data_10288_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10288
_Entry.PDB_ID 2DA6
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 9 9 ASN H H 9 8.856 9.008 -0.152 1
1 2 . 1 1 1 A 9 9 ASN HA H 9 4.694 5.340 -0.646 1
1 7 . 1 1 1 A 9 9 ASN CA C 9 53.401 51.665 1.736 1
1 8 . 1 1 1 A 9 9 ASN CB C 9 38.757 42.363 -3.606 1
1 10 . 1 1 1 A 10 10 ARG HA H 10 4.346 4.543 -0.197 1
1 17 . 1 1 1 A 10 10 ARG C C 10 175.405 175.429 -0.024 1
1 18 . 1 1 1 A 10 10 ARG CA C 10 56.181 55.898 0.283 1
1 19 . 1 1 1 A 10 10 ARG CB C 10 31.171 30.644 0.527 1
1 22 . 1 1 1 A 11 11 PHE H H 11 8.310 8.859 -0.549 1
1 23 . 1 1 1 A 11 11 PHE HA H 11 4.291 5.195 -0.904 1
1 31 . 1 1 1 A 11 11 PHE C C 11 174.458 173.008 1.450 1
1 32 . 1 1 1 A 11 11 PHE CA C 11 58.967 56.637 2.330 1
1 33 . 1 1 1 A 11 11 PHE CB C 11 40.138 42.869 -2.731 1
1 39 . 1 1 1 A 11 11 PHE N N 11 123.604 124.558 -0.954 1
1 40 . 1 1 1 A 12 12 LYS H H 12 7.307 8.096 -0.789 1
1 41 . 1 1 1 A 12 12 LYS HA H 12 4.165 4.651 -0.486 1
1 50 . 1 1 1 A 12 12 LYS C C 12 174.385 174.950 -0.565 1
1 51 . 1 1 1 A 12 12 LYS CA C 12 54.593 54.134 0.459 1
1 52 . 1 1 1 A 12 12 LYS CB C 12 34.712 36.003 -1.291 1
1 56 . 1 1 1 A 12 12 LYS N N 12 127.282 125.638 1.644 1
1 57 . 1 1 1 A 13 13 TRP H H 13 8.039 8.536 -0.497 1
1 58 . 1 1 1 A 13 13 TRP HA H 13 4.370 4.751 -0.381 1
1 67 . 1 1 1 A 13 13 TRP C C 13 177.857 176.236 1.621 1
1 68 . 1 1 1 A 13 13 TRP CA C 13 56.675 57.248 -0.573 1
1 69 . 1 1 1 A 13 13 TRP CB C 13 30.317 30.412 -0.095 1
1 75 . 1 1 1 A 13 13 TRP N N 13 124.264 126.164 -1.900 1
1 77 . 1 1 1 A 14 14 GLY H H 14 9.815 8.781 1.034 1
1 78 . 1 1 1 A 14 14 GLY HA2 H 14 4.370 4.276 0.094 1
1 79 . 1 1 1 A 14 14 GLY HA3 H 14 4.335 4.299 0.036 1
1 80 . 1 1 1 A 14 14 GLY C C 14 172.904 174.749 -1.845 1
1 81 . 1 1 1 A 14 14 GLY CA C 14 44.157 43.827 0.330 1
1 82 . 1 1 1 A 14 14 GLY N N 14 115.294 108.659 6.635 1
1 83 . 1 1 1 A 15 15 PRO HA H 15 4.327 4.410 -0.083 1
1 90 . 1 1 1 A 15 15 PRO C C 15 179.726 178.605 1.121 1
1 91 . 1 1 1 A 15 15 PRO CA C 15 65.171 65.087 0.084 1
1 92 . 1 1 1 A 15 15 PRO CB C 15 31.829 32.012 -0.183 1
1 95 . 1 1 1 A 16 16 ALA H H 16 9.214 8.115 1.099 1
1 96 . 1 1 1 A 16 16 ALA HA H 16 4.166 4.138 0.028 1
1 100 . 1 1 1 A 16 16 ALA C C 16 181.184 179.694 1.490 1
1 101 . 1 1 1 A 16 16 ALA CA C 16 55.370 55.156 0.214 1
1 102 . 1 1 1 A 16 16 ALA CB C 16 18.058 19.042 -0.984 1
1 103 . 1 1 1 A 16 16 ALA N N 16 122.414 119.933 2.481 1
1 104 . 1 1 1 A 17 17 SER H H 17 7.985 8.207 -0.222 1
1 105 . 1 1 1 A 17 17 SER HA H 17 4.317 4.116 0.201 1
1 107 . 1 1 1 A 17 17 SER C C 17 175.381 176.823 -1.442 1
1 108 . 1 1 1 A 17 17 SER CA C 17 63.163 62.183 0.980 1
1 109 . 1 1 1 A 17 17 SER CB C 17 64.055 63.011 1.044 1
1 110 . 1 1 1 A 17 17 SER N N 17 116.568 114.272 2.296 1
1 111 . 1 1 1 A 18 18 GLN H H 18 8.316 7.865 0.451 1
1 112 . 1 1 1 A 18 18 GLN HA H 18 3.323 3.412 -0.089 1
1 119 . 1 1 1 A 18 18 GLN C C 18 176.812 178.577 -1.765 1
1 120 . 1 1 1 A 18 18 GLN CA C 18 60.025 59.366 0.659 1
1 121 . 1 1 1 A 18 18 GLN CB C 18 28.686 28.450 0.236 1
1 123 . 1 1 1 A 18 18 GLN N N 18 119.002 120.879 -1.877 1
1 125 . 1 1 1 A 19 19 GLN H H 19 7.582 8.201 -0.619 1
1 126 . 1 1 1 A 19 19 GLN HA H 19 4.062 4.102 -0.040 1
1 133 . 1 1 1 A 19 19 GLN C C 19 178.488 178.453 0.035 1
1 134 . 1 1 1 A 19 19 GLN CA C 19 59.248 59.214 0.034 1
1 135 . 1 1 1 A 19 19 GLN CB C 19 28.203 28.136 0.067 1
1 137 . 1 1 1 A 19 19 GLN N N 19 116.221 118.661 -2.440 1
1 139 . 1 1 1 A 20 20 ILE H H 20 7.246 7.961 -0.715 1
1 140 . 1 1 1 A 20 20 ILE HA H 20 3.570 3.619 -0.049 1
1 150 . 1 1 1 A 20 20 ILE C C 20 178.999 178.511 0.488 1
1 151 . 1 1 1 A 20 20 ILE CA C 20 64.996 65.708 -0.712 1
1 152 . 1 1 1 A 20 20 ILE CB C 20 38.139 37.964 0.175 1
1 156 . 1 1 1 A 20 20 ILE N N 20 120.521 120.880 -0.359 1
1 157 . 1 1 1 A 21 21 LEU H H 21 8.034 7.839 0.195 1
1 158 . 1 1 1 A 21 21 LEU HA H 21 3.491 3.610 -0.119 1
1 168 . 1 1 1 A 21 21 LEU C C 21 178.196 178.791 -0.595 1
1 169 . 1 1 1 A 21 21 LEU CA C 21 57.944 57.547 0.397 1
1 170 . 1 1 1 A 21 21 LEU CB C 21 37.864 40.234 -2.370 1
1 174 . 1 1 1 A 21 21 LEU N N 21 121.259 118.743 2.516 1
1 175 . 1 1 1 A 22 22 TYR H H 22 8.479 7.593 0.886 1
1 176 . 1 1 1 A 22 22 TYR HA H 22 4.224 4.297 -0.073 1
1 183 . 1 1 1 A 22 22 TYR C C 22 179.630 178.553 1.077 1
1 184 . 1 1 1 A 22 22 TYR CA C 22 62.422 60.810 1.612 1
1 185 . 1 1 1 A 22 22 TYR CB C 22 37.434 37.757 -0.323 1
1 190 . 1 1 1 A 22 22 TYR N N 22 117.805 118.358 -0.553 1
1 191 . 1 1 1 A 23 23 GLN H H 23 7.707 8.328 -0.621 1
1 192 . 1 1 1 A 23 23 GLN HA H 23 4.166 4.043 0.123 1
1 199 . 1 1 1 A 23 23 GLN C C 23 178.633 178.294 0.339 1
1 200 . 1 1 1 A 23 23 GLN CA C 23 58.789 59.180 -0.391 1
1 201 . 1 1 1 A 23 23 GLN CB C 23 28.534 28.133 0.401 1
1 203 . 1 1 1 A 23 23 GLN N N 23 117.580 118.341 -0.761 1
1 205 . 1 1 1 A 24 24 ALA H H 24 8.155 7.925 0.230 1
1 206 . 1 1 1 A 24 24 ALA HA H 24 4.187 4.290 -0.103 1
1 210 . 1 1 1 A 24 24 ALA C C 24 180.018 179.248 0.770 1
1 211 . 1 1 1 A 24 24 ALA CA C 24 55.228 55.037 0.191 1
1 212 . 1 1 1 A 24 24 ALA CB C 24 19.468 18.653 0.815 1
1 213 . 1 1 1 A 24 24 ALA N N 24 122.813 122.292 0.521 1
1 214 . 1 1 1 A 25 25 TYR H H 25 8.995 8.628 0.367 1
1 215 . 1 1 1 A 25 25 TYR HA H 25 4.348 4.784 -0.436 1
1 222 . 1 1 1 A 25 25 TYR C C 25 175.792 177.315 -1.523 1
1 223 . 1 1 1 A 25 25 TYR CA C 25 61.681 61.969 -0.288 1
1 224 . 1 1 1 A 25 25 TYR CB C 25 38.175 38.578 -0.403 1
1 229 . 1 1 1 A 25 25 TYR N N 25 121.343 120.504 0.839 1
1 230 . 1 1 1 A 26 26 ASP H H 26 7.260 8.861 -1.601 1
1 231 . 1 1 1 A 26 26 ASP HA H 26 4.373 4.457 -0.084 1
1 234 . 1 1 1 A 26 26 ASP C C 26 177.322 178.159 -0.837 1
1 235 . 1 1 1 A 26 26 ASP CA C 26 56.603 57.530 -0.927 1
1 236 . 1 1 1 A 26 26 ASP CB C 26 41.060 41.791 -0.731 1
1 237 . 1 1 1 A 26 26 ASP N N 26 114.020 119.252 -5.232 1
1 238 . 1 1 1 A 27 27 ARG H H 27 7.343 7.851 -0.508 1
1 239 . 1 1 1 A 27 27 ARG HA H 27 4.302 4.365 -0.063 1
1 246 . 1 1 1 A 27 27 ARG C C 27 176.546 176.367 0.179 1
1 247 . 1 1 1 A 27 27 ARG CA C 27 57.563 57.662 -0.099 1
1 248 . 1 1 1 A 27 27 ARG CB C 27 31.500 31.426 0.074 1
1 251 . 1 1 1 A 27 27 ARG N N 27 116.729 116.804 -0.075 1
1 252 . 1 1 1 A 28 28 GLN H H 28 8.306 8.217 0.089 1
1 253 . 1 1 1 A 28 28 GLN HA H 28 4.396 4.620 -0.224 1
1 260 . 1 1 1 A 28 28 GLN C C 28 172.831 175.589 -2.758 1
1 261 . 1 1 1 A 28 28 GLN CA C 28 55.355 54.657 0.698 1
1 262 . 1 1 1 A 28 28 GLN CB C 28 31.062 31.296 -0.234 1
1 264 . 1 1 1 A 28 28 GLN N N 28 121.612 118.587 3.025 1
1 266 . 1 1 1 A 29 29 LYS H H 29 8.354 8.587 -0.233 1
1 267 . 1 1 1 A 29 29 LYS HA H 29 4.099 3.470 0.629 1
1 276 . 1 1 1 A 29 29 LYS C C 29 176.084 176.607 -0.523 1
1 277 . 1 1 1 A 29 29 LYS CA C 29 57.873 57.762 0.111 1
1 278 . 1 1 1 A 29 29 LYS CB C 29 33.313 32.695 0.618 1
1 282 . 1 1 1 A 29 29 LYS N N 29 125.038 125.506 -0.468 1
1 283 . 1 1 1 A 30 30 ASN H H 30 8.856 8.074 0.782 1
1 284 . 1 1 1 A 30 30 ASN HA H 30 4.958 4.935 0.023 1
1 289 . 1 1 1 A 30 30 ASN C C 30 171.179 173.504 -2.325 1
1 290 . 1 1 1 A 30 30 ASN CA C 30 50.891 50.565 0.326 1
1 291 . 1 1 1 A 30 30 ASN CB C 30 39.907 38.492 1.415 1
1 292 . 1 1 1 A 30 30 ASN N N 30 115.764 115.160 0.604 1
1 294 . 1 1 1 A 31 31 PRO HA H 31 4.299 4.483 -0.184 1
1 301 . 1 1 1 A 31 31 PRO C C 31 177.493 176.775 0.718 1
1 302 . 1 1 1 A 31 31 PRO CA C 31 62.489 62.631 -0.142 1
1 303 . 1 1 1 A 31 31 PRO CB C 31 31.216 32.085 -0.869 1
1 306 . 1 1 1 A 32 32 SER H H 32 9.368 8.398 0.970 1
1 307 . 1 1 1 A 32 32 SER HA H 32 4.372 4.753 -0.381 1
1 310 . 1 1 1 A 32 32 SER C C 32 174.821 175.745 -0.924 1
1 311 . 1 1 1 A 32 32 SER CA C 32 57.203 57.445 -0.242 1
1 312 . 1 1 1 A 32 32 SER CB C 32 65.594 64.303 1.291 1
1 313 . 1 1 1 A 32 32 SER N N 32 120.847 117.274 3.573 1
1 314 . 1 1 1 A 33 33 LYS H H 33 9.152 8.910 0.242 1
1 315 . 1 1 1 A 33 33 LYS HA H 33 3.719 3.984 -0.265 1
1 324 . 1 1 1 A 33 33 LYS C C 33 177.833 178.192 -0.359 1
1 325 . 1 1 1 A 33 33 LYS CA C 33 61.188 59.928 1.260 1
1 326 . 1 1 1 A 33 33 LYS CB C 33 32.572 32.174 0.398 1
1 330 . 1 1 1 A 33 33 LYS N N 33 122.966 124.556 -1.590 1
1 331 . 1 1 1 A 34 34 GLU H H 34 8.902 7.987 0.915 1
1 332 . 1 1 1 A 34 34 GLU HA H 34 4.089 4.126 -0.037 1
1 337 . 1 1 1 A 34 34 GLU C C 34 180.286 178.980 1.306 1
1 338 . 1 1 1 A 34 34 GLU CA C 34 60.483 59.207 1.276 1
1 339 . 1 1 1 A 34 34 GLU CB C 34 28.835 30.055 -1.220 1
1 341 . 1 1 1 A 34 34 GLU N N 34 117.645 119.048 -1.403 1
1 342 . 1 1 1 A 35 35 GLU H H 35 7.673 8.063 -0.390 1
1 343 . 1 1 1 A 35 35 GLU HA H 35 4.023 4.002 0.021 1
1 348 . 1 1 1 A 35 35 GLU C C 35 180.237 179.046 1.191 1
1 349 . 1 1 1 A 35 35 GLU CA C 35 59.214 59.192 0.022 1
1 350 . 1 1 1 A 35 35 GLU CB C 35 30.099 29.293 0.806 1
1 352 . 1 1 1 A 35 35 GLU N N 35 121.077 120.518 0.559 1
1 353 . 1 1 1 A 36 36 ARG H H 36 8.932 8.266 0.666 1
1 354 . 1 1 1 A 36 36 ARG HA H 36 3.928 3.750 0.178 1
1 362 . 1 1 1 A 36 36 ARG C C 36 178.464 179.063 -0.599 1
1 363 . 1 1 1 A 36 36 ARG CA C 36 60.974 59.923 1.051 1
1 364 . 1 1 1 A 36 36 ARG CB C 36 31.171 29.994 1.177 1
1 367 . 1 1 1 A 36 36 ARG N N 36 119.441 120.022 -0.581 1
1 369 . 1 1 1 A 37 37 GLU H H 37 8.756 7.851 0.905 1
1 370 . 1 1 1 A 37 37 GLU HA H 37 3.948 4.100 -0.152 1
1 375 . 1 1 1 A 37 37 GLU C C 37 179.606 178.669 0.937 1
1 376 . 1 1 1 A 37 37 GLU CA C 37 60.094 59.111 0.983 1
1 377 . 1 1 1 A 37 37 GLU CB C 37 29.110 29.361 -0.251 1
1 379 . 1 1 1 A 37 37 GLU N N 37 119.017 119.733 -0.716 1
1 380 . 1 1 1 A 38 38 ALA H H 38 7.733 7.998 -0.265 1
1 381 . 1 1 1 A 38 38 ALA HA H 38 4.325 4.097 0.228 1
1 385 . 1 1 1 A 38 38 ALA C C 38 180.820 178.548 2.272 1
1 386 . 1 1 1 A 38 38 ALA CA C 38 55.194 54.471 0.723 1
1 387 . 1 1 1 A 38 38 ALA CB C 38 17.654 18.509 -0.855 1
1 388 . 1 1 1 A 38 38 ALA N N 38 122.889 122.089 0.800 1
1 389 . 1 1 1 A 39 39 LEU H H 39 7.740 7.962 -0.222 1
1 390 . 1 1 1 A 39 39 LEU HA H 39 4.176 4.274 -0.098 1
1 400 . 1 1 1 A 39 39 LEU C C 39 179.266 178.808 0.458 1
1 401 . 1 1 1 A 39 39 LEU CA C 39 57.944 56.084 1.860 1
1 402 . 1 1 1 A 39 39 LEU CB C 39 42.105 42.356 -0.251 1
1 406 . 1 1 1 A 39 39 LEU N N 39 119.783 116.621 3.162 1
1 407 . 1 1 1 A 40 40 VAL H H 40 8.451 8.455 -0.004 1
1 408 . 1 1 1 A 40 40 VAL HA H 40 3.259 3.621 -0.362 1
1 416 . 1 1 1 A 40 40 VAL C C 40 177.153 177.796 -0.643 1
1 417 . 1 1 1 A 40 40 VAL CA C 40 67.254 66.894 0.360 1
1 418 . 1 1 1 A 40 40 VAL CB C 40 31.747 31.481 0.266 1
1 421 . 1 1 1 A 40 40 VAL N N 40 121.481 119.987 1.494 1
1 422 . 1 1 1 A 41 41 GLU H H 41 7.254 8.109 -0.855 1
1 423 . 1 1 1 A 41 41 GLU HA H 41 4.159 4.106 0.053 1
1 428 . 1 1 1 A 41 41 GLU C C 41 179.483 178.908 0.575 1
1 429 . 1 1 1 A 41 41 GLU CA C 41 59.248 59.503 -0.255 1
1 430 . 1 1 1 A 41 41 GLU CB C 41 29.358 29.273 0.085 1
1 432 . 1 1 1 A 41 41 GLU N N 41 116.549 119.808 -3.259 1
1 433 . 1 1 1 A 42 42 GLU H H 42 8.103 8.132 -0.029 1
1 434 . 1 1 1 A 42 42 GLU HA H 42 4.020 4.048 -0.028 1
1 439 . 1 1 1 A 42 42 GLU C C 42 180.115 178.788 1.327 1
1 440 . 1 1 1 A 42 42 GLU CA C 42 59.847 59.514 0.333 1
1 441 . 1 1 1 A 42 42 GLU CB C 42 30.218 29.402 0.816 1
1 443 . 1 1 1 A 42 42 GLU N N 42 119.578 119.231 0.347 1
1 444 . 1 1 1 A 43 43 CYS H H 43 8.955 8.131 0.824 1
1 445 . 1 1 1 A 43 43 CYS HA H 43 4.153 4.236 -0.083 1
1 448 . 1 1 1 A 43 43 CYS C C 43 176.498 177.641 -1.143 1
1 449 . 1 1 1 A 43 43 CYS CA C 43 64.856 62.456 2.400 1
1 450 . 1 1 1 A 43 43 CYS CB C 43 27.390 27.811 -0.421 1
1 451 . 1 1 1 A 43 43 CYS N N 43 118.199 118.827 -0.628 1
1 452 . 1 1 1 A 44 44 ASN H H 44 8.543 7.977 0.566 1
1 453 . 1 1 1 A 44 44 ASN HA H 44 4.635 4.433 0.202 1
1 458 . 1 1 1 A 44 44 ASN C C 44 178.633 177.670 0.963 1
1 459 . 1 1 1 A 44 44 ASN CA C 44 56.603 56.335 0.268 1
1 460 . 1 1 1 A 44 44 ASN CB C 44 37.187 38.217 -1.030 1
1 461 . 1 1 1 A 44 44 ASN N N 44 117.002 119.664 -2.662 1
1 463 . 1 1 1 A 45 45 ARG H H 45 8.296 8.187 0.109 1
1 464 . 1 1 1 A 45 45 ARG HA H 45 3.977 4.066 -0.089 1
1 471 . 1 1 1 A 45 45 ARG C C 45 178.149 178.498 -0.349 1
1 472 . 1 1 1 A 45 45 ARG CA C 45 60.589 59.586 1.003 1
1 473 . 1 1 1 A 45 45 ARG CB C 45 30.099 30.227 -0.128 1
1 476 . 1 1 1 A 45 45 ARG N N 45 121.021 120.921 0.100 1
1 477 . 1 1 1 A 46 46 ALA H H 46 7.914 8.231 -0.317 1
1 478 . 1 1 1 A 46 46 ALA HA H 46 4.128 4.059 0.069 1
1 482 . 1 1 1 A 46 46 ALA C C 46 181.208 180.048 1.160 1
1 483 . 1 1 1 A 46 46 ALA CA C 46 55.264 54.983 0.281 1
1 484 . 1 1 1 A 46 46 ALA CB C 46 18.759 18.307 0.452 1
1 485 . 1 1 1 A 46 46 ALA N N 46 121.570 120.723 0.847 1
1 486 . 1 1 1 A 47 47 GLU H H 47 8.730 8.362 0.368 1
1 487 . 1 1 1 A 47 47 GLU HA H 47 4.194 4.050 0.144 1
1 492 . 1 1 1 A 47 47 GLU C C 47 180.115 179.048 1.067 1
1 493 . 1 1 1 A 47 47 GLU CA C 47 58.401 59.021 -0.620 1
1 494 . 1 1 1 A 47 47 GLU CB C 47 29.523 29.712 -0.189 1
1 496 . 1 1 1 A 47 47 GLU N N 47 117.532 118.075 -0.543 1
1 497 . 1 1 1 A 48 48 CYS H H 48 8.283 7.923 0.360 1
1 498 . 1 1 1 A 48 48 CYS HA H 48 4.002 4.107 -0.105 1
1 501 . 1 1 1 A 48 48 CYS C C 48 177.031 177.318 -0.287 1
1 502 . 1 1 1 A 48 48 CYS CA C 48 64.749 64.036 0.713 1
1 503 . 1 1 1 A 48 48 CYS CB C 48 25.907 27.259 -1.352 1
1 504 . 1 1 1 A 48 48 CYS N N 48 118.282 119.195 -0.913 1
1 505 . 1 1 1 A 49 49 LEU H H 49 8.181 8.088 0.093 1
1 506 . 1 1 1 A 49 49 LEU HA H 49 4.175 3.905 0.270 1
1 516 . 1 1 1 A 49 49 LEU C C 49 180.430 178.703 1.727 1
1 517 . 1 1 1 A 49 49 LEU CA C 49 57.873 58.185 -0.312 1
1 518 . 1 1 1 A 49 49 LEU CB C 49 41.539 41.595 -0.056 1
1 522 . 1 1 1 A 49 49 LEU N N 49 120.371 120.803 -0.432 1
1 523 . 1 1 1 A 50 50 GLN H H 50 7.934 8.487 -0.553 1
1 524 . 1 1 1 A 50 50 GLN HA H 50 4.102 4.083 0.019 1
1 531 . 1 1 1 A 50 50 GLN C C 50 177.322 177.117 0.205 1
1 532 . 1 1 1 A 50 50 GLN CA C 50 58.156 58.647 -0.491 1
1 533 . 1 1 1 A 50 50 GLN CB C 50 28.616 28.636 -0.020 1
1 535 . 1 1 1 A 50 50 GLN N N 50 118.175 117.376 0.799 1
1 537 . 1 1 1 A 51 51 ARG H H 51 7.632 7.649 -0.017 1
1 538 . 1 1 1 A 51 51 ARG HA H 51 4.347 4.360 -0.013 1
1 545 . 1 1 1 A 51 51 ARG C C 51 176.546 176.460 0.086 1
1 546 . 1 1 1 A 51 51 ARG CA C 51 56.286 55.917 0.369 1
1 547 . 1 1 1 A 51 51 ARG CB C 51 31.314 30.193 1.121 1
1 550 . 1 1 1 A 51 51 ARG N N 51 116.454 117.779 -1.325 1
1 551 . 1 1 1 A 52 52 GLY H H 52 7.949 8.481 -0.532 1
1 552 . 1 1 1 A 52 52 GLY HA2 H 52 4.033 3.965 0.068 1
1 553 . 1 1 1 A 52 52 GLY HA3 H 52 3.903 3.967 -0.064 1
1 554 . 1 1 1 A 52 52 GLY C C 52 174.385 174.114 0.271 1
1 555 . 1 1 1 A 52 52 GLY CA C 52 46.231 45.267 0.964 1
1 556 . 1 1 1 A 52 52 GLY N N 52 108.854 107.590 1.264 1
