 1
1 1254 . 8 1 1 A 116 116 ARG CA C 116 56.470 52.937 3.533 1
1 1255 . 8 1 1 A 116 116 ARG CB C 116 29.585 30.040 -0.455 1
1 1257 . 8 1 1 A 116 116 ARG N N 116 123.504 120.941 2.563 1
1 1258 . 8 1 1 A 117 117 PRO HA H 117 4.242 4.239 0.003 1
1 1264 . 8 1 1 A 117 117 PRO C C 117 178.947 178.059 0.888 1
1 1265 . 8 1 1 A 117 117 PRO CA C 117 65.684 64.534 1.150 1
1 1266 . 8 1 1 A 117 117 PRO CB C 117 30.949 32.046 -1.097 1
1 1269 . 8 1 1 A 118 118 GLU H H 118 10.821 8.860 1.961 1
1 1270 . 8 1 1 A 118 118 GLU HA H 118 4.197 4.047 0.150 1
1 1271 . 8 1 1 A 118 118 GLU C C 118 176.627 178.682 -2.055 1
1 1272 . 8 1 1 A 118 118 GLU CA C 118 58.045 59.234 -1.189 1
1 1273 . 8 1 1 A 118 118 GLU CB C 118 27.101 29.167 -2.066 1
1 1274 . 8 1 1 A 118 118 GLU N N 118 119.242 116.205 3.037 1
1 1275 . 8 1 1 A 119 119 MET H H 119 7.226 8.066 -0.840 1
1 1276 . 8 1 1 A 119 119 MET HA H 119 4.591 4.048 0.543 1
1 1279 . 8 1 1 A 119 119 MET C C 119 180.024 178.499 1.525 1
1 1280 . 8 1 1 A 119 119 MET CA C 119 54.695 58.422 -3.727 1
1 1281 . 8 1 1 A 119 119 MET CB C 119 31.012 32.090 -1.078 1
1 1283 . 8 1 1 A 119 119 MET N N 119 119.475 120.317 -0.842 1
1 1284 . 8 1 1 A 120 120 ARG H H 120 7.877 7.286 0.591 1
1 1285 . 8 1 1 A 120 120 ARG HA H 120 3.988 3.918 0.070 1
1 1292 . 8 1 1 A 120 120 ARG C C 120 177.705 178.878 -1.173 1
1 1293 . 8 1 1 A 120 120 ARG CA C 120 60.773 58.466 2.307 1
1 1294 . 8 1 1 A 120 120 ARG CB C 120 31.159 29.761 1.398 1
1 1295 . 8 1 1 A 120 120 ARG N N 120 122.099 119.864 2.235 1
1 1296 . 8 1 1 A 121 121 LEU H H 121 6.732 7.899 -1.167 1
1 1297 . 8 1 1 A 121 121 LEU HA H 121 4.170 3.962 0.208 1
1 1307 . 8 1 1 A 121 121 LEU C C 121 176.220 178.441 -2.221 1
1 1308 . 8 1 1 A 121 121 LEU CA C 121 57.370 58.003 -0.633 1
1 1309 . 8 1 1 A 121 121 LEU CB C 121 42.945 41.613 1.332 1
1 1312 . 8 1 1 A 121 121 LEU N N 121 114.436 119.667 -5.231 1
1 1313 . 8 1 1 A 122 122 LYS H H 122 7.555 9.103 -1.548 1
1 1314 . 8 1 1 A 122 122 LYS HA H 122 4.338 4.273 0.065 1
1 1321 . 8 1 1 A 122 122 LYS C C 122 176.969 176.814 0.155 1
1 1322 . 8 1 1 A 122 122 LYS CA C 122 55.621 56.128 -0.507 1
1 1323 . 8 1 1 A 122 122 LYS CB C 122 32.414 32.349 0.065 1
1 1327 . 8 1 1 A 122 122 LYS N N 122 115.754 116.619 -0.865 1
1 1328 . 8 1 1 A 123 123 LYS H H 123 7.688 8.126 -0.438 1
1 1329 . 8 1 1 A 123 123 LYS HA H 123 4.535 4.379 0.156 1
1 1330 . 8 1 1 A 123 123 LYS CA C 123 58.461 58.282 0.179 1
1 1331 . 8 1 1 A 123 123 LYS CB C 123 33.138 31.193 1.945 1
1 1332 . 8 1 1 A 123 123 LYS N N 123 120.843 117.512 3.331 1
1 1333 . 8 1 1 A 126 126 ARG HA H 126 4.347 4.267 0.080 1
1 1338 . 8 1 1 A 126 126 ARG C C 126 174.573 175.952 -1.379 1
1 1339 . 8 1 1 A 126 126 ARG CA C 126 55.998 57.030 -1.032 1
1 1340 . 8 1 1 A 126 126 ARG CB C 126 31.569 30.752 0.817 1
1 128 . 9 1 1 A 18 18 GLY H H 18 8.343 8.464 -0.121 1
1 129 . 9 1 1 A 18 18 GLY HA2 H 18 3.894 3.859 0.035 1
1 130 . 9 1 1 A 18 18 GLY C C 18 177.743 175.991 1.752 1
1 131 . 9 1 1 A 18 18 GLY CA C 18 45.497 46.453 -0.956 1
1 132 . 9 1 1 A 18 18 GLY N N 18 109.925 107.185 2.740 1
1 133 . 9 1 1 A 19 19 SER H H 19 8.005 8.987 -0.982 1
1 134 . 9 1 1 A 19 19 SER HA H 19 4.329 4.184 0.145 1
1 136 . 9 1 1 A 19 19 SER C C 19 175.168 176.470 -1.302 1
1 137 . 9 1 1 A 19 19 SER CA C 19 58.852 61.446 -2.594 1
1 138 . 9 1 1 A 19 19 SER CB C 19 63.604 62.548 1.056 1
1 139 . 9 1 1 A 19 19 SER N N 19 115.090 121.789 -6.699 1
1 140 . 9 1 1 A 20 20 TYR H H 20 8.040 7.962 0.078 1
1 141 . 9 1 1 A 20 20 TYR HA H 20 4.439 4.287 0.152 1
1 146 . 9 1 1 A 20 20 TYR C C 20 176.111 178.261 -2.150 1
1 147 . 9 1 1 A 20 20 TYR CA C 20 57.966 61.392 -3.426 1
1 148 . 9 1 1 A 20 20 TYR CB C 20 37.472 38.344 -0.872 1
1 149 . 9 1 1 A 20 20 TYR N N 20 118.675 120.052 -1.377 1
1 150 . 9 1 1 A 21 21 GLN H H 21 7.909 8.348 -0.439 1
1 151 . 9 1 1 A 21 21 GLN HA H 21 3.903 4.187 -0.284 1
1 155 . 9 1 1 A 21 21 GLN C C 21 178.003 178.118 -0.115 1
1 156 . 9 1 1 A 21 21 GLN CA C 21 58.523 58.726 -0.203 1
1 157 . 9 1 1 A 21 21 GLN CB C 21 28.438 28.701 -0.263 1
1 159 . 9 1 1 A 21 21 GLN N N 21 117.056 119.110 -2.054 1
1 160 . 9 1 1 A 22 22 GLU H H 22 8.965 8.847 0.118 1
1 161 . 9 1 1 A 22 22 GLU HA H 22 4.267 4.242 0.025 1
1 165 . 9 1 1 A 22 22 GLU C C 22 176.451 177.843 -1.392 1
1 166 . 9 1 1 A 22 22 GLU CA C 22 58.273 58.733 -0.460 1
1 167 . 9 1 1 A 22 22 GLU CB C 22 29.412 29.972 -0.560 1
1 169 . 9 1 1 A 22 22 GLU N N 22 117.289 118.605 -1.316 1
1 170 . 9 1 1 A 23 23 ILE H H 23 7.596 8.027 -0.431 1
1 171 . 9 1 1 A 23 23 ILE HA H 23 4.161 4.408 -0.247 1
1 180 . 9 1 1 A 23 23 ILE C C 23 176.195 175.833 0.362 1
1 181 . 9 1 1 A 23 23 ILE CA C 23 58.120 60.814 -2.694 1
1 182 . 9 1 1 A 23 23 ILE CB C 23 38.461 37.980 0.481 1
1 186 . 9 1 1 A 23 23 ILE N N 23 114.005 117.284 -3.279 1
1 187 . 9 1 1 A 24 24 ILE H H 24 7.178 7.352 -0.174 1
1 188 . 9 1 1 A 24 24 ILE HA H 24 3.740 3.942 -0.202 1
1 197 . 9 1 1 A 24 24 ILE C C 24 177.831 176.917 0.914 1
1 198 . 9 1 1 A 24 24 ILE CA C 24 63.318 62.496 0.822 1
1 199 . 9 1 1 A 24 24 ILE CB C 24 36.590 38.189 -1.599 1
1 203 . 9 1 1 A 24 24 ILE N N 24 122.099 125.362 -3.263 1
1 204 . 9 1 1 A 25 25 GLY H H 25 8.618 9.003 -0.385 1
1 205 . 9 1 1 A 25 25 GLY HA2 H 25 4.390 3.954 0.436 1
1 206 . 9 1 1 A 25 25 GLY HA3 H 25 4.168 3.991 0.177 1
1 207 . 9 1 1 A 25 25 GLY C C 25 175.210 176.024 -0.814 1
1 208 . 9 1 1 A 25 25 GLY CA C 25 45.798 45.116 0.682 1
1 209 . 9 1 1 A 25 25 GLY N N 25 115.531 118.465 -2.934 1
1 210 . 9 1 1 A 26 26 ARG H H 26 8.277 8.134 0.143 1
1 211 . 9 1 1 A 26 26 ARG HA H 26 4.477 4.516 -0.039 1
1 218 . 9 1 1 A 26 26 ARG C C 26 175.944 177.795 -1.851 1
1 219 . 9 1 1 A 26 26 ARG CA C 26 54.408 56.939 -2.531 1
1 220 . 9 1 1 A 26 26 ARG CB C 26 29.501 30.093 -0.592 1
1 223 . 9 1 1 A 26 26 ARG N N 26 119.689 121.653 -1.964 1
1 224 . 9 1 1 A 27 27 THR H H 27 7.923 8.755 -0.832 1
1 225 . 9 1 1 A 27 27 THR HA H 27 3.792 4.080 -0.288 1
1 230 . 9 1 1 A 27 27 THR C C 27 175.251 176.474 -1.223 1
1 231 . 9 1 1 A 27 27 THR CA C 27 64.791 65.291 -0.500 1
1 232 . 9 1 1 A 27 27 THR CB C 27 68.354 68.028 0.326 1
1 234 . 9 1 1 A 27 27 THR N N 27 109.195 113.219 -4.024 1
1 235 . 9 1 1 A 28 28 TRP H H 28 7.389 8.101 -0.712 1
1 236 . 9 1 1 A 28 28 TRP HA H 28 4.441 4.375 0.066 1
1 240 . 9 1 1 A 28 28 TRP C C 28 178.519 178.588 -0.069 1
1 241 . 9 1 1 A 28 28 TRP CA C 28 57.789 61.408 -3.619 1
1 242 . 9 1 1 A 28 28 TRP CB C 28 27.387 30.005 -2.618 1
1 243 . 9 1 1 A 28 28 TRP N N 28 120.127 124.974 -4.847 1
1 244 . 9 1 1 A 29 29 ILE H H 29 6.832 8.306 -1.474 1
1 245 . 9 1 1 A 29 29 ILE HA H 29 3.612 3.640 -0.028 1
1 254 . 9 1 1 A 29 29 ILE C C 29 176.023 176.973 -0.950 1
1 255 . 9 1 1 A 29 29 ILE CA C 29 63.773 63.432 0.341 1
1 256 . 9 1 1 A 29 29 ILE CB C 29 37.567 37.353 0.214 1
1 260 . 9 1 1 A 29 29 ILE N N 29 119.913 117.478 2.435 1
1 261 . 9 1 1 A 30 30 PHE H H 30 7.329 7.763 -0.434 1
1 262 . 9 1 1 A 30 30 PHE HA H 30 3.912 4.431 -0.519 1
1 268 . 9 1 1 A 30 30 PHE C C 30 177.101 178.239 -1.138 1
1 269 . 9 1 1 A 30 30 PHE CA C 30 59.436 61.407 -1.971 1
1 270 . 9 1 1 A 30 30 PHE CB C 30 38.734 39.572 -0.838 1
1 271 . 9 1 1 A 30 30 PHE N N 30 116.638 120.347 -3.709 1
1 272 . 9 1 1 A 31 31 ARG H H 31 7.399 8.240 -0.841 1
1 273 . 9 1 1 A 31 31 ARG HA H 31 4.287 4.197 0.090 1
1 278 . 9 1 1 A 31 31 ARG C C 31 176.539 178.702 -2.163 1
1 279 . 9 1 1 A 31 31 ARG CA C 31 58.852 59.378 -0.526 1
1 280 . 9 1 1 A 31 31 ARG CB C 31 29.461 30.267 -0.806 1
1 281 . 9 1 1 A 31 31 ARG N N 31 122.099 121.597 0.502 1
1 282 . 9 1 1 A 32 32 GLY H H 32 8.346 7.923 0.423 1
1 283 . 9 1 1 A 32 32 GLY HA2 H 32 4.284 3.542 0.742 1
1 284 . 9 1 1 A 32 32 GLY HA3 H 32 3.629 3.796 -0.167 1
1 285 . 9 1 1 A 32 32 GLY C C 32 173.791 173.719 0.072 1
1 286 . 9 1 1 A 32 32 GLY CA C 32 45.793 46.145 -0.352 1
1 287 . 9 1 1 A 32 32 GLY N N 32 109.964 106.868 3.096 1
1 288 . 9 1 1 A 33 33 ALA H H 33 7.510 9.184 -1.674 1
1 289 . 9 1 1 A 33 33 ALA HA H 33 4.193 4.516 -0.323 1
1 293 . 9 1 1 A 33 33 ALA C C 33 176.672 176.974 -0.302 1
1 294 . 9 1 1 A 33 33 ALA CA C 33 54.401 52.569 1.832 1
1 295 . 9 1 1 A 33 33 ALA CB C 33 19.368 22.083 -2.715 1
1 296 . 9 1 1 A 33 33 ALA N N 33 122.266 119.795 2.471 1
1 297 . 9 1 1 A 34 34 HIS H H 34 8.759 7.846 0.913 1
1 298 . 9 1 1 A 34 34 HIS HA H 34 4.529 4.928 -0.399 1
1 302 . 9 1 1 A 34 34 HIS C C 34 175.767 174.671 1.096 1
1 303 . 9 1 1 A 34 34 HIS CA C 34 54.997 54.917 0.080 1
1 304 . 9 1 1 A 34 34 HIS CB C 34 31.089 30.764 0.325 1
1 305 . 9 1 1 A 34 34 HIS N N 34 119.038 117.873 1.165 1
1 306 . 9 1 1 A 35 35 ARG H H 35 8.142 8.424 -0.282 1
1 307 . 9 1 1 A 35 35 ARG HA H 35 4.700 4.508 0.192 1
1 314 . 9 1 1 A 35 35 ARG C C 35 177.572 176.164 1.408 1
1 315 . 9 1 1 A 35 35 ARG CA C 35 54.103 55.603 -1.500 1
1 316 . 9 1 1 A 35 35 ARG CB C 35 29.112 32.186 -3.074 1
1 319 . 9 1 1 A 35 35 ARG N N 35 127.785 127.475 0.310 1
1 320 . 9 1 1 A 36 36 GLY H H 36 9.352 7.745 1.607 1
1 321 . 9 1 1 A 36 36 GLY HA2 H 36 4.291 3.831 0.460 1
1 322 . 9 1 1 A 36 36 GLY HA3 H 36 3.247 3.977 -0.730 1
1 323 . 9 1 1 A 36 36 GLY C C 36 173.876 172.997 0.879 1
1 324 . 9 1 1 A 36 36 GLY CA C 36 45.644 45.403 0.241 1
1 325 . 9 1 1 A 36 36 GLY N N 36 109.626 108.010 1.616 1
1 326 . 9 1 1 A 37 37 ARG H H 37 9.384 8.450 0.934 1
1 327 . 9 1 1 A 37 37 ARG HA H 37 4.688 4.351 0.337 1
1 333 . 9 1 1 A 37 37 ARG C C 37 175.081 175.130 -0.049 1
1 334 . 9 1 1 A 37 37 ARG CA C 37 55.742 56.532 -0.790 1
1 335 . 9 1 1 A 37 37 ARG CB C 37 28.138 30.612 -2.474 1
1 338 . 9 1 1 A 37 37 ARG N N 37 127.132 122.889 4.243 1
1 339 . 9 1 1 A 38 38 VAL H H 38 7.605 6.432 1.173 1
1 340 . 9 1 1 A 38 38 VAL HA H 38 4.591 3.903 0.688 1
1 348 . 9 1 1 A 38 38 VAL C C 38 174.391 174.293 0.098 1
1 349 . 9 1 1 A 38 38 VAL CA C 38 60.092 60.287 -0.195 1
1 350 . 9 1 1 A 38 38 VAL CB C 38 33.328 32.937 0.391 1
1 353 . 9 1 1 A 38 38 VAL N N 38 126.253 125.698 0.555 1
1 354 . 9 1 1 A 39 39 ASN H H 39 9.007 7.870 1.137 1
1 355 . 9 1 1 A 39 39 ASN HA H 39 4.736 4.814 -0.078 1
1 358 . 9 1 1 A 39 39 ASN C C 39 174.562 175.006 -0.444 1
1 359 . 9 1 1 A 39 39 ASN CA C 39 51.577 52.259 -0.682 1
1 360 . 9 1 1 A 39 39 ASN CB C 39 40.749 41.719 -0.970 1
1 361 . 9 1 1 A 39 39 ASN N N 39 123.411 122.229 1.182 1
1 362 . 9 1 1 A 40 40 LYS H H 40 8.510 8.687 -0.177 1
1 363 . 9 1 1 A 40 40 LYS HA H 40 3.909 3.875 0.034 1
1 370 . 9 1 1 A 40 40 LYS C C 40 176.629 178.202 -1.573 1
1 371 . 9 1 1 A 40 40 LYS CA C 40 59.141 60.315 -1.174 1
1 372 . 9 1 1 A 40 40 LYS CB C 40 32.301 32.382 -0.081 1
1 376 . 9 1 1 A 40 40 LYS N N 40 116.303 125.073 -8.770 1
1 377 . 9 1 1 A 41 41 LYS H H 41 7.907 8.506 -0.599 1
1 378 . 9 1 1 A 41 41 LYS HA H 41 4.172 3.909 0.263 1
1 384 . 9 1 1 A 41 41 LYS C C 41 177.229 175.605 1.624 1
1 385 . 9 1 1 A 41 41 LYS CA C 41 57.392 57.825 -0.433 1
1 386 . 9 1 1 A 41 41 LYS CB C 41 32.667 30.925 1.742 1
1 390 . 9 1 1 A 41 41 LYS N N 41 117.066 117.500 -0.434 1
1 391 . 9 1 1 A 42 42 ASN H H 42 7.962 8.321 -0.359 1
1 392 . 9 1 1 A 42 42 ASN HA H 42 4.392 4.577 -0.185 1
1 395 . 9 1 1 A 42 42 ASN C C 42 179.805 175.946 3.859 1
1 396 . 9 1 1 A 42 42 ASN CA C 42 52.335 52.614 -0.279 1
1 397 . 9 1 1 A 42 42 ASN CB C 42 39.348 39.134 0.214 1
1 398 . 9 1 1 A 42 42 ASN N N 42 114.442 116.737 -2.295 1
1 399 . 9 1 1 A 43 43 ILE H H 43 7.806 8.781 -0.975 1
1 400 . 9 1 1 A 43 43 ILE HA H 43 3.747 3.930 -0.183 1
1 409 . 9 1 1 A 43 43 ILE C C 43 174.219 177.392 -3.173 1
1 410 . 9 1 1 A 43 43 ILE CA C 43 64.505 63.403 1.102 1
1 411 . 9 1 1 A 43 43 ILE CB C 43 36.595 38.429 -1.834 1
1 415 . 9 1 1 A 43 43 ILE N N 43 121.001 120.627 0.374 1
1 416 . 9 1 1 A 44 44 VAL H H 44 6.154 7.591 -1.437 1
1 417 . 9 1 1 A 44 44 VAL HA H 44 3.497 3.930 -0.433 1
1 425 . 9 1 1 A 44 44 VAL C C 44 176.282 176.146 0.136 1
1 426 . 9 1 1 A 44 44 VAL CA C 44 63.606 63.246 0.360 1
1 427 . 9 1 1 A 44 44 VAL CB C 44 30.614 32.064 -1.450 1
1 430 . 9 1 1 A 44 44 VAL N N 44 110.500 119.673 -9.173 1
1 431 . 9 1 1 A 45 45 TRP H H 45 7.419 8.249 -0.830 1
1 432 . 9 1 1 A 45 45 TRP HA H 45 4.716 4.834 -0.118 1
1 438 . 9 1 1 A 45 45 TRP C C 45 175.422 176.250 -0.828 1
1 439 . 9 1 1 A 45 45 TRP CA C 45 56.188 57.862 -1.674 1
1 440 . 9 1 1 A 45 45 TRP CB C 45 31.245 31.318 -0.073 1
1 441 . 9 1 1 A 45 45 TRP N N 45 118.601 121.073 -2.472 1
1 442 . 9 1 1 A 46 46 HIS H H 46 7.582 7.506 0.076 1
1 443 . 9 1 1 A 46 46 HIS HA H 46 4.227 4.624 -0.397 1
1 448 . 9 1 1 A 46 46 HIS C C 46 177.485 175.011 2.474 1
1 449 . 9 1 1 A 46 46 HIS CA C 46 56.799 56.025 0.774 1
1 450 . 9 1 1 A 46 46 HIS CB C 46 32.017 30.884 1.133 1
1 451 . 9 1 1 A 46 46 HIS N N 46 122.648 117.752 4.896 1
1 452 . 9 1 1 A 47 47 GLU H H 47 7.948 8.346 -0.398 1
1 453 . 9 1 1 A 47 47 GLU HA H 47 4.098 4.355 -0.257 1
1 457 . 9 1 1 A 47 47 GLU C C 47 175.596 175.925 -0.329 1
1 458 . 9 1 1 A 47 47 GLU CA C 47 56.482 56.870 -0.388 1
1 459 . 9 1 1 A 47 47 GLU CB C 47 31.839 30.178 1.661 1
1 461 . 9 1 1 A 47 47 GLU N N 47 120.485 121.969 -1.484 1
1 462 . 9 1 1 A 48 48 LEU H H 48 9.304 8.473 0.831 1
1 463 . 9 1 1 A 48 48 LEU HA H 48 4.218 4.524 -0.306 1
1 472 . 9 1 1 A 48 48 LEU C C 48 177.743 176.027 1.716 1
1 473 . 9 1 1 A 48 48 LEU CA C 48 55.043 54.716 0.327 1
1 474 . 9 1 1 A 48 48 LEU CB C 48 41.948 40.863 1.085 1
1 477 . 9 1 1 A 48 48 LEU N N 48 128.658 127.009 1.649 1
1 478 . 9 1 1 A 49 49 ILE H H 49 8.028 8.693 -0.665 1
1 479 . 9 1 1 A 49 49 ILE HA H 49 3.279 4.551 -1.272 1
1 488 . 9 1 1 A 49 49 ILE C C 49 174.821 176.266 -1.445 1
1 489 . 9 1 1 A 49 49 ILE CA C 49 63.901 60.086 3.815 1
1 490 . 9 1 1 A 49 49 ILE CB C 49 37.775 38.792 -1.017 1
1 494 . 9 1 1 A 49 49 ILE N N 49 120.341 125.742 -5.401 1
1 495 . 9 1 1 A 50 50 GLY H H 50 9.038 7.902 1.136 1
1 496 . 9 1 1 A 50 50 GLY HA2 H 50 4.717 4.271 0.446 1
1 497 . 9 1 1 A 50 50 GLY HA3 H 50 3.491 4.294 -0.803 1
1 498 . 9 1 1 A 50 50 GLY C C 50 175.084 174.427 0.657 1
1 499 . 9 1 1 A 50 50 GLY CA C 50 44.599 45.516 -0.917 1
1 500 . 9 1 1 A 50 50 GLY N N 50 110.284 109.487 0.797 1
1 501 . 9 1 1 A 51 51 LEU H H 51 8.400 7.688 0.712 1
1 502 . 9 1 1 A 51 51 LEU HA H 51 4.723 3.606 1.117 1
1 512 . 9 1 1 A 51 51 LEU C C 51 177.147 175.494 1.653 1
1 513 . 9 1 1 A 51 51 LEU CA C 51 54.350 55.423 -1.073 1
1 514 . 9 1 1 A 51 51 LEU CB C 51 42.985 42.433 0.552 1
1 518 . 9 1 1 A 51 51 LEU N N 51 120.471 122.742 -2.271 1
1 519 . 9 1 1 A 52 52 LYS H H 52 7.505 8.078 -0.573 1
1 520 . 9 1 1 A 52 52 LYS HA H 52 4.250 3.696 0.554 1
1 527 . 9 1 1 A 52 52 LYS C C 52 174.995 175.036 -0.041 1
1 528 . 9 1 1 A 52 52 LYS CA C 52 55.589 56.134 -0.545 1
1 529 . 9 1 1 A 52 52 LYS CB C 52 33.025 32.398 0.627 1
1 533 . 9 1 1 A 52 52 LYS N N 52 122.406 126.172 -3.766 1
1 534 . 9 1 1 A 53 53 VAL H H 53 9.075 8.369 0.706 1
1 535 . 9 1 1 A 53 53 VAL HA H 53 5.071 5.114 -0.043 1
1 543 . 9 1 1 A 53 53 VAL C C 53 171.170 173.740 -2.570 1
1 544 . 9 1 1 A 53 53 VAL CA C 53 58.523 59.159 -0.636 1
1 545 . 9 1 1 A 53 53 VAL CB C 53 35.698 35.582 0.116 1
1 548 . 9 1 1 A 53 53 VAL N N 53 124.509 124.733 -0.224 1
1 549 . 9 1 1 A 54 54 ARG H H 54 8.148 8.177 -0.029 1
1 550 . 9 1 1 A 54 54 ARG HA H 54 5.329 4.935 0.394 1
1 557 . 9 1 1 A 54 54 ARG C C 54 176.113 174.443 1.670 1
1 558 . 9 1 1 A 54 54 ARG CA C 54 53.817 54.063 -0.246 1
1 559 . 9 1 1 A 54 54 ARG CB C 54 34.511 33.835 0.676 1
1 562 . 9 1 1 A 54 54 ARG N N 54 123.625 121.860 1.765 1
1 563 . 9 1 1 A 55 55 VAL H H 55 8.659 9.285 -0.626 1
1 564 . 9 1 1 A 55 55 VAL HA H 55 4.085 4.092 -0.007 1
1 572 . 9 1 1 A 55 55 VAL C C 55 176.282 175.512 0.770 1
1 573 . 9 1 1 A 55 55 VAL CA C 55 62.814 62.296 0.518 1
1 574 . 9 1 1 A 55 55 VAL CB C 55 30.628 31.309 -0.681 1
1 577 . 9 1 1 A 55 55 VAL N N 55 125.383 123.163 2.220 1
1 578 . 9 1 1 A 56 56 VAL H H 56 8.057 8.587 -0.530 1
1 579 . 9 1 1 A 56 56 VAL HA H 56 4.123 4.028 0.095 1
1 587 . 9 1 1 A 56 56 VAL C C 56 175.426 176.275 -0.849 1
1 588 . 9 1 1 A 56 56 VAL CA C 56 62.786 64.329 -1.543 1
1 589 . 9 1 1 A 56 56 VAL CB C 56 32.267 32.302 -0.035 1
1 592 . 9 1 1 A 56 56 VAL N N 56 124.936 129.079 -4.143 1
1 593 . 9 1 1 A 57 57 ASN H H 57 7.527 8.147 -0.620 1
1 594 . 9 1 1 A 57 57 ASN HA H 57 4.817 5.290 -0.473 1
1 597 . 9 1 1 A 57 57 ASN C C 57 172.973 173.609 -0.636 1
1 598 . 9 1 1 A 57 57 ASN CA C 57 52.460 52.069 0.391 1
1 599 . 9 1 1 A 57 57 ASN CB C 57 42.070 41.456 0.614 1
1 600 . 9 1 1 A 57 57 ASN N N 57 114.777 118.377 -3.600 1
1 601 . 9 1 1 A 58 58 SER H H 58 8.193 8.922 -0.729 1
1 602 . 9 1 1 A 58 58 SER HA H 58 5.214 5.019 0.195 1
1 605 . 9 1 1 A 58 58 SER C C 58 174.221 172.149 2.072 1
1 606 . 9 1 1 A 58 58 SER CA C 58 56.778 57.386 -0.608 1
1 607 . 9 1 1 A 58 58 SER CB C 58 63.906 66.533 -2.627 1
1 608 . 9 1 1 A 58 58 SER N N 58 115.531 118.943 -3.412 1
1 609 . 9 1 1 A 59 59 THR H H 59 8.053 7.982 0.071 1
1 610 . 9 1 1 A 59 59 THR HA H 59 4.305 4.589 -0.284 1
1 615 . 9 1 1 A 59 59 THR C C 59 174.478 172.347 2.131 1
1 616 . 9 1 1 A 59 59 THR CA C 59 63.305 60.060 3.245 1
1 617 . 9 1 1 A 59 59 THR CB C 59 68.354 68.085 0.269 1
1 619 . 9 1 1 A 59 59 THR N N 59 116.405 116.268 0.137 1
1 620 . 9 1 1 A 60 60 HIS H H 60 8.359 7.935 0.424 1
1 621 . 9 1 1 A 60 60 HIS HA H 60 5.167 5.136 0.031 1
1 626 . 9 1 1 A 60 60 HIS CA C 60 52.792 53.011 -0.219 1
1 627 . 9 1 1 A 60 60 HIS CB C 60 32.142 31.960 0.182 1
1 628 . 9 1 1 A 60 60 HIS N N 60 123.625 124.855 -1.230 1
1 629 . 9 1 1 A 61 61 PRO HA H 61 4.277 4.351 -0.074 1
1 636 . 9 1 1 A 61 61 PRO C C 61 178.217 177.355 0.862 1
1 637 . 9 1 1 A 61 61 PRO CA C 61 64.375 64.361 0.014 1
1 638 . 9 1 1 A 61 61 PRO CB C 61 32.007 32.133 -0.126 1
1 641 . 9 1 1 A 62 62 GLY H H 62 8.421 8.110 0.311 1
1 642 . 9 1 1 A 62 62 GLY HA2 H 62 3.889 3.810 0.079 1
1 643 . 9 1 1 A 62 62 GLY HA3 H 62 3.653 3.911 -0.258 1
1 644 . 9 1 1 A 62 62 GLY C C 62 174.994 174.164 0.830 1
1 645 . 9 1 1 A 62 62 GLY CA C 62 45.831 45.380 0.451 1
1 646 . 9 1 1 A 62 62 GLY N N 62 106.132 105.861 0.271 1
1 647 . 9 1 1 A 63 63 TYR H H 63 7.327 7.593 -0.266 1
1 648 . 9 1 1 A 63 63 TYR HA H 63 4.846 4.496 0.350 1
1 652 . 9 1 1 A 63 63 TYR C C 63 175.593 175.350 0.243 1
1 653 . 9 1 1 A 63 63 TYR CA C 63 56.071 58.291 -2.220 1
1 654 . 9 1 1 A 63 63 TYR CB C 63 38.962 40.485 -1.523 1
1 655 . 9 1 1 A 63 63 TYR N N 63 116.628 117.259 -0.631 1
1 656 . 9 1 1 A 64 64 VAL H H 64 7.296 7.554 -0.258 1
1 657 . 9 1 1 A 64 64 VAL HA H 64 3.180 4.070 -0.890 1
1 665 . 9 1 1 A 64 64 VAL C C 64 177.312 176.472 0.840 1
1 666 . 9 1 1 A 64 64 VAL CA C 64 65.688 62.543 3.145 1
1 667 . 9 1 1 A 64 64 VAL CB C 64 30.957 32.177 -1.220 1
1 670 . 9 1 1 A 64 64 VAL N N 64 117.940 118.406 -0.466 1
1 671 . 9 1 1 A 65 65 GLY H H 65 8.449 9.418 -0.969 1
1 672 . 9 1 1 A 65 65 GLY HA2 H 65 4.320 3.959 0.361 1
1 673 . 9 1 1 A 65 65 GLY HA3 H 65 3.515 3.971 -0.456 1
1 674 . 9 1 1 A 65 65 GLY C C 65 174.821 173.592 1.229 1
1 675 . 9 1 1 A 65 65 GLY CA C 65 44.599 45.267 -0.668 1
1 676 . 9 1 1 A 65 65 GLY N N 65 115.317 114.080 1.237 1
1 677 . 9 1 1 A 66 66 ILE H H 66 7.095 7.559 -0.464 1
1 678 . 9 1 1 A 66 66 ILE HA H 66 3.193 4.737 -1.544 1
1 687 . 9 1 1 A 66 66 ILE C C 66 174.308 175.354 -1.046 1
1 688 . 9 1 1 A 66 66 ILE CA C 66 63.470 60.144 3.326 1
1 689 . 9 1 1 A 66 66 ILE CB C 66 37.775 39.879 -2.104 1
1 693 . 9 1 1 A 66 66 ILE N N 66 122.099 122.751 -0.652 1
1 694 . 9 1 1 A 67 67 GLU H H 67 7.126 9.247 -2.121 1
1 695 . 9 1 1 A 67 67 GLU HA H 67 5.343 5.327 0.016 1
1 699 . 9 1 1 A 67 67 GLU C C 67 174.652 175.400 -0.748 1
1 700 . 9 1 1 A 67 67 GLU CA C 67 54.109 54.566 -0.457 1
1 701 . 9 1 1 A 67 67 GLU CB C 67 33.619 33.010 0.609 1
1 703 . 9 1 1 A 67 67 GLU N N 67 125.164 127.291 -2.127 1
1 704 . 9 1 1 A 68 68 GLY H H 68 8.401 8.273 0.128 1
1 705 . 9 1 1 A 68 68 GLY HA2 H 68 4.364 2.886 1.478 1
1 706 . 9 1 1 A 68 68 GLY HA3 H 68 4.041 3.831 0.210 1
1 707 . 9 1 1 A 68 68 GLY C C 68 171.644 171.028 0.616 1
1 708 . 9 1 1 A 68 68 GLY CA C 68 45.680 44.300 1.380 1
1 709 . 9 1 1 A 68 68 GLY N N 68 109.626 111.924 -2.298 1
1 710 . 9 1 1 A 69 69 TYR H H 69 8.422 10.315 -1.893 1
1 711 . 9 1 1 A 69 69 TYR HA H 69 5.079 4.922 0.157 1
1 714 . 9 1 1 A 69 69 TYR C C 69 176.194 175.437 0.757 1
1 715 . 9 1 1 A 69 69 TYR CA C 69 57.681 57.524 0.157 1
1 716 . 9 1 1 A 69 69 TYR CB C 69 41.043 39.844 1.199 1
1 717 . 9 1 1 A 69 69 TYR N N 69 119.689 118.447 1.242 1
1 718 . 9 1 1 A 70 70 VAL H H 70 8.753 8.752 0.001 1
1 719 . 9 1 1 A 70 70 VAL HA H 70 4.143 4.402 -0.259 1
1 727 . 9 1 1 A 70 70 VAL C C 70 176.540 175.673 0.867 1
1 728 . 9 1 1 A 70 70 VAL CA C 70 63.477 63.752 -0.275 1
1 729 . 9 1 1 A 70 70 VAL CB C 70 30.952 32.200 -1.248 1
1 732 . 9 1 1 A 70 70 VAL N N 70 123.420 125.019 -1.599 1
1 733 . 9 1 1 A 71 71 ILE H H 71 9.101 10.246 -1.145 1
1 734 . 9 1 1 A 71 71 ILE HA H 71 4.834 4.581 0.253 1
1 743 . 9 1 1 A 71 71 ILE C C 71 175.418 175.889 -0.471 1
1 744 . 9 1 1 A 71 71 ILE CA C 71 60.637 62.389 -1.752 1
1 745 . 9 1 1 A 71 71 ILE CB C 71 39.853 40.077 -0.224 1
1 749 . 9 1 1 A 71 71 ILE N N 71 119.913 125.081 -5.168 1
1 750 . 9 1 1 A 72 72 ASP H H 72 8.030 8.310 -0.280 1
1 751 . 9 1 1 A 72 72 ASP HA H 72 4.964 5.276 -0.312 1
1 754 . 9 1 1 A 72 72 ASP C C 72 173.017 175.255 -2.238 1
1 755 . 9 1 1 A 72 72 ASP CA C 72 53.511 53.301 0.210 1
1 756 . 9 1 1 A 72 72 ASP CB C 72 41.932 43.907 -1.975 1
1 757 . 9 1 1 A 72 72 ASP N N 72 118.377 119.980 -1.603 1
1 758 . 9 1 1 A 73 73 GLU H H 73 9.349 8.731 0.618 1
1 759 . 9 1 1 A 73 73 GLU HA H 73 4.868 5.125 -0.257 1
1 762 . 9 1 1 A 73 73 GLU C C 73 173.793 174.903 -1.110 1
1 763 . 9 1 1 A 73 73 GLU CA C 73 55.521 56.381 -0.860 1
1 764 . 9 1 1 A 73 73 GLU CB C 73 33.138 32.145 0.993 1
1 766 . 9 1 1 A 73 73 GLU N N 73 123.848 123.284 0.564 1
1 767 . 9 1 1 A 74 74 THR H H 74 8.748 8.714 0.034 1
1 768 . 9 1 1 A 74 74 THR HA H 74 4.992 4.812 0.180 1
1 773 . 9 1 1 A 74 74 THR CA C 74 59.450 59.882 -0.432 1
1 774 . 9 1 1 A 74 74 THR CB C 74 70.429 70.635 -0.206 1
1 776 . 9 1 1 A 74 74 THR N N 74 116.628 120.234 -3.606 1
1 777 . 9 1 1 A 75 75 ARG HA H 75 3.741 3.970 -0.229 1
1 782 . 9 1 1 A 75 75 ARG C C 75 177.140 177.101 0.039 1
1 783 . 9 1 1 A 75 75 ARG CA C 75 60.041 58.317 1.724 1
1 784 . 9 1 1 A 75 75 ARG CB C 75 29.930 30.154 -0.224 1
1 787 . 9 1 1 A 76 76 ASN H H 76 8.497 8.038 0.459 1
1 788 . 9 1 1 A 76 76 ASN HA H 76 5.310 4.920 0.390 1
1 791 . 9 1 1 A 76 76 ASN C C 76 175.509 174.004 1.505 1
1 792 . 9 1 1 A 76 76 ASN CA C 76 52.320 53.051 -0.731 1
1 793 . 9 1 1 A 76 76 ASN CB C 76 40.744 40.352 0.392 1
1 794 . 9 1 1 A 76 76 ASN N N 76 111.053 115.800 -4.747 1
1 795 . 9 1 1 A 77 77 MET H H 77 7.528 7.355 0.173 1
1 796 . 9 1 1 A 77 77 MET HA H 77 5.392 4.934 0.458 1
1 801 . 9 1 1 A 77 77 MET C C 77 174.824 173.963 0.861 1
1 802 . 9 1 1 A 77 77 MET CA C 77 54.994 54.055 0.939 1
1 803 . 9 1 1 A 77 77 MET CB C 77 36.753 35.067 1.686 1
1 805 . 9 1 1 A 77 77 MET N N 77 119.913 115.970 3.943 1
1 806 . 9 1 1 A 78 78 LEU H H 78 8.977 8.818 0.159 1
1 807 . 9 1 1 A 78 78 LEU HA H 78 4.803 5.624 -0.821 1
1 817 . 9 1 1 A 78 78 LEU C C 78 174.563 175.020 -0.457 1
1 818 . 9 1 1 A 78 78 LEU CA C 78 53.964 54.155 -0.191 1
1 819 . 9 1 1 A 78 78 LEU CB C 78 44.903 45.249 -0.346 1
1 823 . 9 1 1 A 78 78 LEU N N 78 121.224 122.543 -1.319 1
1 824 . 9 1 1 A 79 79 VAL H H 79 8.115 9.246 -1.131 1
1 825 . 9 1 1 A 79 79 VAL HA H 79 4.783 5.352 -0.569 1
1 833 . 9 1 1 A 79 79 VAL C C 79 175.297 174.981 0.316 1
1 834 . 9 1 1 A 79 79 VAL CA C 79 61.821 60.856 0.965 1
1 835 . 9 1 1 A 79 79 VAL CB C 79 31.146 34.866 -3.720 1
1 838 . 9 1 1 A 79 79 VAL N N 79 124.062 127.429 -3.367 1
1 839 . 9 1 1 A 80 80 ILE H H 80 9.342 8.775 0.567 1
1 840 . 9 1 1 A 80 80 ILE HA H 80 4.764 5.256 -0.492 1
1 849 . 9 1 1 A 80 80 ILE C C 80 174.127 174.376 -0.249 1
1 850 . 9 1 1 A 80 80 ILE CA C 80 59.897 59.772 0.125 1
1 851 . 9 1 1 A 80 80 ILE CB C 80 42.225 41.901 0.324 1
1 855 . 9 1 1 A 80 80 ILE N N 80 129.970 126.735 3.235 1
1 856 . 9 1 1 A 81 81 ALA H H 81 9.478 9.978 -0.500 1
1 857 . 9 1 1 A 81 81 ALA HA H 81 5.139 5.602 -0.463 1
1 861 . 9 1 1 A 81 81 ALA C C 81 176.970 176.297 0.673 1
1 862 . 9 1 1 A 81 81 ALA CA C 81 50.835 50.186 0.649 1
1 863 . 9 1 1 A 81 81 ALA CB C 81 21.451 21.903 -0.452 1
1 864 . 9 1 1 A 81 81 ALA N N 81 129.756 128.766 0.990 1
1 865 . 9 1 1 A 82 82 GLY H H 82 8.691 8.506 0.185 1
1 866 . 9 1 1 A 82 82 GLY HA2 H 82 5.110 4.225 0.885 1
1 867 . 9 1 1 A 82 82 GLY HA3 H 82 4.241 4.283 -0.042 1
1 868 . 9 1 1 A 82 82 GLY C C 82 173.017 174.389 -1.372 1
1 869 . 9 1 1 A 82 82 GLY CA C 82 44.166 45.081 -0.915 1
1 870 . 9 1 1 A 82 82 GLY N N 82 113.568 108.497 5.071 1
1 871 . 9 1 1 A 83 83 GLU H H 83 8.659 9.134 -0.475 1
1 872 . 9 1 1 A 83 83 GLU HA H 83 4.286 4.235 0.051 1
1 876 . 9 1 1 A 83 83 GLU C C 83 177.570 176.196 1.374 1
1 877 . 9 1 1 A 83 83 GLU CA C 83 59.017 58.792 0.225 1
1 878 . 9 1 1 A 83 83 GLU CB C 83 29.762 29.149 0.613 1
1 880 . 9 1 1 A 83 83 GLU N N 83 120.019 123.813 -3.794 1
1 881 . 9 1 1 A 84 84 ASN H H 84 8.549 8.816 -0.267 1
1 882 . 9 1 1 A 84 84 ASN HA H 84 4.821 5.036 -0.215 1
1 884 . 9 1 1 A 84 84 ASN C C 84 173.878 174.420 -0.542 1
1 885 . 9 1 1 A 84 84 ASN CA C 84 52.919 52.215 0.704 1
1 886 . 9 1 1 A 84 84 ASN CB C 84 40.150 39.298 0.852 1
1 887 . 9 1 1 A 84 84 ASN N N 84 112.778 124.451 -11.673 1
1 888 . 9 1 1 A 85 85 LYS H H 85 7.116 7.285 -0.169 1
1 889 . 9 1 1 A 85 85 LYS HA H 85 4.344 5.104 -0.760 1
1 895 . 9 1 1 A 85 85 LYS C C 85 173.278 174.537 -1.259 1
1 896 . 9 1 1 A 85 85 LYS CA C 85 55.292 54.666 0.626 1
1 897 . 9 1 1 A 85 85 LYS CB C 85 36.124 36.236 -0.112 1
1 901 . 9 1 1 A 85 85 LYS N N 85 118.377 120.370 -1.993 1
1 902 . 9 1 1 A 86 86 VAL H H 86 7.781 8.836 -1.055 1
1 903 . 9 1 1 A 86 86 VAL HA H 86 4.749 5.397 -0.648 1
1 911 . 9 1 1 A 86 86 VAL C C 86 174.739 174.249 0.490 1
1 912 . 9 1 1 A 86 86 VAL CA C 86 60.716 59.679 1.037 1
1 913 . 9 1 1 A 86 86 VAL CB C 86 33.619 35.208 -1.589 1
1 916 . 9 1 1 A 86 86 VAL N N 86 120.127 117.884 2.243 1
1 917 . 9 1 1 A 87 87 TRP H H 87 9.558 9.833 -0.275 1
1 918 . 9 1 1 A 87 87 TRP HA H 87 4.958 5.338 -0.380 1
1 923 . 9 1 1 A 87 87 TRP C C 87 174.909 175.066 -0.157 1
1 924 . 9 1 1 A 87 87 TRP CA C 87 57.073 56.050 1.023 1
1 925 . 9 1 1 A 87 87 TRP CB C 87 33.028 30.606 2.422 1
1 926 . 9 1 1 A 87 87 TRP N N 87 127.346 123.574 3.772 1
1 927 . 9 1 1 A 88 88 LYS H H 88 8.590 8.118 0.472 1
1 928 . 9 1 1 A 88 88 LYS HA H 88 4.856 4.662 0.194 1
1 935 . 9 1 1 A 88 88 LYS C C 88 175.382 174.266 1.116 1
1 936 . 9 1 1 A 88 88 LYS CA C 88 55.887 54.511 1.376 1
1 937 . 9 1 1 A 88 88 LYS CB C 88 32.434 33.174 -0.740 1
1 941 . 9 1 1 A 88 88 LYS N N 88 123.625 125.591 -1.966 1
1 942 . 9 1 1 A 89 89 VAL H H 89 8.829 8.007 0.822 1
1 943 . 9 1 1 A 89 89 VAL HA H 89 4.406 4.442 -0.036 1
1 951 . 9 1 1 A 89 89 VAL CA C 89 58.371 58.865 -0.494 1
1 952 . 9 1 1 A 89 89 VAL CB C 89 34.512 31.969 2.543 1
1 955 . 9 1 1 A 89 89 VAL N N 89 124.285 122.461 1.824 1
1 956 . 9 1 1 A 90 90 PRO HA H 90 5.073 4.592 0.481 1
1 961 . 9 1 1 A 90 90 PRO C C 90 177.231 177.775 -0.544 1
1 962 . 9 1 1 A 90 90 PRO CA C 90 61.795 62.825 -1.030 1
1 963 . 9 1 1 A 90 90 PRO CB C 90 31.660 32.971 -1.311 1
1 964 . 9 1 1 A 91 91 LYS H H 91 8.116 8.622 -0.506 1
1 965 . 9 1 1 A 91 91 LYS HA H 91 4.024 4.212 -0.188 1
1 969 . 9 1 1 A 91 91 LYS C C 91 178.518 177.115 1.403 1
1 970 . 9 1 1 A 91 91 LYS CA C 91 59.621 58.955 0.666 1
1 971 . 9 1 1 A 91 91 LYS CB C 91 34.217 31.864 2.353 1
1 973 . 9 1 1 A 91 91 LYS N N 91 121.224 122.245 -1.021 1
1 974 . 9 1 1 A 92 92 ASP H H 92 8.505 8.454 0.051 1
1 975 . 9 1 1 A 92 92 ASP HA H 92 3.781 4.596 -0.815 1
1 978 . 9 1 1 A 92 92 ASP C C 92 176.975 176.895 0.080 1
1 979 . 9 1 1 A 92 92 ASP CA C 92 56.773 54.720 2.053 1
1 980 . 9 1 1 A 92 92 ASP CB C 92 39.590 40.130 -0.540 1
1 981 . 9 1 1 A 92 92 ASP N N 92 111.815 118.824 -7.009 1
1 982 . 9 1 1 A 93 93 VAL H H 93 6.691 7.213 -0.522 1
1 983 . 9 1 1 A 93 93 VAL HA H 93 4.678 4.700 -0.022 1
1 991 . 9 1 1 A 93 93 VAL C C 93 176.537 175.020 1.517 1
1 992 . 9 1 1 A 93 93 VAL CA C 93 60.120 60.585 -0.465 1
1 993 . 9 1 1 A 93 93 VAL CB C 93 31.093 32.470 -1.377 1
1 996 . 9 1 1 A 93 93 VAL N N 93 107.879 111.967 -4.088 1
1 997 . 9 1 1 A 94 94 CYS H H 94 7.249 7.703 -0.454 1
1 998 . 9 1 1 A 94 94 CYS HA H 94 5.062 4.785 0.277 1
1 1001 . 9 1 1 A 94 94 CYS C C 94 173.103 172.009 1.094 1