1 557 . 1 1 1 A 53 53 VAL H H 53 7.944 7.576 0.368 1
1 558 . 1 1 1 A 53 53 VAL HA H 53 4.250 3.969 0.281 1
1 566 . 1 1 1 A 53 53 VAL C C 53 175.525 175.148 0.377 1
1 567 . 1 1 1 A 53 53 VAL CA C 53 60.377 62.584 -2.207 1
1 568 . 1 1 1 A 53 53 VAL CB C 53 34.283 32.775 1.508 1
1 571 . 1 1 1 A 53 53 VAL N N 53 118.316 120.759 -2.443 1
1 572 . 1 1 1 A 54 54 SER H H 54 8.502 8.515 -0.013 1
1 573 . 1 1 1 A 54 54 SER HA H 54 4.625 4.881 -0.256 1
1 576 . 1 1 1 A 54 54 SER C C 54 174.603 174.051 0.552 1
1 577 . 1 1 1 A 54 54 SER CA C 54 56.092 54.214 1.878 1
1 578 . 1 1 1 A 54 54 SER CB C 54 63.697 63.803 -0.106 1
1 579 . 1 1 1 A 54 54 SER N N 54 120.337 118.584 1.753 1
1 580 . 1 1 1 A 55 55 PRO HA H 55 4.624 4.517 0.107 1
1 587 . 1 1 1 A 55 55 PRO C C 55 177.322 177.283 0.039 1
1 588 . 1 1 1 A 55 55 PRO CA C 55 64.431 64.137 0.294 1
1 589 . 1 1 1 A 55 55 PRO CB C 55 31.913 31.638 0.275 1
1 592 . 1 1 1 A 56 56 SER H H 56 7.931 8.448 -0.517 1
1 593 . 1 1 1 A 56 56 SER HA H 56 4.428 4.716 -0.288 1
1 596 . 1 1 1 A 56 56 SER C C 56 174.749 175.087 -0.338 1
1 597 . 1 1 1 A 56 56 SER CA C 56 59.130 58.147 0.983 1
1 598 . 1 1 1 A 56 56 SER CB C 56 63.056 63.941 -0.885 1
1 599 . 1 1 1 A 56 56 SER N N 56 112.637 112.857 -0.220 1
1 600 . 1 1 1 A 57 57 LYS H H 57 8.121 7.628 0.493 1
1 601 . 1 1 1 A 57 57 LYS HA H 57 4.467 4.777 -0.310 1
1 609 . 1 1 1 A 57 57 LYS C C 57 176.570 176.209 0.361 1
1 610 . 1 1 1 A 57 57 LYS CA C 57 55.264 55.229 0.035 1
1 611 . 1 1 1 A 57 57 LYS CB C 57 32.160 33.226 -1.066 1
1 615 . 1 1 1 A 57 57 LYS N N 57 123.185 119.553 3.632 1
1 616 . 1 1 1 A 58 58 ALA H H 58 7.886 7.921 -0.035 1
1 617 . 1 1 1 A 58 58 ALA HA H 58 3.923 3.944 -0.021 1
1 621 . 1 1 1 A 58 58 ALA C C 58 177.469 179.924 -2.455 1
1 622 . 1 1 1 A 58 58 ALA CA C 58 54.276 54.886 -0.610 1
1 623 . 1 1 1 A 58 58 ALA CB C 58 18.271 18.206 0.065 1
1 624 . 1 1 1 A 58 58 ALA N N 58 123.941 123.384 0.557 1
1 625 . 1 1 1 A 59 59 HIS H H 59 8.077 8.135 -0.058 1
1 626 . 1 1 1 A 59 59 HIS HA H 59 4.420 4.404 0.016 1
1 631 . 1 1 1 A 59 59 HIS C C 59 177.542 177.619 -0.077 1
1 632 . 1 1 1 A 59 59 HIS CA C 59 57.767 58.564 -0.797 1
1 633 . 1 1 1 A 59 59 HIS CB C 59 29.852 28.648 1.204 1
1 636 . 1 1 1 A 59 59 HIS N N 59 115.566 115.468 0.098 1
1 637 . 1 1 1 A 60 60 GLY H H 60 8.110 7.905 0.205 1
1 638 . 1 1 1 A 60 60 GLY HA2 H 60 3.873 3.386 0.487 1
1 639 . 1 1 1 A 60 60 GLY HA3 H 60 4.025 3.512 0.513 1
1 640 . 1 1 1 A 60 60 GLY C C 60 174.918 175.693 -0.775 1
1 641 . 1 1 1 A 60 60 GLY CA C 60 45.559 47.072 -1.513 1
1 642 . 1 1 1 A 60 60 GLY N N 60 109.216 110.097 -0.881 1
1 643 . 1 1 1 A 61 61 LEU H H 61 8.280 8.491 -0.211 1
1 644 . 1 1 1 A 61 61 LEU HA H 61 4.198 3.927 0.271 1
1 654 . 1 1 1 A 61 61 LEU C C 61 178.900 177.563 1.337 1
1 655 . 1 1 1 A 61 61 LEU CA C 61 55.758 57.907 -2.149 1
1 656 . 1 1 1 A 61 61 LEU CB C 61 42.544 41.703 0.841 1
1 660 . 1 1 1 A 61 61 LEU N N 61 120.521 123.055 -2.534 1
1 661 . 1 1 1 A 62 62 GLY H H 62 8.184 8.100 0.084 1
1 662 . 1 1 1 A 62 62 GLY HA2 H 62 3.978 3.859 0.119 1
1 663 . 1 1 1 A 62 62 GLY HA3 H 62 3.817 3.866 -0.049 1
1 664 . 1 1 1 A 62 62 GLY C C 62 176.012 175.360 0.652 1
1 665 . 1 1 1 A 62 62 GLY CA C 62 46.767 47.359 -0.592 1
1 666 . 1 1 1 A 62 62 GLY N N 62 108.987 108.349 0.638 1
1 667 . 1 1 1 A 63 63 SER HA H 63 4.322 4.333 -0.011 1
1 670 . 1 1 1 A 63 63 SER C C 63 174.167 175.092 -0.925 1
1 671 . 1 1 1 A 63 63 SER CA C 63 59.919 61.920 -2.001 1
1 672 . 1 1 1 A 63 63 SER CB C 63 63.312 62.971 0.341 1
1 673 . 1 1 1 A 64 64 ASN H H 64 8.087 8.318 -0.231 1
1 674 . 1 1 1 A 64 64 ASN HA H 64 4.850 4.628 0.222 1
1 679 . 1 1 1 A 64 64 ASN C C 64 173.899 175.091 -1.192 1
1 680 . 1 1 1 A 64 64 ASN CA C 64 53.218 53.062 0.156 1
1 681 . 1 1 1 A 64 64 ASN CB C 64 39.164 39.051 0.113 1
1 682 . 1 1 1 A 64 64 ASN N N 64 118.041 116.589 1.452 1
1 684 . 1 1 1 A 65 65 LEU H H 65 7.293 7.648 -0.355 1
1 685 . 1 1 1 A 65 65 LEU HA H 65 3.995 4.711 -0.716 1
1 695 . 1 1 1 A 65 65 LEU C C 65 175.696 175.313 0.383 1
1 696 . 1 1 1 A 65 65 LEU CA C 65 56.005 54.653 1.352 1
1 697 . 1 1 1 A 65 65 LEU CB C 65 43.120 43.771 -0.651 1
1 701 . 1 1 1 A 65 65 LEU N N 65 120.953 123.016 -2.063 1
1 702 . 1 1 1 A 66 66 VAL H H 66 9.517 9.096 0.421 1
1 703 . 1 1 1 A 66 66 VAL HA H 66 3.481 4.498 -1.017 1
1 711 . 1 1 1 A 66 66 VAL C C 66 175.429 175.175 0.254 1
1 712 . 1 1 1 A 66 66 VAL CA C 66 65.243 61.469 3.774 1
1 713 . 1 1 1 A 66 66 VAL CB C 66 31.335 33.266 -1.931 1
1 716 . 1 1 1 A 66 66 VAL N N 66 127.924 126.875 1.049 1
1 717 . 1 1 1 A 67 67 THR H H 67 6.253 8.292 -2.039 1
1 718 . 1 1 1 A 67 67 THR HA H 67 4.779 4.757 0.022 1
1 723 . 1 1 1 A 67 67 THR C C 67 174.894 174.855 0.039 1
1 724 . 1 1 1 A 67 67 THR CA C 67 58.719 59.588 -0.869 1
1 725 . 1 1 1 A 67 67 THR CB C 67 72.153 71.808 0.345 1
1 727 . 1 1 1 A 67 67 THR N N 67 113.376 116.292 -2.916 1
1 728 . 1 1 1 A 68 68 GLU H H 68 9.348 8.867 0.481 1
1 729 . 1 1 1 A 68 68 GLU HA H 68 3.634 3.984 -0.350 1
1 734 . 1 1 1 A 68 68 GLU C C 68 177.809 178.477 -0.668 1
1 735 . 1 1 1 A 68 68 GLU CA C 68 61.505 59.972 1.533 1
1 736 . 1 1 1 A 68 68 GLU CB C 68 28.285 29.680 -1.395 1
1 738 . 1 1 1 A 68 68 GLU N N 68 124.534 122.119 2.415 1
1 739 . 1 1 1 A 69 69 VAL H H 69 8.126 8.069 0.057 1
1 740 . 1 1 1 A 69 69 VAL HA H 69 3.862 3.520 0.342 1
1 748 . 1 1 1 A 69 69 VAL C C 69 177.712 178.006 -0.294 1
1 749 . 1 1 1 A 69 69 VAL CA C 69 65.701 66.912 -1.211 1
1 750 . 1 1 1 A 69 69 VAL CB C 69 31.829 31.444 0.385 1
1 753 . 1 1 1 A 69 69 VAL N N 69 119.139 119.703 -0.564 1
1 754 . 1 1 1 A 70 70 ARG H H 70 7.235 8.047 -0.812 1
1 755 . 1 1 1 A 70 70 ARG HA H 70 4.265 3.817 0.448 1
1 762 . 1 1 1 A 70 70 ARG C C 70 180.430 179.381 1.049 1
1 763 . 1 1 1 A 70 70 ARG CA C 70 59.742 60.024 -0.282 1
1 764 . 1 1 1 A 70 70 ARG CB C 70 29.439 29.746 -0.307 1
1 767 . 1 1 1 A 70 70 ARG N N 70 119.541 119.384 0.157 1
1 768 . 1 1 1 A 71 71 VAL H H 71 8.144 8.064 0.080 1
1 769 . 1 1 1 A 71 71 VAL HA H 71 4.018 3.934 0.084 1
1 777 . 1 1 1 A 71 71 VAL C C 71 177.493 177.949 -0.456 1
1 778 . 1 1 1 A 71 71 VAL CA C 71 67.924 66.571 1.353 1
1 779 . 1 1 1 A 71 71 VAL CB C 71 32.289 31.679 0.610 1
1 782 . 1 1 1 A 71 71 VAL N N 71 120.755 120.281 0.474 1
1 783 . 1 1 1 A 72 72 TYR H H 72 9.411 8.556 0.855 1
1 784 . 1 1 1 A 72 72 TYR HA H 72 3.908 4.247 -0.339 1
1 791 . 1 1 1 A 72 72 TYR C C 72 178.464 178.096 0.368 1
1 792 . 1 1 1 A 72 72 TYR CA C 72 63.444 61.719 1.725 1
1 793 . 1 1 1 A 72 72 TYR CB C 72 38.211 38.658 -0.447 1
1 798 . 1 1 1 A 72 72 TYR N N 72 121.175 121.315 -0.140 1
1 799 . 1 1 1 A 73 73 ASN H H 73 8.816 8.711 0.105 1
1 800 . 1 1 1 A 73 73 ASN HA H 73 4.538 4.623 -0.085 1
1 805 . 1 1 1 A 73 73 ASN C C 73 176.958 178.035 -1.077 1
1 806 . 1 1 1 A 73 73 ASN CA C 73 56.109 56.624 -0.515 1
1 807 . 1 1 1 A 73 73 ASN CB C 73 38.422 38.871 -0.449 1
1 808 . 1 1 1 A 73 73 ASN N N 73 118.122 118.104 0.018 1
1 810 . 1 1 1 A 74 74 TRP H H 74 8.657 8.410 0.247 1
1 811 . 1 1 1 A 74 74 TRP HA H 74 4.111 4.543 -0.432 1
1 820 . 1 1 1 A 74 74 TRP C C 74 179.654 178.364 1.290 1
1 821 . 1 1 1 A 74 74 TRP CA C 74 62.950 61.227 1.723 1
1 822 . 1 1 1 A 74 74 TRP CB C 74 29.555 29.616 -0.061 1
1 828 . 1 1 1 A 74 74 TRP N N 74 123.988 123.273 0.715 1
1 830 . 1 1 1 A 75 75 PHE H H 75 8.562 8.420 0.142 1
1 831 . 1 1 1 A 75 75 PHE HA H 75 3.821 4.445 -0.624 1
1 839 . 1 1 1 A 75 75 PHE C C 75 177.614 178.128 -0.514 1
1 840 . 1 1 1 A 75 75 PHE CA C 75 63.374 62.022 1.352 1
1 841 . 1 1 1 A 75 75 PHE CB C 75 39.648 38.104 1.544 1
1 847 . 1 1 1 A 75 75 PHE N N 75 118.325 117.085 1.240 1
1 848 . 1 1 1 A 76 76 ALA H H 76 8.305 8.109 0.196 1
1 849 . 1 1 1 A 76 76 ALA HA H 76 3.909 3.952 -0.043 1
1 853 . 1 1 1 A 76 76 ALA C C 76 180.868 179.623 1.245 1
1 854 . 1 1 1 A 76 76 ALA CA C 76 55.566 55.100 0.466 1
1 855 . 1 1 1 A 76 76 ALA CB C 76 17.820 18.172 -0.352 1
1 856 . 1 1 1 A 76 76 ALA N N 76 121.119 122.553 -1.434 1
1 857 . 1 1 1 A 77 77 ASN H H 77 8.335 8.213 0.122 1
1 858 . 1 1 1 A 77 77 ASN HA H 77 4.355 4.320 0.035 1
1 863 . 1 1 1 A 77 77 ASN C C 77 177.105 177.931 -0.826 1
1 864 . 1 1 1 A 77 77 ASN CA C 77 56.145 56.193 -0.048 1
1 865 . 1 1 1 A 77 77 ASN CB C 77 38.063 38.547 -0.484 1
1 866 . 1 1 1 A 77 77 ASN N N 77 117.433 116.687 0.746 1
1 868 . 1 1 1 A 78 78 ARG H H 78 7.664 7.520 0.144 1
1 869 . 1 1 1 A 78 78 ARG HA H 78 3.629 3.723 -0.094 1
1 876 . 1 1 1 A 78 78 ARG C C 78 179.216 177.527 1.689 1
1 877 . 1 1 1 A 78 78 ARG CA C 78 58.773 58.479 0.294 1
1 878 . 1 1 1 A 78 78 ARG CB C 78 29.605 29.044 0.561 1
1 881 . 1 1 1 A 78 78 ARG N N 78 121.999 118.575 3.424 1
1 882 . 1 1 1 A 79 79 ARG H H 79 8.320 7.434 0.886 1
1 883 . 1 1 1 A 79 79 ARG HA H 79 4.307 4.306 0.001 1
1 890 . 1 1 1 A 79 79 ARG C C 79 180.406 178.454 1.952 1
1 891 . 1 1 1 A 79 79 ARG CA C 79 60.270 57.489 2.781 1
1 892 . 1 1 1 A 79 79 ARG CB C 79 31.335 30.672 0.663 1
1 895 . 1 1 1 A 79 79 ARG N N 79 118.139 118.036 0.103 1
1 896 . 1 1 1 A 80 80 LYS H H 80 7.759 7.898 -0.139 1
1 897 . 1 1 1 A 80 80 LYS HA H 80 4.052 4.178 -0.126 1
1 905 . 1 1 1 A 80 80 LYS C C 80 178.999 179.302 -0.303 1
1 906 . 1 1 1 A 80 80 LYS CA C 80 59.531 59.415 0.116 1
1 907 . 1 1 1 A 80 80 LYS CB C 80 32.374 32.500 -0.126 1
1 911 . 1 1 1 A 80 80 LYS N N 80 120.899 119.436 1.463 1
1 912 . 1 1 1 A 81 81 GLU H H 81 8.041 8.326 -0.285 1
1 913 . 1 1 1 A 81 81 GLU HA H 81 4.044 4.167 -0.123 1
1 918 . 1 1 1 A 81 81 GLU C C 81 179.168 178.407 0.761 1
1 919 . 1 1 1 A 81 81 GLU CA C 81 59.036 59.489 -0.453 1
1 920 . 1 1 1 A 81 81 GLU CB C 81 29.561 29.169 0.392 1
1 922 . 1 1 1 A 81 81 GLU N N 81 120.193 118.786 1.407 1
1 923 . 1 1 1 A 82 82 GLU H H 82 8.131 8.429 -0.298 1
1 924 . 1 1 1 A 82 82 GLU HA H 82 4.017 4.084 -0.067 1
1 929 . 1 1 1 A 82 82 GLU C C 82 178.343 178.173 0.170 1
1 930 . 1 1 1 A 82 82 GLU CA C 82 59.319 59.203 0.116 1
1 931 . 1 1 1 A 82 82 GLU CB C 82 29.770 29.209 0.561 1
1 933 . 1 1 1 A 82 82 GLU N N 82 119.626 118.469 1.157 1
1 934 . 1 1 1 A 83 83 ALA H H 83 7.935 7.747 0.188 1
1 935 . 1 1 1 A 83 83 ALA HA H 83 4.180 4.190 -0.010 1
1 939 . 1 1 1 A 83 83 ALA C C 83 179.994 179.460 0.534 1
1 940 . 1 1 1 A 83 83 ALA CA C 83 54.629 53.931 0.698 1
1 941 . 1 1 1 A 83 83 ALA CB C 83 18.090 18.843 -0.753 1
1 942 . 1 1 1 A 83 83 ALA N N 83 121.476 121.909 -0.433 1
1 943 . 1 1 1 A 84 84 PHE H H 84 8.043 8.195 -0.152 1
1 944 . 1 1 1 A 84 84 PHE HA H 84 4.420 4.062 0.358 1
1 952 . 1 1 1 A 84 84 PHE C C 84 177.250 177.125 0.125 1
1 953 . 1 1 1 A 84 84 PHE CA C 84 60.059 61.687 -1.628 1
1 954 . 1 1 1 A 84 84 PHE CB C 84 38.952 39.383 -0.431 1
1 960 . 1 1 1 A 84 84 PHE N N 84 119.074 120.555 -1.481 1
1 961 . 1 1 1 A 85 85 ARG H H 85 8.031 8.385 -0.354 1
1 962 . 1 1 1 A 85 85 ARG HA H 85 3.992 4.132 -0.140 1
1 968 . 1 1 1 A 85 85 ARG C C 85 178.319 178.156 0.163 1
1 969 . 1 1 1 A 85 85 ARG CA C 85 58.523 59.536 -1.013 1
1 970 . 1 1 1 A 85 85 ARG CB C 85 30.346 29.981 0.365 1
1 973 . 1 1 1 A 85 85 ARG N N 85 119.291 117.460 1.831 1
1 974 . 1 1 1 A 86 86 GLN H H 86 8.091 7.752 0.339 1
1 975 . 1 1 1 A 86 86 GLN HA H 86 4.148 4.332 -0.184 1
1 982 . 1 1 1 A 86 86 GLN C C 86 177.105 178.241 -1.136 1
1 983 . 1 1 1 A 86 86 GLN CA C 86 57.556 57.298 0.258 1
1 984 . 1 1 1 A 86 86 GLN CB C 86 28.855 29.392 -0.537 1
1 986 . 1 1 1 A 86 86 GLN N N 86 119.097 117.464 1.633 1
1 988 . 1 1 1 A 87 87 LYS H H 87 7.898 8.132 -0.234 1
1 989 . 1 1 1 A 87 87 LYS HA H 87 4.116 4.128 -0.012 1
1 997 . 1 1 1 A 87 87 LYS C C 87 177.542 179.024 -1.482 1
1 998 . 1 1 1 A 87 87 LYS CA C 87 57.944 58.847 -0.903 1
1 999 . 1 1 1 A 87 87 LYS CB C 87 32.242 31.804 0.438 1
1 1003 . 1 1 1 A 87 87 LYS N N 87 120.968 121.680 -0.712 1
1 1004 . 1 1 1 A 88 88 LEU H H 88 7.903 8.158 -0.255 1
1 1005 . 1 1 1 A 88 88 LEU HA H 88 4.144 4.184 -0.040 1
1 1015 . 1 1 1 A 88 88 LEU C C 88 178.221 178.086 0.135 1
1 1016 . 1 1 1 A 88 88 LEU CA C 88 56.145 56.894 -0.749 1
1 1017 . 1 1 1 A 88 88 LEU CB C 88 42.215 41.557 0.658 1
1 1021 . 1 1 1 A 88 88 LEU N N 88 120.558 117.348 3.210 1
1 1022 . 1 1 1 A 89 89 ALA H H 89 7.894 7.397 0.497 1
1 1023 . 1 1 1 A 89 89 ALA HA H 89 4.224 4.281 -0.057 1
1 1027 . 1 1 1 A 89 89 ALA C C 89 178.609 179.355 -0.746 1
1 1028 . 1 1 1 A 89 89 ALA CA C 89 53.392 53.335 0.057 1
1 1029 . 1 1 1 A 89 89 ALA CB C 89 18.695 19.198 -0.503 1
1 1030 . 1 1 1 A 89 89 ALA N N 89 122.387 122.414 -0.027 1
1 1031 . 1 1 1 A 90 90 MET H H 90 8.084 7.805 0.279 1
1 1032 . 1 1 1 A 90 90 MET HA H 90 4.356 4.171 0.185 1
1 1040 . 1 1 1 A 90 90 MET C C 90 176.982 176.334 0.648 1
1 1041 . 1 1 1 A 90 90 MET CA C 90 56.551 57.553 -1.002 1
1 1042 . 1 1 1 A 90 90 MET CB C 90 32.719 31.189 1.530 1
1 1045 . 1 1 1 A 90 90 MET N N 90 118.509 116.879 1.630 1
1 1046 . 1 1 1 A 91 91 ASP H H 91 8.261 7.717 0.544 1
1 1047 . 1 1 1 A 91 91 ASP HA H 91 4.524 4.589 -0.065 1
1 1050 . 1 1 1 A 91 91 ASP C C 91 176.643 176.225 0.418 1
1 1051 . 1 1 1 A 91 91 ASP CA C 91 54.981 53.877 1.104 1
1 1052 . 1 1 1 A 91 91 ASP CB C 91 40.870 41.462 -0.592 1
1 1053 . 1 1 1 A 91 91 ASP N N 91 120.771 121.686 -0.915 1
1 1054 . 1 1 1 A 92 92 ALA H H 92 7.971 8.512 -0.541 1
1 1055 . 1 1 1 A 92 92 ALA HA H 92 4.200 4.354 -0.154 1
1 1059 . 1 1 1 A 92 92 ALA C C 92 177.929 177.323 0.606 1
1 1060 . 1 1 1 A 92 92 ALA CA C 92 53.184 51.785 1.399 1
1 1061 . 1 1 1 A 92 92 ALA CB C 92 18.890 19.783 -0.893 1
1 1062 . 1 1 1 A 92 92 ALA N N 92 123.057 124.270 -1.213 1
1 1063 . 1 1 1 A 93 93 TYR H H 93 8.019 8.276 -0.257 1
1 1064 . 1 1 1 A 93 93 TYR HA H 93 4.523 4.065 0.458 1
1 1071 . 1 1 1 A 93 93 TYR C C 93 176.279 174.192 2.087 1
1 1072 . 1 1 1 A 93 93 TYR CA C 93 58.401 58.842 -0.441 1
1 1073 . 1 1 1 A 93 93 TYR CB C 93 38.669 35.469 3.200 1
1 1078 . 1 1 1 A 93 93 TYR N N 93 118.337 115.446 2.891 1
1 1079 . 1 1 1 A 94 94 SER H H 94 8.037 7.784 0.253 1
1 1080 . 1 1 1 A 94 94 SER HA H 94 4.484 4.942 -0.458 1
1 1082 . 1 1 1 A 94 94 SER C C 94 174.554 173.517 1.037 1
1 1083 . 1 1 1 A 94 94 SER CA C 94 58.401 55.846 2.555 1
1 1084 . 1 1 1 A 94 94 SER CB C 94 63.806 65.550 -1.744 1
1 1085 . 1 1 1 A 94 94 SER N N 94 116.640 113.980 2.660 1
1 1086 . 1 1 1 A 96 96 ASN HA H 96 4.770 4.938 -0.168 1
1 1091 . 1 1 1 A 96 96 ASN C C 96 175.161 173.982 1.179 1
1 1092 . 1 1 1 A 96 96 ASN CA C 96 53.395 52.181 1.214 1
1 1093 . 1 1 1 A 96 96 ASN CB C 96 38.999 41.677 -2.678 1
1 1095 . 1 1 1 A 97 97 SER H H 97 8.230 8.558 -0.328 1
1 1096 . 1 1 1 A 97 97 SER HA H 97 4.481 4.489 -0.008 1
1 1099 . 1 1 1 A 97 97 SER C C 97 174.482 174.662 -0.180 1
1 1100 . 1 1 1 A 97 97 SER CA C 97 58.300 59.673 -1.373 1