1 1002 . 9 1 1 A 94 94 CYS CA C 94 58.001 57.396 0.605 1
1 1003 . 9 1 1 A 94 94 CYS CB C 94 31.418 30.499 0.919 1
1 1004 . 9 1 1 A 94 94 CYS N N 94 117.940 117.401 0.539 1
1 1005 . 9 1 1 A 95 95 ILE H H 95 8.153 8.457 -0.304 1
1 1006 . 9 1 1 A 95 95 ILE HA H 95 4.159 4.851 -0.692 1
1 1016 . 9 1 1 A 95 95 ILE C C 95 174.736 174.797 -0.061 1
1 1017 . 9 1 1 A 95 95 ILE CA C 95 61.234 60.220 1.014 1
1 1018 . 9 1 1 A 95 95 ILE CB C 95 38.071 39.832 -1.761 1
1 1022 . 9 1 1 A 95 95 ILE N N 95 121.876 120.526 1.350 1
1 1023 . 9 1 1 A 96 96 PHE H H 96 8.400 9.008 -0.608 1
1 1024 . 9 1 1 A 96 96 PHE HA H 96 5.004 4.973 0.031 1
1 1029 . 9 1 1 A 96 96 PHE C C 96 174.005 174.051 -0.046 1
1 1030 . 9 1 1 A 96 96 PHE CA C 96 56.922 56.042 0.880 1
1 1031 . 9 1 1 A 96 96 PHE CB C 96 44.006 41.773 2.233 1
1 1032 . 9 1 1 A 96 96 PHE N N 96 125.820 126.035 -0.215 1
1 1033 . 9 1 1 A 97 97 GLU H H 97 8.985 8.420 0.565 1
1 1034 . 9 1 1 A 97 97 GLU HA H 97 5.275 5.182 0.093 1
1 1038 . 9 1 1 A 97 97 GLU C C 97 175.596 174.767 0.829 1
1 1039 . 9 1 1 A 97 97 GLU CA C 97 55.070 54.520 0.550 1
1 1040 . 9 1 1 A 97 97 GLU CB C 97 33.628 30.998 2.630 1
1 1042 . 9 1 1 A 97 97 GLU N N 97 121.010 123.977 -2.967 1
1 1043 . 9 1 1 A 98 98 PHE H H 98 9.304 9.098 0.206 1
1 1044 . 9 1 1 A 98 98 PHE HA H 98 5.337 5.035 0.302 1
1 1048 . 9 1 1 A 98 98 PHE C C 98 174.650 175.676 -1.026 1
1 1049 . 9 1 1 A 98 98 PHE CA C 98 57.363 57.741 -0.378 1
1 1050 . 9 1 1 A 98 98 PHE CB C 98 41.936 40.581 1.355 1
1 1051 . 9 1 1 A 98 98 PHE N N 98 128.658 126.358 2.300 1
1 1052 . 9 1 1 A 99 99 GLU H H 99 8.721 9.148 -0.427 1
1 1053 . 9 1 1 A 99 99 GLU HA H 99 5.457 4.667 0.790 1
1 1058 . 9 1 1 A 99 99 GLU C C 99 176.368 176.688 -0.320 1
1 1059 . 9 1 1 A 99 99 GLU CA C 99 54.401 55.412 -1.011 1
1 1060 . 9 1 1 A 99 99 GLU CB C 99 33.068 31.104 1.964 1
1 1062 . 9 1 1 A 99 99 GLU N N 99 122.759 123.635 -0.876 1
1 1063 . 9 1 1 A 100 100 THR H H 100 8.588 10.592 -2.004 1
1 1064 . 9 1 1 A 100 100 THR HA H 100 4.603 4.399 0.204 1
1 1069 . 9 1 1 A 100 100 THR C C 100 177.144 176.707 0.437 1
1 1070 . 9 1 1 A 100 100 THR CA C 100 60.774 63.589 -2.815 1
1 1071 . 9 1 1 A 100 100 THR CB C 100 70.136 69.453 0.683 1
1 1073 . 9 1 1 A 100 100 THR N N 100 116.191 121.258 -5.067 1
1 1074 . 9 1 1 A 101 101 TRP H H 101 9.287 9.136 0.151 1
1 1075 . 9 1 1 A 101 101 TRP HA H 101 4.591 4.515 0.076 1
1 1080 . 9 1 1 A 101 101 TRP C C 101 176.457 176.436 0.021 1
1 1081 . 9 1 1 A 101 101 TRP CA C 101 60.045 58.880 1.165 1
1 1082 . 9 1 1 A 101 101 TRP CB C 101 28.578 28.439 0.139 1
1 1083 . 9 1 1 A 101 101 TRP N N 101 122.220 124.935 -2.715 1
1 1084 . 9 1 1 A 102 102 ASP H H 102 7.553 8.282 -0.729 1
1 1085 . 9 1 1 A 102 102 ASP HA H 102 4.129 4.436 -0.307 1
1 1088 . 9 1 1 A 102 102 ASP C C 102 176.714 176.330 0.384 1
1 1089 . 9 1 1 A 102 102 ASP CA C 102 52.775 53.375 -0.600 1
1 1090 . 9 1 1 A 102 102 ASP CB C 102 39.231 41.038 -1.807 1
1 1091 . 9 1 1 A 102 102 ASP N N 102 115.763 119.804 -4.041 1
1 1092 . 9 1 1 A 103 103 GLY H H 103 7.910 8.412 -0.502 1
1 1093 . 9 1 1 A 103 103 GLY HA2 H 103 4.216 3.980 0.236 1
1 1094 . 9 1 1 A 103 103 GLY HA3 H 103 3.686 4.014 -0.328 1
1 1095 . 9 1 1 A 103 103 GLY C C 103 174.566 174.390 0.176 1
1 1096 . 9 1 1 A 103 103 GLY CA C 103 45.179 46.260 -1.081 1
1 1097 . 9 1 1 A 103 103 GLY N N 103 108.311 109.073 -0.762 1
1 1098 . 9 1 1 A 104 104 THR H H 104 7.691 7.394 0.297 1
1 1099 . 9 1 1 A 104 104 THR HA H 104 4.031 4.586 -0.555 1
1 1104 . 9 1 1 A 104 104 THR C C 104 173.405 173.893 -0.488 1
1 1105 . 9 1 1 A 104 104 THR CA C 104 64.307 61.678 2.629 1
1 1106 . 9 1 1 A 104 104 THR CB C 104 68.354 70.968 -2.614 1
1 1108 . 9 1 1 A 104 104 THR N N 104 119.913 115.622 4.291 1
1 1109 . 9 1 1 A 105 105 LYS H H 105 8.297 8.716 -0.419 1
1 1110 . 9 1 1 A 105 105 LYS HA H 105 5.457 4.762 0.695 1
1 1116 . 9 1 1 A 105 105 LYS C C 105 177.055 175.595 1.460 1
1 1117 . 9 1 1 A 105 105 LYS CA C 105 54.401 55.894 -1.493 1
1 1118 . 9 1 1 A 105 105 LYS CB C 105 34.230 33.963 0.267 1
1 1122 . 9 1 1 A 105 105 LYS N N 105 125.597 124.895 0.702 1
1 1123 . 9 1 1 A 106 106 ILE H H 106 9.238 9.023 0.215 1
1 1124 . 9 1 1 A 106 106 ILE HA H 106 4.289 4.866 -0.577 1
1 1133 . 9 1 1 A 106 106 ILE C C 106 174.221 174.550 -0.329 1
1 1134 . 9 1 1 A 106 106 ILE CA C 106 60.631 59.943 0.688 1
1 1135 . 9 1 1 A 106 106 ILE CB C 106 41.927 39.926 2.001 1
1 1139 . 9 1 1 A 106 106 ILE N N 106 124.499 124.784 -0.285 1
1 1140 . 9 1 1 A 107 107 LYS H H 107 8.650 9.050 -0.400 1
1 1141 . 9 1 1 A 107 107 LYS HA H 107 5.608 5.061 0.547 1
1 1147 . 9 1 1 A 107 107 LYS C C 107 175.681 175.154 0.527 1
1 1148 . 9 1 1 A 107 107 LYS CA C 107 55.248 54.895 0.353 1
1 1149 . 9 1 1 A 107 107 LYS CB C 107 33.618 34.394 -0.776 1
1 1153 . 9 1 1 A 107 107 LYS N N 107 130.844 128.427 2.417 1
1 1154 . 9 1 1 A 108 108 ILE H H 108 9.448 8.346 1.102 1
1 1155 . 9 1 1 A 108 108 ILE HA H 108 4.741 4.883 -0.142 1
1 1164 . 9 1 1 A 108 108 ILE C C 108 172.670 173.747 -1.077 1
1 1165 . 9 1 1 A 108 108 ILE CA C 108 59.157 59.505 -0.348 1
1 1166 . 9 1 1 A 108 108 ILE CB C 108 42.241 41.924 0.317 1
1 1170 . 9 1 1 A 108 108 ILE N N 108 125.160 127.295 -2.135 1
1 1171 . 9 1 1 A 109 109 SER H H 109 8.490 8.665 -0.175 1
1 1172 . 9 1 1 A 109 109 SER HA H 109 4.437 5.047 -0.610 1
1 1175 . 9 1 1 A 109 109 SER C C 109 176.536 176.737 -0.201 1
1 1176 . 9 1 1 A 109 109 SER CA C 109 58.850 56.881 1.969 1
1 1177 . 9 1 1 A 109 109 SER CB C 109 63.010 65.005 -1.995 1
1 1178 . 9 1 1 A 109 109 SER N N 109 122.750 120.104 2.646 1
1 1179 . 9 1 1 A 110 110 GLY H H 110 9.292 8.612 0.680 1
1 1180 . 9 1 1 A 110 110 GLY HA2 H 110 5.193 3.990 1.203 1
1 1181 . 9 1 1 A 110 110 GLY HA3 H 110 3.755 4.086 -0.331 1
1 1182 . 9 1 1 A 110 110 GLY C C 110 176.964 175.451 1.513 1
1 1183 . 9 1 1 A 110 110 GLY CA C 110 48.168 46.792 1.376 1
1 1184 . 9 1 1 A 110 110 GLY N N 110 116.628 110.095 6.533 1
1 1185 . 9 1 1 A 111 111 GLU H H 111 8.576 8.876 -0.300 1
1 1186 . 9 1 1 A 111 111 GLU HA H 111 4.080 4.097 -0.017 1
1 1191 . 9 1 1 A 111 111 GLU C C 111 178.867 178.659 0.208 1
1 1192 . 9 1 1 A 111 111 GLU CA C 111 59.150 59.146 0.004 1
1 1193 . 9 1 1 A 111 111 GLU CB C 111 28.831 28.709 0.122 1
1 1195 . 9 1 1 A 111 111 GLU N N 111 120.564 118.917 1.647 1
1 1196 . 9 1 1 A 112 112 LYS H H 112 7.605 7.736 -0.131 1
1 1197 . 9 1 1 A 112 112 LYS HA H 112 4.229 4.053 0.176 1
1 1202 . 9 1 1 A 112 112 LYS C C 112 176.710 178.203 -1.493 1
1 1203 . 9 1 1 A 112 112 LYS CA C 112 57.083 59.122 -2.039 1
1 1204 . 9 1 1 A 112 112 LYS CB C 112 32.183 32.711 -0.528 1
1 1208 . 9 1 1 A 112 112 LYS N N 112 116.628 118.803 -2.175 1
1 1209 . 9 1 1 A 113 113 LEU H H 113 7.784 7.750 0.034 1
1 1210 . 9 1 1 A 113 113 LEU HA H 113 4.387 4.307 0.080 1
1 1220 . 9 1 1 A 113 113 LEU C C 113 176.195 176.511 -0.316 1
1 1221 . 9 1 1 A 113 113 LEU CA C 113 52.617 54.092 -1.475 1
1 1222 . 9 1 1 A 113 113 LEU CB C 113 42.820 41.072 1.748 1
1 1226 . 9 1 1 A 113 113 LEU N N 113 114.219 114.626 -0.407 1
1 1227 . 9 1 1 A 114 114 VAL H H 114 7.032 7.578 -0.546 1
1 1228 . 9 1 1 A 114 114 VAL HA H 114 3.723 3.885 -0.162 1
1 1236 . 9 1 1 A 114 114 VAL C C 114 175.430 177.243 -1.813 1
1 1237 . 9 1 1 A 114 114 VAL CA C 114 65.537 63.902 1.635 1
1 1238 . 9 1 1 A 114 114 VAL CB C 114 32.115 31.277 0.838 1
1 1241 . 9 1 1 A 114 114 VAL N N 114 121.773 120.709 1.064 1
1 1242 . 9 1 1 A 115 115 GLY H H 115 8.678 8.722 -0.044 1
1 1243 . 9 1 1 A 115 115 GLY HA2 H 115 4.313 3.945 0.368 1
1 1244 . 9 1 1 A 115 115 GLY HA3 H 115 3.846 3.946 -0.100 1
1 1245 . 9 1 1 A 115 115 GLY C C 115 172.462 173.580 -1.118 1
1 1246 . 9 1 1 A 115 115 GLY CA C 115 43.743 45.547 -1.804 1
1 1247 . 9 1 1 A 115 115 GLY N N 115 117.503 116.820 0.683 1
1 1248 . 9 1 1 A 116 116 ARG H H 116 8.701 8.412 0.289 1
1 1249 . 9 1 1 A 116 116 ARG HA H 116 3.926 4.614 -0.688 1
1 1254 . 9 1 1 A 116 116 ARG CA C 116 56.470 53.581 2.889 1
1 1255 . 9 1 1 A 116 116 ARG CB C 116 29.585 29.279 0.306 1
1 1257 . 9 1 1 A 116 116 ARG N N 116 123.504 120.818 2.686 1
1 1258 . 9 1 1 A 117 117 PRO HA H 117 4.242 4.234 0.008 1
1 1264 . 9 1 1 A 117 117 PRO C C 117 178.947 178.022 0.925 1
1 1265 . 9 1 1 A 117 117 PRO CA C 117 65.684 64.575 1.109 1
1 1266 . 9 1 1 A 117 117 PRO CB C 117 30.949 32.058 -1.109 1
1 1269 . 9 1 1 A 118 118 GLU H H 118 10.821 8.810 2.011 1
1 1270 . 9 1 1 A 118 118 GLU HA H 118 4.197 4.078 0.119 1
1 1271 . 9 1 1 A 118 118 GLU C C 118 176.627 178.905 -2.278 1
1 1272 . 9 1 1 A 118 118 GLU CA C 118 58.045 59.235 -1.190 1
1 1273 . 9 1 1 A 118 118 GLU CB C 118 27.101 29.263 -2.162 1
1 1274 . 9 1 1 A 118 118 GLU N N 118 119.242 116.285 2.957 1
1 1275 . 9 1 1 A 119 119 MET H H 119 7.226 8.059 -0.833 1
1 1276 . 9 1 1 A 119 119 MET HA H 119 4.591 3.879 0.712 1
1 1279 . 9 1 1 A 119 119 MET C C 119 180.024 178.122 1.902 1
1 1280 . 9 1 1 A 119 119 MET CA C 119 54.695 58.935 -4.240 1
1 1281 . 9 1 1 A 119 119 MET CB C 119 31.012 31.990 -0.978 1
1 1283 . 9 1 1 A 119 119 MET N N 119 119.475 120.048 -0.573 1
1 1284 . 9 1 1 A 120 120 ARG H H 120 7.877 7.776 0.101 1
1 1285 . 9 1 1 A 120 120 ARG HA H 120 3.988 3.989 -0.001 1
1 1292 . 9 1 1 A 120 120 ARG C C 120 177.705 178.970 -1.265 1
1 1293 . 9 1 1 A 120 120 ARG CA C 120 60.773 58.417 2.356 1
1 1294 . 9 1 1 A 120 120 ARG CB C 120 31.159 29.799 1.360 1
1 1295 . 9 1 1 A 120 120 ARG N N 120 122.099 120.070 2.029 1
1 1296 . 9 1 1 A 121 121 LEU H H 121 6.732 8.024 -1.292 1
1 1297 . 9 1 1 A 121 121 LEU HA H 121 4.170 4.072 0.098 1
1 1307 . 9 1 1 A 121 121 LEU C C 121 176.220 179.475 -3.255 1
1 1308 . 9 1 1 A 121 121 LEU CA C 121 57.370 57.783 -0.413 1
1 1309 . 9 1 1 A 121 121 LEU CB C 121 42.945 40.862 2.083 1
1 1312 . 9 1 1 A 121 121 LEU N N 121 114.436 119.330 -4.894 1
1 1313 . 9 1 1 A 122 122 LYS H H 122 7.555 9.143 -1.588 1
1 1314 . 9 1 1 A 122 122 LYS HA H 122 4.338 4.239 0.099 1
1 1321 . 9 1 1 A 122 122 LYS C C 122 176.969 176.249 0.720 1
1 1322 . 9 1 1 A 122 122 LYS CA C 122 55.621 58.524 -2.903 1
1 1323 . 9 1 1 A 122 122 LYS CB C 122 32.414 32.973 -0.559 1
1 1327 . 9 1 1 A 122 122 LYS N N 122 115.754 117.331 -1.577 1
1 1328 . 9 1 1 A 123 123 LYS H H 123 7.688 8.745 -1.057 1
1 1329 . 9 1 1 A 123 123 LYS HA H 123 4.535 4.075 0.460 1
1 1330 . 9 1 1 A 123 123 LYS CA C 123 58.461 57.006 1.455 1
1 1331 . 9 1 1 A 123 123 LYS CB C 123 33.138 31.171 1.967 1
1 1332 . 9 1 1 A 123 123 LYS N N 123 120.843 118.014 2.829 1
1 1333 . 9 1 1 A 126 126 ARG HA H 126 4.347 3.901 0.446 1
1 1338 . 9 1 1 A 126 126 ARG C C 126 174.573 175.513 -0.940 1
1 1339 . 9 1 1 A 126 126 ARG CA C 126 55.998 57.254 -1.256 1
1 1340 . 9 1 1 A 126 126 ARG CB C 126 31.569 28.410 3.159 1
1 128 . 10 1 1 A 18 18 GLY H H 18 8.343 8.068 0.275 1
1 129 . 10 1 1 A 18 18 GLY HA2 H 18 3.894 3.972 -0.078 1
1 130 . 10 1 1 A 18 18 GLY C C 18 177.743 175.794 1.949 1
1 131 . 10 1 1 A 18 18 GLY CA C 18 45.497 47.091 -1.594 1
1 132 . 10 1 1 A 18 18 GLY N N 18 109.925 108.023 1.902 1
1 133 . 10 1 1 A 19 19 SER H H 19 8.005 8.610 -0.605 1
1 134 . 10 1 1 A 19 19 SER HA H 19 4.329 4.077 0.252 1
1 136 . 10 1 1 A 19 19 SER C C 19 175.168 176.176 -1.008 1
1 137 . 10 1 1 A 19 19 SER CA C 19 58.852 61.631 -2.779 1
1 138 . 10 1 1 A 19 19 SER CB C 19 63.604 62.643 0.961 1
1 139 . 10 1 1 A 19 19 SER N N 19 115.090 121.422 -6.332 1
1 140 . 10 1 1 A 20 20 TYR H H 20 8.040 8.022 0.018 1
1 141 . 10 1 1 A 20 20 TYR HA H 20 4.439 4.315 0.124 1
1 146 . 10 1 1 A 20 20 TYR C C 20 176.111 178.656 -2.545 1
1 147 . 10 1 1 A 20 20 TYR CA C 20 57.966 61.365 -3.399 1
1 148 . 10 1 1 A 20 20 TYR CB C 20 37.472 38.421 -0.949 1
1 149 . 10 1 1 A 20 20 TYR N N 20 118.675 119.985 -1.310 1
1 150 . 10 1 1 A 21 21 GLN H H 21 7.909 8.473 -0.564 1
1 151 . 10 1 1 A 21 21 GLN HA H 21 3.903 4.139 -0.236 1
1 155 . 10 1 1 A 21 21 GLN C C 21 178.003 177.351 0.652 1
1 156 . 10 1 1 A 21 21 GLN CA C 21 58.523 58.472 0.051 1
1 157 . 10 1 1 A 21 21 GLN CB C 21 28.438 28.600 -0.162 1
1 159 . 10 1 1 A 21 21 GLN N N 21 117.056 118.510 -1.454 1
1 160 . 10 1 1 A 22 22 GLU H H 22 8.965 9.011 -0.046 1
1 161 . 10 1 1 A 22 22 GLU HA H 22 4.267 4.460 -0.193 1
1 165 . 10 1 1 A 22 22 GLU C C 22 176.451 177.902 -1.451 1
1 166 . 10 1 1 A 22 22 GLU CA C 22 58.273 58.242 0.031 1
1 167 . 10 1 1 A 22 22 GLU CB C 22 29.412 30.674 -1.262 1
1 169 . 10 1 1 A 22 22 GLU N N 22 117.289 119.334 -2.045 1
1 170 . 10 1 1 A 23 23 ILE H H 23 7.596 8.049 -0.453 1
1 171 . 10 1 1 A 23 23 ILE HA H 23 4.161 4.452 -0.291 1
1 180 . 10 1 1 A 23 23 ILE C C 23 176.195 175.706 0.489 1
1 181 . 10 1 1 A 23 23 ILE CA C 23 58.120 60.846 -2.726 1
1 182 . 10 1 1 A 23 23 ILE CB C 23 38.461 37.797 0.664 1
1 186 . 10 1 1 A 23 23 ILE N N 23 114.005 117.423 -3.418 1
1 187 . 10 1 1 A 24 24 ILE H H 24 7.178 7.666 -0.488 1
1 188 . 10 1 1 A 24 24 ILE HA H 24 3.740 4.014 -0.274 1
1 197 . 10 1 1 A 24 24 ILE C C 24 177.831 177.135 0.696 1
1 198 . 10 1 1 A 24 24 ILE CA C 24 63.318 62.295 1.023 1
1 199 . 10 1 1 A 24 24 ILE CB C 24 36.590 38.269 -1.679 1
1 203 . 10 1 1 A 24 24 ILE N N 24 122.099 125.276 -3.177 1
1 204 . 10 1 1 A 25 25 GLY H H 25 8.618 9.182 -0.564 1
1 205 . 10 1 1 A 25 25 GLY HA2 H 25 4.390 4.001 0.389 1
1 206 . 10 1 1 A 25 25 GLY HA3 H 25 4.168 4.032 0.136 1
1 207 . 10 1 1 A 25 25 GLY C C 25 175.210 175.850 -0.640 1
1 208 . 10 1 1 A 25 25 GLY CA C 25 45.798 45.115 0.683 1
1 209 . 10 1 1 A 25 25 GLY N N 25 115.531 118.618 -3.087 1
1 210 . 10 1 1 A 26 26 ARG H H 26 8.277 8.286 -0.009 1
1 211 . 10 1 1 A 26 26 ARG HA H 26 4.477 4.514 -0.037 1
1 218 . 10 1 1 A 26 26 ARG C C 26 175.944 177.448 -1.504 1
1 219 . 10 1 1 A 26 26 ARG CA C 26 54.408 57.019 -2.611 1
1 220 . 10 1 1 A 26 26 ARG CB C 26 29.501 29.985 -0.484 1
1 223 . 10 1 1 A 26 26 ARG N N 26 119.689 120.815 -1.126 1
1 224 . 10 1 1 A 27 27 THR H H 27 7.923 8.922 -0.999 1
1 225 . 10 1 1 A 27 27 THR HA H 27 3.792 3.980 -0.188 1
1 230 . 10 1 1 A 27 27 THR C C 27 175.251 176.455 -1.204 1
1 231 . 10 1 1 A 27 27 THR CA C 27 64.791 65.264 -0.473 1
1 232 . 10 1 1 A 27 27 THR CB C 27 68.354 67.966 0.388 1
1 234 . 10 1 1 A 27 27 THR N N 27 109.195 113.108 -3.913 1
1 235 . 10 1 1 A 28 28 TRP H H 28 7.389 8.093 -0.704 1