1 1101 . 1 1 1 A 97 97 SER CB C 97 63.697 63.695 0.002 1
1 1102 . 1 1 1 A 97 97 SER N N 97 115.866 117.769 -1.903 1
1 1103 . 1 1 1 A 98 98 GLY H H 98 8.228 8.141 0.087 1
1 1104 . 1 1 1 A 98 98 GLY HA2 H 98 4.098 4.134 -0.036 1
1 1105 . 1 1 1 A 98 98 GLY HA3 H 98 4.098 4.135 -0.037 1
1 1106 . 1 1 1 A 98 98 GLY C C 98 171.788 170.809 0.979 1
1 1107 . 1 1 1 A 98 98 GLY CA C 98 44.803 45.245 -0.442 1
1 1108 . 1 1 1 A 98 98 GLY N N 98 110.658 110.574 0.084 1
1 1109 . 1 1 1 A 99 99 PRO HA H 99 4.463 4.557 -0.094 1
1 1116 . 1 1 1 A 99 99 PRO CA C 99 63.230 62.705 0.525 1
1 1117 . 1 1 1 A 99 99 PRO CB C 99 32.044 32.510 -0.466 1
1 1120 . 1 1 1 A 100 100 SER H H 100 8.514 8.418 0.096 1
1 1121 . 1 1 1 A 100 100 SER CA C 100 58.450 57.911 0.539 1
1 1122 . 1 1 1 A 100 100 SER CB C 100 63.889 64.156 -0.267 1
1 1 . 2 1 1 A 9 9 ASN H H 9 8.856 8.960 -0.104 1
1 2 . 2 1 1 A 9 9 ASN HA H 9 4.694 5.068 -0.374 1
1 7 . 2 1 1 A 9 9 ASN CA C 9 53.401 52.042 1.359 1
1 8 . 2 1 1 A 9 9 ASN CB C 9 38.757 40.607 -1.850 1
1 10 . 2 1 1 A 10 10 ARG HA H 10 4.346 5.179 -0.833 1
1 17 . 2 1 1 A 10 10 ARG C C 10 175.405 174.730 0.675 1
1 18 . 2 1 1 A 10 10 ARG CA C 10 56.181 54.818 1.363 1
1 19 . 2 1 1 A 10 10 ARG CB C 10 31.171 32.403 -1.232 1
1 22 . 2 1 1 A 11 11 PHE H H 11 8.310 8.659 -0.349 1
1 23 . 2 1 1 A 11 11 PHE HA H 11 4.291 4.706 -0.415 1
1 31 . 2 1 1 A 11 11 PHE C C 11 174.458 172.851 1.607 1
1 32 . 2 1 1 A 11 11 PHE CA C 11 58.967 58.315 0.652 1
1 33 . 2 1 1 A 11 11 PHE CB C 11 40.138 41.465 -1.327 1
1 39 . 2 1 1 A 11 11 PHE N N 11 123.604 127.307 -3.703 1
1 40 . 2 1 1 A 12 12 LYS H H 12 7.307 8.615 -1.308 1
1 41 . 2 1 1 A 12 12 LYS HA H 12 4.165 4.600 -0.435 1
1 50 . 2 1 1 A 12 12 LYS C C 12 174.385 175.922 -1.537 1
1 51 . 2 1 1 A 12 12 LYS CA C 12 54.593 53.966 0.627 1
1 52 . 2 1 1 A 12 12 LYS CB C 12 34.712 35.395 -0.683 1
1 56 . 2 1 1 A 12 12 LYS N N 12 127.282 128.251 -0.969 1
1 57 . 2 1 1 A 13 13 TRP H H 13 8.039 8.349 -0.310 1
1 58 . 2 1 1 A 13 13 TRP HA H 13 4.370 4.592 -0.222 1
1 67 . 2 1 1 A 13 13 TRP C C 13 177.857 176.446 1.411 1
1 68 . 2 1 1 A 13 13 TRP CA C 13 56.675 56.947 -0.272 1
1 69 . 2 1 1 A 13 13 TRP CB C 13 30.317 30.279 0.038 1
1 75 . 2 1 1 A 13 13 TRP N N 13 124.264 126.956 -2.692 1
1 77 . 2 1 1 A 14 14 GLY H H 14 9.815 8.631 1.184 1
1 78 . 2 1 1 A 14 14 GLY HA2 H 14 4.370 4.194 0.176 1
1 79 . 2 1 1 A 14 14 GLY HA3 H 14 4.335 4.210 0.125 1
1 80 . 2 1 1 A 14 14 GLY C C 14 172.904 174.763 -1.859 1
1 81 . 2 1 1 A 14 14 GLY CA C 14 44.157 43.878 0.279 1
1 82 . 2 1 1 A 14 14 GLY N N 14 115.294 108.664 6.630 1
1 83 . 2 1 1 A 15 15 PRO HA H 15 4.327 4.377 -0.050 1
1 90 . 2 1 1 A 15 15 PRO C C 15 179.726 178.874 0.852 1
1 91 . 2 1 1 A 15 15 PRO CA C 15 65.171 65.283 -0.112 1
1 92 . 2 1 1 A 15 15 PRO CB C 15 31.829 31.840 -0.011 1
1 95 . 2 1 1 A 16 16 ALA H H 16 9.214 8.139 1.075 1
1 96 . 2 1 1 A 16 16 ALA HA H 16 4.166 4.110 0.056 1
1 100 . 2 1 1 A 16 16 ALA C C 16 181.184 179.669 1.515 1
1 101 . 2 1 1 A 16 16 ALA CA C 16 55.370 55.244 0.126 1
1 102 . 2 1 1 A 16 16 ALA CB C 16 18.058 18.791 -0.733 1
1 103 . 2 1 1 A 16 16 ALA N N 16 122.414 119.797 2.617 1
1 104 . 2 1 1 A 17 17 SER H H 17 7.985 8.172 -0.187 1
1 105 . 2 1 1 A 17 17 SER HA H 17 4.317 4.102 0.215 1
1 107 . 2 1 1 A 17 17 SER C C 17 175.381 176.708 -1.327 1
1 108 . 2 1 1 A 17 17 SER CA C 17 63.163 62.169 0.994 1
1 109 . 2 1 1 A 17 17 SER CB C 17 64.055 62.942 1.113 1
1 110 . 2 1 1 A 17 17 SER N N 17 116.568 114.344 2.224 1
1 111 . 2 1 1 A 18 18 GLN H H 18 8.316 7.874 0.442 1
1 112 . 2 1 1 A 18 18 GLN HA H 18 3.323 3.456 -0.133 1
1 119 . 2 1 1 A 18 18 GLN C C 18 176.812 178.548 -1.736 1
1 120 . 2 1 1 A 18 18 GLN CA C 18 60.025 59.068 0.957 1
1 121 . 2 1 1 A 18 18 GLN CB C 18 28.686 28.390 0.296 1
1 123 . 2 1 1 A 18 18 GLN N N 18 119.002 120.926 -1.924 1
1 125 . 2 1 1 A 19 19 GLN H H 19 7.582 8.199 -0.617 1
1 126 . 2 1 1 A 19 19 GLN HA H 19 4.062 4.086 -0.024 1
1 133 . 2 1 1 A 19 19 GLN C C 19 178.488 178.560 -0.072 1
1 134 . 2 1 1 A 19 19 GLN CA C 19 59.248 59.270 -0.022 1
1 135 . 2 1 1 A 19 19 GLN CB C 19 28.203 28.128 0.075 1
1 137 . 2 1 1 A 19 19 GLN N N 19 116.221 118.635 -2.414 1
1 139 . 2 1 1 A 20 20 ILE H H 20 7.246 8.075 -0.829 1
1 140 . 2 1 1 A 20 20 ILE HA H 20 3.570 3.620 -0.050 1
1 150 . 2 1 1 A 20 20 ILE C C 20 178.999 178.542 0.457 1
1 151 . 2 1 1 A 20 20 ILE CA C 20 64.996 65.445 -0.449 1
1 152 . 2 1 1 A 20 20 ILE CB C 20 38.139 37.430 0.709 1
1 156 . 2 1 1 A 20 20 ILE N N 20 120.521 120.934 -0.413 1
1 157 . 2 1 1 A 21 21 LEU H H 21 8.034 7.800 0.234 1
1 158 . 2 1 1 A 21 21 LEU HA H 21 3.491 3.556 -0.065 1
1 168 . 2 1 1 A 21 21 LEU C C 21 178.196 178.415 -0.219 1
1 169 . 2 1 1 A 21 21 LEU CA C 21 57.944 57.404 0.540 1
1 170 . 2 1 1 A 21 21 LEU CB C 21 37.864 40.475 -2.611 1
1 174 . 2 1 1 A 21 21 LEU N N 21 121.259 119.244 2.015 1
1 175 . 2 1 1 A 22 22 TYR H H 22 8.479 7.593 0.886 1
1 176 . 2 1 1 A 22 22 TYR HA H 22 4.224 4.281 -0.057 1
1 183 . 2 1 1 A 22 22 TYR C C 22 179.630 178.605 1.025 1
1 184 . 2 1 1 A 22 22 TYR CA C 22 62.422 60.891 1.531 1
1 185 . 2 1 1 A 22 22 TYR CB C 22 37.434 37.715 -0.281 1
1 190 . 2 1 1 A 22 22 TYR N N 22 117.805 118.973 -1.168 1
1 191 . 2 1 1 A 23 23 GLN H H 23 7.707 8.315 -0.608 1
1 192 . 2 1 1 A 23 23 GLN HA H 23 4.166 4.054 0.112 1
1 199 . 2 1 1 A 23 23 GLN C C 23 178.633 178.632 0.001 1
1 200 . 2 1 1 A 23 23 GLN CA C 23 58.789 59.154 -0.365 1
1 201 . 2 1 1 A 23 23 GLN CB C 23 28.534 28.204 0.330 1
1 203 . 2 1 1 A 23 23 GLN N N 23 117.580 118.223 -0.643 1
1 205 . 2 1 1 A 24 24 ALA H H 24 8.155 7.898 0.257 1
1 206 . 2 1 1 A 24 24 ALA HA H 24 4.187 4.220 -0.033 1
1 210 . 2 1 1 A 24 24 ALA C C 24 180.018 179.295 0.723 1
1 211 . 2 1 1 A 24 24 ALA CA C 24 55.228 55.118 0.110 1
1 212 . 2 1 1 A 24 24 ALA CB C 24 19.468 18.543 0.925 1
1 213 . 2 1 1 A 24 24 ALA N N 24 122.813 122.238 0.575 1
1 214 . 2 1 1 A 25 25 TYR H H 25 8.995 8.383 0.612 1
1 215 . 2 1 1 A 25 25 TYR HA H 25 4.348 4.865 -0.517 1
1 222 . 2 1 1 A 25 25 TYR C C 25 175.792 177.427 -1.635 1
1 223 . 2 1 1 A 25 25 TYR CA C 25 61.681 61.784 -0.103 1
1 224 . 2 1 1 A 25 25 TYR CB C 25 38.175 38.650 -0.475 1
1 229 . 2 1 1 A 25 25 TYR N N 25 121.343 120.544 0.799 1
1 230 . 2 1 1 A 26 26 ASP H H 26 7.260 8.704 -1.444 1
1 231 . 2 1 1 A 26 26 ASP HA H 26 4.373 4.487 -0.114 1
1 234 . 2 1 1 A 26 26 ASP C C 26 177.322 178.301 -0.979 1
1 235 . 2 1 1 A 26 26 ASP CA C 26 56.603 57.520 -0.917 1
1 236 . 2 1 1 A 26 26 ASP CB C 26 41.060 41.708 -0.648 1
1 237 . 2 1 1 A 26 26 ASP N N 26 114.020 119.282 -5.262 1
1 238 . 2 1 1 A 27 27 ARG H H 27 7.343 7.902 -0.559 1
1 239 . 2 1 1 A 27 27 ARG HA H 27 4.302 4.358 -0.056 1
1 246 . 2 1 1 A 27 27 ARG C C 27 176.546 176.213 0.333 1
1 247 . 2 1 1 A 27 27 ARG CA C 27 57.563 57.748 -0.185 1
1 248 . 2 1 1 A 27 27 ARG CB C 27 31.500 31.394 0.106 1
1 251 . 2 1 1 A 27 27 ARG N N 27 116.729 116.785 -0.056 1
1 252 . 2 1 1 A 28 28 GLN H H 28 8.306 7.903 0.403 1
1 253 . 2 1 1 A 28 28 GLN HA H 28 4.396 4.745 -0.349 1
1 260 . 2 1 1 A 28 28 GLN C C 28 172.831 175.140 -2.309 1
1 261 . 2 1 1 A 28 28 GLN CA C 28 55.355 54.304 1.051 1
1 262 . 2 1 1 A 28 28 GLN CB C 28 31.062 31.850 -0.788 1
1 264 . 2 1 1 A 28 28 GLN N N 28 121.612 118.378 3.234 1
1 266 . 2 1 1 A 29 29 LYS H H 29 8.354 8.585 -0.231 1
1 267 . 2 1 1 A 29 29 LYS HA H 29 4.099 3.600 0.499 1
1 276 . 2 1 1 A 29 29 LYS C C 29 176.084 176.450 -0.366 1
1 277 . 2 1 1 A 29 29 LYS CA C 29 57.873 57.302 0.571 1
1 278 . 2 1 1 A 29 29 LYS CB C 29 33.313 32.777 0.536 1
1 282 . 2 1 1 A 29 29 LYS N N 29 125.038 123.551 1.487 1
1 283 . 2 1 1 A 30 30 ASN H H 30 8.856 7.996 0.860 1
1 284 . 2 1 1 A 30 30 ASN HA H 30 4.958 5.088 -0.130 1
1 289 . 2 1 1 A 30 30 ASN C C 30 171.179 172.622 -1.443 1
1 290 . 2 1 1 A 30 30 ASN CA C 30 50.891 50.355 0.536 1
1 291 . 2 1 1 A 30 30 ASN CB C 30 39.907 39.209 0.698 1
1 292 . 2 1 1 A 30 30 ASN N N 30 115.764 117.409 -1.645 1
1 294 . 2 1 1 A 31 31 PRO HA H 31 4.299 4.449 -0.150 1
1 301 . 2 1 1 A 31 31 PRO C C 31 177.493 176.694 0.799 1
1 302 . 2 1 1 A 31 31 PRO CA C 31 62.489 62.551 -0.062 1
1 303 . 2 1 1 A 31 31 PRO CB C 31 31.216 31.738 -0.522 1
1 306 . 2 1 1 A 32 32 SER H H 32 9.368 8.478 0.890 1
1 307 . 2 1 1 A 32 32 SER HA H 32 4.372 4.764 -0.392 1
1 310 . 2 1 1 A 32 32 SER C C 32 174.821 175.753 -0.932 1
1 311 . 2 1 1 A 32 32 SER CA C 32 57.203 57.529 -0.326 1
1 312 . 2 1 1 A 32 32 SER CB C 32 65.594 64.553 1.041 1
1 313 . 2 1 1 A 32 32 SER N N 32 120.847 117.798 3.049 1
1 314 . 2 1 1 A 33 33 LYS H H 33 9.152 8.974 0.178 1
1 315 . 2 1 1 A 33 33 LYS HA H 33 3.719 3.892 -0.173 1
1 324 . 2 1 1 A 33 33 LYS C C 33 177.833 178.263 -0.430 1
1 325 . 2 1 1 A 33 33 LYS CA C 33 61.188 60.321 0.867 1
1 326 . 2 1 1 A 33 33 LYS CB C 33 32.572 32.401 0.171 1
1 330 . 2 1 1 A 33 33 LYS N N 33 122.966 124.648 -1.682 1
1 331 . 2 1 1 A 34 34 GLU H H 34 8.902 8.523 0.379 1
1 332 . 2 1 1 A 34 34 GLU HA H 34 4.089 4.019 0.070 1
1 337 . 2 1 1 A 34 34 GLU C C 34 180.286 179.101 1.185 1
1 338 . 2 1 1 A 34 34 GLU CA C 34 60.483 59.326 1.157 1
1 339 . 2 1 1 A 34 34 GLU CB C 34 28.835 29.367 -0.532 1
1 341 . 2 1 1 A 34 34 GLU N N 34 117.645 117.964 -0.319 1
1 342 . 2 1 1 A 35 35 GLU H H 35 7.673 8.212 -0.539 1
1 343 . 2 1 1 A 35 35 GLU HA H 35 4.023 3.930 0.093 1
1 348 . 2 1 1 A 35 35 GLU C C 35 180.237 179.335 0.902 1
1 349 . 2 1 1 A 35 35 GLU CA C 35 59.214 59.383 -0.169 1
1 350 . 2 1 1 A 35 35 GLU CB C 35 30.099 29.237 0.862 1
1 352 . 2 1 1 A 35 35 GLU N N 35 121.077 119.942 1.135 1
1 353 . 2 1 1 A 36 36 ARG H H 36 8.932 8.265 0.667 1
1 354 . 2 1 1 A 36 36 ARG HA H 36 3.928 3.783 0.145 1
1 362 . 2 1 1 A 36 36 ARG C C 36 178.464 179.142 -0.678 1
1 363 . 2 1 1 A 36 36 ARG CA C 36 60.974 60.116 0.858 1
1 364 . 2 1 1 A 36 36 ARG CB C 36 31.171 29.831 1.340 1
1 367 . 2 1 1 A 36 36 ARG N N 36 119.441 120.084 -0.643 1
1 369 . 2 1 1 A 37 37 GLU H H 37 8.756 8.508 0.248 1
1 370 . 2 1 1 A 37 37 GLU HA H 37 3.948 4.099 -0.151 1
1 375 . 2 1 1 A 37 37 GLU C C 37 179.606 179.061 0.545 1
1 376 . 2 1 1 A 37 37 GLU CA C 37 60.094 59.052 1.042 1
1 377 . 2 1 1 A 37 37 GLU CB C 37 29.110 29.209 -0.099 1
1 379 . 2 1 1 A 37 37 GLU N N 37 119.017 119.752 -0.735 1
1 380 . 2 1 1 A 38 38 ALA H H 38 7.733 8.116 -0.383 1
1 381 . 2 1 1 A 38 38 ALA HA H 38 4.325 4.122 0.203 1
1 385 . 2 1 1 A 38 38 ALA C C 38 180.820 178.426 2.394 1
1 386 . 2 1 1 A 38 38 ALA CA C 38 55.194 54.410 0.784 1
1 387 . 2 1 1 A 38 38 ALA CB C 38 17.654 18.572 -0.918 1
1 388 . 2 1 1 A 38 38 ALA N N 38 122.889 121.875 1.014 1
1 389 . 2 1 1 A 39 39 LEU H H 39 7.740 7.843 -0.103 1
1 390 . 2 1 1 A 39 39 LEU HA H 39 4.176 4.251 -0.075 1
1 400 . 2 1 1 A 39 39 LEU C C 39 179.266 178.797 0.469 1
1 401 . 2 1 1 A 39 39 LEU CA C 39 57.944 56.094 1.850 1
1 402 . 2 1 1 A 39 39 LEU CB C 39 42.105 42.356 -0.251 1
1 406 . 2 1 1 A 39 39 LEU N N 39 119.783 117.193 2.590 1
1 407 . 2 1 1 A 40 40 VAL H H 40 8.451 8.158 0.293 1
1 408 . 2 1 1 A 40 40 VAL HA H 40 3.259 3.644 -0.385 1
1 416 . 2 1 1 A 40 40 VAL C C 40 177.153 177.682 -0.529 1
1 417 . 2 1 1 A 40 40 VAL CA C 40 67.254 66.978 0.276 1
1 418 . 2 1 1 A 40 40 VAL CB C 40 31.747 31.431 0.316 1
1 421 . 2 1 1 A 40 40 VAL N N 40 121.481 119.991 1.490 1
1 422 . 2 1 1 A 41 41 GLU H H 41 7.254 7.987 -0.733 1
1 423 . 2 1 1 A 41 41 GLU HA H 41 4.159 4.137 0.022 1
1 428 . 2 1 1 A 41 41 GLU C C 41 179.483 178.829 0.654 1
1 429 . 2 1 1 A 41 41 GLU CA C 41 59.248 59.349 -0.101 1
1 430 . 2 1 1 A 41 41 GLU CB C 41 29.358 29.525 -0.167 1
1 432 . 2 1 1 A 41 41 GLU N N 41 116.549 119.822 -3.273 1
1 433 . 2 1 1 A 42 42 GLU H H 42 8.103 7.801 0.302 1
1 434 . 2 1 1 A 42 42 GLU HA H 42 4.020 4.049 -0.029 1
1 439 . 2 1 1 A 42 42 GLU C C 42 180.115 178.769 1.346 1
1 440 . 2 1 1 A 42 42 GLU CA C 42 59.847 59.531 0.316 1
1 441 . 2 1 1 A 42 42 GLU CB C 42 30.218 29.221 0.997 1
1 443 . 2 1 1 A 42 42 GLU N N 42 119.578 119.363 0.215 1
1 444 . 2 1 1 A 43 43 CYS H H 43 8.955 8.155 0.800 1
1 445 . 2 1 1 A 43 43 CYS HA H 43 4.153 4.219 -0.066 1
1 448 . 2 1 1 A 43 43 CYS C C 43 176.498 177.493 -0.995 1
1 449 . 2 1 1 A 43 43 CYS CA C 43 64.856 62.468 2.388 1
1 450 . 2 1 1 A 43 43 CYS CB C 43 27.390 27.819 -0.429 1
1 451 . 2 1 1 A 43 43 CYS N N 43 118.199 118.797 -0.598 1
1 452 . 2 1 1 A 44 44 ASN H H 44 8.543 7.914 0.629 1
1 453 . 2 1 1 A 44 44 ASN HA H 44 4.635 4.423 0.212 1
1 458 . 2 1 1 A 44 44 ASN C C 44 178.633 177.510 1.123 1
1 459 . 2 1 1 A 44 44 ASN CA C 44 56.603 56.362 0.241 1
1 460 . 2 1 1 A 44 44 ASN CB C 44 37.187 38.028 -0.841 1
1 461 . 2 1 1 A 44 44 ASN N N 44 117.002 119.450 -2.448 1
1 463 . 2 1 1 A 45 45 ARG H H 45 8.296 8.221 0.075 1
1 464 . 2 1 1 A 45 45 ARG HA H 45 3.977 4.009 -0.032 1
1 471 . 2 1 1 A 45 45 ARG C C 45 178.149 178.288 -0.139 1
1 472 . 2 1 1 A 45 45 ARG CA C 45 60.589 59.592 0.997 1
1 473 . 2 1 1 A 45 45 ARG CB C 45 30.099 30.149 -0.050 1
1 476 . 2 1 1 A 45 45 ARG N N 45 121.021 121.244 -0.223 1
1 477 . 2 1 1 A 46 46 ALA H H 46 7.914 8.203 -0.289 1
1 478 . 2 1 1 A 46 46 ALA HA H 46 4.128 4.117 0.011 1
1 482 . 2 1 1 A 46 46 ALA C C 46 181.208 180.227 0.981 1
1 483 . 2 1 1 A 46 46 ALA CA C 46 55.264 54.919 0.345 1
1 484 . 2 1 1 A 46 46 ALA CB C 46 18.759 18.506 0.253 1
1 485 . 2 1 1 A 46 46 ALA N N 46 121.570 120.712 0.858 1
1 486 . 2 1 1 A 47 47 GLU H H 47 8.730 8.626 0.104 1
1 487 . 2 1 1 A 47 47 GLU HA H 47 4.194 4.039 0.155 1
1 492 . 2 1 1 A 47 47 GLU C C 47 180.115 179.163 0.952 1
1 493 . 2 1 1 A 47 47 GLU CA C 47 58.401 59.609 -1.208 1
1 494 . 2 1 1 A 47 47 GLU CB C 47 29.523 29.329 0.194 1
1 496 . 2 1 1 A 47 47 GLU N N 47 117.532 118.188 -0.656 1
1 497 . 2 1 1 A 48 48 CYS H H 48 8.283 7.885 0.398 1
1 498 . 2 1 1 A 48 48 CYS HA H 48 4.002 4.135 -0.133 1
1 501 . 2 1 1 A 48 48 CYS C C 48 177.031 177.432 -0.401 1
1 502 . 2 1 1 A 48 48 CYS CA C 48 64.749 63.837 0.912 1
1 503 . 2 1 1 A 48 48 CYS CB C 48 25.907 27.256 -1.349 1
1 504 . 2 1 1 A 48 48 CYS N N 48 118.282 119.131 -0.849 1
1 505 . 2 1 1 A 49 49 LEU H H 49 8.181 8.025 0.156 1
1 506 . 2 1 1 A 49 49 LEU HA H 49 4.175 3.870 0.305 1
1 516 . 2 1 1 A 49 49 LEU C C 49 180.430 178.829 1.601 1
1 517 . 2 1 1 A 49 49 LEU CA C 49 57.873 58.204 -0.331 1
1 518 . 2 1 1 A 49 49 LEU CB C 49 41.539 41.687 -0.148 1
1 522 . 2 1 1 A 49 49 LEU N N 49 120.371 120.982 -0.611 1
1 523 . 2 1 1 A 50 50 GLN H H 50 7.934 8.713 -0.779 1
1 524 . 2 1 1 A 50 50 GLN HA H 50 4.102 4.056 0.046 1
1 531 . 2 1 1 A 50 50 GLN C C 50 177.322 177.117 0.205 1
1 532 . 2 1 1 A 50 50 GLN CA C 50 58.156 58.773 -0.617 1
1 533 . 2 1 1 A 50 50 GLN CB C 50 28.616 28.641 -0.025 1
1 535 . 2 1 1 A 50 50 GLN N N 50 118.175 117.324 0.851 1
1 537 . 2 1 1 A 51 51 ARG H H 51 7.632 7.697 -0.065 1
1 538 . 2 1 1 A 51 51 ARG HA H 51 4.347 4.369 -0.022 1
1 545 . 2 1 1 A 51 51 ARG C C 51 176.546 176.465 0.081 1
1 546 . 2 1 1 A 51 51 ARG CA C 51 56.286 55.939 0.347 1
1 547 . 2 1 1 A 51 51 ARG CB C 51 31.314 30.145 1.169 1
1 550 . 2 1 1 A 51 51 ARG N N 51 116.454 117.739 -1.285 1
1 551 . 2 1 1 A 52 52 GLY H H 52 7.949 8.371 -0.422 1
1 552 . 2 1 1 A 52 52 GLY HA2 H 52 4.033 3.967 0.066 1
1 553 . 2 1 1 A 52 52 GLY HA3 H 52 3.903 3.968 -0.065 1
1 554 . 2 1 1 A 52 52 GLY C C 52 174.385 174.208 0.177 1
1 555 . 2 1 1 A 52 52 GLY CA C 52 46.231 45.280 0.951 1
1 556 . 2 1 1 A 52 52 GLY N N 52 108.854 107.682 1.172 1
1 557 . 2 1 1 A 53 53 VAL H H 53 7.944 7.538 0.406 1
1 558 . 2 1 1 A 53 53 VAL HA H 53 4.250 4.051 0.199 1
1 566 . 2 1 1 A 53 53 VAL C C 53 175.525 175.084 0.441 1
1 567 . 2 1 1 A 53 53 VAL CA C 53 60.377 62.513 -2.136 1
1 568 . 2 1 1 A 53 53 VAL CB C 53 34.283 32.845 1.438 1
1 571 . 2 1 1 A 53 53 VAL N N 53 118.316 120.676 -2.360 1
1 572 . 2 1 1 A 54 54 SER H H 54 8.502 8.501 0.001 1
1 573 . 2 1 1 A 54 54 SER HA H 54 4.625 4.898 -0.273 1
1 576 . 2 1 1 A 54 54 SER C C 54 174.603 174.095 0.508 1
1 577 . 2 1 1 A 54 54 SER CA C 54 56.092 54.212 1.880 1
1 578 . 2 1 1 A 54 54 SER CB C 54 63.697 63.823 -0.126 1
1 579 . 2 1 1 A 54 54 SER N N 54 120.337 118.472 1.865 1
1 580 . 2 1 1 A 55 55 PRO HA H 55 4.624 4.535 0.089 1
1 587 . 2 1 1 A 55 55 PRO C C 55 177.322 177.440 -0.118 1
1 588 . 2 1 1 A 55 55 PRO CA C 55 64.431 64.243 0.188 1
1 589 . 2 1 1 A 55 55 PRO CB C 55 31.913 31.716 0.197 1
1 592 . 2 1 1 A 56 56 SER H H 56 7.931 8.428 -0.497 1
1 593 . 2 1 1 A 56 56 SER HA H 56 4.428 4.606 -0.178 1
1 596 . 2 1 1 A 56 56 SER C C 56 174.749 174.751 -0.002 1
1 597 . 2 1 1 A 56 56 SER CA C 56 59.130 59.101 0.029 1
1 598 . 2 1 1 A 56 56 SER CB C 56 63.056 63.795 -0.739 1
1 599 . 2 1 1 A 56 56 SER N N 56 112.637 112.987 -0.350 1
1 600 . 2 1 1 A 57 57 LYS H H 57 8.121 7.674 0.447 1
1 601 . 2 1 1 A 57 57 LYS HA H 57 4.467 4.903 -0.436 1
1 609 . 2 1 1 A 57 57 LYS C C 57 176.570 176.254 0.316 1
1 610 . 2 1 1 A 57 57 LYS CA C 57 55.264 55.141 0.123 1
1 611 . 2 1 1 A 57 57 LYS CB C 57 32.160 32.580 -0.420 1
1 615 . 2 1 1 A 57 57 LYS N N 57 123.185 118.130 5.055 1
1 616 . 2 1 1 A 58 58 ALA H H 58 7.886 7.996 -0.110 1
1 617 . 2 1 1 A 58 58 ALA HA H 58 3.923 3.937 -0.014 1
1 621 . 2 1 1 A 58 58 ALA C C 58 177.469 179.711 -2.242 1
1 622 . 2 1 1 A 58 58 ALA CA C 58 54.276 54.842 -0.566 1
1 623 . 2 1 1 A 58 58 ALA CB C 58 18.271 18.620 -0.349 1
1 624 . 2 1 1 A 58 58 ALA N N 58 123.941 122.514 1.427 1
1 625 . 2 1 1 A 59 59 HIS H H 59 8.077 8.104 -0.027 1
1 626 . 2 1 1 A 59 59 HIS HA H 59 4.420 4.380 0.040 1
1 631 . 2 1 1 A 59 59 HIS C C 59 177.542 177.672 -0.130 1
1 632 . 2 1 1 A 59 59 HIS CA C 59 57.767 58.598 -0.831 1
1 633 . 2 1 1 A 59 59 HIS CB C 59 29.852 28.649 1.203 1
1 636 . 2 1 1 A 59 59 HIS N N 59 115.566 115.856 -0.290 1
1 637 . 2 1 1 A 60 60 GLY H H 60 8.110 7.718 0.392 1
1 638 . 2 1 1 A 60 60 GLY HA2 H 60 3.873 3.377 0.496 1
1 639 . 2 1 1 A 60 60 GLY HA3 H 60 4.025 3.492 0.533 1
1 640 . 2 1 1 A 60 60 GLY C C 60 174.918 175.731 -0.813 1
1 641 . 2 1 1 A 60 60 GLY CA C 60 45.559 46.883 -1.324 1
1 642 . 2 1 1 A 60 60 GLY N N 60 109.216 110.405 -1.189 1
1 643 . 2 1 1 A 61 61 LEU H H 61 8.280 8.221 0.059 1
1 644 . 2 1 1 A 61 61 LEU HA H 61 4.198 3.964 0.234 1
1 654 . 2 1 1 A 61 61 LEU C C 61 178.900 177.596 1.304 1
1 655 . 2 1 1 A 61 61 LEU CA C 61 55.758 57.936 -2.178 1
1 656 . 2 1 1 A 61 61 LEU CB C 61 42.544 41.807 0.737 1
1 660 . 2 1 1 A 61 61 LEU N N 61 120.521 123.000 -2.479 1
1 661 . 2 1 1 A 62 62 GLY H H 62 8.184 7.752 0.432 1
1 662 . 2 1 1 A 62 62 GLY HA2 H 62 3.978 3.830 0.148 1
1 663 . 2 1 1 A 62 62 GLY HA3 H 62 3.817 3.832 -0.015 1
1 664 . 2 1 1 A 62 62 GLY C C 62 176.012 174.916 1.096 1
1 665 . 2 1 1 A 62 62 GLY CA C 62 46.767 47.353 -0.586 1
1 666 . 2 1 1 A 62 62 GLY N N 62 108.987 108.436 0.551 1
1 667 . 2 1 1 A 63 63 SER HA H 63 4.322 4.230 0.092 1
1 670 . 2 1 1 A 63 63 SER C C 63 174.167 176.140 -1.973 1
1 671 . 2 1 1 A 63 63 SER CA C 63 59.919 61.269 -1.350 1
1 672 . 2 1 1 A 63 63 SER CB C 63 63.312 62.304 1.008 1
1 673 . 2 1 1 A 64 64 ASN H H 64 8.087 7.955 0.132 1
1 674 . 2 1 1 A 64 64 ASN HA H 64 4.850 4.893 -0.043 1
1 679 . 2 1 1 A 64 64 ASN C C 64 173.899 175.208 -1.309 1
1 680 . 2 1 1 A 64 64 ASN CA C 64 53.218 53.499 -0.281 1
1 681 . 2 1 1 A 64 64 ASN CB C 64 39.164 38.962 0.202 1
1 682 . 2 1 1 A 64 64 ASN N N 64 118.041 117.292 0.749 1
1 684 . 2 1 1 A 65 65 LEU H H 65 7.293 7.417 -0.124 1
1 685 . 2 1 1 A 65 65 LEU HA H 65 3.995 4.506 -0.511 1
1 695 . 2 1 1 A 65 65 LEU C C 65 175.696 175.439 0.257 1
1 696 . 2 1 1 A 65 65 LEU CA C 65 56.005 55.266 0.739 1
1 697 . 2 1 1 A 65 65 LEU CB C 65 43.120 43.187 -0.067 1
1 701 . 2 1 1 A 65 65 LEU N N 65 120.953 123.058 -2.105 1
1 702 . 2 1 1 A 66 66 VAL H H 66 9.517 9.008 0.509 1
1 703 . 2 1 1 A 66 66 VAL HA H 66 3.481 4.572 -1.091 1
1 711 . 2 1 1 A 66 66 VAL C C 66 175.429 175.010 0.419 1
1 712 . 2 1 1 A 66 66 VAL CA C 66 65.243 61.488 3.755 1
1 713 . 2 1 1 A 66 66 VAL CB C 66 31.335 33.535 -2.200 1
1 716 . 2 1 1 A 66 66 VAL N N 66 127.924 126.478 1.446 1
1 717 . 2 1 1 A 67 67 THR H H 67 6.253 8.378 -2.125 1
1 718 . 2 1 1 A 67 67 THR HA H 67 4.779 4.744 0.035 1
1 723 . 2 1 1 A 67 67 THR C C 67 174.894 174.748 0.146 1
1 724 . 2 1 1 A 67 67 THR CA C 67 58.719 59.531 -0.812 1
1 725 . 2 1 1 A 67 67 THR CB C 67 72.153 71.701 0.452 1
1 727 . 2 1 1 A 67 67 THR N N 67 113.376 115.820 -2.444 1
1 728 . 2 1 1 A 68 68 GLU H H 68 9.348 8.882 0.466 1
1 729 . 2 1 1 A 68 68 GLU HA H 68 3.634 4.011 -0.377 1
1 734 . 2 1 1 A 68 68 GLU C C 68 177.809 178.334 -0.525 1
1 735 . 2 1 1 A 68 68 GLU CA C 68 61.505 60.122 1.383 1
1 736 . 2 1 1 A 68 68 GLU CB C 68 28.285 29.691 -1.406 1
1 738 . 2 1 1 A 68 68 GLU N N 68 124.534 122.184 2.350 1
1 739 . 2 1 1 A 69 69 VAL H H 69 8.126 7.927 0.199 1
1 740 . 2 1 1 A 69 69 VAL HA H 69 3.862 3.530 0.332 1
1 748 . 2 1 1 A 69 69 VAL C C 69 177.712 178.061 -0.349 1
1 749 . 2 1 1 A 69 69 VAL CA C 69 65.701 66.800 -1.099 1
1 750 . 2 1 1 A 69 69 VAL CB C 69 31.829 31.548 0.281 1
1 753 . 2 1 1 A 69 69 VAL N N 69 119.139 119.825 -0.686 1
1 754 . 2 1 1 A 70 70 ARG H H 70 7.235 8.220 -0.985 1
1 755 . 2 1 1 A 70 70 ARG HA H 70 4.265 3.920 0.345 1
1 762 . 2 1 1 A 70 70 ARG C C 70 180.430 179.460 0.970 1
1 763 . 2 1 1 A 70 70 ARG CA C 70 59.742 60.159 -0.417 1
1 764 . 2 1 1 A 70 70 ARG CB C 70 29.439 29.880 -0.441 1
1 767 . 2 1 1 A 70 70 ARG N N 70 119.541 119.172 0.369 1
1 768 . 2 1 1 A 71 71 VAL H H 71 8.144 8.071 0.073 1
1 769 . 2 1 1 A 71 71 VAL HA H 71 4.018 3.939 0.079 1
1 777 . 2 1 1 A 71 71 VAL C C 71 177.493 178.138 -0.645 1
1 778 . 2 1 1 A 71 71 VAL CA C 71 67.924 66.569 1.355 1
1 779 . 2 1 1 A 71 71 VAL CB C 71 32.289 31.837 0.452 1
1 782 . 2 1 1 A 71 71 VAL N N 71 120.755 120.182 0.573 1
1 783 . 2 1 1 A 72 72 TYR H H 72 9.411 8.415 0.996 1
1 784 . 2 1 1 A 72 72 TYR HA H 72 3.908 4.248 -0.340 1
1 791 . 2 1 1 A 72 72 TYR C C 72 178.464 178.047 0.417 1
1 792 . 2 1 1 A 72 72 TYR CA C 72 63.444 61.811 1.633 1
1 793 . 2 1 1 A 72 72 TYR CB C 72 38.211 39.002 -0.791 1
1 798 . 2 1 1 A 72 72 TYR N N 72 121.175 121.495 -0.320 1
1 799 . 2 1 1 A 73 73 ASN H H 73 8.816 8.656 0.160 1
1 800 . 2 1 1 A 73 73 ASN HA H 73 4.538 4.668 -0.130 1
1 805 . 2 1 1 A 73 73 ASN C C 73 176.958 178.036 -1.078 1
1 806 . 2 1 1 A 73 73 ASN CA C 73 56.109 56.706 -0.597 1
1 807 . 2 1 1 A 73 73 ASN CB C 73 38.422 38.686 -0.264 1
1 808 . 2 1 1 A 73 73 ASN N N 73 118.122 118.032 0.090 1
1 810 . 2 1 1 A 74 74 TRP H H 74 8.657 8.271 0.386 1
1 811 . 2 1 1 A 74 74 TRP HA H 74 4.111 4.556 -0.445 1
1 820 . 2 1 1 A 74 74 TRP C C 74 179.654 178.440 1.214 1
1 821 . 2 1 1 A 74 74 TRP CA C 74 62.950 61.228 1.722 1
1 822 . 2 1 1 A 74 74 TRP CB C 74 29.555 29.503 0.052 1
1 828 . 2 1 1 A 74 74 TRP N N 74 123.988 122.974 1.014 1
1 830 . 2 1 1 A 75 75 PHE H H 75 8.562 8.282 0.280 1
1 831 . 2 1 1 A 75 75 PHE HA H 75 3.821 4.332 -0.511 1
1 839 . 2 1 1 A 75 75 PHE C C 75 177.614 178.221 -0.607 1
1 840 . 2 1 1 A 75 75 PHE CA C 75 63.374 61.883 1.491 1
1 841 . 2 1 1 A 75 75 PHE CB C 75 39.648 38.278 1.370 1
1 847 . 2 1 1 A 75 75 PHE N N 75 118.325 117.214 1.111 1
1 848 . 2 1 1 A 76 76 ALA H H 76 8.305 8.115 0.190 1
1 849 . 2 1 1 A 76 76 ALA HA H 76 3.909 3.936 -0.027 1
1 853 . 2 1 1 A 76 76 ALA C C 76 180.868 179.773 1.095 1
1 854 . 2 1 1 A 76 76 ALA CA C 76 55.566 55.192 0.374 1
1 855 . 2 1 1 A 76 76 ALA CB C 76 17.820 18.299 -0.479 1
1 856 . 2 1 1 A 76 76 ALA N N 76 121.119 122.189 -1.070 1
1 857 . 2 1 1 A 77 77 ASN H H 77 8.335 8.062 0.273 1
1 858 . 2 1 1 A 77 77 ASN HA H 77 4.355 4.398 -0.043 1
1 863 . 2 1 1 A 77 77 ASN C C 77 177.105 177.587 -0.482 1
1 864 . 2 1 1 A 77 77 ASN CA C 77 56.145 56.175 -0.030 1
1 865 . 2 1 1 A 77 77 ASN CB C 77 38.063 38.689 -0.626 1
1 866 . 2 1 1 A 77 77 ASN N N 77 117.433 116.283 1.150 1
1 868 . 2 1 1 A 78 78 ARG H H 78 7.664 7.218 0.446 1
1 869 . 2 1 1 A 78 78 ARG HA H 78 3.629 3.846 -0.217 1
1 876 . 2 1 1 A 78 78 ARG C C 78 179.216 177.641 1.575 1
1 877 . 2 1 1 A 78 78 ARG CA C 78 58.773 58.638 0.135 1
1 878 . 2 1 1 A 78 78 ARG CB C 78 29.605 29.455 0.150 1
1 881 . 2 1 1 A 78 78 ARG N N 78 121.999 118.745 3.254 1
1 882 . 2 1 1 A 79 79 ARG H H 79 8.320 7.721 0.599 1
1 883 . 2 1 1 A 79 79 ARG HA H 79 4.307 4.344 -0.037 1
1 890 . 2 1 1 A 79 79 ARG C C 79 180.406 178.201 2.205 1
1 891 . 2 1 1 A 79 79 ARG CA C 79 60.270 57.450 2.820 1
1 892 . 2 1 1 A 79 79 ARG CB C 79 31.335 30.821 0.514 1
1 895 . 2 1 1 A 79 79 ARG N N 79 118.139 117.924 0.215 1
1 896 . 2 1 1 A 80 80 LYS H H 80 7.759 8.148 -0.389 1
1 897 . 2 1 1 A 80 80 LYS HA H 80 4.052 4.129 -0.077 1
1 905 . 2 1 1 A 80 80 LYS C C 80 178.999 179.228 -0.229 1
1 906 . 2 1 1 A 80 80 LYS CA C 80 59.531 59.024 0.507 1
1 907 . 2 1 1 A 80 80 LYS CB C 80 32.374 32.506 -0.132 1
1 911 . 2 1 1 A 80 80 LYS N N 80 120.899 119.142 1.757 1
1 912 . 2 1 1 A 81 81 GLU H H 81 8.041 8.313 -0.272 1
1 913 . 2 1 1 A 81 81 GLU HA H 81 4.044 4.186 -0.142 1
1 918 . 2 1 1 A 81 81 GLU C C 81 179.168 178.563 0.605 1
1 919 . 2 1 1 A 81 81 GLU CA C 81 59.036 59.564 -0.528 1
1 920 . 2 1 1 A 81 81 GLU CB C 81 29.561 29.175 0.386 1
1 922 . 2 1 1 A 81 81 GLU N N 81 120.193 118.820 1.373 1
1 923 . 2 1 1 A 82 82 GLU H H 82 8.131 8.513 -0.382 1
1 924 . 2 1 1 A 82 82 GLU HA H 82 4.017 4.081 -0.064 1
1 929 . 2 1 1 A 82 82 GLU C C 82 178.343 178.180 0.163 1
1 930 . 2 1 1 A 82 82 GLU CA C 82 59.319 59.330 -0.011 1
1 931 . 2 1 1 A 82 82 GLU CB C 82 29.770 29.181 0.589 1
1 933 . 2 1 1 A 82 82 GLU N N 82 119.626 119.074 0.552 1
1 934 . 2 1 1 A 83 83 ALA H H 83 7.935 7.683 0.252 1
1 935 . 2 1 1 A 83 83 ALA HA H 83 4.180 4.209 -0.029 1
1 939 . 2 1 1 A 83 83 ALA C C 83 179.994 179.445 0.549 1
1 940 . 2 1 1 A 83 83 ALA CA C 83 54.629 53.764 0.865 1
1 941 . 2 1 1 A 83 83 ALA CB C 83 18.090 18.951 -0.861 1
1 942 . 2 1 1 A 83 83 ALA N N 83 121.476 121.903 -0.427 1
1 943 . 2 1 1 A 84 84 PHE H H 84 8.043 7.973 0.070 1
1 944 . 2 1 1 A 84 84 PHE HA H 84 4.420 4.066 0.354 1
1 952 . 2 1 1 A 84 84 PHE C C 84 177.250 177.127 0.123 1
1 953 . 2 1 1 A 84 84 PHE CA C 84 60.059 61.697 -1.638 1
1 954 . 2 1 1 A 84 84 PHE CB C 84 38.952 39.393 -0.441 1
1 960 . 2 1 1 A 84 84 PHE N N 84 119.074 120.521 -1.447 1
1 961 . 2 1 1 A 85 85 ARG H H 85 8.031 8.388 -0.357 1
1 962 . 2 1 1 A 85 85 ARG HA H 85 3.992 4.125 -0.133 1
1 968 . 2 1 1 A 85 85 ARG C C 85 178.319 178.289 0.030 1
1 969 . 2 1 1 A 85 85 ARG CA C 85 58.523 59.635 -1.112 1
1 970 . 2 1 1 A 85 85 ARG CB C 85 30.346 30.007 0.339 1
1 973 . 2 1 1 A 85 85 ARG N N 85 119.291 117.647 1.644 1
1 974 . 2 1 1 A 86 86 GLN H H 86 8.091 7.970 0.121 1
1 975 . 2 1 1 A 86 86 GLN HA H 86 4.148 4.299 -0.151 1
1 982 . 2 1 1 A 86 86 GLN C C 86 177.105 178.263 -1.158 1
1 983 . 2 1 1 A 86 86 GLN CA C 86 57.556 57.383 0.173 1
1 984 . 2 1 1 A 86 86 GLN CB C 86 28.855 29.396 -0.541 1
1 986 . 2 1 1 A 86 86 GLN N N 86 119.097 117.547 1.550 1
1 988 . 2 1 1 A 87 87 LYS H H 87 7.898 8.352 -0.454 1
1 989 . 2 1 1 A 87 87 LYS HA H 87 4.116 4.049 0.067 1
1 997 . 2 1 1 A 87 87 LYS C C 87 177.542 179.242 -1.700 1
1 998 . 2 1 1 A 87 87 LYS CA C 87 57.944 59.176 -1.232 1
1 999 . 2 1 1 A 87 87 LYS CB C 87 32.242 31.878 0.364 1
1 1003 . 2 1 1 A 87 87 LYS N N 87 120.968 122.146 -1.178 1
1 1004 . 2 1 1 A 88 88 LEU H H 88 7.903 8.127 -0.224 1
1 1005 . 2 1 1 A 88 88 LEU HA H 88 4.144 4.228 -0.084 1
1 1015 . 2 1 1 A 88 88 LEU C C 88 178.221 178.496 -0.275 1
1 1016 . 2 1 1 A 88 88 LEU CA C 88 56.145 57.061 -0.916 1
1 1017 . 2 1 1 A 88 88 LEU CB C 88 42.215 41.499 0.716 1
1 1021 . 2 1 1 A 88 88 LEU N N 88 120.558 117.655 2.903 1
1 1022 . 2 1 1 A 89 89 ALA H H 89 7.894 7.498 0.396 1
1 1023 . 2 1 1 A 89 89 ALA HA H 89 4.224 4.365 -0.141 1
1 1027 . 2 1 1 A 89 89 ALA C C 89 178.609 179.045 -0.436 1
1 1028 . 2 1 1 A 89 89 ALA CA C 89 53.392 54.189 -0.797 1
1 1029 . 2 1 1 A 89 89 ALA CB C 89 18.695 19.482 -0.787 1
1 1030 . 2 1 1 A 89 89 ALA N N 89 122.387 122.217 0.170 1
1 1031 . 2 1 1 A 90 90 MET H H 90 8.084 8.118 -0.034 1
1 1032 . 2 1 1 A 90 90 MET HA H 90 4.356 4.191 0.165 1
1 1040 . 2 1 1 A 90 90 MET C C 90 176.982 176.563 0.419 1
1 1041 . 2 1 1 A 90 90 MET CA C 90 56.551 58.555 -2.004 1
1 1042 . 2 1 1 A 90 90 MET CB C 90 32.719 32.675 0.044 1
1 1045 . 2 1 1 A 90 90 MET N N 90 118.509 116.477 2.032 1
1 1046 . 2 1 1 A 91 91 ASP H H 91 8.261 7.509 0.752 1
1 1047 . 2 1 1 A 91 91 ASP HA H 91 4.524 4.571 -0.047 1
1 1050 . 2 1 1 A 91 91 ASP C C 91 176.643 175.630 1.013 1
1 1051 . 2 1 1 A 91 91 ASP CA C 91 54.981 54.011 0.970 1
1 1052 . 2 1 1 A 91 91 ASP CB C 91 40.870 41.306 -0.436 1
1 1053 . 2 1 1 A 91 91 ASP N N 91 120.771 120.307 0.464 1
1 1054 . 2 1 1 A 92 92 ALA H H 92 7.971 8.497 -0.526 1
1 1055 . 2 1 1 A 92 92 ALA HA H 92 4.200 4.670 -0.470 1
1 1059 . 2 1 1 A 92 92 ALA C C 92 177.929 176.796 1.133 1
1 1060 . 2 1 1 A 92 92 ALA CA C 92 53.184 50.599 2.585 1
1 1061 . 2 1 1 A 92 92 ALA CB C 92 18.890 19.853 -0.963 1
1 1062 . 2 1 1 A 92 92 ALA N N 92 123.057 125.031 -1.974 1
1 1063 . 2 1 1 A 93 93 TYR H H 93 8.019 8.934 -0.915 1
1 1064 . 2 1 1 A 93 93 TYR HA H 93 4.523 4.501 0.022 1
1 1071 . 2 1 1 A 93 93 TYR C C 93 176.279 175.188 1.091 1
1 1072 . 2 1 1 A 93 93 TYR CA C 93 58.401 57.799 0.602 1
1 1073 . 2 1 1 A 93 93 TYR CB C 93 38.669 39.415 -0.746 1
1 1078 . 2 1 1 A 93 93 TYR N N 93 118.337 123.970 -5.633 1
1 1079 . 2 1 1 A 94 94 SER H H 94 8.037 8.917 -0.880 1