1 236 . 10 1 1 A 28 28 TRP HA H 28 4.441 4.350 0.091 1
1 240 . 10 1 1 A 28 28 TRP C C 28 178.519 178.481 0.038 1
1 241 . 10 1 1 A 28 28 TRP CA C 28 57.789 61.298 -3.509 1
1 242 . 10 1 1 A 28 28 TRP CB C 28 27.387 29.832 -2.445 1
1 243 . 10 1 1 A 28 28 TRP N N 28 120.127 124.981 -4.854 1
1 244 . 10 1 1 A 29 29 ILE H H 29 6.832 8.321 -1.489 1
1 245 . 10 1 1 A 29 29 ILE HA H 29 3.612 3.588 0.024 1
1 254 . 10 1 1 A 29 29 ILE C C 29 176.023 176.984 -0.961 1
1 255 . 10 1 1 A 29 29 ILE CA C 29 63.773 63.475 0.298 1
1 256 . 10 1 1 A 29 29 ILE CB C 29 37.567 37.350 0.217 1
1 260 . 10 1 1 A 29 29 ILE N N 29 119.913 117.924 1.989 1
1 261 . 10 1 1 A 30 30 PHE H H 30 7.329 7.626 -0.297 1
1 262 . 10 1 1 A 30 30 PHE HA H 30 3.912 4.439 -0.527 1
1 268 . 10 1 1 A 30 30 PHE C C 30 177.101 178.034 -0.933 1
1 269 . 10 1 1 A 30 30 PHE CA C 30 59.436 61.271 -1.835 1
1 270 . 10 1 1 A 30 30 PHE CB C 30 38.734 39.825 -1.091 1
1 271 . 10 1 1 A 30 30 PHE N N 30 116.638 120.397 -3.759 1
1 272 . 10 1 1 A 31 31 ARG H H 31 7.399 8.760 -1.361 1
1 273 . 10 1 1 A 31 31 ARG HA H 31 4.287 4.311 -0.024 1
1 278 . 10 1 1 A 31 31 ARG C C 31 176.539 178.272 -1.733 1
1 279 . 10 1 1 A 31 31 ARG CA C 31 58.852 59.139 -0.287 1
1 280 . 10 1 1 A 31 31 ARG CB C 31 29.461 30.329 -0.868 1
1 281 . 10 1 1 A 31 31 ARG N N 31 122.099 120.710 1.389 1
1 282 . 10 1 1 A 32 32 GLY H H 32 8.346 7.743 0.603 1
1 283 . 10 1 1 A 32 32 GLY HA2 H 32 4.284 3.580 0.704 1
1 284 . 10 1 1 A 32 32 GLY HA3 H 32 3.629 3.778 -0.149 1
1 285 . 10 1 1 A 32 32 GLY C C 32 173.791 173.909 -0.118 1
1 286 . 10 1 1 A 32 32 GLY CA C 32 45.793 46.555 -0.762 1
1 287 . 10 1 1 A 32 32 GLY N N 32 109.964 106.108 3.856 1
1 288 . 10 1 1 A 33 33 ALA H H 33 7.510 8.158 -0.648 1
1 289 . 10 1 1 A 33 33 ALA HA H 33 4.193 4.357 -0.164 1
1 293 . 10 1 1 A 33 33 ALA C C 33 176.672 176.495 0.177 1
1 294 . 10 1 1 A 33 33 ALA CA C 33 54.401 52.500 1.901 1
1 295 . 10 1 1 A 33 33 ALA CB C 33 19.368 21.556 -2.188 1
1 296 . 10 1 1 A 33 33 ALA N N 33 122.266 120.571 1.695 1
1 297 . 10 1 1 A 34 34 HIS H H 34 8.759 8.292 0.467 1
1 298 . 10 1 1 A 34 34 HIS HA H 34 4.529 4.933 -0.404 1
1 302 . 10 1 1 A 34 34 HIS C C 34 175.767 174.554 1.213 1
1 303 . 10 1 1 A 34 34 HIS CA C 34 54.997 54.108 0.889 1
1 304 . 10 1 1 A 34 34 HIS CB C 34 31.089 31.651 -0.562 1
1 305 . 10 1 1 A 34 34 HIS N N 34 119.038 118.256 0.782 1
1 306 . 10 1 1 A 35 35 ARG H H 35 8.142 8.309 -0.167 1
1 307 . 10 1 1 A 35 35 ARG HA H 35 4.700 4.664 0.036 1
1 314 . 10 1 1 A 35 35 ARG C C 35 177.572 176.767 0.805 1
1 315 . 10 1 1 A 35 35 ARG CA C 35 54.103 55.534 -1.431 1
1 316 . 10 1 1 A 35 35 ARG CB C 35 29.112 31.583 -2.471 1
1 319 . 10 1 1 A 35 35 ARG N N 35 127.785 123.428 4.357 1
1 320 . 10 1 1 A 36 36 GLY H H 36 9.352 7.959 1.393 1
1 321 . 10 1 1 A 36 36 GLY HA2 H 36 4.291 3.987 0.304 1
1 322 . 10 1 1 A 36 36 GLY HA3 H 36 3.247 4.062 -0.815 1
1 323 . 10 1 1 A 36 36 GLY C C 36 173.876 173.111 0.765 1
1 324 . 10 1 1 A 36 36 GLY CA C 36 45.644 45.350 0.294 1
1 325 . 10 1 1 A 36 36 GLY N N 36 109.626 109.557 0.069 1
1 326 . 10 1 1 A 37 37 ARG H H 37 9.384 8.438 0.946 1
1 327 . 10 1 1 A 37 37 ARG HA H 37 4.688 4.326 0.362 1
1 333 . 10 1 1 A 37 37 ARG C C 37 175.081 174.784 0.297 1
1 334 . 10 1 1 A 37 37 ARG CA C 37 55.742 56.780 -1.038 1
1 335 . 10 1 1 A 37 37 ARG CB C 37 28.138 30.924 -2.786 1
1 338 . 10 1 1 A 37 37 ARG N N 37 127.132 122.547 4.585 1
1 339 . 10 1 1 A 38 38 VAL H H 38 7.605 5.876 1.729 1
1 340 . 10 1 1 A 38 38 VAL HA H 38 4.591 4.234 0.357 1
1 348 . 10 1 1 A 38 38 VAL C C 38 174.391 173.621 0.770 1
1 349 . 10 1 1 A 38 38 VAL CA C 38 60.092 59.776 0.316 1
1 350 . 10 1 1 A 38 38 VAL CB C 38 33.328 33.731 -0.403 1
1 353 . 10 1 1 A 38 38 VAL N N 38 126.253 124.633 1.620 1
1 354 . 10 1 1 A 39 39 ASN H H 39 9.007 8.023 0.984 1
1 355 . 10 1 1 A 39 39 ASN HA H 39 4.736 4.928 -0.192 1
1 358 . 10 1 1 A 39 39 ASN C C 39 174.562 175.094 -0.532 1
1 359 . 10 1 1 A 39 39 ASN CA C 39 51.577 51.864 -0.287 1
1 360 . 10 1 1 A 39 39 ASN CB C 39 40.749 41.943 -1.194 1
1 361 . 10 1 1 A 39 39 ASN N N 39 123.411 123.333 0.078 1
1 362 . 10 1 1 A 40 40 LYS H H 40 8.510 8.747 -0.237 1
1 363 . 10 1 1 A 40 40 LYS HA H 40 3.909 3.897 0.012 1
1 370 . 10 1 1 A 40 40 LYS C C 40 176.629 178.245 -1.616 1
1 371 . 10 1 1 A 40 40 LYS CA C 40 59.141 60.362 -1.221 1
1 372 . 10 1 1 A 40 40 LYS CB C 40 32.301 32.306 -0.005 1
1 376 . 10 1 1 A 40 40 LYS N N 40 116.303 124.341 -8.038 1
1 377 . 10 1 1 A 41 41 LYS H H 41 7.907 8.570 -0.663 1
1 378 . 10 1 1 A 41 41 LYS HA H 41 4.172 3.837 0.335 1
1 384 . 10 1 1 A 41 41 LYS C C 41 177.229 175.629 1.600 1
1 385 . 10 1 1 A 41 41 LYS CA C 41 57.392 57.803 -0.411 1
1 386 . 10 1 1 A 41 41 LYS CB C 41 32.667 30.833 1.834 1
1 390 . 10 1 1 A 41 41 LYS N N 41 117.066 117.520 -0.454 1
1 391 . 10 1 1 A 42 42 ASN H H 42 7.962 8.959 -0.997 1
1 392 . 10 1 1 A 42 42 ASN HA H 42 4.392 4.557 -0.165 1
1 395 . 10 1 1 A 42 42 ASN C C 42 179.805 175.996 3.809 1
1 396 . 10 1 1 A 42 42 ASN CA C 42 52.335 52.656 -0.321 1
1 397 . 10 1 1 A 42 42 ASN CB C 42 39.348 39.163 0.185 1
1 398 . 10 1 1 A 42 42 ASN N N 42 114.442 116.739 -2.297 1
1 399 . 10 1 1 A 43 43 ILE H H 43 7.806 8.394 -0.588 1
1 400 . 10 1 1 A 43 43 ILE HA H 43 3.747 3.929 -0.182 1
1 409 . 10 1 1 A 43 43 ILE C C 43 174.219 177.329 -3.110 1
1 410 . 10 1 1 A 43 43 ILE CA C 43 64.505 63.394 1.111 1
1 411 . 10 1 1 A 43 43 ILE CB C 43 36.595 38.311 -1.716 1
1 415 . 10 1 1 A 43 43 ILE N N 43 121.001 120.577 0.424 1
1 416 . 10 1 1 A 44 44 VAL H H 44 6.154 7.778 -1.624 1
1 417 . 10 1 1 A 44 44 VAL HA H 44 3.497 3.916 -0.419 1
1 425 . 10 1 1 A 44 44 VAL C C 44 176.282 176.298 -0.016 1
1 426 . 10 1 1 A 44 44 VAL CA C 44 63.606 63.156 0.450 1
1 427 . 10 1 1 A 44 44 VAL CB C 44 30.614 31.861 -1.247 1
1 430 . 10 1 1 A 44 44 VAL N N 44 110.500 119.584 -9.084 1
1 431 . 10 1 1 A 45 45 TRP H H 45 7.419 8.219 -0.800 1
1 432 . 10 1 1 A 45 45 TRP HA H 45 4.716 4.897 -0.181 1
1 438 . 10 1 1 A 45 45 TRP C C 45 175.422 175.743 -0.321 1
1 439 . 10 1 1 A 45 45 TRP CA C 45 56.188 57.497 -1.309 1
1 440 . 10 1 1 A 45 45 TRP CB C 45 31.245 31.015 0.230 1
1 441 . 10 1 1 A 45 45 TRP N N 45 118.601 120.622 -2.021 1
1 442 . 10 1 1 A 46 46 HIS H H 46 7.582 7.838 -0.256 1
1 443 . 10 1 1 A 46 46 HIS HA H 46 4.227 4.864 -0.637 1
1 448 . 10 1 1 A 46 46 HIS C C 46 177.485 174.757 2.728 1
1 449 . 10 1 1 A 46 46 HIS CA C 46 56.799 55.439 1.360 1
1 450 . 10 1 1 A 46 46 HIS CB C 46 32.017 31.968 0.049 1
1 451 . 10 1 1 A 46 46 HIS N N 46 122.648 118.637 4.011 1
1 452 . 10 1 1 A 47 47 GLU H H 47 7.948 8.214 -0.266 1
1 453 . 10 1 1 A 47 47 GLU HA H 47 4.098 4.261 -0.163 1
1 457 . 10 1 1 A 47 47 GLU C C 47 175.596 176.329 -0.733 1
1 458 . 10 1 1 A 47 47 GLU CA C 47 56.482 56.437 0.045 1
1 459 . 10 1 1 A 47 47 GLU CB C 47 31.839 29.506 2.333 1
1 461 . 10 1 1 A 47 47 GLU N N 47 120.485 121.027 -0.542 1
1 462 . 10 1 1 A 48 48 LEU H H 48 9.304 9.739 -0.435 1
1 463 . 10 1 1 A 48 48 LEU HA H 48 4.218 4.396 -0.178 1
1 472 . 10 1 1 A 48 48 LEU C C 48 177.743 176.451 1.292 1
1 473 . 10 1 1 A 48 48 LEU CA C 48 55.043 54.925 0.118 1
1 474 . 10 1 1 A 48 48 LEU CB C 48 41.948 41.028 0.920 1
1 477 . 10 1 1 A 48 48 LEU N N 48 128.658 125.783 2.875 1
1 478 . 10 1 1 A 49 49 ILE H H 49 8.028 8.932 -0.904 1
1 479 . 10 1 1 A 49 49 ILE HA H 49 3.279 4.740 -1.461 1
1 488 . 10 1 1 A 49 49 ILE C C 49 174.821 177.317 -2.496 1
1 489 . 10 1 1 A 49 49 ILE CA C 49 63.901 62.272 1.629 1
1 490 . 10 1 1 A 49 49 ILE CB C 49 37.775 40.914 -3.139 1
1 494 . 10 1 1 A 49 49 ILE N N 49 120.341 123.870 -3.529 1
1 495 . 10 1 1 A 50 50 GLY H H 50 9.038 7.329 1.709 1
1 496 . 10 1 1 A 50 50 GLY HA2 H 50 4.717 4.233 0.484 1
1 497 . 10 1 1 A 50 50 GLY HA3 H 50 3.491 4.304 -0.813 1
1 498 . 10 1 1 A 50 50 GLY C C 50 175.084 173.810 1.274 1
1 499 . 10 1 1 A 50 50 GLY CA C 50 44.599 45.472 -0.873 1
1 500 . 10 1 1 A 50 50 GLY N N 50 110.284 109.732 0.552 1
1 501 . 10 1 1 A 51 51 LEU H H 51 8.400 6.111 2.289 1
1 502 . 10 1 1 A 51 51 LEU HA H 51 4.723 3.805 0.918 1
1 512 . 10 1 1 A 51 51 LEU C C 51 177.147 175.442 1.705 1
1 513 . 10 1 1 A 51 51 LEU CA C 51 54.350 55.522 -1.172 1
1 514 . 10 1 1 A 51 51 LEU CB C 51 42.985 42.711 0.274 1
1 518 . 10 1 1 A 51 51 LEU N N 51 120.471 122.259 -1.788 1
1 519 . 10 1 1 A 52 52 LYS H H 52 7.505 8.337 -0.832 1
1 520 . 10 1 1 A 52 52 LYS HA H 52 4.250 4.386 -0.136 1
1 527 . 10 1 1 A 52 52 LYS C C 52 174.995 175.113 -0.118 1
1 528 . 10 1 1 A 52 52 LYS CA C 52 55.589 54.735 0.854 1
1 529 . 10 1 1 A 52 52 LYS CB C 52 33.025 33.609 -0.584 1
1 533 . 10 1 1 A 52 52 LYS N N 52 122.406 124.263 -1.857 1
1 534 . 10 1 1 A 53 53 VAL H H 53 9.075 8.132 0.943 1
1 535 . 10 1 1 A 53 53 VAL HA H 53 5.071 5.040 0.031 1
1 543 . 10 1 1 A 53 53 VAL C C 53 171.170 173.571 -2.401 1
1 544 . 10 1 1 A 53 53 VAL CA C 53 58.523 59.119 -0.596 1
1 545 . 10 1 1 A 53 53 VAL CB C 53 35.698 35.383 0.315 1
1 548 . 10 1 1 A 53 53 VAL N N 53 124.509 124.514 -0.005 1
1 549 . 10 1 1 A 54 54 ARG H H 54 8.148 8.567 -0.419 1
1 550 . 10 1 1 A 54 54 ARG HA H 54 5.329 4.922 0.407 1
1 557 . 10 1 1 A 54 54 ARG C C 54 176.113 174.517 1.596 1
1 558 . 10 1 1 A 54 54 ARG CA C 54 53.817 53.928 -0.111 1
1 559 . 10 1 1 A 54 54 ARG CB C 54 34.511 33.761 0.750 1
1 562 . 10 1 1 A 54 54 ARG N N 54 123.625 121.602 2.023 1
1 563 . 10 1 1 A 55 55 VAL H H 55 8.659 9.534 -0.875 1
1 564 . 10 1 1 A 55 55 VAL HA H 55 4.085 4.028 0.057 1
1 572 . 10 1 1 A 55 55 VAL C C 55 176.282 175.382 0.900 1
1 573 . 10 1 1 A 55 55 VAL CA C 55 62.814 62.476 0.338 1
1 574 . 10 1 1 A 55 55 VAL CB C 55 30.628 31.102 -0.474 1
1 577 . 10 1 1 A 55 55 VAL N N 55 125.383 123.161 2.222 1
1 578 . 10 1 1 A 56 56 VAL H H 56 8.057 8.044 0.013 1
1 579 . 10 1 1 A 56 56 VAL HA H 56 4.123 3.981 0.142 1
1 587 . 10 1 1 A 56 56 VAL C C 56 175.426 176.142 -0.716 1
1 588 . 10 1 1 A 56 56 VAL CA C 56 62.786 64.231 -1.445 1
1 589 . 10 1 1 A 56 56 VAL CB C 56 32.267 32.506 -0.239 1
1 592 . 10 1 1 A 56 56 VAL N N 56 124.936 129.085 -4.149 1
1 593 . 10 1 1 A 57 57 ASN H H 57 7.527 8.208 -0.681 1
1 594 . 10 1 1 A 57 57 ASN HA H 57 4.817 5.229 -0.412 1
1 597 . 10 1 1 A 57 57 ASN C C 57 172.973 173.588 -0.615 1
1 598 . 10 1 1 A 57 57 ASN CA C 57 52.460 51.656 0.804 1
1 599 . 10 1 1 A 57 57 ASN CB C 57 42.070 41.313 0.757 1
1 600 . 10 1 1 A 57 57 ASN N N 57 114.777 117.156 -2.379 1
1 601 . 10 1 1 A 58 58 SER H H 58 8.193 8.913 -0.720 1
1 602 . 10 1 1 A 58 58 SER HA H 58 5.214 4.846 0.368 1
1 605 . 10 1 1 A 58 58 SER C C 58 174.221 172.233 1.988 1
1 606 . 10 1 1 A 58 58 SER CA C 58 56.778 56.351 0.427 1
1 607 . 10 1 1 A 58 58 SER CB C 58 63.906 65.262 -1.356 1
1 608 . 10 1 1 A 58 58 SER N N 58 115.531 119.923 -4.392 1
1 609 . 10 1 1 A 59 59 THR H H 59 8.053 7.881 0.172 1
1 610 . 10 1 1 A 59 59 THR HA H 59 4.305 4.708 -0.403 1
1 615 . 10 1 1 A 59 59 THR C C 59 174.478 172.967 1.511 1
1 616 . 10 1 1 A 59 59 THR CA C 59 63.305 60.607 2.698 1
1 617 . 10 1 1 A 59 59 THR CB C 59 68.354 68.464 -0.110 1
1 619 . 10 1 1 A 59 59 THR N N 59 116.405 115.541 0.864 1
1 620 . 10 1 1 A 60 60 HIS H H 60 8.359 8.042 0.317 1
1 621 . 10 1 1 A 60 60 HIS HA H 60 5.167 5.078 0.089 1
1 626 . 10 1 1 A 60 60 HIS CA C 60 52.792 53.118 -0.326 1
1 627 . 10 1 1 A 60 60 HIS CB C 60 32.142 30.734 1.408 1
1 628 . 10 1 1 A 60 60 HIS N N 60 123.625 124.214 -0.589 1
1 629 . 10 1 1 A 61 61 PRO HA H 61 4.277 4.355 -0.078 1
1 636 . 10 1 1 A 61 61 PRO C C 61 178.217 177.432 0.785 1
1 637 . 10 1 1 A 61 61 PRO CA C 61 64.375 64.423 -0.048 1
1 638 . 10 1 1 A 61 61 PRO CB C 61 32.007 32.138 -0.131 1
1 641 . 10 1 1 A 62 62 GLY H H 62 8.421 8.118 0.303 1
1 642 . 10 1 1 A 62 62 GLY HA2 H 62 3.889 3.810 0.079 1
1 643 . 10 1 1 A 62 62 GLY HA3 H 62 3.653 3.919 -0.266 1
1 644 . 10 1 1 A 62 62 GLY C C 62 174.994 173.975 1.019 1
1 645 . 10 1 1 A 62 62 GLY CA C 62 45.831 45.341 0.490 1
1 646 . 10 1 1 A 62 62 GLY N N 62 106.132 105.865 0.267 1
1 647 . 10 1 1 A 63 63 TYR H H 63 7.327 7.823 -0.496 1
1 648 . 10 1 1 A 63 63 TYR HA H 63 4.846 4.564 0.282 1
1 652 . 10 1 1 A 63 63 TYR C C 63 175.593 175.514 0.079 1
1 653 . 10 1 1 A 63 63 TYR CA C 63 56.071 58.263 -2.192 1
1 654 . 10 1 1 A 63 63 TYR CB C 63 38.962 40.314 -1.352 1
1 655 . 10 1 1 A 63 63 TYR N N 63 116.628 116.953 -0.325 1
1 656 . 10 1 1 A 64 64 VAL H H 64 7.296 7.059 0.237 1
1 657 . 10 1 1 A 64 64 VAL HA H 64 3.180 4.107 -0.927 1
1 665 . 10 1 1 A 64 64 VAL C C 64 177.312 176.515 0.797 1
1 666 . 10 1 1 A 64 64 VAL CA C 64 65.688 62.756 2.932 1
1 667 . 10 1 1 A 64 64 VAL CB C 64 30.957 31.710 -0.753 1
1 670 . 10 1 1 A 64 64 VAL N N 64 117.940 118.331 -0.391 1
1 671 . 10 1 1 A 65 65 GLY H H 65 8.449 10.195 -1.746 1
1 672 . 10 1 1 A 65 65 GLY HA2 H 65 4.320 3.945 0.375 1
1 673 . 10 1 1 A 65 65 GLY HA3 H 65 3.515 3.947 -0.432 1
1 674 . 10 1 1 A 65 65 GLY C C 65 174.821 173.389 1.432 1
1 675 . 10 1 1 A 65 65 GLY CA C 65 44.599 45.301 -0.702 1
1 676 . 10 1 1 A 65 65 GLY N N 65 115.317 114.157 1.160 1
1 677 . 10 1 1 A 66 66 ILE H H 66 7.095 7.488 -0.393 1
1 678 . 10 1 1 A 66 66 ILE HA H 66 3.193 4.695 -1.502 1
1 687 . 10 1 1 A 66 66 ILE C C 66 174.308 174.595 -0.287 1
1 688 . 10 1 1 A 66 66 ILE CA C 66 63.470 60.093 3.377 1
1 689 . 10 1 1 A 66 66 ILE CB C 66 37.775 40.903 -3.128 1
1 693 . 10 1 1 A 66 66 ILE N N 66 122.099 122.469 -0.370 1
1 694 . 10 1 1 A 67 67 GLU H H 67 7.126 9.134 -2.008 1
1 695 . 10 1 1 A 67 67 GLU HA H 67 5.343 5.289 0.054 1
1 699 . 10 1 1 A 67 67 GLU C C 67 174.652 175.530 -0.878 1
1 700 . 10 1 1 A 67 67 GLU CA C 67 54.109 54.460 -0.351 1
1 701 . 10 1 1 A 67 67 GLU CB C 67 33.619 33.267 0.352 1
1 703 . 10 1 1 A 67 67 GLU N N 67 125.164 128.933 -3.769 1
1 704 . 10 1 1 A 68 68 GLY H H 68 8.401 8.053 0.348 1
1 705 . 10 1 1 A 68 68 GLY HA2 H 68 4.364 2.704 1.660 1
1 706 . 10 1 1 A 68 68 GLY HA3 H 68 4.041 3.925 0.116 1
1 707 . 10 1 1 A 68 68 GLY C C 68 171.644 171.063 0.581 1
1 708 . 10 1 1 A 68 68 GLY CA C 68 45.680 44.408 1.272 1
1 709 . 10 1 1 A 68 68 GLY N N 68 109.626 111.989 -2.363 1
1 710 . 10 1 1 A 69 69 TYR H H 69 8.422 10.220 -1.798 1
1 711 . 10 1 1 A 69 69 TYR HA H 69 5.079 4.821 0.258 1
1 714 . 10 1 1 A 69 69 TYR C C 69 176.194 175.409 0.785 1