1 1080 . 2 1 1 A 94 94 SER HA H 94 4.484 4.651 -0.167 1
1 1082 . 2 1 1 A 94 94 SER C C 94 174.554 172.510 2.044 1
1 1083 . 2 1 1 A 94 94 SER CA C 94 58.401 56.965 1.436 1
1 1084 . 2 1 1 A 94 94 SER CB C 94 63.806 66.204 -2.398 1
1 1085 . 2 1 1 A 94 94 SER N N 94 116.640 113.340 3.300 1
1 1086 . 2 1 1 A 96 96 ASN HA H 96 4.770 5.565 -0.795 1
1 1091 . 2 1 1 A 96 96 ASN C C 96 175.161 173.461 1.700 1
1 1092 . 2 1 1 A 96 96 ASN CA C 96 53.395 51.909 1.486 1
1 1093 . 2 1 1 A 96 96 ASN CB C 96 38.999 42.672 -3.673 1
1 1095 . 2 1 1 A 97 97 SER H H 97 8.230 8.979 -0.749 1
1 1096 . 2 1 1 A 97 97 SER HA H 97 4.481 5.389 -0.908 1
1 1099 . 2 1 1 A 97 97 SER C C 97 174.482 173.128 1.354 1
1 1100 . 2 1 1 A 97 97 SER CA C 97 58.300 56.978 1.322 1
1 1101 . 2 1 1 A 97 97 SER CB C 97 63.697 66.446 -2.749 1
1 1102 . 2 1 1 A 97 97 SER N N 97 115.866 118.906 -3.040 1
1 1103 . 2 1 1 A 98 98 GLY H H 98 8.228 8.374 -0.146 1
1 1104 . 2 1 1 A 98 98 GLY HA2 H 98 4.098 4.196 -0.098 1
1 1105 . 2 1 1 A 98 98 GLY HA3 H 98 4.098 4.197 -0.099 1
1 1106 . 2 1 1 A 98 98 GLY C C 98 171.788 174.115 -2.327 1
1 1107 . 2 1 1 A 98 98 GLY CA C 98 44.803 45.142 -0.339 1
1 1108 . 2 1 1 A 98 98 GLY N N 98 110.658 112.262 -1.604 1
1 1109 . 2 1 1 A 99 99 PRO HA H 99 4.463 4.543 -0.080 1
1 1116 . 2 1 1 A 99 99 PRO CA C 99 63.230 63.494 -0.264 1
1 1117 . 2 1 1 A 99 99 PRO CB C 99 32.044 31.971 0.073 1
1 1120 . 2 1 1 A 100 100 SER H H 100 8.514 7.853 0.661 1
1 1121 . 2 1 1 A 100 100 SER CA C 100 58.450 60.348 -1.898 1
1 1122 . 2 1 1 A 100 100 SER CB C 100 63.889 64.048 -0.159 1
1 1 . 3 1 1 A 9 9 ASN H H 9 8.856 8.014 0.842 1
1 2 . 3 1 1 A 9 9 ASN HA H 9 4.694 4.802 -0.108 1
1 7 . 3 1 1 A 9 9 ASN CA C 9 53.401 52.692 0.709 1
1 8 . 3 1 1 A 9 9 ASN CB C 9 38.757 36.931 1.826 1
1 10 . 3 1 1 A 10 10 ARG HA H 10 4.346 5.178 -0.832 1
1 17 . 3 1 1 A 10 10 ARG C C 10 175.405 174.472 0.933 1
1 18 . 3 1 1 A 10 10 ARG CA C 10 56.181 54.357 1.824 1
1 19 . 3 1 1 A 10 10 ARG CB C 10 31.171 35.066 -3.895 1
1 22 . 3 1 1 A 11 11 PHE H H 11 8.310 9.122 -0.812 1
1 23 . 3 1 1 A 11 11 PHE HA H 11 4.291 5.069 -0.778 1
1 31 . 3 1 1 A 11 11 PHE C C 11 174.458 171.876 2.582 1
1 32 . 3 1 1 A 11 11 PHE CA C 11 58.967 56.264 2.703 1
1 33 . 3 1 1 A 11 11 PHE CB C 11 40.138 40.639 -0.501 1
1 39 . 3 1 1 A 11 11 PHE N N 11 123.604 116.435 7.169 1
1 40 . 3 1 1 A 12 12 LYS H H 12 7.307 8.352 -1.045 1
1 41 . 3 1 1 A 12 12 LYS HA H 12 4.165 4.712 -0.547 1
1 50 . 3 1 1 A 12 12 LYS C C 12 174.385 175.590 -1.205 1
1 51 . 3 1 1 A 12 12 LYS CA C 12 54.593 54.041 0.552 1
1 52 . 3 1 1 A 12 12 LYS CB C 12 34.712 35.455 -0.743 1
1 56 . 3 1 1 A 12 12 LYS N N 12 127.282 119.412 7.870 1
1 57 . 3 1 1 A 13 13 TRP H H 13 8.039 8.369 -0.330 1
1 58 . 3 1 1 A 13 13 TRP HA H 13 4.370 4.464 -0.094 1
1 67 . 3 1 1 A 13 13 TRP C C 13 177.857 176.275 1.582 1
1 68 . 3 1 1 A 13 13 TRP CA C 13 56.675 56.759 -0.084 1
1 69 . 3 1 1 A 13 13 TRP CB C 13 30.317 30.240 0.077 1
1 75 . 3 1 1 A 13 13 TRP N N 13 124.264 126.977 -2.713 1
1 77 . 3 1 1 A 14 14 GLY H H 14 9.815 8.717 1.098 1
1 78 . 3 1 1 A 14 14 GLY HA2 H 14 4.370 4.273 0.097 1
1 79 . 3 1 1 A 14 14 GLY HA3 H 14 4.335 4.299 0.036 1
1 80 . 3 1 1 A 14 14 GLY C C 14 172.904 174.744 -1.840 1
1 81 . 3 1 1 A 14 14 GLY CA C 14 44.157 43.825 0.332 1
1 82 . 3 1 1 A 14 14 GLY N N 14 115.294 108.500 6.794 1
1 83 . 3 1 1 A 15 15 PRO HA H 15 4.327 4.378 -0.051 1
1 90 . 3 1 1 A 15 15 PRO C C 15 179.726 178.703 1.023 1
1 91 . 3 1 1 A 15 15 PRO CA C 15 65.171 65.183 -0.012 1
1 92 . 3 1 1 A 15 15 PRO CB C 15 31.829 31.912 -0.083 1
1 95 . 3 1 1 A 16 16 ALA H H 16 9.214 8.091 1.123 1
1 96 . 3 1 1 A 16 16 ALA HA H 16 4.166 4.135 0.031 1
1 100 . 3 1 1 A 16 16 ALA C C 16 181.184 179.782 1.402 1
1 101 . 3 1 1 A 16 16 ALA CA C 16 55.370 55.239 0.131 1
1 102 . 3 1 1 A 16 16 ALA CB C 16 18.058 18.955 -0.897 1
1 103 . 3 1 1 A 16 16 ALA N N 16 122.414 119.858 2.556 1
1 104 . 3 1 1 A 17 17 SER H H 17 7.985 8.227 -0.242 1
1 105 . 3 1 1 A 17 17 SER HA H 17 4.317 4.105 0.212 1
1 107 . 3 1 1 A 17 17 SER C C 17 175.381 176.626 -1.245 1
1 108 . 3 1 1 A 17 17 SER CA C 17 63.163 62.126 1.037 1
1 109 . 3 1 1 A 17 17 SER CB C 17 64.055 62.970 1.085 1
1 110 . 3 1 1 A 17 17 SER N N 17 116.568 114.112 2.456 1
1 111 . 3 1 1 A 18 18 GLN H H 18 8.316 7.857 0.459 1
1 112 . 3 1 1 A 18 18 GLN HA H 18 3.323 3.474 -0.151 1
1 119 . 3 1 1 A 18 18 GLN C C 18 176.812 178.574 -1.762 1
1 120 . 3 1 1 A 18 18 GLN CA C 18 60.025 59.029 0.996 1
1 121 . 3 1 1 A 18 18 GLN CB C 18 28.686 28.402 0.284 1
1 123 . 3 1 1 A 18 18 GLN N N 18 119.002 120.970 -1.968 1
1 125 . 3 1 1 A 19 19 GLN H H 19 7.582 8.180 -0.598 1
1 126 . 3 1 1 A 19 19 GLN HA H 19 4.062 4.071 -0.009 1
1 133 . 3 1 1 A 19 19 GLN C C 19 178.488 178.571 -0.083 1
1 134 . 3 1 1 A 19 19 GLN CA C 19 59.248 59.175 0.073 1
1 135 . 3 1 1 A 19 19 GLN CB C 19 28.203 28.235 -0.032 1
1 137 . 3 1 1 A 19 19 GLN N N 19 116.221 118.834 -2.613 1
1 139 . 3 1 1 A 20 20 ILE H H 20 7.246 7.929 -0.683 1
1 140 . 3 1 1 A 20 20 ILE HA H 20 3.570 3.609 -0.039 1
1 150 . 3 1 1 A 20 20 ILE C C 20 178.999 178.573 0.426 1
1 151 . 3 1 1 A 20 20 ILE CA C 20 64.996 65.520 -0.524 1
1 152 . 3 1 1 A 20 20 ILE CB C 20 38.139 37.683 0.456 1
1 156 . 3 1 1 A 20 20 ILE N N 20 120.521 120.834 -0.313 1
1 157 . 3 1 1 A 21 21 LEU H H 21 8.034 7.930 0.104 1
1 158 . 3 1 1 A 21 21 LEU HA H 21 3.491 3.540 -0.049 1
1 168 . 3 1 1 A 21 21 LEU C C 21 178.196 178.383 -0.187 1
1 169 . 3 1 1 A 21 21 LEU CA C 21 57.944 57.480 0.464 1
1 170 . 3 1 1 A 21 21 LEU CB C 21 37.864 40.340 -2.476 1
1 174 . 3 1 1 A 21 21 LEU N N 21 121.259 118.927 2.332 1
1 175 . 3 1 1 A 22 22 TYR H H 22 8.479 7.518 0.961 1
1 176 . 3 1 1 A 22 22 TYR HA H 22 4.224 4.285 -0.061 1
1 183 . 3 1 1 A 22 22 TYR C C 22 179.630 178.621 1.009 1
1 184 . 3 1 1 A 22 22 TYR CA C 22 62.422 60.670 1.752 1
1 185 . 3 1 1 A 22 22 TYR CB C 22 37.434 37.670 -0.236 1
1 190 . 3 1 1 A 22 22 TYR N N 22 117.805 118.934 -1.129 1
1 191 . 3 1 1 A 23 23 GLN H H 23 7.707 8.329 -0.622 1
1 192 . 3 1 1 A 23 23 GLN HA H 23 4.166 4.007 0.159 1
1 199 . 3 1 1 A 23 23 GLN C C 23 178.633 178.702 -0.069 1
1 200 . 3 1 1 A 23 23 GLN CA C 23 58.789 59.069 -0.280 1
1 201 . 3 1 1 A 23 23 GLN CB C 23 28.534 28.252 0.282 1
1 203 . 3 1 1 A 23 23 GLN N N 23 117.580 118.358 -0.778 1
1 205 . 3 1 1 A 24 24 ALA H H 24 8.155 7.718 0.437 1
1 206 . 3 1 1 A 24 24 ALA HA H 24 4.187 4.166 0.021 1
1 210 . 3 1 1 A 24 24 ALA C C 24 180.018 179.239 0.779 1
1 211 . 3 1 1 A 24 24 ALA CA C 24 55.228 55.185 0.043 1
1 212 . 3 1 1 A 24 24 ALA CB C 24 19.468 18.478 0.990 1
1 213 . 3 1 1 A 24 24 ALA N N 24 122.813 122.212 0.601 1
1 214 . 3 1 1 A 25 25 TYR H H 25 8.995 8.502 0.493 1
1 215 . 3 1 1 A 25 25 TYR HA H 25 4.348 4.696 -0.348 1
1 222 . 3 1 1 A 25 25 TYR C C 25 175.792 177.617 -1.825 1
1 223 . 3 1 1 A 25 25 TYR CA C 25 61.681 61.715 -0.034 1
1 224 . 3 1 1 A 25 25 TYR CB C 25 38.175 38.658 -0.483 1
1 229 . 3 1 1 A 25 25 TYR N N 25 121.343 120.163 1.180 1
1 230 . 3 1 1 A 26 26 ASP H H 26 7.260 8.708 -1.448 1
1 231 . 3 1 1 A 26 26 ASP HA H 26 4.373 4.469 -0.096 1
1 234 . 3 1 1 A 26 26 ASP C C 26 177.322 178.144 -0.822 1
1 235 . 3 1 1 A 26 26 ASP CA C 26 56.603 57.471 -0.868 1
1 236 . 3 1 1 A 26 26 ASP CB C 26 41.060 41.029 0.031 1
1 237 . 3 1 1 A 26 26 ASP N N 26 114.020 119.286 -5.266 1
1 238 . 3 1 1 A 27 27 ARG H H 27 7.343 7.615 -0.272 1
1 239 . 3 1 1 A 27 27 ARG HA H 27 4.302 4.348 -0.046 1
1 246 . 3 1 1 A 27 27 ARG C C 27 176.546 176.320 0.226 1
1 247 . 3 1 1 A 27 27 ARG CA C 27 57.563 57.736 -0.173 1
1 248 . 3 1 1 A 27 27 ARG CB C 27 31.500 31.383 0.117 1
1 251 . 3 1 1 A 27 27 ARG N N 27 116.729 117.011 -0.282 1
1 252 . 3 1 1 A 28 28 GLN H H 28 8.306 8.161 0.145 1
1 253 . 3 1 1 A 28 28 GLN HA H 28 4.396 4.671 -0.275 1
1 260 . 3 1 1 A 28 28 GLN C C 28 172.831 175.278 -2.447 1
1 261 . 3 1 1 A 28 28 GLN CA C 28 55.355 54.752 0.603 1
1 262 . 3 1 1 A 28 28 GLN CB C 28 31.062 31.423 -0.361 1
1 264 . 3 1 1 A 28 28 GLN N N 28 121.612 118.458 3.154 1
1 266 . 3 1 1 A 29 29 LYS H H 29 8.354 8.510 -0.156 1
1 267 . 3 1 1 A 29 29 LYS HA H 29 4.099 3.631 0.468 1
1 276 . 3 1 1 A 29 29 LYS C C 29 176.084 176.412 -0.328 1
1 277 . 3 1 1 A 29 29 LYS CA C 29 57.873 57.866 0.007 1
1 278 . 3 1 1 A 29 29 LYS CB C 29 33.313 32.698 0.615 1
1 282 . 3 1 1 A 29 29 LYS N N 29 125.038 124.475 0.563 1
1 283 . 3 1 1 A 30 30 ASN H H 30 8.856 7.884 0.972 1
1 284 . 3 1 1 A 30 30 ASN HA H 30 4.958 5.135 -0.177 1
1 289 . 3 1 1 A 30 30 ASN C C 30 171.179 172.668 -1.489 1
1 290 . 3 1 1 A 30 30 ASN CA C 30 50.891 50.422 0.469 1
1 291 . 3 1 1 A 30 30 ASN CB C 30 39.907 39.131 0.776 1
1 292 . 3 1 1 A 30 30 ASN N N 30 115.764 117.555 -1.791 1
1 294 . 3 1 1 A 31 31 PRO HA H 31 4.299 4.452 -0.153 1
1 301 . 3 1 1 A 31 31 PRO C C 31 177.493 176.742 0.751 1
1 302 . 3 1 1 A 31 31 PRO CA C 31 62.489 62.597 -0.108 1
1 303 . 3 1 1 A 31 31 PRO CB C 31 31.216 31.815 -0.599 1
1 306 . 3 1 1 A 32 32 SER H H 32 9.368 8.478 0.890 1
1 307 . 3 1 1 A 32 32 SER HA H 32 4.372 4.755 -0.383 1
1 310 . 3 1 1 A 32 32 SER C C 32 174.821 175.805 -0.984 1
1 311 . 3 1 1 A 32 32 SER CA C 32 57.203 57.588 -0.385 1
1 312 . 3 1 1 A 32 32 SER CB C 32 65.594 64.483 1.111 1
1 313 . 3 1 1 A 32 32 SER N N 32 120.847 117.569 3.278 1
1 314 . 3 1 1 A 33 33 LYS H H 33 9.152 8.972 0.180 1
1 315 . 3 1 1 A 33 33 LYS HA H 33 3.719 3.909 -0.190 1
1 324 . 3 1 1 A 33 33 LYS C C 33 177.833 178.241 -0.408 1
1 325 . 3 1 1 A 33 33 LYS CA C 33 61.188 60.311 0.877 1
1 326 . 3 1 1 A 33 33 LYS CB C 33 32.572 32.346 0.226 1
1 330 . 3 1 1 A 33 33 LYS N N 33 122.966 124.639 -1.673 1
1 331 . 3 1 1 A 34 34 GLU H H 34 8.902 8.330 0.572 1
1 332 . 3 1 1 A 34 34 GLU HA H 34 4.089 4.062 0.027 1
1 337 . 3 1 1 A 34 34 GLU C C 34 180.286 179.344 0.942 1
1 338 . 3 1 1 A 34 34 GLU CA C 34 60.483 59.314 1.169 1
1 339 . 3 1 1 A 34 34 GLU CB C 34 28.835 29.307 -0.472 1
1 341 . 3 1 1 A 34 34 GLU N N 34 117.645 118.747 -1.102 1
1 342 . 3 1 1 A 35 35 GLU H H 35 7.673 8.135 -0.462 1
1 343 . 3 1 1 A 35 35 GLU HA H 35 4.023 3.953 0.070 1
1 348 . 3 1 1 A 35 35 GLU C C 35 180.237 179.243 0.994 1
1 349 . 3 1 1 A 35 35 GLU CA C 35 59.214 59.421 -0.207 1
1 350 . 3 1 1 A 35 35 GLU CB C 35 30.099 29.325 0.774 1
1 352 . 3 1 1 A 35 35 GLU N N 35 121.077 120.066 1.011 1
1 353 . 3 1 1 A 36 36 ARG H H 36 8.932 8.291 0.641 1
1 354 . 3 1 1 A 36 36 ARG HA H 36 3.928 3.763 0.165 1
1 362 . 3 1 1 A 36 36 ARG C C 36 178.464 179.078 -0.614 1
1 363 . 3 1 1 A 36 36 ARG CA C 36 60.974 59.985 0.989 1
1 364 . 3 1 1 A 36 36 ARG CB C 36 31.171 30.009 1.162 1
1 367 . 3 1 1 A 36 36 ARG N N 36 119.441 120.109 -0.668 1
1 369 . 3 1 1 A 37 37 GLU H H 37 8.756 8.282 0.474 1
1 370 . 3 1 1 A 37 37 GLU HA H 37 3.948 4.092 -0.144 1
1 375 . 3 1 1 A 37 37 GLU C C 37 179.606 178.694 0.912 1
1 376 . 3 1 1 A 37 37 GLU CA C 37 60.094 59.080 1.014 1
1 377 . 3 1 1 A 37 37 GLU CB C 37 29.110 29.233 -0.123 1
1 379 . 3 1 1 A 37 37 GLU N N 37 119.017 119.610 -0.593 1
1 380 . 3 1 1 A 38 38 ALA H H 38 7.733 8.070 -0.337 1
1 381 . 3 1 1 A 38 38 ALA HA H 38 4.325 4.091 0.234 1
1 385 . 3 1 1 A 38 38 ALA C C 38 180.820 178.617 2.203 1
1 386 . 3 1 1 A 38 38 ALA CA C 38 55.194 54.567 0.627 1
1 387 . 3 1 1 A 38 38 ALA CB C 38 17.654 18.516 -0.862 1
1 388 . 3 1 1 A 38 38 ALA N N 38 122.889 121.686 1.203 1
1 389 . 3 1 1 A 39 39 LEU H H 39 7.740 7.913 -0.173 1
1 390 . 3 1 1 A 39 39 LEU HA H 39 4.176 4.239 -0.063 1
1 400 . 3 1 1 A 39 39 LEU C C 39 179.266 178.840 0.426 1
1 401 . 3 1 1 A 39 39 LEU CA C 39 57.944 56.270 1.674 1
1 402 . 3 1 1 A 39 39 LEU CB C 39 42.105 42.249 -0.144 1
1 406 . 3 1 1 A 39 39 LEU N N 39 119.783 117.115 2.668 1
1 407 . 3 1 1 A 40 40 VAL H H 40 8.451 8.234 0.217 1
1 408 . 3 1 1 A 40 40 VAL HA H 40 3.259 3.627 -0.368 1
1 416 . 3 1 1 A 40 40 VAL C C 40 177.153 177.713 -0.560 1
1 417 . 3 1 1 A 40 40 VAL CA C 40 67.254 66.934 0.320 1
1 418 . 3 1 1 A 40 40 VAL CB C 40 31.747 31.466 0.281 1
1 421 . 3 1 1 A 40 40 VAL N N 40 121.481 119.959 1.522 1
1 422 . 3 1 1 A 41 41 GLU H H 41 7.254 8.132 -0.878 1
1 423 . 3 1 1 A 41 41 GLU HA H 41 4.159 4.129 0.030 1
1 428 . 3 1 1 A 41 41 GLU C C 41 179.483 178.899 0.584 1
1 429 . 3 1 1 A 41 41 GLU CA C 41 59.248 59.418 -0.170 1
1 430 . 3 1 1 A 41 41 GLU CB C 41 29.358 29.331 0.027 1
1 432 . 3 1 1 A 41 41 GLU N N 41 116.549 119.805 -3.256 1
1 433 . 3 1 1 A 42 42 GLU H H 42 8.103 7.742 0.361 1
1 434 . 3 1 1 A 42 42 GLU HA H 42 4.020 4.048 -0.028 1
1 439 . 3 1 1 A 42 42 GLU C C 42 180.115 178.804 1.311 1
1 440 . 3 1 1 A 42 42 GLU CA C 42 59.847 59.509 0.338 1
1 441 . 3 1 1 A 42 42 GLU CB C 42 30.218 29.361 0.857 1
1 443 . 3 1 1 A 42 42 GLU N N 42 119.578 119.239 0.339 1
1 444 . 3 1 1 A 43 43 CYS H H 43 8.955 8.168 0.787 1
1 445 . 3 1 1 A 43 43 CYS HA H 43 4.153 4.220 -0.067 1
1 448 . 3 1 1 A 43 43 CYS C C 43 176.498 177.683 -1.185 1
1 449 . 3 1 1 A 43 43 CYS CA C 43 64.856 62.515 2.341 1
1 450 . 3 1 1 A 43 43 CYS CB C 43 27.390 27.722 -0.332 1
1 451 . 3 1 1 A 43 43 CYS N N 43 118.199 118.910 -0.711 1
1 452 . 3 1 1 A 44 44 ASN H H 44 8.543 7.934 0.609 1
1 453 . 3 1 1 A 44 44 ASN HA H 44 4.635 4.449 0.186 1
1 458 . 3 1 1 A 44 44 ASN C C 44 178.633 177.726 0.907 1
1 459 . 3 1 1 A 44 44 ASN CA C 44 56.603 56.316 0.287 1
1 460 . 3 1 1 A 44 44 ASN CB C 44 37.187 38.234 -1.047 1
1 461 . 3 1 1 A 44 44 ASN N N 44 117.002 119.582 -2.580 1
1 463 . 3 1 1 A 45 45 ARG H H 45 8.296 8.121 0.175 1
1 464 . 3 1 1 A 45 45 ARG HA H 45 3.977 4.099 -0.122 1
1 471 . 3 1 1 A 45 45 ARG C C 45 178.149 178.381 -0.232 1
1 472 . 3 1 1 A 45 45 ARG CA C 45 60.589 59.500 1.089 1
1 473 . 3 1 1 A 45 45 ARG CB C 45 30.099 30.305 -0.206 1
1 476 . 3 1 1 A 45 45 ARG N N 45 121.021 120.901 0.120 1
1 477 . 3 1 1 A 46 46 ALA H H 46 7.914 8.355 -0.441 1
1 478 . 3 1 1 A 46 46 ALA HA H 46 4.128 4.115 0.013 1
1 482 . 3 1 1 A 46 46 ALA C C 46 181.208 180.223 0.985 1
1 483 . 3 1 1 A 46 46 ALA CA C 46 55.264 54.892 0.372 1
1 484 . 3 1 1 A 46 46 ALA CB C 46 18.759 18.505 0.254 1
1 485 . 3 1 1 A 46 46 ALA N N 46 121.570 120.810 0.760 1
1 486 . 3 1 1 A 47 47 GLU H H 47 8.730 8.622 0.108 1
1 487 . 3 1 1 A 47 47 GLU HA H 47 4.194 4.039 0.155 1
1 492 . 3 1 1 A 47 47 GLU C C 47 180.115 179.143 0.972 1
1 493 . 3 1 1 A 47 47 GLU CA C 47 58.401 59.212 -0.811 1
1 494 . 3 1 1 A 47 47 GLU CB C 47 29.523 29.284 0.239 1
1 496 . 3 1 1 A 47 47 GLU N N 47 117.532 118.144 -0.612 1
1 497 . 3 1 1 A 48 48 CYS H H 48 8.283 7.828 0.455 1
1 498 . 3 1 1 A 48 48 CYS HA H 48 4.002 4.111 -0.109 1
1 501 . 3 1 1 A 48 48 CYS C C 48 177.031 177.360 -0.329 1
1 502 . 3 1 1 A 48 48 CYS CA C 48 64.749 63.838 0.911 1
1 503 . 3 1 1 A 48 48 CYS CB C 48 25.907 27.250 -1.343 1