1 715 . 10 1 1 A 69 69 TYR CA C 69 57.681 57.575 0.106 1
1 716 . 10 1 1 A 69 69 TYR CB C 69 41.043 39.483 1.560 1
1 717 . 10 1 1 A 69 69 TYR N N 69 119.689 119.224 0.465 1
1 718 . 10 1 1 A 70 70 VAL H H 70 8.753 8.631 0.122 1
1 719 . 10 1 1 A 70 70 VAL HA H 70 4.143 4.303 -0.160 1
1 727 . 10 1 1 A 70 70 VAL C C 70 176.540 175.626 0.914 1
1 728 . 10 1 1 A 70 70 VAL CA C 70 63.477 63.728 -0.251 1
1 729 . 10 1 1 A 70 70 VAL CB C 70 30.952 32.168 -1.216 1
1 732 . 10 1 1 A 70 70 VAL N N 70 123.420 126.085 -2.665 1
1 733 . 10 1 1 A 71 71 ILE H H 71 9.101 10.772 -1.671 1
1 734 . 10 1 1 A 71 71 ILE HA H 71 4.834 4.799 0.035 1
1 743 . 10 1 1 A 71 71 ILE C C 71 175.418 175.793 -0.375 1
1 744 . 10 1 1 A 71 71 ILE CA C 71 60.637 62.447 -1.810 1
1 745 . 10 1 1 A 71 71 ILE CB C 71 39.853 39.908 -0.055 1
1 749 . 10 1 1 A 71 71 ILE N N 71 119.913 125.754 -5.841 1
1 750 . 10 1 1 A 72 72 ASP H H 72 8.030 8.159 -0.129 1
1 751 . 10 1 1 A 72 72 ASP HA H 72 4.964 5.057 -0.093 1
1 754 . 10 1 1 A 72 72 ASP C C 72 173.017 175.310 -2.293 1
1 755 . 10 1 1 A 72 72 ASP CA C 72 53.511 53.669 -0.158 1
1 756 . 10 1 1 A 72 72 ASP CB C 72 41.932 43.075 -1.143 1
1 757 . 10 1 1 A 72 72 ASP N N 72 118.377 119.954 -1.577 1
1 758 . 10 1 1 A 73 73 GLU H H 73 9.349 8.732 0.617 1
1 759 . 10 1 1 A 73 73 GLU HA H 73 4.868 4.949 -0.081 1
1 762 . 10 1 1 A 73 73 GLU C C 73 173.793 174.835 -1.042 1
1 763 . 10 1 1 A 73 73 GLU CA C 73 55.521 56.503 -0.982 1
1 764 . 10 1 1 A 73 73 GLU CB C 73 33.138 31.810 1.328 1
1 766 . 10 1 1 A 73 73 GLU N N 73 123.848 123.818 0.030 1
1 767 . 10 1 1 A 74 74 THR H H 74 8.748 8.671 0.077 1
1 768 . 10 1 1 A 74 74 THR HA H 74 4.992 4.780 0.212 1
1 773 . 10 1 1 A 74 74 THR CA C 74 59.450 60.247 -0.797 1
1 774 . 10 1 1 A 74 74 THR CB C 74 70.429 69.887 0.542 1
1 776 . 10 1 1 A 74 74 THR N N 74 116.628 120.068 -3.440 1
1 777 . 10 1 1 A 75 75 ARG HA H 75 3.741 3.958 -0.217 1
1 782 . 10 1 1 A 75 75 ARG C C 75 177.140 177.319 -0.179 1
1 783 . 10 1 1 A 75 75 ARG CA C 75 60.041 58.228 1.813 1
1 784 . 10 1 1 A 75 75 ARG CB C 75 29.930 30.156 -0.226 1
1 787 . 10 1 1 A 76 76 ASN H H 76 8.497 8.413 0.084 1
1 788 . 10 1 1 A 76 76 ASN HA H 76 5.310 5.022 0.288 1
1 791 . 10 1 1 A 76 76 ASN C C 76 175.509 174.608 0.901 1
1 792 . 10 1 1 A 76 76 ASN CA C 76 52.320 52.878 -0.558 1
1 793 . 10 1 1 A 76 76 ASN CB C 76 40.744 41.129 -0.385 1
1 794 . 10 1 1 A 76 76 ASN N N 76 111.053 117.195 -6.142 1
1 795 . 10 1 1 A 77 77 MET H H 77 7.528 7.406 0.122 1
1 796 . 10 1 1 A 77 77 MET HA H 77 5.392 4.923 0.469 1
1 801 . 10 1 1 A 77 77 MET C C 77 174.824 174.059 0.765 1
1 802 . 10 1 1 A 77 77 MET CA C 77 54.994 54.073 0.921 1
1 803 . 10 1 1 A 77 77 MET CB C 77 36.753 35.193 1.560 1
1 805 . 10 1 1 A 77 77 MET N N 77 119.913 115.597 4.316 1
1 806 . 10 1 1 A 78 78 LEU H H 78 8.977 8.728 0.249 1
1 807 . 10 1 1 A 78 78 LEU HA H 78 4.803 5.385 -0.582 1
1 817 . 10 1 1 A 78 78 LEU C C 78 174.563 174.924 -0.361 1
1 818 . 10 1 1 A 78 78 LEU CA C 78 53.964 54.279 -0.315 1
1 819 . 10 1 1 A 78 78 LEU CB C 78 44.903 45.309 -0.406 1
1 823 . 10 1 1 A 78 78 LEU N N 78 121.224 122.548 -1.324 1
1 824 . 10 1 1 A 79 79 VAL H H 79 8.115 8.930 -0.815 1
1 825 . 10 1 1 A 79 79 VAL HA H 79 4.783 5.018 -0.235 1
1 833 . 10 1 1 A 79 79 VAL C C 79 175.297 175.273 0.024 1
1 834 . 10 1 1 A 79 79 VAL CA C 79 61.821 60.767 1.054 1
1 835 . 10 1 1 A 79 79 VAL CB C 79 31.146 35.029 -3.883 1
1 838 . 10 1 1 A 79 79 VAL N N 79 124.062 126.947 -2.885 1
1 839 . 10 1 1 A 80 80 ILE H H 80 9.342 8.819 0.523 1
1 840 . 10 1 1 A 80 80 ILE HA H 80 4.764 5.221 -0.457 1
1 849 . 10 1 1 A 80 80 ILE C C 80 174.127 174.711 -0.584 1
1 850 . 10 1 1 A 80 80 ILE CA C 80 59.897 59.211 0.686 1
1 851 . 10 1 1 A 80 80 ILE CB C 80 42.225 40.494 1.731 1
1 855 . 10 1 1 A 80 80 ILE N N 80 129.970 125.825 4.145 1
1 856 . 10 1 1 A 81 81 ALA H H 81 9.478 9.840 -0.362 1
1 857 . 10 1 1 A 81 81 ALA HA H 81 5.139 5.500 -0.361 1
1 861 . 10 1 1 A 81 81 ALA C C 81 176.970 176.814 0.156 1
1 862 . 10 1 1 A 81 81 ALA CA C 81 50.835 50.414 0.421 1
1 863 . 10 1 1 A 81 81 ALA CB C 81 21.451 21.916 -0.465 1
1 864 . 10 1 1 A 81 81 ALA N N 81 129.756 126.315 3.441 1
1 865 . 10 1 1 A 82 82 GLY H H 82 8.691 8.846 -0.155 1
1 866 . 10 1 1 A 82 82 GLY HA2 H 82 5.110 4.394 0.716 1
1 867 . 10 1 1 A 82 82 GLY HA3 H 82 4.241 4.589 -0.348 1
1 868 . 10 1 1 A 82 82 GLY C C 82 173.017 174.621 -1.604 1
1 869 . 10 1 1 A 82 82 GLY CA C 82 44.166 44.684 -0.518 1
1 870 . 10 1 1 A 82 82 GLY N N 82 113.568 109.418 4.150 1
1 871 . 10 1 1 A 83 83 GLU H H 83 8.659 8.852 -0.193 1
1 872 . 10 1 1 A 83 83 GLU HA H 83 4.286 4.307 -0.021 1
1 876 . 10 1 1 A 83 83 GLU C C 83 177.570 176.176 1.394 1
1 877 . 10 1 1 A 83 83 GLU CA C 83 59.017 58.461 0.556 1
1 878 . 10 1 1 A 83 83 GLU CB C 83 29.762 29.209 0.553 1
1 880 . 10 1 1 A 83 83 GLU N N 83 120.019 121.290 -1.271 1
1 881 . 10 1 1 A 84 84 ASN H H 84 8.549 8.620 -0.071 1
1 882 . 10 1 1 A 84 84 ASN HA H 84 4.821 4.878 -0.057 1
1 884 . 10 1 1 A 84 84 ASN C C 84 173.878 173.734 0.144 1
1 885 . 10 1 1 A 84 84 ASN CA C 84 52.919 53.051 -0.132 1
1 886 . 10 1 1 A 84 84 ASN CB C 84 40.150 39.367 0.783 1
1 887 . 10 1 1 A 84 84 ASN N N 84 112.778 124.199 -11.421 1
1 888 . 10 1 1 A 85 85 LYS H H 85 7.116 7.790 -0.674 1
1 889 . 10 1 1 A 85 85 LYS HA H 85 4.344 5.017 -0.673 1
1 895 . 10 1 1 A 85 85 LYS C C 85 173.278 174.658 -1.380 1
1 896 . 10 1 1 A 85 85 LYS CA C 85 55.292 55.184 0.108 1
1 897 . 10 1 1 A 85 85 LYS CB C 85 36.124 36.264 -0.140 1
1 901 . 10 1 1 A 85 85 LYS N N 85 118.377 120.756 -2.379 1
1 902 . 10 1 1 A 86 86 VAL H H 86 7.781 8.725 -0.944 1
1 903 . 10 1 1 A 86 86 VAL HA H 86 4.749 5.300 -0.551 1
1 911 . 10 1 1 A 86 86 VAL C C 86 174.739 174.583 0.156 1
1 912 . 10 1 1 A 86 86 VAL CA C 86 60.716 59.450 1.266 1
1 913 . 10 1 1 A 86 86 VAL CB C 86 33.619 35.471 -1.852 1
1 916 . 10 1 1 A 86 86 VAL N N 86 120.127 118.291 1.836 1
1 917 . 10 1 1 A 87 87 TRP H H 87 9.558 8.991 0.567 1
1 918 . 10 1 1 A 87 87 TRP HA H 87 4.958 5.143 -0.185 1
1 923 . 10 1 1 A 87 87 TRP C C 87 174.909 174.932 -0.023 1
1 924 . 10 1 1 A 87 87 TRP CA C 87 57.073 55.956 1.117 1
1 925 . 10 1 1 A 87 87 TRP CB C 87 33.028 31.596 1.432 1
1 926 . 10 1 1 A 87 87 TRP N N 87 127.346 123.195 4.151 1
1 927 . 10 1 1 A 88 88 LYS H H 88 8.590 7.419 1.171 1
1 928 . 10 1 1 A 88 88 LYS HA H 88 4.856 4.622 0.234 1
1 935 . 10 1 1 A 88 88 LYS C C 88 175.382 174.131 1.251 1
1 936 . 10 1 1 A 88 88 LYS CA C 88 55.887 54.562 1.325 1
1 937 . 10 1 1 A 88 88 LYS CB C 88 32.434 33.808 -1.374 1
1 941 . 10 1 1 A 88 88 LYS N N 88 123.625 122.132 1.493 1
1 942 . 10 1 1 A 89 89 VAL H H 89 8.829 8.031 0.798 1
1 943 . 10 1 1 A 89 89 VAL HA H 89 4.406 4.645 -0.239 1
1 951 . 10 1 1 A 89 89 VAL CA C 89 58.371 58.807 -0.436 1
1 952 . 10 1 1 A 89 89 VAL CB C 89 34.512 32.657 1.855 1
1 955 . 10 1 1 A 89 89 VAL N N 89 124.285 122.768 1.517 1
1 956 . 10 1 1 A 90 90 PRO HA H 90 5.073 4.594 0.479 1
1 961 . 10 1 1 A 90 90 PRO C C 90 177.231 178.031 -0.800 1
1 962 . 10 1 1 A 90 90 PRO CA C 90 61.795 62.981 -1.186 1
1 963 . 10 1 1 A 90 90 PRO CB C 90 31.660 32.600 -0.940 1
1 964 . 10 1 1 A 91 91 LYS H H 91 8.116 8.616 -0.500 1
1 965 . 10 1 1 A 91 91 LYS HA H 91 4.024 4.178 -0.154 1
1 969 . 10 1 1 A 91 91 LYS C C 91 178.518 176.918 1.600 1
1 970 . 10 1 1 A 91 91 LYS CA C 91 59.621 59.521 0.100 1
1 971 . 10 1 1 A 91 91 LYS CB C 91 34.217 32.121 2.096 1
1 973 . 10 1 1 A 91 91 LYS N N 91 121.224 123.319 -2.095 1
1 974 . 10 1 1 A 92 92 ASP H H 92 8.505 8.436 0.069 1
1 975 . 10 1 1 A 92 92 ASP HA H 92 3.781 4.721 -0.940 1
1 978 . 10 1 1 A 92 92 ASP C C 92 176.975 176.627 0.348 1
1 979 . 10 1 1 A 92 92 ASP CA C 92 56.773 54.471 2.302 1
1 980 . 10 1 1 A 92 92 ASP CB C 92 39.590 40.439 -0.849 1
1 981 . 10 1 1 A 92 92 ASP N N 92 111.815 116.372 -4.557 1
1 982 . 10 1 1 A 93 93 VAL H H 93 6.691 7.795 -1.104 1
1 983 . 10 1 1 A 93 93 VAL HA H 93 4.678 4.524 0.154 1
1 991 . 10 1 1 A 93 93 VAL C C 93 176.537 174.971 1.566 1
1 992 . 10 1 1 A 93 93 VAL CA C 93 60.120 60.291 -0.171 1
1 993 . 10 1 1 A 93 93 VAL CB C 93 31.093 31.768 -0.675 1
1 996 . 10 1 1 A 93 93 VAL N N 93 107.879 111.691 -3.812 1
1 997 . 10 1 1 A 94 94 CYS H H 94 7.249 7.819 -0.570 1
1 998 . 10 1 1 A 94 94 CYS HA H 94 5.062 4.657 0.405 1
1 1001 . 10 1 1 A 94 94 CYS C C 94 173.103 172.447 0.656 1
1 1002 . 10 1 1 A 94 94 CYS CA C 94 58.001 58.062 -0.061 1
1 1003 . 10 1 1 A 94 94 CYS CB C 94 31.418 30.709 0.709 1
1 1004 . 10 1 1 A 94 94 CYS N N 94 117.940 118.494 -0.554 1
1 1005 . 10 1 1 A 95 95 ILE H H 95 8.153 8.081 0.072 1
1 1006 . 10 1 1 A 95 95 ILE HA H 95 4.159 4.643 -0.484 1
1 1016 . 10 1 1 A 95 95 ILE C C 95 174.736 174.622 0.114 1
1 1017 . 10 1 1 A 95 95 ILE CA C 95 61.234 60.063 1.171 1
1 1018 . 10 1 1 A 95 95 ILE CB C 95 38.071 39.705 -1.634 1
1 1022 . 10 1 1 A 95 95 ILE N N 95 121.876 122.764 -0.888 1
1 1023 . 10 1 1 A 96 96 PHE H H 96 8.400 8.666 -0.266 1
1 1024 . 10 1 1 A 96 96 PHE HA H 96 5.004 4.695 0.309 1
1 1029 . 10 1 1 A 96 96 PHE C C 96 174.005 174.400 -0.395 1
1 1030 . 10 1 1 A 96 96 PHE CA C 96 56.922 57.046 -0.124 1
1 1031 . 10 1 1 A 96 96 PHE CB C 96 44.006 40.563 3.443 1
1 1032 . 10 1 1 A 96 96 PHE N N 96 125.820 126.571 -0.751 1
1 1033 . 10 1 1 A 97 97 GLU H H 97 8.985 8.443 0.542 1
1 1034 . 10 1 1 A 97 97 GLU HA H 97 5.275 5.153 0.122 1
1 1038 . 10 1 1 A 97 97 GLU C C 97 175.596 174.811 0.785 1
1 1039 . 10 1 1 A 97 97 GLU CA C 97 55.070 54.528 0.542 1
1 1040 . 10 1 1 A 97 97 GLU CB C 97 33.628 30.579 3.049 1
1 1042 . 10 1 1 A 97 97 GLU N N 97 121.010 124.621 -3.611 1
1 1043 . 10 1 1 A 98 98 PHE H H 98 9.304 9.080 0.224 1
1 1044 . 10 1 1 A 98 98 PHE HA H 98 5.337 5.117 0.220 1
1 1048 . 10 1 1 A 98 98 PHE C C 98 174.650 175.762 -1.112 1
1 1049 . 10 1 1 A 98 98 PHE CA C 98 57.363 57.827 -0.464 1
1 1050 . 10 1 1 A 98 98 PHE CB C 98 41.936 40.294 1.642 1
1 1051 . 10 1 1 A 98 98 PHE N N 98 128.658 126.328 2.330 1
1 1052 . 10 1 1 A 99 99 GLU H H 99 8.721 8.959 -0.238 1
1 1053 . 10 1 1 A 99 99 GLU HA H 99 5.457 4.743 0.714 1
1 1058 . 10 1 1 A 99 99 GLU C C 99 176.368 176.610 -0.242 1
1 1059 . 10 1 1 A 99 99 GLU CA C 99 54.401 55.526 -1.125 1
1 1060 . 10 1 1 A 99 99 GLU CB C 99 33.068 31.422 1.646 1
1 1062 . 10 1 1 A 99 99 GLU N N 99 122.759 123.540 -0.781 1
1 1063 . 10 1 1 A 100 100 THR H H 100 8.588 10.034 -1.446 1
1 1064 . 10 1 1 A 100 100 THR HA H 100 4.603 4.439 0.164 1
1 1069 . 10 1 1 A 100 100 THR C C 100 177.144 176.562 0.582 1
1 1070 . 10 1 1 A 100 100 THR CA C 100 60.774 63.195 -2.421 1
1 1071 . 10 1 1 A 100 100 THR CB C 100 70.136 70.020 0.116 1
1 1073 . 10 1 1 A 100 100 THR N N 100 116.191 120.884 -4.693 1
1 1074 . 10 1 1 A 101 101 TRP H H 101 9.287 9.032 0.255 1
1 1075 . 10 1 1 A 101 101 TRP HA H 101 4.591 4.507 0.084 1
1 1080 . 10 1 1 A 101 101 TRP C C 101 176.457 176.438 0.019 1
1 1081 . 10 1 1 A 101 101 TRP CA C 101 60.045 58.868 1.177 1
1 1082 . 10 1 1 A 101 101 TRP CB C 101 28.578 28.288 0.290 1
1 1083 . 10 1 1 A 101 101 TRP N N 101 122.220 124.096 -1.876 1
1 1084 . 10 1 1 A 102 102 ASP H H 102 7.553 8.238 -0.685 1
1 1085 . 10 1 1 A 102 102 ASP HA H 102 4.129 4.428 -0.299 1
1 1088 . 10 1 1 A 102 102 ASP C C 102 176.714 176.341 0.373 1
1 1089 . 10 1 1 A 102 102 ASP CA C 102 52.775 53.373 -0.598 1
1 1090 . 10 1 1 A 102 102 ASP CB C 102 39.231 41.054 -1.823 1
1 1091 . 10 1 1 A 102 102 ASP N N 102 115.763 119.784 -4.021 1
1 1092 . 10 1 1 A 103 103 GLY H H 103 7.910 8.471 -0.561 1
1 1093 . 10 1 1 A 103 103 GLY HA2 H 103 4.216 3.945 0.271 1
1 1094 . 10 1 1 A 103 103 GLY HA3 H 103 3.686 3.980 -0.294 1
1 1095 . 10 1 1 A 103 103 GLY C C 103 174.566 174.389 0.177 1
1 1096 . 10 1 1 A 103 103 GLY CA C 103 45.179 46.199 -1.020 1
1 1097 . 10 1 1 A 103 103 GLY N N 103 108.311 108.984 -0.673 1
1 1098 . 10 1 1 A 104 104 THR H H 104 7.691 7.363 0.328 1
1 1099 . 10 1 1 A 104 104 THR HA H 104 4.031 4.641 -0.610 1
1 1104 . 10 1 1 A 104 104 THR C C 104 173.405 174.047 -0.642 1
1 1105 . 10 1 1 A 104 104 THR CA C 104 64.307 61.606 2.701 1
1 1106 . 10 1 1 A 104 104 THR CB C 104 68.354 70.929 -2.575 1
1 1108 . 10 1 1 A 104 104 THR N N 104 119.913 115.486 4.427 1
1 1109 . 10 1 1 A 105 105 LYS H H 105 8.297 8.764 -0.467 1
1 1110 . 10 1 1 A 105 105 LYS HA H 105 5.457 4.813 0.644 1
1 1116 . 10 1 1 A 105 105 LYS C C 105 177.055 175.501 1.554 1
1 1117 . 10 1 1 A 105 105 LYS CA C 105 54.401 55.768 -1.367 1
1 1118 . 10 1 1 A 105 105 LYS CB C 105 34.230 33.864 0.366 1
1 1122 . 10 1 1 A 105 105 LYS N N 105 125.597 124.045 1.552 1
1 1123 . 10 1 1 A 106 106 ILE H H 106 9.238 9.006 0.232 1
1 1124 . 10 1 1 A 106 106 ILE HA H 106 4.289 4.876 -0.587 1
1 1133 . 10 1 1 A 106 106 ILE C C 106 174.221 174.345 -0.124 1
1 1134 . 10 1 1 A 106 106 ILE CA C 106 60.631 59.896 0.735 1
1 1135 . 10 1 1 A 106 106 ILE CB C 106 41.927 40.060 1.867 1
1 1139 . 10 1 1 A 106 106 ILE N N 106 124.499 124.550 -0.051 1
1 1140 . 10 1 1 A 107 107 LYS H H 107 8.650 9.110 -0.460 1
1 1141 . 10 1 1 A 107 107 LYS HA H 107 5.608 5.035 0.573 1
1 1147 . 10 1 1 A 107 107 LYS C C 107 175.681 174.980 0.701 1
1 1148 . 10 1 1 A 107 107 LYS CA C 107 55.248 54.991 0.257 1
1 1149 . 10 1 1 A 107 107 LYS CB C 107 33.618 34.293 -0.675 1
1 1153 . 10 1 1 A 107 107 LYS N N 107 130.844 128.933 1.911 1
1 1154 . 10 1 1 A 108 108 ILE H H 108 9.448 8.462 0.986 1
1 1155 . 10 1 1 A 108 108 ILE HA H 108 4.741 4.868 -0.127 1
1 1164 . 10 1 1 A 108 108 ILE C C 108 172.670 173.950 -1.280 1
1 1165 . 10 1 1 A 108 108 ILE CA C 108 59.157 59.439 -0.282 1
1 1166 . 10 1 1 A 108 108 ILE CB C 108 42.241 42.262 -0.021 1
1 1170 . 10 1 1 A 108 108 ILE N N 108 125.160 127.553 -2.393 1
1 1171 . 10 1 1 A 109 109 SER H H 109 8.490 9.045 -0.555 1
1 1172 . 10 1 1 A 109 109 SER HA H 109 4.437 4.705 -0.268 1
1 1175 . 10 1 1 A 109 109 SER C C 109 176.536 176.230 0.306 1
1 1176 . 10 1 1 A 109 109 SER CA C 109 58.850 58.410 0.440 1
1 1177 . 10 1 1 A 109 109 SER CB C 109 63.010 63.684 -0.674 1
1 1178 . 10 1 1 A 109 109 SER N N 109 122.750 124.244 -1.494 1
1 1179 . 10 1 1 A 110 110 GLY H H 110 9.292 8.642 0.650 1
1 1180 . 10 1 1 A 110 110 GLY HA2 H 110 5.193 4.036 1.157 1
1 1181 . 10 1 1 A 110 110 GLY HA3 H 110 3.755 4.145 -0.390 1