1 504 . 3 1 1 A 48 48 CYS N N 48 118.282 119.178 -0.896 1
1 505 . 3 1 1 A 49 49 LEU H H 49 8.181 8.085 0.096 1
1 506 . 3 1 1 A 49 49 LEU HA H 49 4.175 3.876 0.299 1
1 516 . 3 1 1 A 49 49 LEU C C 49 180.430 178.835 1.595 1
1 517 . 3 1 1 A 49 49 LEU CA C 49 57.873 58.159 -0.286 1
1 518 . 3 1 1 A 49 49 LEU CB C 49 41.539 41.752 -0.213 1
1 522 . 3 1 1 A 49 49 LEU N N 49 120.371 120.844 -0.473 1
1 523 . 3 1 1 A 50 50 GLN H H 50 7.934 8.625 -0.691 1
1 524 . 3 1 1 A 50 50 GLN HA H 50 4.102 4.050 0.052 1
1 531 . 3 1 1 A 50 50 GLN C C 50 177.322 177.339 -0.017 1
1 532 . 3 1 1 A 50 50 GLN CA C 50 58.156 58.735 -0.579 1
1 533 . 3 1 1 A 50 50 GLN CB C 50 28.616 28.477 0.139 1
1 535 . 3 1 1 A 50 50 GLN N N 50 118.175 117.512 0.663 1
1 537 . 3 1 1 A 51 51 ARG H H 51 7.632 7.798 -0.166 1
1 538 . 3 1 1 A 51 51 ARG HA H 51 4.347 4.354 -0.007 1
1 545 . 3 1 1 A 51 51 ARG C C 51 176.546 176.414 0.132 1
1 546 . 3 1 1 A 51 51 ARG CA C 51 56.286 55.983 0.303 1
1 547 . 3 1 1 A 51 51 ARG CB C 51 31.314 30.429 0.885 1
1 550 . 3 1 1 A 51 51 ARG N N 51 116.454 117.943 -1.489 1
1 551 . 3 1 1 A 52 52 GLY H H 52 7.949 8.129 -0.180 1
1 552 . 3 1 1 A 52 52 GLY HA2 H 52 4.033 3.968 0.065 1
1 553 . 3 1 1 A 52 52 GLY HA3 H 52 3.903 3.969 -0.066 1
1 554 . 3 1 1 A 52 52 GLY C C 52 174.385 174.274 0.111 1
1 555 . 3 1 1 A 52 52 GLY CA C 52 46.231 45.255 0.976 1
1 556 . 3 1 1 A 52 52 GLY N N 52 108.854 107.595 1.259 1
1 557 . 3 1 1 A 53 53 VAL H H 53 7.944 7.507 0.437 1
1 558 . 3 1 1 A 53 53 VAL HA H 53 4.250 4.065 0.185 1
1 566 . 3 1 1 A 53 53 VAL C C 53 175.525 174.859 0.666 1
1 567 . 3 1 1 A 53 53 VAL CA C 53 60.377 62.515 -2.138 1
1 568 . 3 1 1 A 53 53 VAL CB C 53 34.283 32.843 1.440 1
1 571 . 3 1 1 A 53 53 VAL N N 53 118.316 120.765 -2.449 1
1 572 . 3 1 1 A 54 54 SER H H 54 8.502 8.499 0.003 1
1 573 . 3 1 1 A 54 54 SER HA H 54 4.625 4.924 -0.299 1
1 576 . 3 1 1 A 54 54 SER C C 54 174.603 174.077 0.526 1
1 577 . 3 1 1 A 54 54 SER CA C 54 56.092 54.185 1.907 1
1 578 . 3 1 1 A 54 54 SER CB C 54 63.697 63.827 -0.130 1
1 579 . 3 1 1 A 54 54 SER N N 54 120.337 118.281 2.056 1
1 580 . 3 1 1 A 55 55 PRO HA H 55 4.624 4.532 0.092 1
1 587 . 3 1 1 A 55 55 PRO C C 55 177.322 177.657 -0.335 1
1 588 . 3 1 1 A 55 55 PRO CA C 55 64.431 64.288 0.143 1
1 589 . 3 1 1 A 55 55 PRO CB C 55 31.913 31.754 0.159 1
1 592 . 3 1 1 A 56 56 SER H H 56 7.931 8.302 -0.371 1
1 593 . 3 1 1 A 56 56 SER HA H 56 4.428 4.579 -0.151 1
1 596 . 3 1 1 A 56 56 SER C C 56 174.749 175.181 -0.432 1
1 597 . 3 1 1 A 56 56 SER CA C 56 59.130 59.383 -0.253 1
1 598 . 3 1 1 A 56 56 SER CB C 56 63.056 64.043 -0.987 1
1 599 . 3 1 1 A 56 56 SER N N 56 112.637 112.740 -0.103 1
1 600 . 3 1 1 A 57 57 LYS H H 57 8.121 7.639 0.482 1
1 601 . 3 1 1 A 57 57 LYS HA H 57 4.467 4.854 -0.387 1
1 609 . 3 1 1 A 57 57 LYS C C 57 176.570 176.189 0.381 1
1 610 . 3 1 1 A 57 57 LYS CA C 57 55.264 54.964 0.300 1
1 611 . 3 1 1 A 57 57 LYS CB C 57 32.160 32.728 -0.568 1
1 615 . 3 1 1 A 57 57 LYS N N 57 123.185 117.727 5.458 1
1 616 . 3 1 1 A 58 58 ALA H H 58 7.886 7.927 -0.041 1
1 617 . 3 1 1 A 58 58 ALA HA H 58 3.923 4.037 -0.114 1
1 621 . 3 1 1 A 58 58 ALA C C 58 177.469 179.749 -2.280 1
1 622 . 3 1 1 A 58 58 ALA CA C 58 54.276 54.871 -0.595 1
1 623 . 3 1 1 A 58 58 ALA CB C 58 18.271 18.246 0.025 1
1 624 . 3 1 1 A 58 58 ALA N N 58 123.941 123.316 0.625 1
1 625 . 3 1 1 A 59 59 HIS H H 59 8.077 8.134 -0.057 1
1 626 . 3 1 1 A 59 59 HIS HA H 59 4.420 4.388 0.032 1
1 631 . 3 1 1 A 59 59 HIS C C 59 177.542 177.534 0.008 1
1 632 . 3 1 1 A 59 59 HIS CA C 59 57.767 58.570 -0.803 1
1 633 . 3 1 1 A 59 59 HIS CB C 59 29.852 28.463 1.389 1
1 636 . 3 1 1 A 59 59 HIS N N 59 115.566 115.345 0.221 1
1 637 . 3 1 1 A 60 60 GLY H H 60 8.110 7.953 0.157 1
1 638 . 3 1 1 A 60 60 GLY HA2 H 60 3.873 3.428 0.445 1
1 639 . 3 1 1 A 60 60 GLY HA3 H 60 4.025 3.564 0.461 1
1 640 . 3 1 1 A 60 60 GLY C C 60 174.918 175.713 -0.795 1
1 641 . 3 1 1 A 60 60 GLY CA C 60 45.559 46.929 -1.370 1
1 642 . 3 1 1 A 60 60 GLY N N 60 109.216 110.485 -1.269 1
1 643 . 3 1 1 A 61 61 LEU H H 61 8.280 8.320 -0.040 1
1 644 . 3 1 1 A 61 61 LEU HA H 61 4.198 3.963 0.235 1
1 654 . 3 1 1 A 61 61 LEU C C 61 178.900 177.445 1.455 1
1 655 . 3 1 1 A 61 61 LEU CA C 61 55.758 57.870 -2.112 1
1 656 . 3 1 1 A 61 61 LEU CB C 61 42.544 41.986 0.558 1
1 660 . 3 1 1 A 61 61 LEU N N 61 120.521 123.240 -2.719 1
1 661 . 3 1 1 A 62 62 GLY H H 62 8.184 7.678 0.506 1
1 662 . 3 1 1 A 62 62 GLY HA2 H 62 3.978 3.827 0.151 1
1 663 . 3 1 1 A 62 62 GLY HA3 H 62 3.817 3.828 -0.011 1
1 664 . 3 1 1 A 62 62 GLY C C 62 176.012 175.199 0.813 1
1 665 . 3 1 1 A 62 62 GLY CA C 62 46.767 47.343 -0.576 1
1 666 . 3 1 1 A 62 62 GLY N N 62 108.987 108.394 0.593 1
1 667 . 3 1 1 A 63 63 SER HA H 63 4.322 4.194 0.128 1
1 670 . 3 1 1 A 63 63 SER C C 63 174.167 175.716 -1.549 1
1 671 . 3 1 1 A 63 63 SER CA C 63 59.919 60.971 -1.052 1
1 672 . 3 1 1 A 63 63 SER CB C 63 63.312 63.092 0.220 1
1 673 . 3 1 1 A 64 64 ASN H H 64 8.087 8.053 0.034 1
1 674 . 3 1 1 A 64 64 ASN HA H 64 4.850 4.959 -0.109 1
1 679 . 3 1 1 A 64 64 ASN C C 64 173.899 175.077 -1.178 1
1 680 . 3 1 1 A 64 64 ASN CA C 64 53.218 53.388 -0.170 1
1 681 . 3 1 1 A 64 64 ASN CB C 64 39.164 39.180 -0.016 1
1 682 . 3 1 1 A 64 64 ASN N N 64 118.041 117.353 0.688 1
1 684 . 3 1 1 A 65 65 LEU H H 65 7.293 7.160 0.133 1
1 685 . 3 1 1 A 65 65 LEU HA H 65 3.995 4.657 -0.662 1
1 695 . 3 1 1 A 65 65 LEU C C 65 175.696 175.114 0.582 1
1 696 . 3 1 1 A 65 65 LEU CA C 65 56.005 55.046 0.959 1
1 697 . 3 1 1 A 65 65 LEU CB C 65 43.120 43.529 -0.409 1
1 701 . 3 1 1 A 65 65 LEU N N 65 120.953 122.992 -2.039 1
1 702 . 3 1 1 A 66 66 VAL H H 66 9.517 9.065 0.452 1
1 703 . 3 1 1 A 66 66 VAL HA H 66 3.481 4.599 -1.118 1
1 711 . 3 1 1 A 66 66 VAL C C 66 175.429 174.968 0.461 1
1 712 . 3 1 1 A 66 66 VAL CA C 66 65.243 61.282 3.961 1
1 713 . 3 1 1 A 66 66 VAL CB C 66 31.335 33.430 -2.095 1
1 716 . 3 1 1 A 66 66 VAL N N 66 127.924 126.262 1.662 1
1 717 . 3 1 1 A 67 67 THR H H 67 6.253 8.350 -2.097 1
1 718 . 3 1 1 A 67 67 THR HA H 67 4.779 4.835 -0.056 1
1 723 . 3 1 1 A 67 67 THR C C 67 174.894 175.065 -0.171 1
1 724 . 3 1 1 A 67 67 THR CA C 67 58.719 59.427 -0.708 1
1 725 . 3 1 1 A 67 67 THR CB C 67 72.153 72.008 0.145 1
1 727 . 3 1 1 A 67 67 THR N N 67 113.376 116.392 -3.016 1
1 728 . 3 1 1 A 68 68 GLU H H 68 9.348 8.880 0.468 1
1 729 . 3 1 1 A 68 68 GLU HA H 68 3.634 3.992 -0.358 1
1 734 . 3 1 1 A 68 68 GLU C C 68 177.809 178.336 -0.527 1
1 735 . 3 1 1 A 68 68 GLU CA C 68 61.505 60.110 1.395 1
1 736 . 3 1 1 A 68 68 GLU CB C 68 28.285 29.688 -1.403 1
1 738 . 3 1 1 A 68 68 GLU N N 68 124.534 122.135 2.399 1
1 739 . 3 1 1 A 69 69 VAL H H 69 8.126 7.927 0.199 1
1 740 . 3 1 1 A 69 69 VAL HA H 69 3.862 3.516 0.346 1
1 748 . 3 1 1 A 69 69 VAL C C 69 177.712 178.087 -0.375 1
1 749 . 3 1 1 A 69 69 VAL CA C 69 65.701 66.873 -1.172 1
1 750 . 3 1 1 A 69 69 VAL CB C 69 31.829 31.473 0.356 1
1 753 . 3 1 1 A 69 69 VAL N N 69 119.139 119.908 -0.769 1
1 754 . 3 1 1 A 70 70 ARG H H 70 7.235 8.108 -0.873 1
1 755 . 3 1 1 A 70 70 ARG HA H 70 4.265 3.914 0.351 1
1 762 . 3 1 1 A 70 70 ARG C C 70 180.430 179.460 0.970 1
1 763 . 3 1 1 A 70 70 ARG CA C 70 59.742 60.171 -0.429 1
1 764 . 3 1 1 A 70 70 ARG CB C 70 29.439 29.957 -0.518 1
1 767 . 3 1 1 A 70 70 ARG N N 70 119.541 119.251 0.290 1
1 768 . 3 1 1 A 71 71 VAL H H 71 8.144 8.106 0.038 1
1 769 . 3 1 1 A 71 71 VAL HA H 71 4.018 3.939 0.079 1
1 777 . 3 1 1 A 71 71 VAL C C 71 177.493 178.030 -0.537 1
1 778 . 3 1 1 A 71 71 VAL CA C 71 67.924 66.595 1.329 1
1 779 . 3 1 1 A 71 71 VAL CB C 71 32.289 31.766 0.523 1
1 782 . 3 1 1 A 71 71 VAL N N 71 120.755 120.346 0.409 1
1 783 . 3 1 1 A 72 72 TYR H H 72 9.411 8.480 0.931 1
1 784 . 3 1 1 A 72 72 TYR HA H 72 3.908 4.277 -0.369 1
1 791 . 3 1 1 A 72 72 TYR C C 72 178.464 178.128 0.336 1
1 792 . 3 1 1 A 72 72 TYR CA C 72 63.444 61.790 1.654 1
1 793 . 3 1 1 A 72 72 TYR CB C 72 38.211 38.863 -0.652 1
1 798 . 3 1 1 A 72 72 TYR N N 72 121.175 121.454 -0.279 1
1 799 . 3 1 1 A 73 73 ASN H H 73 8.816 8.791 0.025 1
1 800 . 3 1 1 A 73 73 ASN HA H 73 4.538 4.724 -0.186 1
1 805 . 3 1 1 A 73 73 ASN C C 73 176.958 178.104 -1.146 1
1 806 . 3 1 1 A 73 73 ASN CA C 73 56.109 56.755 -0.646 1
1 807 . 3 1 1 A 73 73 ASN CB C 73 38.422 38.498 -0.076 1
1 808 . 3 1 1 A 73 73 ASN N N 73 118.122 117.706 0.416 1
1 810 . 3 1 1 A 74 74 TRP H H 74 8.657 8.397 0.260 1
1 811 . 3 1 1 A 74 74 TRP HA H 74 4.111 4.471 -0.360 1
1 820 . 3 1 1 A 74 74 TRP C C 74 179.654 178.474 1.180 1
1 821 . 3 1 1 A 74 74 TRP CA C 74 62.950 61.536 1.414 1
1 822 . 3 1 1 A 74 74 TRP CB C 74 29.555 29.769 -0.214 1
1 828 . 3 1 1 A 74 74 TRP N N 74 123.988 122.952 1.036 1
1 830 . 3 1 1 A 75 75 PHE H H 75 8.562 8.483 0.079 1
1 831 . 3 1 1 A 75 75 PHE HA H 75 3.821 4.432 -0.611 1
1 839 . 3 1 1 A 75 75 PHE C C 75 177.614 178.100 -0.486 1
1 840 . 3 1 1 A 75 75 PHE CA C 75 63.374 62.026 1.348 1
1 841 . 3 1 1 A 75 75 PHE CB C 75 39.648 38.437 1.211 1
1 847 . 3 1 1 A 75 75 PHE N N 75 118.325 117.030 1.295 1
1 848 . 3 1 1 A 76 76 ALA H H 76 8.305 8.193 0.112 1
1 849 . 3 1 1 A 76 76 ALA HA H 76 3.909 3.961 -0.052 1
1 853 . 3 1 1 A 76 76 ALA C C 76 180.868 180.171 0.697 1
1 854 . 3 1 1 A 76 76 ALA CA C 76 55.566 55.259 0.307 1
1 855 . 3 1 1 A 76 76 ALA CB C 76 17.820 17.975 -0.155 1
1 856 . 3 1 1 A 76 76 ALA N N 76 121.119 122.602 -1.483 1
1 857 . 3 1 1 A 77 77 ASN H H 77 8.335 7.877 0.458 1
1 858 . 3 1 1 A 77 77 ASN HA H 77 4.355 4.362 -0.007 1
1 863 . 3 1 1 A 77 77 ASN C C 77 177.105 177.785 -0.680 1
1 864 . 3 1 1 A 77 77 ASN CA C 77 56.145 56.148 -0.003 1
1 865 . 3 1 1 A 77 77 ASN CB C 77 38.063 38.596 -0.533 1
1 866 . 3 1 1 A 77 77 ASN N N 77 117.433 116.751 0.682 1
1 868 . 3 1 1 A 78 78 ARG H H 78 7.664 7.331 0.333 1
1 869 . 3 1 1 A 78 78 ARG HA H 78 3.629 3.744 -0.115 1
1 876 . 3 1 1 A 78 78 ARG C C 78 179.216 177.699 1.517 1
1 877 . 3 1 1 A 78 78 ARG CA C 78 58.773 58.595 0.178 1
1 878 . 3 1 1 A 78 78 ARG CB C 78 29.605 29.125 0.480 1
1 881 . 3 1 1 A 78 78 ARG N N 78 121.999 118.536 3.463 1
1 882 . 3 1 1 A 79 79 ARG H H 79 8.320 7.465 0.855 1
1 883 . 3 1 1 A 79 79 ARG HA H 79 4.307 4.507 -0.200 1
1 890 . 3 1 1 A 79 79 ARG C C 79 180.406 178.369 2.037 1
1 891 . 3 1 1 A 79 79 ARG CA C 79 60.270 57.576 2.694 1
1 892 . 3 1 1 A 79 79 ARG CB C 79 31.335 30.564 0.771 1
1 895 . 3 1 1 A 79 79 ARG N N 79 118.139 117.799 0.340 1
1 896 . 3 1 1 A 80 80 LYS H H 80 7.759 7.857 -0.098 1
1 897 . 3 1 1 A 80 80 LYS HA H 80 4.052 4.206 -0.154 1
1 905 . 3 1 1 A 80 80 LYS C C 80 178.999 179.470 -0.471 1
1 906 . 3 1 1 A 80 80 LYS CA C 80 59.531 59.456 0.075 1
1 907 . 3 1 1 A 80 80 LYS CB C 80 32.374 32.399 -0.025 1
1 911 . 3 1 1 A 80 80 LYS N N 80 120.899 119.464 1.435 1
1 912 . 3 1 1 A 81 81 GLU H H 81 8.041 8.408 -0.367 1
1 913 . 3 1 1 A 81 81 GLU HA H 81 4.044 4.118 -0.074 1
1 918 . 3 1 1 A 81 81 GLU C C 81 179.168 178.429 0.739 1
1 919 . 3 1 1 A 81 81 GLU CA C 81 59.036 59.563 -0.527 1
1 920 . 3 1 1 A 81 81 GLU CB C 81 29.561 29.161 0.400 1
1 922 . 3 1 1 A 81 81 GLU N N 81 120.193 118.595 1.598 1
1 923 . 3 1 1 A 82 82 GLU H H 82 8.131 8.545 -0.414 1
1 924 . 3 1 1 A 82 82 GLU HA H 82 4.017 4.064 -0.047 1
1 929 . 3 1 1 A 82 82 GLU C C 82 178.343 178.130 0.213 1
1 930 . 3 1 1 A 82 82 GLU CA C 82 59.319 59.328 -0.009 1
1 931 . 3 1 1 A 82 82 GLU CB C 82 29.770 29.294 0.476 1
1 933 . 3 1 1 A 82 82 GLU N N 82 119.626 118.983 0.643 1
1 934 . 3 1 1 A 83 83 ALA H H 83 7.935 7.772 0.163 1
1 935 . 3 1 1 A 83 83 ALA HA H 83 4.180 4.199 -0.019 1
1 939 . 3 1 1 A 83 83 ALA C C 83 179.994 179.501 0.493 1
1 940 . 3 1 1 A 83 83 ALA CA C 83 54.629 53.997 0.632 1
1 941 . 3 1 1 A 83 83 ALA CB C 83 18.090 18.820 -0.730 1
1 942 . 3 1 1 A 83 83 ALA N N 83 121.476 122.293 -0.817 1
1 943 . 3 1 1 A 84 84 PHE H H 84 8.043 7.959 0.084 1
1 944 . 3 1 1 A 84 84 PHE HA H 84 4.420 4.012 0.408 1
1 952 . 3 1 1 A 84 84 PHE C C 84 177.250 177.072 0.178 1
1 953 . 3 1 1 A 84 84 PHE CA C 84 60.059 61.494 -1.435 1
1 954 . 3 1 1 A 84 84 PHE CB C 84 38.952 39.381 -0.429 1
1 960 . 3 1 1 A 84 84 PHE N N 84 119.074 120.306 -1.232 1
1 961 . 3 1 1 A 85 85 ARG H H 85 8.031 7.871 0.160 1
1 962 . 3 1 1 A 85 85 ARG HA H 85 3.992 4.141 -0.149 1
1 968 . 3 1 1 A 85 85 ARG C C 85 178.319 178.359 -0.040 1
1 969 . 3 1 1 A 85 85 ARG CA C 85 58.523 59.569 -1.046 1
1 970 . 3 1 1 A 85 85 ARG CB C 85 30.346 29.925 0.421 1
1 973 . 3 1 1 A 85 85 ARG N N 85 119.291 117.653 1.638 1
1 974 . 3 1 1 A 86 86 GLN H H 86 8.091 7.980 0.111 1
1 975 . 3 1 1 A 86 86 GLN HA H 86 4.148 4.270 -0.122 1
1 982 . 3 1 1 A 86 86 GLN C C 86 177.105 178.251 -1.146 1
1 983 . 3 1 1 A 86 86 GLN CA C 86 57.556 57.385 0.171 1
1 984 . 3 1 1 A 86 86 GLN CB C 86 28.855 29.455 -0.600 1
1 986 . 3 1 1 A 86 86 GLN N N 86 119.097 117.597 1.500 1
1 988 . 3 1 1 A 87 87 LYS H H 87 7.898 8.333 -0.435 1
1 989 . 3 1 1 A 87 87 LYS HA H 87 4.116 4.026 0.090 1
1 997 . 3 1 1 A 87 87 LYS C C 87 177.542 179.248 -1.706 1
1 998 . 3 1 1 A 87 87 LYS CA C 87 57.944 59.119 -1.175 1
1 999 . 3 1 1 A 87 87 LYS CB C 87 32.242 31.821 0.421 1
1 1003 . 3 1 1 A 87 87 LYS N N 87 120.968 122.104 -1.136 1
1 1004 . 3 1 1 A 88 88 LEU H H 88 7.903 8.055 -0.152 1
1 1005 . 3 1 1 A 88 88 LEU HA H 88 4.144 4.192 -0.048 1
1 1015 . 3 1 1 A 88 88 LEU C C 88 178.221 178.410 -0.189 1
1 1016 . 3 1 1 A 88 88 LEU CA C 88 56.145 57.212 -1.067 1
1 1017 . 3 1 1 A 88 88 LEU CB C 88 42.215 41.459 0.756 1
1 1021 . 3 1 1 A 88 88 LEU N N 88 120.558 117.716 2.842 1
1 1022 . 3 1 1 A 89 89 ALA H H 89 7.894 7.633 0.261 1
1 1023 . 3 1 1 A 89 89 ALA HA H 89 4.224 4.286 -0.062 1
1 1027 . 3 1 1 A 89 89 ALA C C 89 178.609 179.179 -0.570 1
1 1028 . 3 1 1 A 89 89 ALA CA C 89 53.392 54.050 -0.658 1
1 1029 . 3 1 1 A 89 89 ALA CB C 89 18.695 19.141 -0.446 1
1 1030 . 3 1 1 A 89 89 ALA N N 89 122.387 122.466 -0.079 1
1 1031 . 3 1 1 A 90 90 MET H H 90 8.084 8.024 0.060 1
1 1032 . 3 1 1 A 90 90 MET HA H 90 4.356 4.129 0.227 1
1 1040 . 3 1 1 A 90 90 MET C C 90 176.982 177.090 -0.108 1
1 1041 . 3 1 1 A 90 90 MET CA C 90 56.551 58.437 -1.886 1
1 1042 . 3 1 1 A 90 90 MET CB C 90 32.719 32.124 0.595 1
1 1045 . 3 1 1 A 90 90 MET N N 90 118.509 116.805 1.704 1
1 1046 . 3 1 1 A 91 91 ASP H H 91 8.261 7.929 0.332 1
1 1047 . 3 1 1 A 91 91 ASP HA H 91 4.524 4.772 -0.248 1
1 1050 . 3 1 1 A 91 91 ASP C C 91 176.643 175.108 1.535 1
1 1051 . 3 1 1 A 91 91 ASP CA C 91 54.981 54.108 0.873 1
1 1052 . 3 1 1 A 91 91 ASP CB C 91 40.870 41.838 -0.968 1
1 1053 . 3 1 1 A 91 91 ASP N N 91 120.771 118.819 1.952 1
1 1054 . 3 1 1 A 92 92 ALA H H 92 7.971 8.559 -0.588 1
1 1055 . 3 1 1 A 92 92 ALA HA H 92 4.200 4.555 -0.355 1
1 1059 . 3 1 1 A 92 92 ALA C C 92 177.929 174.967 2.962 1
1 1060 . 3 1 1 A 92 92 ALA CA C 92 53.184 51.197 1.987 1
1 1061 . 3 1 1 A 92 92 ALA CB C 92 18.890 22.521 -3.631 1
1 1062 . 3 1 1 A 92 92 ALA N N 92 123.057 120.243 2.814 1
1 1063 . 3 1 1 A 93 93 TYR H H 93 8.019 8.354 -0.335 1
1 1064 . 3 1 1 A 93 93 TYR HA H 93 4.523 4.026 0.497 1
1 1071 . 3 1 1 A 93 93 TYR C C 93 176.279 174.599 1.680 1
1 1072 . 3 1 1 A 93 93 TYR CA C 93 58.401 58.791 -0.390 1
1 1073 . 3 1 1 A 93 93 TYR CB C 93 38.669 35.470 3.199 1
1 1078 . 3 1 1 A 93 93 TYR N N 93 118.337 114.526 3.811 1
1 1079 . 3 1 1 A 94 94 SER H H 94 8.037 7.642 0.395 1
1 1080 . 3 1 1 A 94 94 SER HA H 94 4.484 5.150 -0.666 1
1 1082 . 3 1 1 A 94 94 SER C C 94 174.554 173.226 1.328 1
1 1083 . 3 1 1 A 94 94 SER CA C 94 58.401 57.569 0.832 1
1 1084 . 3 1 1 A 94 94 SER CB C 94 63.806 66.896 -3.090 1
1 1085 . 3 1 1 A 94 94 SER N N 94 116.640 114.974 1.666 1
1 1086 . 3 1 1 A 96 96 ASN HA H 96 4.770 4.760 0.010 1
1 1091 . 3 1 1 A 96 96 ASN C C 96 175.161 175.107 0.054 1
1 1092 . 3 1 1 A 96 96 ASN CA C 96 53.395 52.464 0.931 1
1 1093 . 3 1 1 A 96 96 ASN CB C 96 38.999 39.375 -0.376 1
1 1095 . 3 1 1 A 97 97 SER H H 97 8.230 8.488 -0.258 1
1 1096 . 3 1 1 A 97 97 SER HA H 97 4.481 4.376 0.105 1
1 1099 . 3 1 1 A 97 97 SER C C 97 174.482 175.391 -0.909 1
1 1100 . 3 1 1 A 97 97 SER CA C 97 58.300 60.342 -2.042 1
1 1101 . 3 1 1 A 97 97 SER CB C 97 63.697 63.861 -0.164 1
1 1102 . 3 1 1 A 97 97 SER N N 97 115.866 117.785 -1.919 1
1 1103 . 3 1 1 A 98 98 GLY H H 98 8.228 8.597 -0.369 1
1 1104 . 3 1 1 A 98 98 GLY HA2 H 98 4.098 4.007 0.091 1
1 1105 . 3 1 1 A 98 98 GLY HA3 H 98 4.098 4.010 0.088 1
1 1106 . 3 1 1 A 98 98 GLY C C 98 171.788 173.267 -1.479 1
1 1107 . 3 1 1 A 98 98 GLY CA C 98 44.803 45.312 -0.509 1
1 1108 . 3 1 1 A 98 98 GLY N N 98 110.658 112.197 -1.539 1
1 1109 . 3 1 1 A 99 99 PRO HA H 99 4.463 4.664 -0.201 1
1 1116 . 3 1 1 A 99 99 PRO CA C 99 63.230 62.804 0.426 1
1 1117 . 3 1 1 A 99 99 PRO CB C 99 32.044 31.911 0.133 1
1 1120 . 3 1 1 A 100 100 SER H H 100 8.514 8.834 -0.320 1
1 1121 . 3 1 1 A 100 100 SER CA C 100 58.450 61.464 -3.014 1
1 1122 . 3 1 1 A 100 100 SER CB C 100 63.889 63.633 0.256 1
1 1 . 4 1 1 A 9 9 ASN H H 9 8.856 7.696 1.160 1
1 2 . 4 1 1 A 9 9 ASN HA H 9 4.694 4.611 0.083 1
1 7 . 4 1 1 A 9 9 ASN CA C 9 53.401 54.157 -0.756 1
1 8 . 4 1 1 A 9 9 ASN CB C 9 38.757 38.708 0.049 1
1 10 . 4 1 1 A 10 10 ARG HA H 10 4.346 4.647 -0.301 1
1 17 . 4 1 1 A 10 10 ARG C C 10 175.405 175.219 0.186 1
1 18 . 4 1 1 A 10 10 ARG CA C 10 56.181 55.026 1.155 1
1 19 . 4 1 1 A 10 10 ARG CB C 10 31.171 30.678 0.493 1
1 22 . 4 1 1 A 11 11 PHE H H 11 8.310 9.094 -0.784 1
1 23 . 4 1 1 A 11 11 PHE HA H 11 4.291 4.458 -0.167 1
1 31 . 4 1 1 A 11 11 PHE C C 11 174.458 174.327 0.131 1
1 32 . 4 1 1 A 11 11 PHE CA C 11 58.967 59.085 -0.118 1
1 33 . 4 1 1 A 11 11 PHE CB C 11 40.138 39.323 0.815 1
1 39 . 4 1 1 A 11 11 PHE N N 11 123.604 128.749 -5.145 1
1 40 . 4 1 1 A 12 12 LYS H H 12 7.307 8.255 -0.948 1
1 41 . 4 1 1 A 12 12 LYS HA H 12 4.165 4.405 -0.240 1
1 50 . 4 1 1 A 12 12 LYS C C 12 174.385 175.753 -1.368 1
1 51 . 4 1 1 A 12 12 LYS CA C 12 54.593 54.028 0.565 1
1 52 . 4 1 1 A 12 12 LYS CB C 12 34.712 34.501 0.211 1
1 56 . 4 1 1 A 12 12 LYS N N 12 127.282 127.631 -0.349 1
1 57 . 4 1 1 A 13 13 TRP H H 13 8.039 8.310 -0.271 1
1 58 . 4 1 1 A 13 13 TRP HA H 13 4.370 4.587 -0.217 1
1 67 . 4 1 1 A 13 13 TRP C C 13 177.857 176.670 1.187 1
1 68 . 4 1 1 A 13 13 TRP CA C 13 56.675 57.039 -0.364 1
1 69 . 4 1 1 A 13 13 TRP CB C 13 30.317 30.370 -0.053 1
1 75 . 4 1 1 A 13 13 TRP N N 13 124.264 127.525 -3.261 1
1 77 . 4 1 1 A 14 14 GLY H H 14 9.815 8.702 1.113 1
1 78 . 4 1 1 A 14 14 GLY HA2 H 14 4.370 4.190 0.180 1
1 79 . 4 1 1 A 14 14 GLY HA3 H 14 4.335 4.222 0.113 1
1 80 . 4 1 1 A 14 14 GLY C C 14 172.904 174.747 -1.843 1
1 81 . 4 1 1 A 14 14 GLY CA C 14 44.157 43.896 0.261 1
1 82 . 4 1 1 A 14 14 GLY N N 14 115.294 108.777 6.517 1
1 83 . 4 1 1 A 15 15 PRO HA H 15 4.327 4.395 -0.068 1
1 90 . 4 1 1 A 15 15 PRO C C 15 179.726 178.888 0.838 1
1 91 . 4 1 1 A 15 15 PRO CA C 15 65.171 65.357 -0.186 1
1 92 . 4 1 1 A 15 15 PRO CB C 15 31.829 31.819 0.010 1
1 95 . 4 1 1 A 16 16 ALA H H 16 9.214 8.137 1.077 1
1 96 . 4 1 1 A 16 16 ALA HA H 16 4.166 4.111 0.055 1
1 100 . 4 1 1 A 16 16 ALA C C 16 181.184 179.713 1.471 1
1 101 . 4 1 1 A 16 16 ALA CA C 16 55.370 55.255 0.115 1
1 102 . 4 1 1 A 16 16 ALA CB C 16 18.058 18.793 -0.735 1
1 103 . 4 1 1 A 16 16 ALA N N 16 122.414 119.618 2.796 1
1 104 . 4 1 1 A 17 17 SER H H 17 7.985 8.186 -0.201 1
1 105 . 4 1 1 A 17 17 SER HA H 17 4.317 4.100 0.217 1
1 107 . 4 1 1 A 17 17 SER C C 17 175.381 176.759 -1.378 1
1 108 . 4 1 1 A 17 17 SER CA C 17 63.163 62.103 1.060 1
1 109 . 4 1 1 A 17 17 SER CB C 17 64.055 63.033 1.022 1
1 110 . 4 1 1 A 17 17 SER N N 17 116.568 114.118 2.450 1
1 111 . 4 1 1 A 18 18 GLN H H 18 8.316 7.858 0.458 1
1 112 . 4 1 1 A 18 18 GLN HA H 18 3.323 3.494 -0.171 1
1 119 . 4 1 1 A 18 18 GLN C C 18 176.812 178.644 -1.832 1
1 120 . 4 1 1 A 18 18 GLN CA C 18 60.025 59.058 0.967 1
1 121 . 4 1 1 A 18 18 GLN CB C 18 28.686 28.351 0.335 1
1 123 . 4 1 1 A 18 18 GLN N N 18 119.002 120.852 -1.850 1
1 125 . 4 1 1 A 19 19 GLN H H 19 7.582 8.210 -0.628 1
1 126 . 4 1 1 A 19 19 GLN HA H 19 4.062 4.100 -0.038 1
1 133 . 4 1 1 A 19 19 GLN C C 19 178.488 178.644 -0.156 1
1 134 . 4 1 1 A 19 19 GLN CA C 19 59.248 59.313 -0.065 1
1 135 . 4 1 1 A 19 19 GLN CB C 19 28.203 28.140 0.063 1
1 137 . 4 1 1 A 19 19 GLN N N 19 116.221 118.655 -2.434 1
1 139 . 4 1 1 A 20 20 ILE H H 20 7.246 7.927 -0.681 1
1 140 . 4 1 1 A 20 20 ILE HA H 20 3.570 3.614 -0.044 1
1 150 . 4 1 1 A 20 20 ILE C C 20 178.999 178.527 0.472 1
1 151 . 4 1 1 A 20 20 ILE CA C 20 64.996 65.510 -0.514 1
1 152 . 4 1 1 A 20 20 ILE CB C 20 38.139 37.649 0.490 1
1 156 . 4 1 1 A 20 20 ILE N N 20 120.521 120.954 -0.433 1
1 157 . 4 1 1 A 21 21 LEU H H 21 8.034 7.844 0.190 1
1 158 . 4 1 1 A 21 21 LEU HA H 21 3.491 3.567 -0.076 1
1 168 . 4 1 1 A 21 21 LEU C C 21 178.196 178.441 -0.245 1
1 169 . 4 1 1 A 21 21 LEU CA C 21 57.944 57.420 0.524 1
1 170 . 4 1 1 A 21 21 LEU CB C 21 37.864 40.490 -2.626 1
1 174 . 4 1 1 A 21 21 LEU N N 21 121.259 119.131 2.128 1
1 175 . 4 1 1 A 22 22 TYR H H 22 8.479 7.600 0.879 1
1 176 . 4 1 1 A 22 22 TYR HA H 22 4.224 4.255 -0.031 1
1 183 . 4 1 1 A 22 22 TYR C C 22 179.630 178.678 0.952 1
1 184 . 4 1 1 A 22 22 TYR CA C 22 62.422 60.716 1.706 1
1 185 . 4 1 1 A 22 22 TYR CB C 22 37.434 37.587 -0.153 1
1 190 . 4 1 1 A 22 22 TYR N N 22 117.805 118.874 -1.069 1
1 191 . 4 1 1 A 23 23 GLN H H 23 7.707 8.329 -0.622 1
1 192 . 4 1 1 A 23 23 GLN HA H 23 4.166 4.038 0.128 1
1 199 . 4 1 1 A 23 23 GLN C C 23 178.633 178.591 0.042 1
1 200 . 4 1 1 A 23 23 GLN CA C 23 58.789 59.221 -0.432 1
1 201 . 4 1 1 A 23 23 GLN CB C 23 28.534 28.096 0.438 1
1 203 . 4 1 1 A 23 23 GLN N N 23 117.580 118.354 -0.774 1
1 205 . 4 1 1 A 24 24 ALA H H 24 8.155 7.872 0.283 1
1 206 . 4 1 1 A 24 24 ALA HA H 24 4.187 4.206 -0.019 1
1 210 . 4 1 1 A 24 24 ALA C C 24 180.018 179.234 0.784 1
1 211 . 4 1 1 A 24 24 ALA CA C 24 55.228 55.195 0.033 1
1 212 . 4 1 1 A 24 24 ALA CB C 24 19.468 18.564 0.904 1
1 213 . 4 1 1 A 24 24 ALA N N 24 122.813 122.362 0.451 1
1 214 . 4 1 1 A 25 25 TYR H H 25 8.995 8.477 0.518 1
1 215 . 4 1 1 A 25 25 TYR HA H 25 4.348 4.889 -0.541 1
1 222 . 4 1 1 A 25 25 TYR C C 25 175.792 177.359 -1.567 1
1 223 . 4 1 1 A 25 25 TYR CA C 25 61.681 61.992 -0.311 1
1 224 . 4 1 1 A 25 25 TYR CB C 25 38.175 38.563 -0.388 1
1 229 . 4 1 1 A 25 25 TYR N N 25 121.343 120.441 0.902 1
1 230 . 4 1 1 A 26 26 ASP H H 26 7.260 8.732 -1.472 1
1 231 . 4 1 1 A 26 26 ASP HA H 26 4.373 4.462 -0.089 1
1 234 . 4 1 1 A 26 26 ASP C C 26 177.322 178.843 -1.521 1
1 235 . 4 1 1 A 26 26 ASP CA C 26 56.603 57.825 -1.222 1
1 236 . 4 1 1 A 26 26 ASP CB C 26 41.060 42.266 -1.206 1
1 237 . 4 1 1 A 26 26 ASP N N 26 114.020 119.193 -5.173 1
1 238 . 4 1 1 A 27 27 ARG H H 27 7.343 7.895 -0.552 1
1 239 . 4 1 1 A 27 27 ARG HA H 27 4.302 4.329 -0.027 1
1 246 . 4 1 1 A 27 27 ARG C C 27 176.546 176.050 0.496 1
1 247 . 4 1 1 A 27 27 ARG CA C 27 57.563 58.098 -0.535 1
1 248 . 4 1 1 A 27 27 ARG CB C 27 31.500 30.948 0.552 1
1 251 . 4 1 1 A 27 27 ARG N N 27 116.729 117.645 -0.916 1
1 252 . 4 1 1 A 28 28 GLN H H 28 8.306 7.932 0.374 1
1 253 . 4 1 1 A 28 28 GLN HA H 28 4.396 4.724 -0.328 1
1 260 . 4 1 1 A 28 28 GLN C C 28 172.831 174.587 -1.756 1
1 261 . 4 1 1 A 28 28 GLN CA C 28 55.355 54.426 0.929 1
1 262 . 4 1 1 A 28 28 GLN CB C 28 31.062 31.613 -0.551 1
1 264 . 4 1 1 A 28 28 GLN N N 28 121.612 118.084 3.528 1
1 266 . 4 1 1 A 29 29 LYS H H 29 8.354 8.647 -0.293 1
1 267 . 4 1 1 A 29 29 LYS HA H 29 4.099 3.639 0.460 1
1 276 . 4 1 1 A 29 29 LYS C C 29 176.084 176.503 -0.419 1
1 277 . 4 1 1 A 29 29 LYS CA C 29 57.873 57.146 0.727 1
1 278 . 4 1 1 A 29 29 LYS CB C 29 33.313 33.328 -0.015 1
1 282 . 4 1 1 A 29 29 LYS N N 29 125.038 122.652 2.386 1
1 283 . 4 1 1 A 30 30 ASN H H 30 8.856 8.135 0.721 1
1 284 . 4 1 1 A 30 30 ASN HA H 30 4.958 4.923 0.035 1
1 289 . 4 1 1 A 30 30 ASN C C 30 171.179 173.657 -2.478 1
1 290 . 4 1 1 A 30 30 ASN CA C 30 50.891 50.628 0.263 1
1 291 . 4 1 1 A 30 30 ASN CB C 30 39.907 38.737 1.170 1
1 292 . 4 1 1 A 30 30 ASN N N 30 115.764 114.554 1.210 1
1 294 . 4 1 1 A 31 31 PRO HA H 31 4.299 4.406 -0.107 1
1 301 . 4 1 1 A 31 31 PRO C C 31 177.493 176.899 0.594 1
1 302 . 4 1 1 A 31 31 PRO CA C 31 62.489 62.608 -0.119 1
1 303 . 4 1 1 A 31 31 PRO CB C 31 31.216 31.791 -0.575 1
1 306 . 4 1 1 A 32 32 SER H H 32 9.368 8.457 0.911 1
1 307 . 4 1 1 A 32 32 SER HA H 32 4.372 4.736 -0.364 1
1 310 . 4 1 1 A 32 32 SER C C 32 174.821 175.801 -0.980 1
1 311 . 4 1 1 A 32 32 SER CA C 32 57.203 57.675 -0.472 1
1 312 . 4 1 1 A 32 32 SER CB C 32 65.594 64.284 1.310 1
1 313 . 4 1 1 A 32 32 SER N N 32 120.847 117.532 3.315 1
1 314 . 4 1 1 A 33 33 LYS H H 33 9.152 8.959 0.193 1
1 315 . 4 1 1 A 33 33 LYS HA H 33 3.719 3.901 -0.182 1
1 324 . 4 1 1 A 33 33 LYS C C 33 177.833 178.259 -0.426 1
1 325 . 4 1 1 A 33 33 LYS CA C 33 61.188 60.370 0.818 1
1 326 . 4 1 1 A 33 33 LYS CB C 33 32.572 32.388 0.184 1
1 330 . 4 1 1 A 33 33 LYS N N 33 122.966 124.646 -1.680 1
1 331 . 4 1 1 A 34 34 GLU H H 34 8.902 8.247 0.655 1
1 332 . 4 1 1 A 34 34 GLU HA H 34 4.089 4.046 0.043 1
1 337 . 4 1 1 A 34 34 GLU C C 34 180.286 179.210 1.076 1
1 338 . 4 1 1 A 34 34 GLU CA C 34 60.483 59.235 1.248 1
1 339 . 4 1 1 A 34 34 GLU CB C 34 28.835 29.273 -0.438 1
1 341 . 4 1 1 A 34 34 GLU N N 34 117.645 117.664 -0.019 1
1 342 . 4 1 1 A 35 35 GLU H H 35 7.673 8.169 -0.496 1
1 343 . 4 1 1 A 35 35 GLU HA H 35 4.023 3.936 0.087 1
1 348 . 4 1 1 A 35 35 GLU C C 35 180.237 179.085 1.152 1
1 349 . 4 1 1 A 35 35 GLU CA C 35 59.214 59.408 -0.194 1
1 350 . 4 1 1 A 35 35 GLU CB C 35 30.099 29.321 0.778 1
1 352 . 4 1 1 A 35 35 GLU N N 35 121.077 120.061 1.016 1
1 353 . 4 1 1 A 36 36 ARG H H 36 8.932 8.218 0.714 1
1 354 . 4 1 1 A 36 36 ARG HA H 36 3.928 3.783 0.145 1
1 362 . 4 1 1 A 36 36 ARG C C 36 178.464 179.000 -0.536 1
1 363 . 4 1 1 A 36 36 ARG CA C 36 60.974 59.936 1.038 1
1 364 . 4 1 1 A 36 36 ARG CB C 36 31.171 29.672 1.499 1
1 367 . 4 1 1 A 36 36 ARG N N 36 119.441 120.048 -0.607 1
1 369 . 4 1 1 A 37 37 GLU H H 37 8.756 8.372 0.384 1
1 370 . 4 1 1 A 37 37 GLU HA H 37 3.948 4.106 -0.158 1
1 375 . 4 1 1 A 37 37 GLU C C 37 179.606 179.129 0.477 1
1 376 . 4 1 1 A 37 37 GLU CA C 37 60.094 59.012 1.082 1
1 377 . 4 1 1 A 37 37 GLU CB C 37 29.110 29.433 -0.323 1
1 379 . 4 1 1 A 37 37 GLU N N 37 119.017 119.685 -0.668 1
1 380 . 4 1 1 A 38 38 ALA H H 38 7.733 8.101 -0.368 1
1 381 . 4 1 1 A 38 38 ALA HA H 38 4.325 4.168 0.157 1
1 385 . 4 1 1 A 38 38 ALA C C 38 180.820 178.289 2.531 1
1 386 . 4 1 1 A 38 38 ALA CA C 38 55.194 54.316 0.878 1
1 387 . 4 1 1 A 38 38 ALA CB C 38 17.654 18.539 -0.885 1
1 388 . 4 1 1 A 38 38 ALA N N 38 122.889 121.922 0.967 1
1 389 . 4 1 1 A 39 39 LEU H H 39 7.740 7.653 0.087 1
1 390 . 4 1 1 A 39 39 LEU HA H 39 4.176 4.285 -0.109 1
1 400 . 4 1 1 A 39 39 LEU C C 39 179.266 178.733 0.533 1
1 401 . 4 1 1 A 39 39 LEU CA C 39 57.944 56.029 1.915 1
1 402 . 4 1 1 A 39 39 LEU CB C 39 42.105 42.353 -0.248 1
1 406 . 4 1 1 A 39 39 LEU N N 39 119.783 116.391 3.392 1
1 407 . 4 1 1 A 40 40 VAL H H 40 8.451 8.283 0.168 1
1 408 . 4 1 1 A 40 40 VAL HA H 40 3.259 3.593 -0.334 1
1 416 . 4 1 1 A 40 40 VAL C C 40 177.153 177.620 -0.467 1
1 417 . 4 1 1 A 40 40 VAL CA C 40 67.254 66.958 0.296 1
1 418 . 4 1 1 A 40 40 VAL CB C 40 31.747 31.520 0.227 1
1 421 . 4 1 1 A 40 40 VAL N N 40 121.481 119.924 1.557 1
1 422 . 4 1 1 A 41 41 GLU H H 41 7.254 7.934 -0.680 1
1 423 . 4 1 1 A 41 41 GLU HA H 41 4.159 4.128 0.031 1
1 428 . 4 1 1 A 41 41 GLU C C 41 179.483 178.898 0.585 1
1 429 . 4 1 1 A 41 41 GLU CA C 41 59.248 59.347 -0.099 1
1 430 . 4 1 1 A 41 41 GLU CB C 41 29.358 29.507 -0.149 1
1 432 . 4 1 1 A 41 41 GLU N N 41 116.549 119.830 -3.281 1
1 433 . 4 1 1 A 42 42 GLU H H 42 8.103 7.727 0.376 1
1 434 . 4 1 1 A 42 42 GLU HA H 42 4.020 4.048 -0.028 1
1 439 . 4 1 1 A 42 42 GLU C C 42 180.115 178.794 1.321 1
1 440 . 4 1 1 A 42 42 GLU CA C 42 59.847 59.517 0.330 1
1 441 . 4 1 1 A 42 42 GLU CB C 42 30.218 29.344 0.874 1
1 443 . 4 1 1 A 42 42 GLU N N 42 119.578 119.350 0.228 1
1 444 . 4 1 1 A 43 43 CYS H H 43 8.955 8.069 0.886 1
1 445 . 4 1 1 A 43 43 CYS HA H 43 4.153 4.242 -0.089 1
1 448 . 4 1 1 A 43 43 CYS C C 43 176.498 177.648 -1.150 1
1 449 . 4 1 1 A 43 43 CYS CA C 43 64.856 62.369 2.487 1
1 450 . 4 1 1 A 43 43 CYS CB C 43 27.390 27.810 -0.420 1
1 451 . 4 1 1 A 43 43 CYS N N 43 118.199 118.906 -0.707 1
1 452 . 4 1 1 A 44 44 ASN H H 44 8.543 7.912 0.631 1
1 453 . 4 1 1 A 44 44 ASN HA H 44 4.635 4.432 0.203 1
1 458 . 4 1 1 A 44 44 ASN C C 44 178.633 177.649 0.984 1
1 459 . 4 1 1 A 44 44 ASN CA C 44 56.603 56.414 0.189 1
1 460 . 4 1 1 A 44 44 ASN CB C 44 37.187 38.185 -0.998 1
1 461 . 4 1 1 A 44 44 ASN N N 44 117.002 119.645 -2.643 1
1 463 . 4 1 1 A 45 45 ARG H H 45 8.296 8.333 -0.037 1
1 464 . 4 1 1 A 45 45 ARG HA H 45 3.977 4.066 -0.089 1
1 471 . 4 1 1 A 45 45 ARG C C 45 178.149 178.233 -0.084 1
1 472 . 4 1 1 A 45 45 ARG CA C 45 60.589 59.495 1.094 1
1 473 . 4 1 1 A 45 45 ARG CB C 45 30.099 30.222 -0.123 1
1 476 . 4 1 1 A 45 45 ARG N N 45 121.021 121.045 -0.024 1
1 477 . 4 1 1 A 46 46 ALA H H 46 7.914 8.364 -0.450 1
1 478 . 4 1 1 A 46 46 ALA HA H 46 4.128 4.111 0.017 1
1 482 . 4 1 1 A 46 46 ALA C C 46 181.208 180.079 1.129 1
1 483 . 4 1 1 A 46 46 ALA CA C 46 55.264 54.928 0.336 1