1 1182 . 10 1 1 A 110 110 GLY C C 110 176.964 175.183 1.781 1
1 1183 . 10 1 1 A 110 110 GLY CA C 110 48.168 46.735 1.433 1
1 1184 . 10 1 1 A 110 110 GLY N N 110 116.628 113.076 3.552 1
1 1185 . 10 1 1 A 111 111 GLU H H 111 8.576 8.917 -0.341 1
1 1186 . 10 1 1 A 111 111 GLU HA H 111 4.080 4.092 -0.012 1
1 1191 . 10 1 1 A 111 111 GLU C C 111 178.867 178.698 0.169 1
1 1192 . 10 1 1 A 111 111 GLU CA C 111 59.150 58.672 0.478 1
1 1193 . 10 1 1 A 111 111 GLU CB C 111 28.831 28.274 0.557 1
1 1195 . 10 1 1 A 111 111 GLU N N 111 120.564 118.511 2.053 1
1 1196 . 10 1 1 A 112 112 LYS H H 112 7.605 7.574 0.031 1
1 1197 . 10 1 1 A 112 112 LYS HA H 112 4.229 4.046 0.183 1
1 1202 . 10 1 1 A 112 112 LYS C C 112 176.710 178.064 -1.354 1
1 1203 . 10 1 1 A 112 112 LYS CA C 112 57.083 58.990 -1.907 1
1 1204 . 10 1 1 A 112 112 LYS CB C 112 32.183 32.774 -0.591 1
1 1208 . 10 1 1 A 112 112 LYS N N 112 116.628 118.969 -2.341 1
1 1209 . 10 1 1 A 113 113 LEU H H 113 7.784 7.737 0.047 1
1 1210 . 10 1 1 A 113 113 LEU HA H 113 4.387 4.312 0.075 1
1 1220 . 10 1 1 A 113 113 LEU C C 113 176.195 176.504 -0.309 1
1 1221 . 10 1 1 A 113 113 LEU CA C 113 52.617 54.105 -1.488 1
1 1222 . 10 1 1 A 113 113 LEU CB C 113 42.820 41.022 1.798 1
1 1226 . 10 1 1 A 113 113 LEU N N 113 114.219 114.501 -0.282 1
1 1227 . 10 1 1 A 114 114 VAL H H 114 7.032 7.501 -0.469 1
1 1228 . 10 1 1 A 114 114 VAL HA H 114 3.723 3.807 -0.084 1
1 1236 . 10 1 1 A 114 114 VAL C C 114 175.430 177.193 -1.763 1
1 1237 . 10 1 1 A 114 114 VAL CA C 114 65.537 63.983 1.554 1
1 1238 . 10 1 1 A 114 114 VAL CB C 114 32.115 31.194 0.921 1
1 1241 . 10 1 1 A 114 114 VAL N N 114 121.773 121.142 0.631 1
1 1242 . 10 1 1 A 115 115 GLY H H 115 8.678 8.715 -0.037 1
1 1243 . 10 1 1 A 115 115 GLY HA2 H 115 4.313 3.929 0.384 1
1 1244 . 10 1 1 A 115 115 GLY HA3 H 115 3.846 3.933 -0.087 1
1 1245 . 10 1 1 A 115 115 GLY C C 115 172.462 173.567 -1.105 1
1 1246 . 10 1 1 A 115 115 GLY CA C 115 43.743 45.535 -1.792 1
1 1247 . 10 1 1 A 115 115 GLY N N 115 117.503 116.815 0.688 1
1 1248 . 10 1 1 A 116 116 ARG H H 116 8.701 8.276 0.425 1
1 1249 . 10 1 1 A 116 116 ARG HA H 116 3.926 4.605 -0.679 1
1 1254 . 10 1 1 A 116 116 ARG CA C 116 56.470 53.457 3.013 1
1 1255 . 10 1 1 A 116 116 ARG CB C 116 29.585 29.465 0.120 1
1 1257 . 10 1 1 A 116 116 ARG N N 116 123.504 120.793 2.711 1
1 1258 . 10 1 1 A 117 117 PRO HA H 117 4.242 4.180 0.062 1
1 1264 . 10 1 1 A 117 117 PRO C C 117 178.947 178.160 0.787 1
1 1265 . 10 1 1 A 117 117 PRO CA C 117 65.684 64.723 0.961 1
1 1266 . 10 1 1 A 117 117 PRO CB C 117 30.949 32.100 -1.151 1
1 1269 . 10 1 1 A 118 118 GLU H H 118 10.821 8.921 1.900 1
1 1270 . 10 1 1 A 118 118 GLU HA H 118 4.197 4.099 0.098 1
1 1271 . 10 1 1 A 118 118 GLU C C 118 176.627 178.470 -1.843 1
1 1272 . 10 1 1 A 118 118 GLU CA C 118 58.045 59.174 -1.129 1
1 1273 . 10 1 1 A 118 118 GLU CB C 118 27.101 29.184 -2.083 1
1 1274 . 10 1 1 A 118 118 GLU N N 118 119.242 116.646 2.596 1
1 1275 . 10 1 1 A 119 119 MET H H 119 7.226 7.978 -0.752 1
1 1276 . 10 1 1 A 119 119 MET HA H 119 4.591 4.008 0.583 1
1 1279 . 10 1 1 A 119 119 MET C C 119 180.024 178.011 2.013 1
1 1280 . 10 1 1 A 119 119 MET CA C 119 54.695 58.920 -4.225 1
1 1281 . 10 1 1 A 119 119 MET CB C 119 31.012 32.200 -1.188 1
1 1283 . 10 1 1 A 119 119 MET N N 119 119.475 120.041 -0.566 1
1 1284 . 10 1 1 A 120 120 ARG H H 120 7.877 7.931 -0.054 1
1 1285 . 10 1 1 A 120 120 ARG HA H 120 3.988 3.994 -0.006 1
1 1292 . 10 1 1 A 120 120 ARG C C 120 177.705 178.804 -1.099 1
1 1293 . 10 1 1 A 120 120 ARG CA C 120 60.773 58.782 1.991 1
1 1294 . 10 1 1 A 120 120 ARG CB C 120 31.159 29.653 1.506 1
1 1295 . 10 1 1 A 120 120 ARG N N 120 122.099 119.917 2.182 1
1 1296 . 10 1 1 A 121 121 LEU H H 121 6.732 7.926 -1.194 1
1 1297 . 10 1 1 A 121 121 LEU HA H 121 4.170 4.023 0.147 1
1 1307 . 10 1 1 A 121 121 LEU C C 121 176.220 178.195 -1.975 1
1 1308 . 10 1 1 A 121 121 LEU CA C 121 57.370 58.034 -0.664 1
1 1309 . 10 1 1 A 121 121 LEU CB C 121 42.945 41.613 1.332 1
1 1312 . 10 1 1 A 121 121 LEU N N 121 114.436 119.439 -5.003 1
1 1313 . 10 1 1 A 122 122 LYS H H 122 7.555 9.288 -1.733 1
1 1314 . 10 1 1 A 122 122 LYS HA H 122 4.338 4.354 -0.016 1
1 1321 . 10 1 1 A 122 122 LYS C C 122 176.969 176.393 0.576 1
1 1322 . 10 1 1 A 122 122 LYS CA C 122 55.621 56.010 -0.389 1
1 1323 . 10 1 1 A 122 122 LYS CB C 122 32.414 31.831 0.583 1
1 1327 . 10 1 1 A 122 122 LYS N N 122 115.754 115.163 0.591 1
1 1328 . 10 1 1 A 123 123 LYS H H 123 7.688 7.400 0.288 1
1 1329 . 10 1 1 A 123 123 LYS HA H 123 4.535 4.451 0.084 1
1 1330 . 10 1 1 A 123 123 LYS CA C 123 58.461 57.674 0.787 1
1 1331 . 10 1 1 A 123 123 LYS CB C 123 33.138 32.584 0.554 1
1 1332 . 10 1 1 A 123 123 LYS N N 123 120.843 121.821 -0.978 1
1 1333 . 10 1 1 A 126 126 ARG HA H 126 4.347 3.582 0.765 1
1 1338 . 10 1 1 A 126 126 ARG C C 126 174.573 176.493 -1.920 1
1 1339 . 10 1 1 A 126 126 ARG CA C 126 55.998 59.289 -3.291 1
1 1340 . 10 1 1 A 126 126 ARG CB C 126 31.569 29.934 1.635 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 1.276 1
2 1 1 1 "RMS(OBS, PRED)" CA 107 1.419 1
3 1 1 1 "RMS(OBS, PRED)" CB 95 1.474 1
4 1 1 1 "RMS(OBS, PRED)" H 102 0.811 1
5 1 1 1 "RMS(OBS, PRED)" HA 118 0.464 1
6 1 1 1 "RMS(OBS, PRED)" N 102 3.295 1
7 1 2 1 "RMS(OBS, PRED)" C 102 1.256 1
8 1 2 1 "RMS(OBS, PRED)" CA 107 1.413 1
9 1 2 1 "RMS(OBS, PRED)" CB 95 1.433 1
10 1 2 1 "RMS(OBS, PRED)" H 102 0.821 1
11 1 2 1 "RMS(OBS, PRED)" HA 118 0.445 1
12 1 2 1 "RMS(OBS, PRED)" N 102 3.244 1
13 1 3 1 "RMS(OBS, PRED)" C 102 1.215 1
14 1 3 1 "RMS(OBS, PRED)" CA 107 1.495 1
15 1 3 1 "RMS(OBS, PRED)" CB 95 1.483 1
16 1 3 1 "RMS(OBS, PRED)" H 102 0.777 1
17 1 3 1 "RMS(OBS, PRED)" HA 118 0.447 1
18 1 3 1 "RMS(OBS, PRED)" N 102 3.489 1
19 1 4 1 "RMS(OBS, PRED)" C 102 1.316 1
20 1 4 1 "RMS(OBS, PRED)" CA 107 1.465 1
21 1 4 1 "RMS(OBS, PRED)" CB 95 1.347 1
22 1 4 1 "RMS(OBS, PRED)" H 102 0.737 1
23 1 4 1 "RMS(OBS, PRED)" HA 118 0.425 1
24 1 4 1 "RMS(OBS, PRED)" N 102 3.173 1
25 1 5 1 "RMS(OBS, PRED)" C 102 1.258 1
26 1 5 1 "RMS(OBS, PRED)" CA 107 1.442 1
27 1 5 1 "RMS(OBS, PRED)" CB 95 1.484 1
28 1 5 1 "RMS(OBS, PRED)" H 102 0.760 1
29 1 5 1 "RMS(OBS, PRED)" HA 118 0.429 1
30 1 5 1 "RMS(OBS, PRED)" N 102 3.284 1
31 1 6 1 "RMS(OBS, PRED)" C 102 1.303 1
32 1 6 1 "RMS(OBS, PRED)" CA 107 1.470 1
33 1 6 1 "RMS(OBS, PRED)" CB 95 1.375 1
34 1 6 1 "RMS(OBS, PRED)" H 102 0.730 1
35 1 6 1 "RMS(OBS, PRED)" HA 118 0.446 1
36 1 6 1 "RMS(OBS, PRED)" N 102 3.123 1
37 1 7 1 "RMS(OBS, PRED)" C 102 1.272 1
38 1 7 1 "RMS(OBS, PRED)" CA 107 1.525 1
39 1 7 1 "RMS(OBS, PRED)" CB 95 1.369 1
40 1 7 1 "RMS(OBS, PRED)" H 102 0.795 1
41 1 7 1 "RMS(OBS, PRED)" HA 118 0.441 1
42 1 7 1 "RMS(OBS, PRED)" N 102 3.349 1
43 1 8 1 "RMS(OBS, PRED)" C 102 1.262 1
44 1 8 1 "RMS(OBS, PRED)" CA 107 1.436 1
45 1 8 1 "RMS(OBS, PRED)" CB 95 1.466 1
46 1 8 1 "RMS(OBS, PRED)" H 102 0.801 1
47 1 8 1 "RMS(OBS, PRED)" HA 118 0.426 1
48 1 8 1 "RMS(OBS, PRED)" N 102 3.215 1
49 1 9 1 "RMS(OBS, PRED)" C 102 1.271 1
50 1 9 1 "RMS(OBS, PRED)" CA 107 1.493 1
51 1 9 1 "RMS(OBS, PRED)" CB 95 1.436 1
52 1 9 1 "RMS(OBS, PRED)" H 102 0.777 1
53 1 9 1 "RMS(OBS, PRED)" HA 118 0.454 1
54 1 9 1 "RMS(OBS, PRED)" N 102 3.302 1
55 1 10 1 "RMS(OBS, PRED)" C 102 1.248 1
56 1 10 1 "RMS(OBS, PRED)" CA 107 1.429 1
57 1 10 1 "RMS(OBS, PRED)" CB 95 1.414 1
58 1 10 1 "RMS(OBS, PRED)" H 102 0.826 1
59 1 10 1 "RMS(OBS, PRED)" HA 118 0.435 1
60 1 10 1 "RMS(OBS, PRED)" N 102 3.170 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
1 128 . 1 1 A 18 18 GLY H H 18 8.343 8.082 0.261 2
1 129 . 1 1 A 18 18 GLY HA2 H 18 3.894 3.939 -0.045 2
1 130 . 1 1 A 18 18 GLY C C 18 177.743 175.123 2.620 2
1 131 . 1 1 A 18 18 GLY CA C 18 45.497 45.346 0.151 2
1 132 . 1 1 A 18 18 GLY N N 18 109.925 108.661 1.264 2
1 133 . 1 1 A 19 19 SER H H 19 8.005 8.654 -0.649 2
1 134 . 1 1 A 19 19 SER HA H 19 4.329 4.233 0.096 2
1 136 . 1 1 A 19 19 SER C C 19 175.168 176.188 -1.020 2
1 137 . 1 1 A 19 19 SER CA C 19 58.852 60.869 -2.017 2
1 138 . 1 1 A 19 19 SER CB C 19 63.604 62.878 0.726 2
1 139 . 1 1 A 19 19 SER N N 19 115.090 117.867 -2.777 2
1 140 . 1 1 A 20 20 TYR H H 20 8.040 7.658 0.382 2
1 141 . 1 1 A 20 20 TYR HA H 20 4.439 4.303 0.136 2
1 146 . 1 1 A 20 20 TYR C C 20 176.111 178.527 -2.416 2
1 147 . 1 1 A 20 20 TYR CA C 20 57.966 61.603 -3.638 2
1 148 . 1 1 A 20 20 TYR CB C 20 37.472 38.419 -0.947 2
1 149 . 1 1 A 20 20 TYR N N 20 118.675 120.132 -1.457 2
1 150 . 1 1 A 21 21 GLN H H 21 7.909 8.436 -0.527 2
1 151 . 1 1 A 21 21 GLN HA H 21 3.903 4.163 -0.260 2
1 155 . 1 1 A 21 21 GLN C C 21 178.003 177.534 0.469 2
1 156 . 1 1 A 21 21 GLN CA C 21 58.523 58.654 -0.130 2
1 157 . 1 1 A 21 21 GLN CB C 21 28.438 28.434 0.004 2
1 159 . 1 1 A 21 21 GLN N N 21 117.056 118.337 -1.281 2
1 160 . 1 1 A 22 22 GLU H H 22 8.965 8.962 0.003 2
1 161 . 1 1 A 22 22 GLU HA H 22 4.267 4.370 -0.103 2
1 165 . 1 1 A 22 22 GLU C C 22 176.451 178.036 -1.585 2
1 166 . 1 1 A 22 22 GLU CA C 22 58.273 58.369 -0.096 2
1 167 . 1 1 A 22 22 GLU CB C 22 29.412 30.305 -0.893 2
1 169 . 1 1 A 22 22 GLU N N 22 117.289 119.055 -1.766 2
1 170 . 1 1 A 23 23 ILE H H 23 7.596 7.916 -0.320 2
1 171 . 1 1 A 23 23 ILE HA H 23 4.161 4.425 -0.264 2
1 180 . 1 1 A 23 23 ILE C C 23 176.195 175.812 0.383 2
1 181 . 1 1 A 23 23 ILE CA C 23 58.120 60.810 -2.690 2
1 182 . 1 1 A 23 23 ILE CB C 23 38.461 37.596 0.865 2
1 186 . 1 1 A 23 23 ILE N N 23 114.005 117.226 -3.221 2
1 187 . 1 1 A 24 24 ILE H H 24 7.178 7.501 -0.323 2
1 188 . 1 1 A 24 24 ILE HA H 24 3.740 4.012 -0.272 2
1 197 . 1 1 A 24 24 ILE C C 24 177.831 176.854 0.977 2
1 198 . 1 1 A 24 24 ILE CA C 24 63.318 62.261 1.057 2
1 199 . 1 1 A 24 24 ILE CB C 24 36.590 38.286 -1.696 2
1 203 . 1 1 A 24 24 ILE N N 24 122.099 125.397 -3.298 2
1 204 . 1 1 A 25 25 GLY H H 25 8.618 8.980 -0.362 2
1 205 . 1 1 A 25 25 GLY HA2 H 25 4.390 3.976 0.414 2
1 206 . 1 1 A 25 25 GLY HA3 H 25 4.168 4.006 0.162 2
1 207 . 1 1 A 25 25 GLY C C 25 175.210 176.089 -0.879 2
1 208 . 1 1 A 25 25 GLY CA C 25 45.798 45.164 0.634 2
1 209 . 1 1 A 25 25 GLY N N 25 115.531 118.153 -2.621 2
1 210 . 1 1 A 26 26 ARG H H 26 8.277 8.213 0.064 2
1 211 . 1 1 A 26 26 ARG HA H 26 4.477 4.531 -0.054 2
1 218 . 1 1 A 26 26 ARG C C 26 175.944 177.725 -1.781 2
1 219 . 1 1 A 26 26 ARG CA C 26 54.408 56.991 -2.583 2
1 220 . 1 1 A 26 26 ARG CB C 26 29.501 30.128 -0.627 2
1 223 . 1 1 A 26 26 ARG N N 26 119.689 121.331 -1.642 2
1 224 . 1 1 A 27 27 THR H H 27 7.923 8.904 -0.981 2
1 225 . 1 1 A 27 27 THR HA H 27 3.792 4.021 -0.229 2
1 230 . 1 1 A 27 27 THR C C 27 175.251 176.518 -1.267 2
1 231 . 1 1 A 27 27 THR CA C 27 64.791 65.258 -0.468 2
1 232 . 1 1 A 27 27 THR CB C 27 68.354 68.040 0.313 2
1 234 . 1 1 A 27 27 THR N N 27 109.195 113.142 -3.947 2
1 235 . 1 1 A 28 28 TRP H H 28 7.389 8.108 -0.719 2
1 236 . 1 1 A 28 28 TRP HA H 28 4.441 4.335 0.106 2
1 240 . 1 1 A 28 28 TRP C C 28 178.519 178.454 0.065 2
1 241 . 1 1 A 28 28 TRP CA C 28 57.789 61.345 -3.556 2
1 242 . 1 1 A 28 28 TRP CB C 28 27.387 29.925 -2.538 2
1 243 . 1 1 A 28 28 TRP N N 28 120.127 124.923 -4.796 2
1 244 . 1 1 A 29 29 ILE H H 29 6.832 8.182 -1.351 2
1 245 . 1 1 A 29 29 ILE HA H 29 3.612 3.418 0.194 2
1 254 . 1 1 A 29 29 ILE C C 29 176.023 176.871 -0.848 2
1 255 . 1 1 A 29 29 ILE CA C 29 63.773 63.386 0.387 2
1 256 . 1 1 A 29 29 ILE CB C 29 37.567 37.306 0.261 2
1 260 . 1 1 A 29 29 ILE N N 29 119.913 117.698 2.215 2
1 261 . 1 1 A 30 30 PHE H H 30 7.329 7.753 -0.424 2
1 262 . 1 1 A 30 30 PHE HA H 30 3.912 4.435 -0.523 2
1 268 . 1 1 A 30 30 PHE C C 30 177.101 177.819 -0.718 2
1 269 . 1 1 A 30 30 PHE CA C 30 59.436 60.717 -1.281 2
1 270 . 1 1 A 30 30 PHE CB C 30 38.734 39.831 -1.097 2
1 271 . 1 1 A 30 30 PHE N N 30 116.638 120.300 -3.662 2
1 272 . 1 1 A 31 31 ARG H H 31 7.399 8.538 -1.139 2
1 273 . 1 1 A 31 31 ARG HA H 31 4.287 4.358 -0.071 2
1 278 . 1 1 A 31 31 ARG C C 31 176.539 178.206 -1.667 2
1 279 . 1 1 A 31 31 ARG CA C 31 58.852 58.955 -0.103 2
1 280 . 1 1 A 31 31 ARG CB C 31 29.461 30.559 -1.098 2
1 281 . 1 1 A 31 31 ARG N N 31 122.099 120.406 1.693 2
1 282 . 1 1 A 32 32 GLY H H 32 8.346 8.095 0.251 2
1 283 . 1 1 A 32 32 GLY HA2 H 32 4.284 3.398 0.886 2
1 284 . 1 1 A 32 32 GLY HA3 H 32 3.629 3.759 -0.130 2
1 285 . 1 1 A 32 32 GLY C C 32 173.791 173.881 -0.090 2
1 286 . 1 1 A 32 32 GLY CA C 32 45.793 46.113 -0.320 2
1 287 . 1 1 A 32 32 GLY N N 32 109.964 106.681 3.283 2
1 288 . 1 1 A 33 33 ALA H H 33 7.510 8.451 -0.941 2
1 289 . 1 1 A 33 33 ALA HA H 33 4.193 4.437 -0.244 2
1 293 . 1 1 A 33 33 ALA C C 33 176.672 176.637 0.035 2
1 294 . 1 1 A 33 33 ALA CA C 33 54.401 52.225 2.176 2
1 295 . 1 1 A 33 33 ALA CB C 33 19.368 21.446 -2.078 2
1 296 . 1 1 A 33 33 ALA N N 33 122.266 120.375 1.891 2
1 297 . 1 1 A 34 34 HIS H H 34 8.759 7.788 0.971 2
1 298 . 1 1 A 34 34 HIS HA H 34 4.529 4.904 -0.375 2
1 302 . 1 1 A 34 34 HIS C C 34 175.767 174.664 1.103 2
1 303 . 1 1 A 34 34 HIS CA C 34 54.997 54.921 0.076 2
1 304 . 1 1 A 34 34 HIS CB C 34 31.089 30.892 0.197 2
1 305 . 1 1 A 34 34 HIS N N 34 119.038 117.830 1.208 2
1 306 . 1 1 A 35 35 ARG H H 35 8.142 8.542 -0.400 2
1 307 . 1 1 A 35 35 ARG HA H 35 4.700 4.605 0.095 2
1 314 . 1 1 A 35 35 ARG C C 35 177.572 176.479 1.093 2
1 315 . 1 1 A 35 35 ARG CA C 35 54.103 55.805 -1.702 2
1 316 . 1 1 A 35 35 ARG CB C 35 29.112 32.122 -3.010 2
1 319 . 1 1 A 35 35 ARG N N 35 127.785 125.822 1.963 2
1 320 . 1 1 A 36 36 GLY H H 36 9.352 7.918 1.434 2
1 321 . 1 1 A 36 36 GLY HA2 H 36 4.291 3.942 0.349 2
1 322 . 1 1 A 36 36 GLY HA3 H 36 3.247 4.025 -0.778 2
1 323 . 1 1 A 36 36 GLY C C 36 173.876 173.269 0.607 2
1 324 . 1 1 A 36 36 GLY CA C 36 45.644 45.486 0.158 2
1 325 . 1 1 A 36 36 GLY N N 36 109.626 108.283 1.343 2
1 326 . 1 1 A 37 37 ARG H H 37 9.384 8.471 0.913 2
1 327 . 1 1 A 37 37 ARG HA H 37 4.688 4.351 0.337 2
1 333 . 1 1 A 37 37 ARG C C 37 175.081 175.142 -0.061 2
1 334 . 1 1 A 37 37 ARG CA C 37 55.742 56.580 -0.838 2
1 335 . 1 1 A 37 37 ARG CB C 37 28.138 30.685 -2.547 2
1 338 . 1 1 A 37 37 ARG N N 37 127.132 122.989 4.143 2
1 339 . 1 1 A 38 38 VAL H H 38 7.605 6.546 1.058 2
1 340 . 1 1 A 38 38 VAL HA H 38 4.591 4.006 0.585 2
1 348 . 1 1 A 38 38 VAL C C 38 174.391 174.381 0.010 2
1 349 . 1 1 A 38 38 VAL CA C 38 60.092 60.380 -0.288 2
1 350 . 1 1 A 38 38 VAL CB C 38 33.328 32.789 0.539 2
1 353 . 1 1 A 38 38 VAL N N 38 126.253 125.653 0.600 2
1 354 . 1 1 A 39 39 ASN H H 39 9.007 7.907 1.099 2
1 355 . 1 1 A 39 39 ASN HA H 39 4.736 4.840 -0.104 2
1 358 . 1 1 A 39 39 ASN C C 39 174.562 175.053 -0.490 2
1 359 . 1 1 A 39 39 ASN CA C 39 51.577 52.236 -0.659 2
1 360 . 1 1 A 39 39 ASN CB C 39 40.749 41.769 -1.020 2
1 361 . 1 1 A 39 39 ASN N N 39 123.411 122.567 0.844 2
1 362 . 1 1 A 40 40 LYS H H 40 8.510 8.722 -0.212 2
1 363 . 1 1 A 40 40 LYS HA H 40 3.909 3.878 0.031 2
1 370 . 1 1 A 40 40 LYS C C 40 176.629 178.249 -1.620 2
1 371 . 1 1 A 40 40 LYS CA C 40 59.141 60.330 -1.189 2
1 372 . 1 1 A 40 40 LYS CB C 40 32.301 32.355 -0.054 2
1 376 . 1 1 A 40 40 LYS N N 40 116.303 124.888 -8.585 2
1 377 . 1 1 A 41 41 LYS H H 41 7.907 8.440 -0.533 2
1 378 . 1 1 A 41 41 LYS HA H 41 4.172 3.757 0.415 2
1 384 . 1 1 A 41 41 LYS C C 41 177.229 175.757 1.472 2
1 385 . 1 1 A 41 41 LYS CA C 41 57.392 57.794 -0.402 2
1 386 . 1 1 A 41 41 LYS CB C 41 32.667 30.821 1.846 2
1 390 . 1 1 A 41 41 LYS N N 41 117.066 117.578 -0.512 2
1 391 . 1 1 A 42 42 ASN H H 42 7.962 8.582 -0.620 2
1 392 . 1 1 A 42 42 ASN HA H 42 4.392 4.609 -0.217 2
1 395 . 1 1 A 42 42 ASN C C 42 179.805 175.986 3.819 2
1 396 . 1 1 A 42 42 ASN CA C 42 52.335 52.733 -0.398 2
1 397 . 1 1 A 42 42 ASN CB C 42 39.348 39.183 0.165 2
1 398 . 1 1 A 42 42 ASN N N 42 114.442 116.747 -2.305 2
1 399 . 1 1 A 43 43 ILE H H 43 7.806 8.484 -0.678 2
1 400 . 1 1 A 43 43 ILE HA H 43 3.747 3.894 -0.147 2
1 409 . 1 1 A 43 43 ILE C C 43 174.219 177.293 -3.074 2
1 410 . 1 1 A 43 43 ILE CA C 43 64.505 63.469 1.036 2
1 411 . 1 1 A 43 43 ILE CB C 43 36.595 38.296 -1.701 2
1 415 . 1 1 A 43 43 ILE N N 43 121.001 120.608 0.393 2
1 416 . 1 1 A 44 44 VAL H H 44 6.154 7.741 -1.587 2
1 417 . 1 1 A 44 44 VAL HA H 44 3.497 3.900 -0.403 2
1 425 . 1 1 A 44 44 VAL C C 44 176.282 176.272 0.010 2
1 426 . 1 1 A 44 44 VAL CA C 44 63.606 63.196 0.410 2
1 427 . 1 1 A 44 44 VAL CB C 44 30.614 31.833 -1.219 2
1 430 . 1 1 A 44 44 VAL N N 44 110.500 119.606 -9.106 2
1 431 . 1 1 A 45 45 TRP H H 45 7.419 8.157 -0.738 2
1 432 . 1 1 A 45 45 TRP HA H 45 4.716 4.843 -0.127 2
1 438 . 1 1 A 45 45 TRP C C 45 175.422 175.987 -0.565 2
1 439 . 1 1 A 45 45 TRP CA C 45 56.188 57.499 -1.311 2
1 440 . 1 1 A 45 45 TRP CB C 45 31.245 30.881 0.364 2
1 441 . 1 1 A 45 45 TRP N N 45 118.601 121.234 -2.633 2
1 442 . 1 1 A 46 46 HIS H H 46 7.582 7.800 -0.218 2
1 443 . 1 1 A 46 46 HIS HA H 46 4.227 4.775 -0.548 2
1 448 . 1 1 A 46 46 HIS C C 46 177.485 174.606 2.879 2
1 449 . 1 1 A 46 46 HIS CA C 46 56.799 55.562 1.237 2
1 450 . 1 1 A 46 46 HIS CB C 46 32.017 31.803 0.214 2
1 451 . 1 1 A 46 46 HIS N N 46 122.648 118.093 4.555 2
1 452 . 1 1 A 47 47 GLU H H 47 7.948 8.322 -0.373 2
1 453 . 1 1 A 47 47 GLU HA H 47 4.098 4.346 -0.248 2
1 457 . 1 1 A 47 47 GLU C C 47 175.596 176.023 -0.427 2
1 458 . 1 1 A 47 47 GLU CA C 47 56.482 56.228 0.254 2
1 459 . 1 1 A 47 47 GLU CB C 47 31.839 29.888 1.951 2
1 461 . 1 1 A 47 47 GLU N N 47 120.485 121.574 -1.089 2
1 462 . 1 1 A 48 48 LEU H H 48 9.304 8.784 0.520 2
1 463 . 1 1 A 48 48 LEU HA H 48 4.218 4.409 -0.191 2
1 472 . 1 1 A 48 48 LEU C C 48 177.743 176.339 1.404 2
1 473 . 1 1 A 48 48 LEU CA C 48 55.043 54.870 0.173 2
1 474 . 1 1 A 48 48 LEU CB C 48 41.948 41.145 0.803 2
1 477 . 1 1 A 48 48 LEU N N 48 128.658 126.356 2.302 2
1 478 . 1 1 A 49 49 ILE H H 49 8.028 8.831 -0.803 2
1 479 . 1 1 A 49 49 ILE HA H 49 3.279 4.583 -1.304 2
1 488 . 1 1 A 49 49 ILE C C 49 174.821 176.954 -2.133 2
1 489 . 1 1 A 49 49 ILE CA C 49 63.901 61.529 2.373 2
1 490 . 1 1 A 49 49 ILE CB C 49 37.775 40.124 -2.349 2
1 494 . 1 1 A 49 49 ILE N N 49 120.341 124.218 -3.877 2
1 495 . 1 1 A 50 50 GLY H H 50 9.038 7.699 1.339 2
1 496 . 1 1 A 50 50 GLY HA2 H 50 4.717 4.235 0.482 2
1 497 . 1 1 A 50 50 GLY HA3 H 50 3.491 4.332 -0.841 2
1 498 . 1 1 A 50 50 GLY C C 50 175.084 173.846 1.238 2
1 499 . 1 1 A 50 50 GLY CA C 50 44.599 45.517 -0.918 2
1 500 . 1 1 A 50 50 GLY N N 50 110.284 109.450 0.834 2
1 501 . 1 1 A 51 51 LEU H H 51 8.400 7.117 1.283 2
1 502 . 1 1 A 51 51 LEU HA H 51 4.723 3.922 0.801 2
1 512 . 1 1 A 51 51 LEU C C 51 177.147 175.459 1.688 2
1 513 . 1 1 A 51 51 LEU CA C 51 54.350 55.256 -0.906 2
1 514 . 1 1 A 51 51 LEU CB C 51 42.985 43.087 -0.102 2
1 518 . 1 1 A 51 51 LEU N N 51 120.471 122.308 -1.837 2
1 519 . 1 1 A 52 52 LYS H H 52 7.505 8.348 -0.843 2
1 520 . 1 1 A 52 52 LYS HA H 52 4.250 4.162 0.088 2
1 527 . 1 1 A 52 52 LYS C C 52 174.995 175.140 -0.145 2
1 528 . 1 1 A 52 52 LYS CA C 52 55.589 55.480 0.109 2
1 529 . 1 1 A 52 52 LYS CB C 52 33.025 33.158 -0.133 2
1 533 . 1 1 A 52 52 LYS N N 52 122.406 125.202 -2.796 2
1 534 . 1 1 A 53 53 VAL H H 53 9.075 8.194 0.881 2
1 535 . 1 1 A 53 53 VAL HA H 53 5.071 4.985 0.086 2
1 543 . 1 1 A 53 53 VAL C C 53 171.170 173.626 -2.456 2
1 544 . 1 1 A 53 53 VAL CA C 53 58.523 59.107 -0.584 2
1 545 . 1 1 A 53 53 VAL CB C 53 35.698 35.339 0.359 2
1 548 . 1 1 A 53 53 VAL N N 53 124.509 124.320 0.189 2
1 549 . 1 1 A 54 54 ARG H H 54 8.148 8.351 -0.203 2
1 550 . 1 1 A 54 54 ARG HA H 54 5.329 4.941 0.388 2
1 557 . 1 1 A 54 54 ARG C C 54 176.113 174.403 1.710 2
1 558 . 1 1 A 54 54 ARG CA C 54 53.817 54.061 -0.244 2
1 559 . 1 1 A 54 54 ARG CB C 54 34.511 33.764 0.747 2
1 562 . 1 1 A 54 54 ARG N N 54 123.625 121.754 1.870 2
1 563 . 1 1 A 55 55 VAL H H 55 8.659 9.478 -0.819 2
1 564 . 1 1 A 55 55 VAL HA H 55 4.085 4.037 0.048 2
1 572 . 1 1 A 55 55 VAL C C 55 176.282 175.402 0.880 2
1 573 . 1 1 A 55 55 VAL CA C 55 62.814 62.447 0.367 2
1 574 . 1 1 A 55 55 VAL CB C 55 30.628 31.141 -0.513 2
1 577 . 1 1 A 55 55 VAL N N 55 125.383 123.198 2.185 2
1 578 . 1 1 A 56 56 VAL H H 56 8.057 8.452 -0.395 2
1 579 . 1 1 A 56 56 VAL HA H 56 4.123 3.989 0.134 2
1 587 . 1 1 A 56 56 VAL C C 56 175.426 176.206 -0.780 2
1 588 . 1 1 A 56 56 VAL CA C 56 62.786 64.251 -1.465 2
1 589 . 1 1 A 56 56 VAL CB C 56 32.267 32.508 -0.241 2
1 592 . 1 1 A 56 56 VAL N N 56 124.936 129.183 -4.247 2
1 593 . 1 1 A 57 57 ASN H H 57 7.527 8.180 -0.653 2
1 594 . 1 1 A 57 57 ASN HA H 57 4.817 5.250 -0.433 2
1 597 . 1 1 A 57 57 ASN C C 57 172.973 173.623 -0.650 2
1 598 . 1 1 A 57 57 ASN CA C 57 52.460 51.819 0.641 2
1 599 . 1 1 A 57 57 ASN CB C 57 42.070 41.391 0.679 2
1 600 . 1 1 A 57 57 ASN N N 57 114.777 117.322 -2.544 2
1 601 . 1 1 A 58 58 SER H H 58 8.193 8.909 -0.716 2
1 602 . 1 1 A 58 58 SER HA H 58 5.214 4.933 0.281 2
1 605 . 1 1 A 58 58 SER C C 58 174.221 172.251 1.970 2
1 606 . 1 1 A 58 58 SER CA C 58 56.778 56.730 0.048 2
1 607 . 1 1 A 58 58 SER CB C 58 63.906 65.722 -1.816 2
1 608 . 1 1 A 58 58 SER N N 58 115.531 119.430 -3.899 2
1 609 . 1 1 A 59 59 THR H H 59 8.053 8.137 -0.084 2
1 610 . 1 1 A 59 59 THR HA H 59 4.305 4.676 -0.371 2
1 615 . 1 1 A 59 59 THR C C 59 174.478 172.861 1.617 2
1 616 . 1 1 A 59 59 THR CA C 59 63.305 60.331 2.974 2
1 617 . 1 1 A 59 59 THR CB C 59 68.354 68.350 0.004 2
1 619 . 1 1 A 59 59 THR N N 59 116.405 116.763 -0.358 2
1 620 . 1 1 A 60 60 HIS H H 60 8.359 8.044 0.315 2
1 621 . 1 1 A 60 60 HIS HA H 60 5.167 5.102 0.065 2
1 626 . 1 1 A 60 60 HIS CA C 60 52.792 53.200 -0.408 2
1 627 . 1 1 A 60 60 HIS CB C 60 32.142 31.569 0.573 2
1 628 . 1 1 A 60 60 HIS N N 60 123.625 124.895 -1.270 2
1 629 . 1 1 A 61 61 PRO HA H 61 4.277 4.361 -0.084 2
1 636 . 1 1 A 61 61 PRO C C 61 178.217 177.396 0.821 2
1 637 . 1 1 A 61 61 PRO CA C 61 64.375 64.329 0.046 2
1 638 . 1 1 A 61 61 PRO CB C 61 32.007 32.037 -0.030 2
1 641 . 1 1 A 62 62 GLY H H 62 8.421 8.072 0.350 2
1 642 . 1 1 A 62 62 GLY HA2 H 62 3.889 3.750 0.139 2
1 643 . 1 1 A 62 62 GLY HA3 H 62 3.653 3.883 -0.230 2
1 644 . 1 1 A 62 62 GLY C C 62 174.994 173.999 0.995 2
1 645 . 1 1 A 62 62 GLY CA C 62 45.831 45.179 0.652 2
1 646 . 1 1 A 62 62 GLY N N 62 106.132 106.056 0.076 2
1 647 . 1 1 A 63 63 TYR H H 63 7.327 7.699 -0.372 2
1 648 . 1 1 A 63 63 TYR HA H 63 4.846 4.572 0.274 2
1 652 . 1 1 A 63 63 TYR C C 63 175.593 175.463 0.130 2
1 653 . 1 1 A 63 63 TYR CA C 63 56.071 58.349 -2.278 2
1 654 . 1 1 A 63 63 TYR CB C 63 38.962 40.445 -1.483 2
1 655 . 1 1 A 63 63 TYR N N 63 116.628 117.139 -0.511 2
1 656 . 1 1 A 64 64 VAL H H 64 7.296 7.210 0.086 2
1 657 . 1 1 A 64 64 VAL HA H 64 3.180 4.099 -0.919 2
1 665 . 1 1 A 64 64 VAL C C 64 177.312 176.557 0.755 2
1 666 . 1 1 A 64 64 VAL CA C 64 65.688 62.840 2.848 2
1 667 . 1 1 A 64 64 VAL CB C 64 30.957 31.890 -0.932 2
1 670 . 1 1 A 64 64 VAL N N 64 117.940 118.460 -0.520 2
1 671 . 1 1 A 65 65 GLY H H 65 8.449 9.692 -1.243 2
1 672 . 1 1 A 65 65 GLY HA2 H 65 4.320 3.952 0.368 2
1 673 . 1 1 A 65 65 GLY HA3 H 65 3.515 3.962 -0.447 2
1 674 . 1 1 A 65 65 GLY C C 65 174.821 173.478 1.343 2
1 675 . 1 1 A 65 65 GLY CA C 65 44.599 45.234 -0.635 2
1 676 . 1 1 A 65 65 GLY N N 65 115.317 114.136 1.180 2
1 677 . 1 1 A 66 66 ILE H H 66 7.095 7.552 -0.457 2
1 678 . 1 1 A 66 66 ILE HA H 66 3.193 4.718 -1.525 2
1 687 . 1 1 A 66 66 ILE C C 66 174.308 174.926 -0.618 2
1 688 . 1 1 A 66 66 ILE CA C 66 63.470 60.088 3.382 2
1 689 . 1 1 A 66 66 ILE CB C 66 37.775 40.315 -2.540 2
1 693 . 1 1 A 66 66 ILE N N 66 122.099 122.641 -0.542 2
1 694 . 1 1 A 67 67 GLU H H 67 7.126 9.135 -2.009 2
1 695 . 1 1 A 67 67 GLU HA H 67 5.343 5.244 0.099 2
1 699 . 1 1 A 67 67 GLU C C 67 174.652 175.404 -0.752 2
1 700 . 1 1 A 67 67 GLU CA C 67 54.109 54.452 -0.343 2
1 701 . 1 1 A 67 67 GLU CB C 67 33.619 32.983 0.636 2
1 703 . 1 1 A 67 67 GLU N N 67 125.164 127.552 -2.388 2
1 704 . 1 1 A 68 68 GLY H H 68 8.401 8.209 0.192 2
1 705 . 1 1 A 68 68 GLY HA2 H 68 4.364 3.014 1.350 2
1 706 . 1 1 A 68 68 GLY HA3 H 68 4.041 3.846 0.195 2
1 707 . 1 1 A 68 68 GLY C C 68 171.644 171.156 0.488 2
1 708 . 1 1 A 68 68 GLY CA C 68 45.680 44.420 1.260 2
1 709 . 1 1 A 68 68 GLY N N 68 109.626 112.049 -2.423 2
1 710 . 1 1 A 69 69 TYR H H 69 8.422 9.917 -1.495 2
1 711 . 1 1 A 69 69 TYR HA H 69 5.079 4.887 0.192 2
1 714 . 1 1 A 69 69 TYR C C 69 176.194 175.410 0.784 2
1 715 . 1 1 A 69 69 TYR CA C 69 57.681 57.442 0.239 2
1 716 . 1 1 A 69 69 TYR CB C 69 41.043 39.756 1.287 2
1 717 . 1 1 A 69 69 TYR N N 69 119.689 119.855 -0.166 2
1 718 . 1 1 A 70 70 VAL H H 70 8.753 8.640 0.113 2
1 719 . 1 1 A 70 70 VAL HA H 70 4.143 4.351 -0.208 2
1 727 . 1 1 A 70 70 VAL C C 70 176.540 175.664 0.876 2
1 728 . 1 1 A 70 70 VAL CA C 70 63.477 63.665 -0.188 2
1 729 . 1 1 A 70 70 VAL CB C 70 30.952 32.176 -1.224 2
1 732 . 1 1 A 70 70 VAL N N 70 123.420 125.792 -2.372 2
1 733 . 1 1 A 71 71 ILE H H 71 9.101 10.137 -1.036 2
1 734 . 1 1 A 71 71 ILE HA H 71 4.834 4.676 0.158 2
1 743 . 1 1 A 71 71 ILE C C 71 175.418 175.802 -0.384 2
1 744 . 1 1 A 71 71 ILE CA C 71 60.637 62.265 -1.628 2
1 745 . 1 1 A 71 71 ILE CB C 71 39.853 40.364 -0.510 2
1 749 . 1 1 A 71 71 ILE N N 71 119.913 125.104 -5.191 2
1 750 . 1 1 A 72 72 ASP H H 72 8.030 8.129 -0.099 2
1 751 . 1 1 A 72 72 ASP HA H 72 4.964 5.245 -0.281 2
1 754 . 1 1 A 72 72 ASP C C 72 173.017 174.738 -1.721 2
1 755 . 1 1 A 72 72 ASP CA C 72 53.511 53.189 0.322 2
1 756 . 1 1 A 72 72 ASP CB C 72 41.932 44.204 -2.272 2
1 757 . 1 1 A 72 72 ASP N N 72 118.377 120.607 -2.230 2
1 758 . 1 1 A 73 73 GLU H H 73 9.349 8.806 0.543 2
1 759 . 1 1 A 73 73 GLU HA H 73 4.868 5.142 -0.274 2
1 762 . 1 1 A 73 73 GLU C C 73 173.793 174.681 -0.888 2
1 763 . 1 1 A 73 73 GLU CA C 73 55.521 56.042 -0.521 2
1 764 . 1 1 A 73 73 GLU CB C 73 33.138 32.028 1.110 2
1 766 . 1 1 A 73 73 GLU N N 73 123.848 123.563 0.285 2
1 767 . 1 1 A 74 74 THR H H 74 8.748 8.584 0.164 2
1 768 . 1 1 A 74 74 THR HA H 74 4.992 4.842 0.150 2
1 773 . 1 1 A 74 74 THR CA C 74 59.450 60.120 -0.670 2
1 774 . 1 1 A 74 74 THR CB C 74 70.429 71.605 -1.175 2
1 776 . 1 1 A 74 74 THR N N 74 116.628 118.031 -1.404 2
1 777 . 1 1 A 75 75 ARG HA H 75 3.741 4.212 -0.471 2
1 782 . 1 1 A 75 75 ARG C C 75 177.140 176.949 0.191 2
1 783 . 1 1 A 75 75 ARG CA C 75 60.041 58.639 1.402 2
1 784 . 1 1 A 75 75 ARG CB C 75 29.930 30.005 -0.075 2
1 787 . 1 1 A 76 76 ASN H H 76 8.497 8.026 0.471 2
1 788 . 1 1 A 76 76 ASN HA H 76 5.310 4.964 0.346 2
1 791 . 1 1 A 76 76 ASN C C 76 175.509 174.167 1.342 2
1 792 . 1 1 A 76 76 ASN CA C 76 52.320 52.545 -0.225 2
1 793 . 1 1 A 76 76 ASN CB C 76 40.744 39.928 0.816 2
1 794 . 1 1 A 76 76 ASN N N 76 111.053 116.390 -5.337 2
1 795 . 1 1 A 77 77 MET H H 77 7.528 7.415 0.113 2
1 796 . 1 1 A 77 77 MET HA H 77 5.392 4.995 0.397 2
1 801 . 1 1 A 77 77 MET C C 77 174.824 174.272 0.552 2
1 802 . 1 1 A 77 77 MET CA C 77 54.994 54.015 0.979 2
1 803 . 1 1 A 77 77 MET CB C 77 36.753 35.412 1.341 2
1 805 . 1 1 A 77 77 MET N N 77 119.913 116.248 3.665 2
1 806 . 1 1 A 78 78 LEU H H 78 8.977 8.598 0.379 2
1 807 . 1 1 A 78 78 LEU HA H 78 4.803 5.405 -0.602 2
1 817 . 1 1 A 78 78 LEU C C 78 174.563 174.683 -0.120 2
1 818 . 1 1 A 78 78 LEU CA C 78 53.964 54.495 -0.531 2
1 819 . 1 1 A 78 78 LEU CB C 78 44.903 45.278 -0.375 2
1 823 . 1 1 A 78 78 LEU N N 78 121.224 121.697 -0.473 2
1 824 . 1 1 A 79 79 VAL H H 79 8.115 9.167 -1.052 2
1 825 . 1 1 A 79 79 VAL HA H 79 4.783 5.064 -0.281 2
1 833 . 1 1 A 79 79 VAL C C 79 175.297 175.032 0.265 2
1 834 . 1 1 A 79 79 VAL CA C 79 61.821 60.765 1.056 2
1 835 . 1 1 A 79 79 VAL CB C 79 31.146 34.563 -3.417 2
1 838 . 1 1 A 79 79 VAL N N 79 124.062 127.358 -3.296 2
1 839 . 1 1 A 80 80 ILE H H 80 9.342 8.778 0.564 2
1 840 . 1 1 A 80 80 ILE HA H 80 4.764 5.268 -0.504 2
1 849 . 1 1 A 80 80 ILE C C 80 174.127 174.657 -0.530 2
1 850 . 1 1 A 80 80 ILE CA C 80 59.897 59.614 0.283 2
1 851 . 1 1 A 80 80 ILE CB C 80 42.225 41.326 0.899 2
1 855 . 1 1 A 80 80 ILE N N 80 129.970 126.480 3.490 2
1 856 . 1 1 A 81 81 ALA H H 81 9.478 9.908 -0.430 2
1 857 . 1 1 A 81 81 ALA HA H 81 5.139 5.528 -0.389 2
1 861 . 1 1 A 81 81 ALA C C 81 176.970 176.514 0.456 2
1 862 . 1 1 A 81 81 ALA CA C 81 50.835 50.356 0.479 2
1 863 . 1 1 A 81 81 ALA CB C 81 21.451 21.998 -0.547 2
1 864 . 1 1 A 81 81 ALA N N 81 129.756 127.691 2.065 2
1 865 . 1 1 A 82 82 GLY H H 82 8.691 8.755 -0.064 2
1 866 . 1 1 A 82 82 GLY HA2 H 82 5.110 4.209 0.901 2
1 867 . 1 1 A 82 82 GLY HA3 H 82 4.241 4.362 -0.121 2
1 868 . 1 1 A 82 82 GLY C C 82 173.017 174.527 -1.510 2
1 869 . 1 1 A 82 82 GLY CA C 82 44.166 44.853 -0.687 2
1 870 . 1 1 A 82 82 GLY N N 82 113.568 108.894 4.674 2
1 871 . 1 1 A 83 83 GLU H H 83 8.659 9.005 -0.345 2
1 872 . 1 1 A 83 83 GLU HA H 83 4.286 4.291 -0.005 2
1 876 . 1 1 A 83 83 GLU C C 83 177.570 176.280 1.290 2
1 877 . 1 1 A 83 83 GLU CA C 83 59.017 58.533 0.484 2
1 878 . 1 1 A 83 83 GLU CB C 83 29.762 29.148 0.615 2
1 880 . 1 1 A 83 83 GLU N N 83 120.019 122.674 -2.654 2
1 881 . 1 1 A 84 84 ASN H H 84 8.549 8.685 -0.136 2
1 882 . 1 1 A 84 84 ASN HA H 84 4.821 4.939 -0.118 2
1 884 . 1 1 A 84 84 ASN C C 84 173.878 174.047 -0.169 2
1 885 . 1 1 A 84 84 ASN CA C 84 52.919 52.804 0.115 2
1 886 . 1 1 A 84 84 ASN CB C 84 40.150 39.033 1.117 2
1 887 . 1 1 A 84 84 ASN N N 84 112.778 124.403 -11.624 2
1 888 . 1 1 A 85 85 LYS H H 85 7.116 7.492 -0.377 2
1 889 . 1 1 A 85 85 LYS HA H 85 4.344 5.004 -0.660 2
1 895 . 1 1 A 85 85 LYS C C 85 173.278 174.627 -1.349 2
1 896 . 1 1 A 85 85 LYS CA C 85 55.292 55.199 0.093 2
1 897 . 1 1 A 85 85 LYS CB C 85 36.124 36.119 0.005 2
1 901 . 1 1 A 85 85 LYS N N 85 118.377 120.535 -2.158 2
1 902 . 1 1 A 86 86 VAL H H 86 7.781 8.778 -0.997 2
1 903 . 1 1 A 86 86 VAL HA H 86 4.749 5.359 -0.610 2
1 911 . 1 1 A 86 86 VAL C C 86 174.739 174.391 0.348 2
1 912 . 1 1 A 86 86 VAL CA C 86 60.716 59.530 1.186 2
1 913 . 1 1 A 86 86 VAL CB C 86 33.619 35.201 -1.582 2
1 916 . 1 1 A 86 86 VAL N N 86 120.127 118.131 1.996 2
1 917 . 1 1 A 87 87 TRP H H 87 9.558 9.861 -0.303 2
1 918 . 1 1 A 87 87 TRP HA H 87 4.958 5.246 -0.288 2
1 923 . 1 1 A 87 87 TRP C C 87 174.909 175.016 -0.107 2
1 924 . 1 1 A 87 87 TRP CA C 87 57.073 55.905 1.168 2
1 925 . 1 1 A 87 87 TRP CB C 87 33.028 30.611 2.417 2
1 926 . 1 1 A 87 87 TRP N N 87 127.346 123.283 4.063 2
1 927 . 1 1 A 88 88 LYS H H 88 8.590 7.866 0.724 2
1 928 . 1 1 A 88 88 LYS HA H 88 4.856 4.621 0.235 2
1 935 . 1 1 A 88 88 LYS C C 88 175.382 174.487 0.895 2
1 936 . 1 1 A 88 88 LYS CA C 88 55.887 54.809 1.079 2
1 937 . 1 1 A 88 88 LYS CB C 88 32.434 33.601 -1.167 2
1 941 . 1 1 A 88 88 LYS N N 88 123.625 124.312 -0.687 2
1 942 . 1 1 A 89 89 VAL H H 89 8.829 8.040 0.789 2
1 943 . 1 1 A 89 89 VAL HA H 89 4.406 4.535 -0.129 2
1 951 . 1 1 A 89 89 VAL CA C 89 58.371 58.861 -0.490 2
1 952 . 1 1 A 89 89 VAL CB C 89 34.512 33.199 1.313 2
1 955 . 1 1 A 89 89 VAL N N 89 124.285 122.894 1.390 2
1 956 . 1 1 A 90 90 PRO HA H 90 5.073 4.595 0.478 2
1 961 . 1 1 A 90 90 PRO C C 90 177.231 177.600 -0.369 2
1 962 . 1 1 A 90 90 PRO CA C 90 61.795 63.029 -1.234 2
1 963 . 1 1 A 90 90 PRO CB C 90 31.660 32.702 -1.042 2
1 964 . 1 1 A 91 91 LYS H H 91 8.116 8.608 -0.492 2
1 965 . 1 1 A 91 91 LYS HA H 91 4.024 4.219 -0.195 2
1 969 . 1 1 A 91 91 LYS C C 91 178.518 177.275 1.243 2
1 970 . 1 1 A 91 91 LYS CA C 91 59.621 59.189 0.432 2
1 971 . 1 1 A 91 91 LYS CB C 91 34.217 32.005 2.212 2
1 973 . 1 1 A 91 91 LYS N N 91 121.224 122.634 -1.410 2
1 974 . 1 1 A 92 92 ASP H H 92 8.505 8.517 -0.012 2
1 975 . 1 1 A 92 92 ASP HA H 92 3.781 4.597 -0.816 2
1 978 . 1 1 A 92 92 ASP C C 92 176.975 176.661 0.314 2
1 979 . 1 1 A 92 92 ASP CA C 92 56.773 54.858 1.915 2
1 980 . 1 1 A 92 92 ASP CB C 92 39.590 40.020 -0.430 2
1 981 . 1 1 A 92 92 ASP N N 92 111.815 117.628 -5.813 2
1 982 . 1 1 A 93 93 VAL H H 93 6.691 7.864 -1.173 2
1 983 . 1 1 A 93 93 VAL HA H 93 4.678 4.519 0.159 2
1 991 . 1 1 A 93 93 VAL C C 93 176.537 174.792 1.745 2
1 992 . 1 1 A 93 93 VAL CA C 93 60.120 60.933 -0.813 2
1 993 . 1 1 A 93 93 VAL CB C 93 31.093 32.412 -1.319 2
1 996 . 1 1 A 93 93 VAL N N 93 107.879 114.357 -6.478 2
1 997 . 1 1 A 94 94 CYS H H 94 7.249 7.742 -0.493 2
1 998 . 1 1 A 94 94 CYS HA H 94 5.062 4.709 0.353 2
1 1001 . 1 1 A 94 94 CYS C C 94 173.103 172.219 0.884 2
1 1002 . 1 1 A 94 94 CYS CA C 94 58.001 57.351 0.650 2
1 1003 . 1 1 A 94 94 CYS CB C 94 31.418 30.779 0.639 2
1 1004 . 1 1 A 94 94 CYS N N 94 117.940 118.007 -0.067 2
1 1005 . 1 1 A 95 95 ILE H H 95 8.153 8.155 -0.002 2
1 1006 . 1 1 A 95 95 ILE HA H 95 4.159 4.742 -0.583 2
1 1016 . 1 1 A 95 95 ILE C C 95 174.736 174.834 -0.098 2
1 1017 . 1 1 A 95 95 ILE CA C 95 61.234 60.212 1.022 2
1 1018 . 1 1 A 95 95 ILE CB C 95 38.071 39.678 -1.607 2
1 1022 . 1 1 A 95 95 ILE N N 95 121.876 121.461 0.415 2
1 1023 . 1 1 A 96 96 PHE H H 96 8.400 8.809 -0.409 2
1 1024 . 1 1 A 96 96 PHE HA H 96 5.004 4.886 0.118 2
1 1029 . 1 1 A 96 96 PHE C C 96 174.005 174.315 -0.310 2
1 1030 . 1 1 A 96 96 PHE CA C 96 56.922 56.571 0.351 2
1 1031 . 1 1 A 96 96 PHE CB C 96 44.006 41.355 2.651 2
1 1032 . 1 1 A 96 96 PHE N N 96 125.820 126.361 -0.541 2
1 1033 . 1 1 A 97 97 GLU H H 97 8.985 8.505 0.480 2
1 1034 . 1 1 A 97 97 GLU HA H 97 5.275 5.191 0.084 2
1 1038 . 1 1 A 97 97 GLU C C 97 175.596 174.881 0.715 2
1 1039 . 1 1 A 97 97 GLU CA C 97 55.070 54.635 0.435 2
1 1040 . 1 1 A 97 97 GLU CB C 97 33.628 31.019 2.609 2
1 1042 . 1 1 A 97 97 GLU N N 97 121.010 123.823 -2.813 2
1 1043 . 1 1 A 98 98 PHE H H 98 9.304 9.119 0.185 2
1 1044 . 1 1 A 98 98 PHE HA H 98 5.337 5.024 0.313 2
1 1048 . 1 1 A 98 98 PHE C C 98 174.650 175.711 -1.061 2
1 1049 . 1 1 A 98 98 PHE CA C 98 57.363 57.880 -0.517 2
1 1050 . 1 1 A 98 98 PHE CB C 98 41.936 40.408 1.528 2
1 1051 . 1 1 A 98 98 PHE N N 98 128.658 126.320 2.338 2
1 1052 . 1 1 A 99 99 GLU H H 99 8.721 8.989 -0.268 2
1 1053 . 1 1 A 99 99 GLU HA H 99 5.457 4.731 0.726 2
1 1058 . 1 1 A 99 99 GLU C C 99 176.368 176.595 -0.227 2
1 1059 . 1 1 A 99 99 GLU CA C 99 54.401 55.438 -1.037 2
1 1060 . 1 1 A 99 99 GLU CB C 99 33.068 31.351 1.717 2
1 1062 . 1 1 A 99 99 GLU N N 99 122.759 123.740 -0.981 2
1 1063 . 1 1 A 100 100 THR H H 100 8.588 10.408 -1.819 2
1 1064 . 1 1 A 100 100 THR HA H 100 4.603 4.442 0.161 2
1 1069 . 1 1 A 100 100 THR C C 100 177.144 176.595 0.549 2
1 1070 . 1 1 A 100 100 THR CA C 100 60.774 63.003 -2.229 2
1 1071 . 1 1 A 100 100 THR CB C 100 70.136 69.809 0.327 2
1 1073 . 1 1 A 100 100 THR N N 100 116.191 120.921 -4.730 2
1 1074 . 1 1 A 101 101 TRP H H 101 9.287 9.050 0.237 2
1 1075 . 1 1 A 101 101 TRP HA H 101 4.591 4.504 0.087 2
1 1080 . 1 1 A 101 101 TRP C C 101 176.457 176.566 -0.109 2
1 1081 . 1 1 A 101 101 TRP CA C 101 60.045 58.984 1.060 2
1 1082 . 1 1 A 101 101 TRP CB C 101 28.578 28.416 0.162 2
1 1083 . 1 1 A 101 101 TRP N N 101 122.220 124.399 -2.179 2
1 1084 . 1 1 A 102 102 ASP H H 102 7.553 8.205 -0.652 2
1 1085 . 1 1 A 102 102 ASP HA H 102 4.129 4.481 -0.352 2
1 1088 . 1 1 A 102 102 ASP C C 102 176.714 176.251 0.463 2
1 1089 . 1 1 A 102 102 ASP CA C 102 52.775 53.317 -0.542 2
1 1090 . 1 1 A 102 102 ASP CB C 102 39.231 40.816 -1.585 2
1 1091 . 1 1 A 102 102 ASP N N 102 115.763 119.716 -3.953 2
1 1092 . 1 1 A 103 103 GLY H H 103 7.910 8.507 -0.597 2
1 1093 . 1 1 A 103 103 GLY HA2 H 103 4.216 3.962 0.254 2
1 1094 . 1 1 A 103 103 GLY HA3 H 103 3.686 3.995 -0.309 2
1 1095 . 1 1 A 103 103 GLY C C 103 174.566 174.212 0.354 2
1 1096 . 1 1 A 103 103 GLY CA C 103 45.179 46.196 -1.017 2
1 1097 . 1 1 A 103 103 GLY N N 103 108.311 108.783 -0.472 2
1 1098 . 1 1 A 104 104 THR H H 104 7.691 7.596 0.094 2
1 1099 . 1 1 A 104 104 THR HA H 104 4.031 4.706 -0.675 2
1 1104 . 1 1 A 104 104 THR C C 104 173.405 173.824 -0.419 2
1 1105 . 1 1 A 104 104 THR CA C 104 64.307 60.762 3.545 2
1 1106 . 1 1 A 104 104 THR CB C 104 68.354 71.229 -2.875 2
1 1108 . 1 1 A 104 104 THR N N 104 119.913 114.646 5.267 2
1 1109 . 1 1 A 105 105 LYS H H 105 8.297 8.735 -0.438 2
1 1110 . 1 1 A 105 105 LYS HA H 105 5.457 4.761 0.696 2
1 1116 . 1 1 A 105 105 LYS C C 105 177.055 175.607 1.448 2
1 1117 . 1 1 A 105 105 LYS CA C 105 54.401 55.874 -1.473 2
1 1118 . 1 1 A 105 105 LYS CB C 105 34.230 33.780 0.450 2
1 1122 . 1 1 A 105 105 LYS N N 105 125.597 123.673 1.924 2
1 1123 . 1 1 A 106 106 ILE H H 106 9.238 9.121 0.117 2
1 1124 . 1 1 A 106 106 ILE HA H 106 4.289 4.818 -0.529 2
1 1133 . 1 1 A 106 106 ILE C C 106 174.221 174.491 -0.270 2
1 1134 . 1 1 A 106 106 ILE CA C 106 60.631 59.900 0.731 2
1 1135 . 1 1 A 106 106 ILE CB C 106 41.927 39.933 1.994 2
1 1139 . 1 1 A 106 106 ILE N N 106 124.499 124.971 -0.472 2
1 1140 . 1 1 A 107 107 LYS H H 107 8.650 9.078 -0.427 2
1 1141 . 1 1 A 107 107 LYS HA H 107 5.608 5.011 0.597 2
1 1147 . 1 1 A 107 107 LYS C C 107 175.681 175.063 0.618 2
1 1148 . 1 1 A 107 107 LYS CA C 107 55.248 54.935 0.313 2
1 1149 . 1 1 A 107 107 LYS CB C 107 33.618 34.172 -0.554 2
1 1153 . 1 1 A 107 107 LYS N N 107 130.844 128.408 2.436 2
1 1154 . 1 1 A 108 108 ILE H H 108 9.448 8.473 0.975 2
1 1155 . 1 1 A 108 108 ILE HA H 108 4.741 4.865 -0.124 2
1 1164 . 1 1 A 108 108 ILE C C 108 172.670 174.159 -1.489 2
1 1165 . 1 1 A 108 108 ILE CA C 108 59.157 59.457 -0.300 2
1 1166 . 1 1 A 108 108 ILE CB C 108 42.241 42.067 0.174 2
1 1170 . 1 1 A 108 108 ILE N N 108 125.160 127.615 -2.455 2
1 1171 . 1 1 A 109 109 SER H H 109 8.490 8.902 -0.412 2
1 1172 . 1 1 A 109 109 SER HA H 109 4.437 4.750 -0.313 2
1 1175 . 1 1 A 109 109 SER C C 109 176.536 176.393 0.143 2
1 1176 . 1 1 A 109 109 SER CA C 109 58.850 58.062 0.788 2
1 1177 . 1 1 A 109 109 SER CB C 109 63.010 64.039 -1.029 2
1 1178 . 1 1 A 109 109 SER N N 109 122.750 122.256 0.494 2
1 1179 . 1 1 A 110 110 GLY H H 110 9.292 8.604 0.688 2
1 1180 . 1 1 A 110 110 GLY HA2 H 110 5.193 4.031 1.162 2
1 1181 . 1 1 A 110 110 GLY HA3 H 110 3.755 4.139 -0.384 2
1 1182 . 1 1 A 110 110 GLY C C 110 176.964 175.107 1.857 2
1 1183 . 1 1 A 110 110 GLY CA C 110 48.168 46.760 1.408 2
1 1184 . 1 1 A 110 110 GLY N N 110 116.628 111.668 4.960 2
1 1185 . 1 1 A 111 111 GLU H H 111 8.576 8.740 -0.164 2
1 1186 . 1 1 A 111 111 GLU HA H 111 4.080 4.146 -0.066 2
1 1191 . 1 1 A 111 111 GLU C C 111 178.867 178.620 0.247 2
1 1192 . 1 1 A 111 111 GLU CA C 111 59.150 58.659 0.491 2
1 1193 . 1 1 A 111 111 GLU CB C 111 28.831 28.894 -0.063 2
1 1195 . 1 1 A 111 111 GLU N N 111 120.564 118.409 2.154 2
1 1196 . 1 1 A 112 112 LYS H H 112 7.605 7.804 -0.199 2
1 1197 . 1 1 A 112 112 LYS HA H 112 4.229 4.041 0.188 2
1 1202 . 1 1 A 112 112 LYS C C 112 176.710 178.100 -1.390 2
1 1203 . 1 1 A 112 112 LYS CA C 112 57.083 59.275 -2.192 2
1 1204 . 1 1 A 112 112 LYS CB C 112 32.183 32.431 -0.248 2
1 1208 . 1 1 A 112 112 LYS N N 112 116.628 119.064 -2.436 2
1 1209 . 1 1 A 113 113 LEU H H 113 7.784 7.756 0.028 2
1 1210 . 1 1 A 113 113 LEU HA H 113 4.387 4.316 0.070 2
1 1220 . 1 1 A 113 113 LEU C C 113 176.195 176.564 -0.369 2
1 1221 . 1 1 A 113 113 LEU CA C 113 52.617 54.122 -1.505 2
1 1222 . 1 1 A 113 113 LEU CB C 113 42.820 41.091 1.729 2
1 1226 . 1 1 A 113 113 LEU N N 113 114.219 114.431 -0.212 2
1 1227 . 1 1 A 114 114 VAL H H 114 7.032 7.465 -0.433 2
1 1228 . 1 1 A 114 114 VAL HA H 114 3.723 3.814 -0.091 2
1 1236 . 1 1 A 114 114 VAL C C 114 175.430 177.219 -1.789 2
1 1237 . 1 1 A 114 114 VAL CA C 114 65.537 63.950 1.587 2
1 1238 . 1 1 A 114 114 VAL CB C 114 32.115 31.279 0.836 2
1 1241 . 1 1 A 114 114 VAL N N 114 121.773 121.060 0.713 2
1 1242 . 1 1 A 115 115 GLY H H 115 8.678 8.807 -0.129 2
1 1243 . 1 1 A 115 115 GLY HA2 H 115 4.313 3.939 0.374 2
1 1244 . 1 1 A 115 115 GLY HA3 H 115 3.846 3.943 -0.097 2
1 1245 . 1 1 A 115 115 GLY C C 115 172.462 173.629 -1.167 2
1 1246 . 1 1 A 115 115 GLY CA C 115 43.743 45.547 -1.804 2
1 1247 . 1 1 A 115 115 GLY N N 115 117.503 116.885 0.617 2
1 1248 . 1 1 A 116 116 ARG H H 116 8.701 8.423 0.278 2
1 1249 . 1 1 A 116 116 ARG HA H 116 3.926 4.621 -0.695 2
1 1254 . 1 1 A 116 116 ARG CA C 116 56.470 53.393 3.077 2
1 1255 . 1 1 A 116 116 ARG CB C 116 29.585 29.584 0.001 2
1 1257 . 1 1 A 116 116 ARG N N 116 123.504 120.836 2.668 2
1 1258 . 1 1 A 117 117 PRO HA H 117 4.242 4.229 0.013 2
1 1264 . 1 1 A 117 117 PRO C C 117 178.947 178.128 0.819 2
1 1265 . 1 1 A 117 117 PRO CA C 117 65.684 64.593 1.091 2
1 1266 . 1 1 A 117 117 PRO CB C 117 30.949 32.063 -1.114 2
1 1269 . 1 1 A 118 118 GLU H H 118 10.821 8.836 1.984 2
1 1270 . 1 1 A 118 118 GLU HA H 118 4.197 4.073 0.124 2
1 1271 . 1 1 A 118 118 GLU C C 118 176.627 178.813 -2.186 2
1 1272 . 1 1 A 118 118 GLU CA C 118 58.045 59.255 -1.210 2
1 1273 . 1 1 A 118 118 GLU CB C 118 27.101 29.246 -2.145 2
1 1274 . 1 1 A 118 118 GLU N N 118 119.242 116.503 2.739 2
1 1275 . 1 1 A 119 119 MET H H 119 7.226 8.073 -0.847 2
1 1276 . 1 1 A 119 119 MET HA H 119 4.591 3.987 0.604 2
1 1279 . 1 1 A 119 119 MET C C 119 180.024 178.345 1.679 2
1 1280 . 1 1 A 119 119 MET CA C 119 54.695 58.796 -4.101 2
1 1281 . 1 1 A 119 119 MET CB C 119 31.012 32.126 -1.114 2
1 1283 . 1 1 A 119 119 MET N N 119 119.475 119.876 -0.401 2
1 1284 . 1 1 A 120 120 ARG H H 120 7.877 7.703 0.174 2
1 1285 . 1 1 A 120 120 ARG HA H 120 3.988 3.999 -0.011 2
1 1292 . 1 1 A 120 120 ARG C C 120 177.705 178.725 -1.020 2
1 1293 . 1 1 A 120 120 ARG CA C 120 60.773 58.413 2.360 2
1 1294 . 1 1 A 120 120 ARG CB C 120 31.159 29.793 1.366 2
1 1295 . 1 1 A 120 120 ARG N N 120 122.099 119.788 2.311 2
1 1296 . 1 1 A 121 121 LEU H H 121 6.732 8.029 -1.297 2
1 1297 . 1 1 A 121 121 LEU HA H 121 4.170 4.019 0.151 2
1 1307 . 1 1 A 121 121 LEU C C 121 176.220 178.676 -2.456 2
1 1308 . 1 1 A 121 121 LEU CA C 121 57.370 57.947 -0.577 2
1 1309 . 1 1 A 121 121 LEU CB C 121 42.945 41.584 1.360 2
1 1312 . 1 1 A 121 121 LEU N N 121 114.436 119.659 -5.223 2
1 1313 . 1 1 A 122 122 LYS H H 122 7.555 8.663 -1.108 2
1 1314 . 1 1 A 122 122 LYS HA H 122 4.338 4.293 0.045 2
1 1321 . 1 1 A 122 122 LYS C C 122 176.969 176.495 0.474 2
1 1322 . 1 1 A 122 122 LYS CA C 122 55.621 56.663 -1.042 2
1 1323 . 1 1 A 122 122 LYS CB C 122 32.414 32.508 -0.094 2
1 1327 . 1 1 A 122 122 LYS N N 122 115.754 116.188 -0.434 2
1 1328 . 1 1 A 123 123 LYS H H 123 7.688 8.028 -0.340 2
1 1329 . 1 1 A 123 123 LYS HA H 123 4.535 4.242 0.293 2
1 1330 . 1 1 A 123 123 LYS CA C 123 58.461 57.381 1.080 2
1 1331 . 1 1 A 123 123 LYS CB C 123 33.138 31.654 1.484 2
1 1332 . 1 1 A 123 123 LYS N N 123 120.843 118.834 2.009 2
1 1333 . 1 1 A 126 126 ARG HA H 126 4.347 4.224 0.123 2
1 1338 . 1 1 A 126 126 ARG C C 126 174.573 175.878 -1.305 2
1 1339 . 1 1 A 126 126 ARG CA C 126 55.998 56.495 -0.497 2
1 1340 . 1 1 A 126 126 ARG CB C 126 31.569 30.595 0.974 2
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