1 484 . 4 1 1 A 46 46 ALA CB C 46 18.759 18.430 0.329 1
1 485 . 4 1 1 A 46 46 ALA N N 46 121.570 120.782 0.788 1
1 486 . 4 1 1 A 47 47 GLU H H 47 8.730 8.649 0.081 1
1 487 . 4 1 1 A 47 47 GLU HA H 47 4.194 4.050 0.144 1
1 492 . 4 1 1 A 47 47 GLU C C 47 180.115 179.014 1.101 1
1 493 . 4 1 1 A 47 47 GLU CA C 47 58.401 59.474 -1.073 1
1 494 . 4 1 1 A 47 47 GLU CB C 47 29.523 29.295 0.228 1
1 496 . 4 1 1 A 47 47 GLU N N 47 117.532 118.366 -0.834 1
1 497 . 4 1 1 A 48 48 CYS H H 48 8.283 7.901 0.382 1
1 498 . 4 1 1 A 48 48 CYS HA H 48 4.002 4.139 -0.137 1
1 501 . 4 1 1 A 48 48 CYS C C 48 177.031 177.372 -0.341 1
1 502 . 4 1 1 A 48 48 CYS CA C 48 64.749 63.892 0.857 1
1 503 . 4 1 1 A 48 48 CYS CB C 48 25.907 27.296 -1.389 1
1 504 . 4 1 1 A 48 48 CYS N N 48 118.282 119.182 -0.900 1
1 505 . 4 1 1 A 49 49 LEU H H 49 8.181 8.032 0.149 1
1 506 . 4 1 1 A 49 49 LEU HA H 49 4.175 3.940 0.235 1
1 516 . 4 1 1 A 49 49 LEU C C 49 180.430 178.660 1.770 1
1 517 . 4 1 1 A 49 49 LEU CA C 49 57.873 58.183 -0.310 1
1 518 . 4 1 1 A 49 49 LEU CB C 49 41.539 41.693 -0.154 1
1 522 . 4 1 1 A 49 49 LEU N N 49 120.371 120.991 -0.620 1
1 523 . 4 1 1 A 50 50 GLN H H 50 7.934 8.510 -0.576 1
1 524 . 4 1 1 A 50 50 GLN HA H 50 4.102 4.078 0.024 1
1 531 . 4 1 1 A 50 50 GLN C C 50 177.322 177.211 0.111 1
1 532 . 4 1 1 A 50 50 GLN CA C 50 58.156 58.655 -0.499 1
1 533 . 4 1 1 A 50 50 GLN CB C 50 28.616 28.629 -0.013 1
1 535 . 4 1 1 A 50 50 GLN N N 50 118.175 117.397 0.778 1
1 537 . 4 1 1 A 51 51 ARG H H 51 7.632 7.726 -0.094 1
1 538 . 4 1 1 A 51 51 ARG HA H 51 4.347 4.361 -0.014 1
1 545 . 4 1 1 A 51 51 ARG C C 51 176.546 176.459 0.087 1
1 546 . 4 1 1 A 51 51 ARG CA C 51 56.286 55.934 0.352 1
1 547 . 4 1 1 A 51 51 ARG CB C 51 31.314 30.164 1.150 1
1 550 . 4 1 1 A 51 51 ARG N N 51 116.454 117.789 -1.335 1
1 551 . 4 1 1 A 52 52 GLY H H 52 7.949 8.437 -0.488 1
1 552 . 4 1 1 A 52 52 GLY HA2 H 52 4.033 3.970 0.063 1
1 553 . 4 1 1 A 52 52 GLY HA3 H 52 3.903 3.971 -0.068 1
1 554 . 4 1 1 A 52 52 GLY C C 52 174.385 174.213 0.172 1
1 555 . 4 1 1 A 52 52 GLY CA C 52 46.231 45.283 0.948 1
1 556 . 4 1 1 A 52 52 GLY N N 52 108.854 107.678 1.176 1
1 557 . 4 1 1 A 53 53 VAL H H 53 7.944 7.506 0.438 1
1 558 . 4 1 1 A 53 53 VAL HA H 53 4.250 4.054 0.196 1
1 566 . 4 1 1 A 53 53 VAL C C 53 175.525 175.252 0.273 1
1 567 . 4 1 1 A 53 53 VAL CA C 53 60.377 62.507 -2.130 1
1 568 . 4 1 1 A 53 53 VAL CB C 53 34.283 32.851 1.432 1
1 571 . 4 1 1 A 53 53 VAL N N 53 118.316 120.656 -2.340 1
1 572 . 4 1 1 A 54 54 SER H H 54 8.502 8.530 -0.028 1
1 573 . 4 1 1 A 54 54 SER HA H 54 4.625 4.898 -0.273 1
1 576 . 4 1 1 A 54 54 SER C C 54 174.603 174.067 0.536 1
1 577 . 4 1 1 A 54 54 SER CA C 54 56.092 54.258 1.834 1
1 578 . 4 1 1 A 54 54 SER CB C 54 63.697 63.799 -0.102 1
1 579 . 4 1 1 A 54 54 SER N N 54 120.337 118.578 1.759 1
1 580 . 4 1 1 A 55 55 PRO HA H 55 4.624 4.521 0.103 1
1 587 . 4 1 1 A 55 55 PRO C C 55 177.322 177.362 -0.040 1
1 588 . 4 1 1 A 55 55 PRO CA C 55 64.431 64.178 0.253 1
1 589 . 4 1 1 A 55 55 PRO CB C 55 31.913 31.654 0.259 1
1 592 . 4 1 1 A 56 56 SER H H 56 7.931 8.432 -0.501 1
1 593 . 4 1 1 A 56 56 SER HA H 56 4.428 4.621 -0.193 1
1 596 . 4 1 1 A 56 56 SER C C 56 174.749 174.883 -0.134 1
1 597 . 4 1 1 A 56 56 SER CA C 56 59.130 59.178 -0.048 1
1 598 . 4 1 1 A 56 56 SER CB C 56 63.056 63.852 -0.796 1
1 599 . 4 1 1 A 56 56 SER N N 56 112.637 112.971 -0.334 1
1 600 . 4 1 1 A 57 57 LYS H H 57 8.121 7.593 0.528 1
1 601 . 4 1 1 A 57 57 LYS HA H 57 4.467 4.972 -0.505 1
1 609 . 4 1 1 A 57 57 LYS C C 57 176.570 176.297 0.273 1
1 610 . 4 1 1 A 57 57 LYS CA C 57 55.264 55.049 0.215 1
1 611 . 4 1 1 A 57 57 LYS CB C 57 32.160 32.425 -0.265 1
1 615 . 4 1 1 A 57 57 LYS N N 57 123.185 117.969 5.216 1
1 616 . 4 1 1 A 58 58 ALA H H 58 7.886 7.995 -0.109 1
1 617 . 4 1 1 A 58 58 ALA HA H 58 3.923 3.895 0.028 1
1 621 . 4 1 1 A 58 58 ALA C C 58 177.469 179.712 -2.243 1
1 622 . 4 1 1 A 58 58 ALA CA C 58 54.276 54.907 -0.631 1
1 623 . 4 1 1 A 58 58 ALA CB C 58 18.271 18.553 -0.282 1
1 624 . 4 1 1 A 58 58 ALA N N 58 123.941 122.521 1.420 1
1 625 . 4 1 1 A 59 59 HIS H H 59 8.077 8.180 -0.103 1
1 626 . 4 1 1 A 59 59 HIS HA H 59 4.420 4.390 0.030 1
1 631 . 4 1 1 A 59 59 HIS C C 59 177.542 177.441 0.101 1
1 632 . 4 1 1 A 59 59 HIS CA C 59 57.767 58.556 -0.789 1
1 633 . 4 1 1 A 59 59 HIS CB C 59 29.852 28.674 1.178 1
1 636 . 4 1 1 A 59 59 HIS N N 59 115.566 115.503 0.063 1
1 637 . 4 1 1 A 60 60 GLY H H 60 8.110 7.589 0.521 1
1 638 . 4 1 1 A 60 60 GLY HA2 H 60 3.873 3.398 0.475 1
1 639 . 4 1 1 A 60 60 GLY HA3 H 60 4.025 3.501 0.524 1
1 640 . 4 1 1 A 60 60 GLY C C 60 174.918 175.666 -0.748 1
1 641 . 4 1 1 A 60 60 GLY CA C 60 45.559 46.949 -1.390 1
1 642 . 4 1 1 A 60 60 GLY N N 60 109.216 110.195 -0.979 1
1 643 . 4 1 1 A 61 61 LEU H H 61 8.280 8.375 -0.095 1
1 644 . 4 1 1 A 61 61 LEU HA H 61 4.198 3.942 0.256 1
1 654 . 4 1 1 A 61 61 LEU C C 61 178.900 177.565 1.335 1
1 655 . 4 1 1 A 61 61 LEU CA C 61 55.758 57.878 -2.120 1
1 656 . 4 1 1 A 61 61 LEU CB C 61 42.544 41.743 0.801 1
1 660 . 4 1 1 A 61 61 LEU N N 61 120.521 123.126 -2.605 1
1 661 . 4 1 1 A 62 62 GLY H H 62 8.184 8.065 0.119 1
1 662 . 4 1 1 A 62 62 GLY HA2 H 62 3.978 3.846 0.132 1
1 663 . 4 1 1 A 62 62 GLY HA3 H 62 3.817 3.850 -0.033 1
1 664 . 4 1 1 A 62 62 GLY C C 62 176.012 175.307 0.705 1
1 665 . 4 1 1 A 62 62 GLY CA C 62 46.767 47.336 -0.569 1
1 666 . 4 1 1 A 62 62 GLY N N 62 108.987 108.357 0.630 1
1 667 . 4 1 1 A 63 63 SER HA H 63 4.322 4.220 0.102 1
1 670 . 4 1 1 A 63 63 SER C C 63 174.167 175.060 -0.893 1
1 671 . 4 1 1 A 63 63 SER CA C 63 59.919 62.144 -2.225 1
1 672 . 4 1 1 A 63 63 SER CB C 63 63.312 62.961 0.351 1
1 673 . 4 1 1 A 64 64 ASN H H 64 8.087 7.980 0.107 1
1 674 . 4 1 1 A 64 64 ASN HA H 64 4.850 5.120 -0.270 1
1 679 . 4 1 1 A 64 64 ASN C C 64 173.899 175.137 -1.238 1
1 680 . 4 1 1 A 64 64 ASN CA C 64 53.218 53.443 -0.225 1
1 681 . 4 1 1 A 64 64 ASN CB C 64 39.164 39.310 -0.146 1
1 682 . 4 1 1 A 64 64 ASN N N 64 118.041 116.468 1.573 1
1 684 . 4 1 1 A 65 65 LEU H H 65 7.293 7.453 -0.160 1
1 685 . 4 1 1 A 65 65 LEU HA H 65 3.995 4.571 -0.576 1
1 695 . 4 1 1 A 65 65 LEU C C 65 175.696 175.650 0.046 1
1 696 . 4 1 1 A 65 65 LEU CA C 65 56.005 54.574 1.431 1
1 697 . 4 1 1 A 65 65 LEU CB C 65 43.120 43.496 -0.376 1
1 701 . 4 1 1 A 65 65 LEU N N 65 120.953 122.877 -1.924 1
1 702 . 4 1 1 A 66 66 VAL H H 66 9.517 8.754 0.763 1
1 703 . 4 1 1 A 66 66 VAL HA H 66 3.481 4.193 -0.712 1
1 711 . 4 1 1 A 66 66 VAL C C 66 175.429 175.005 0.424 1
1 712 . 4 1 1 A 66 66 VAL CA C 66 65.243 61.349 3.894 1
1 713 . 4 1 1 A 66 66 VAL CB C 66 31.335 32.515 -1.180 1
1 716 . 4 1 1 A 66 66 VAL N N 66 127.924 127.145 0.779 1
1 717 . 4 1 1 A 67 67 THR H H 67 6.253 8.339 -2.086 1
1 718 . 4 1 1 A 67 67 THR HA H 67 4.779 4.691 0.088 1
1 723 . 4 1 1 A 67 67 THR C C 67 174.894 174.690 0.204 1
1 724 . 4 1 1 A 67 67 THR CA C 67 58.719 59.833 -1.114 1
1 725 . 4 1 1 A 67 67 THR CB C 67 72.153 71.251 0.902 1
1 727 . 4 1 1 A 67 67 THR N N 67 113.376 115.651 -2.275 1
1 728 . 4 1 1 A 68 68 GLU H H 68 9.348 8.870 0.478 1
1 729 . 4 1 1 A 68 68 GLU HA H 68 3.634 4.015 -0.381 1
1 734 . 4 1 1 A 68 68 GLU C C 68 177.809 178.332 -0.523 1
1 735 . 4 1 1 A 68 68 GLU CA C 68 61.505 60.060 1.445 1
1 736 . 4 1 1 A 68 68 GLU CB C 68 28.285 29.687 -1.402 1
1 738 . 4 1 1 A 68 68 GLU N N 68 124.534 122.204 2.330 1
1 739 . 4 1 1 A 69 69 VAL H H 69 8.126 7.903 0.223 1
1 740 . 4 1 1 A 69 69 VAL HA H 69 3.862 3.538 0.324 1
1 748 . 4 1 1 A 69 69 VAL C C 69 177.712 178.077 -0.365 1
1 749 . 4 1 1 A 69 69 VAL CA C 69 65.701 66.803 -1.102 1
1 750 . 4 1 1 A 69 69 VAL CB C 69 31.829 31.596 0.233 1
1 753 . 4 1 1 A 69 69 VAL N N 69 119.139 119.844 -0.705 1
1 754 . 4 1 1 A 70 70 ARG H H 70 7.235 8.261 -1.026 1
1 755 . 4 1 1 A 70 70 ARG HA H 70 4.265 4.005 0.260 1
1 762 . 4 1 1 A 70 70 ARG C C 70 180.430 179.544 0.886 1
1 763 . 4 1 1 A 70 70 ARG CA C 70 59.742 60.171 -0.429 1
1 764 . 4 1 1 A 70 70 ARG CB C 70 29.439 29.974 -0.535 1
1 767 . 4 1 1 A 70 70 ARG N N 70 119.541 119.133 0.408 1
1 768 . 4 1 1 A 71 71 VAL H H 71 8.144 8.056 0.088 1
1 769 . 4 1 1 A 71 71 VAL HA H 71 4.018 3.943 0.075 1
1 777 . 4 1 1 A 71 71 VAL C C 71 177.493 178.430 -0.937 1
1 778 . 4 1 1 A 71 71 VAL CA C 71 67.924 66.752 1.172 1
1 779 . 4 1 1 A 71 71 VAL CB C 71 32.289 31.747 0.542 1
1 782 . 4 1 1 A 71 71 VAL N N 71 120.755 120.372 0.383 1
1 783 . 4 1 1 A 72 72 TYR H H 72 9.411 8.477 0.934 1
1 784 . 4 1 1 A 72 72 TYR HA H 72 3.908 4.115 -0.207 1
1 791 . 4 1 1 A 72 72 TYR C C 72 178.464 177.131 1.333 1
1 792 . 4 1 1 A 72 72 TYR CA C 72 63.444 62.288 1.156 1
1 793 . 4 1 1 A 72 72 TYR CB C 72 38.211 38.630 -0.419 1
1 798 . 4 1 1 A 72 72 TYR N N 72 121.175 120.948 0.227 1
1 799 . 4 1 1 A 73 73 ASN H H 73 8.816 8.754 0.062 1
1 800 . 4 1 1 A 73 73 ASN HA H 73 4.538 4.527 0.011 1
1 805 . 4 1 1 A 73 73 ASN C C 73 176.958 178.091 -1.133 1
1 806 . 4 1 1 A 73 73 ASN CA C 73 56.109 56.626 -0.517 1
1 807 . 4 1 1 A 73 73 ASN CB C 73 38.422 38.637 -0.215 1
1 808 . 4 1 1 A 73 73 ASN N N 73 118.122 117.581 0.541 1
1 810 . 4 1 1 A 74 74 TRP H H 74 8.657 8.338 0.319 1
1 811 . 4 1 1 A 74 74 TRP HA H 74 4.111 4.389 -0.278 1
1 820 . 4 1 1 A 74 74 TRP C C 74 179.654 178.455 1.199 1
1 821 . 4 1 1 A 74 74 TRP CA C 74 62.950 61.315 1.635 1
1 822 . 4 1 1 A 74 74 TRP CB C 74 29.555 29.542 0.013 1
1 828 . 4 1 1 A 74 74 TRP N N 74 123.988 122.951 1.037 1
1 830 . 4 1 1 A 75 75 PHE H H 75 8.562 8.438 0.124 1
1 831 . 4 1 1 A 75 75 PHE HA H 75 3.821 4.426 -0.605 1
1 839 . 4 1 1 A 75 75 PHE C C 75 177.614 178.271 -0.657 1
1 840 . 4 1 1 A 75 75 PHE CA C 75 63.374 61.770 1.604 1
1 841 . 4 1 1 A 75 75 PHE CB C 75 39.648 38.071 1.577 1
1 847 . 4 1 1 A 75 75 PHE N N 75 118.325 117.690 0.635 1
1 848 . 4 1 1 A 76 76 ALA H H 76 8.305 8.376 -0.071 1
1 849 . 4 1 1 A 76 76 ALA HA H 76 3.909 3.920 -0.011 1
1 853 . 4 1 1 A 76 76 ALA C C 76 180.868 179.664 1.204 1
1 854 . 4 1 1 A 76 76 ALA CA C 76 55.566 55.159 0.407 1
1 855 . 4 1 1 A 76 76 ALA CB C 76 17.820 17.902 -0.082 1
1 856 . 4 1 1 A 76 76 ALA N N 76 121.119 122.254 -1.135 1
1 857 . 4 1 1 A 77 77 ASN H H 77 8.335 8.413 -0.078 1
1 858 . 4 1 1 A 77 77 ASN HA H 77 4.355 4.382 -0.027 1
1 863 . 4 1 1 A 77 77 ASN C C 77 177.105 177.739 -0.634 1
1 864 . 4 1 1 A 77 77 ASN CA C 77 56.145 56.215 -0.070 1
1 865 . 4 1 1 A 77 77 ASN CB C 77 38.063 38.695 -0.632 1
1 866 . 4 1 1 A 77 77 ASN N N 77 117.433 115.518 1.915 1
1 868 . 4 1 1 A 78 78 ARG H H 78 7.664 7.321 0.343 1
1 869 . 4 1 1 A 78 78 ARG HA H 78 3.629 4.083 -0.454 1
1 876 . 4 1 1 A 78 78 ARG C C 78 179.216 178.256 0.960 1
1 877 . 4 1 1 A 78 78 ARG CA C 78 58.773 58.955 -0.182 1
1 878 . 4 1 1 A 78 78 ARG CB C 78 29.605 29.119 0.486 1
1 881 . 4 1 1 A 78 78 ARG N N 78 121.999 118.503 3.496 1
1 882 . 4 1 1 A 79 79 ARG H H 79 8.320 7.844 0.476 1
1 883 . 4 1 1 A 79 79 ARG HA H 79 4.307 4.227 0.080 1
1 890 . 4 1 1 A 79 79 ARG C C 79 180.406 178.447 1.959 1
1 891 . 4 1 1 A 79 79 ARG CA C 79 60.270 58.484 1.786 1
1 892 . 4 1 1 A 79 79 ARG CB C 79 31.335 30.293 1.042 1
1 895 . 4 1 1 A 79 79 ARG N N 79 118.139 118.215 -0.076 1
1 896 . 4 1 1 A 80 80 LYS H H 80 7.759 8.002 -0.243 1
1 897 . 4 1 1 A 80 80 LYS HA H 80 4.052 4.169 -0.117 1
1 905 . 4 1 1 A 80 80 LYS C C 80 178.999 179.222 -0.223 1
1 906 . 4 1 1 A 80 80 LYS CA C 80 59.531 59.288 0.243 1
1 907 . 4 1 1 A 80 80 LYS CB C 80 32.374 32.493 -0.119 1
1 911 . 4 1 1 A 80 80 LYS N N 80 120.899 118.887 2.012 1
1 912 . 4 1 1 A 81 81 GLU H H 81 8.041 8.324 -0.283 1
1 913 . 4 1 1 A 81 81 GLU HA H 81 4.044 4.158 -0.114 1
1 918 . 4 1 1 A 81 81 GLU C C 81 179.168 178.587 0.581 1
1 919 . 4 1 1 A 81 81 GLU CA C 81 59.036 59.574 -0.538 1
1 920 . 4 1 1 A 81 81 GLU CB C 81 29.561 29.115 0.446 1
1 922 . 4 1 1 A 81 81 GLU N N 81 120.193 118.812 1.381 1
1 923 . 4 1 1 A 82 82 GLU H H 82 8.131 8.155 -0.024 1
1 924 . 4 1 1 A 82 82 GLU HA H 82 4.017 4.077 -0.060 1
1 929 . 4 1 1 A 82 82 GLU C C 82 178.343 178.323 0.020 1
1 930 . 4 1 1 A 82 82 GLU CA C 82 59.319 59.373 -0.054 1
1 931 . 4 1 1 A 82 82 GLU CB C 82 29.770 29.233 0.537 1
1 933 . 4 1 1 A 82 82 GLU N N 82 119.626 118.861 0.765 1
1 934 . 4 1 1 A 83 83 ALA H H 83 7.935 7.720 0.215 1
1 935 . 4 1 1 A 83 83 ALA HA H 83 4.180 4.151 0.029 1
1 939 . 4 1 1 A 83 83 ALA C C 83 179.994 179.698 0.296 1
1 940 . 4 1 1 A 83 83 ALA CA C 83 54.629 54.297 0.332 1
1 941 . 4 1 1 A 83 83 ALA CB C 83 18.090 18.746 -0.656 1
1 942 . 4 1 1 A 83 83 ALA N N 83 121.476 122.350 -0.874 1
1 943 . 4 1 1 A 84 84 PHE H H 84 8.043 7.909 0.134 1
1 944 . 4 1 1 A 84 84 PHE HA H 84 4.420 4.059 0.361 1
1 952 . 4 1 1 A 84 84 PHE C C 84 177.250 177.068 0.182 1
1 953 . 4 1 1 A 84 84 PHE CA C 84 60.059 61.823 -1.764 1
1 954 . 4 1 1 A 84 84 PHE CB C 84 38.952 39.389 -0.437 1
1 960 . 4 1 1 A 84 84 PHE N N 84 119.074 120.464 -1.390 1
1 961 . 4 1 1 A 85 85 ARG H H 85 8.031 8.403 -0.372 1
1 962 . 4 1 1 A 85 85 ARG HA H 85 3.992 4.129 -0.137 1
1 968 . 4 1 1 A 85 85 ARG C C 85 178.319 178.438 -0.119 1
1 969 . 4 1 1 A 85 85 ARG CA C 85 58.523 59.576 -1.053 1
1 970 . 4 1 1 A 85 85 ARG CB C 85 30.346 29.959 0.387 1
1 973 . 4 1 1 A 85 85 ARG N N 85 119.291 117.789 1.502 1
1 974 . 4 1 1 A 86 86 GLN H H 86 8.091 7.862 0.229 1
1 975 . 4 1 1 A 86 86 GLN HA H 86 4.148 4.233 -0.085 1
1 982 . 4 1 1 A 86 86 GLN C C 86 177.105 178.221 -1.116 1
1 983 . 4 1 1 A 86 86 GLN CA C 86 57.556 57.639 -0.083 1
1 984 . 4 1 1 A 86 86 GLN CB C 86 28.855 29.358 -0.503 1
1 986 . 4 1 1 A 86 86 GLN N N 86 119.097 117.589 1.508 1
1 988 . 4 1 1 A 87 87 LYS H H 87 7.898 8.217 -0.319 1
1 989 . 4 1 1 A 87 87 LYS HA H 87 4.116 3.997 0.119 1
1 997 . 4 1 1 A 87 87 LYS C C 87 177.542 179.490 -1.948 1
1 998 . 4 1 1 A 87 87 LYS CA C 87 57.944 59.342 -1.398 1
1 999 . 4 1 1 A 87 87 LYS CB C 87 32.242 31.880 0.362 1
1 1003 . 4 1 1 A 87 87 LYS N N 87 120.968 122.137 -1.169 1
1 1004 . 4 1 1 A 88 88 LEU H H 88 7.903 7.915 -0.012 1
1 1005 . 4 1 1 A 88 88 LEU HA H 88 4.144 4.014 0.130 1
1 1015 . 4 1 1 A 88 88 LEU C C 88 178.221 178.614 -0.393 1
1 1016 . 4 1 1 A 88 88 LEU CA C 88 56.145 57.440 -1.295 1
1 1017 . 4 1 1 A 88 88 LEU CB C 88 42.215 41.528 0.687 1
1 1021 . 4 1 1 A 88 88 LEU N N 88 120.558 117.530 3.028 1
1 1022 . 4 1 1 A 89 89 ALA H H 89 7.894 7.866 0.028 1
1 1023 . 4 1 1 A 89 89 ALA HA H 89 4.224 4.255 -0.031 1
1 1027 . 4 1 1 A 89 89 ALA C C 89 178.609 179.663 -1.054 1
1 1028 . 4 1 1 A 89 89 ALA CA C 89 53.392 55.092 -1.700 1
1 1029 . 4 1 1 A 89 89 ALA CB C 89 18.695 18.662 0.033 1
1 1030 . 4 1 1 A 89 89 ALA N N 89 122.387 122.585 -0.198 1
1 1031 . 4 1 1 A 90 90 MET H H 90 8.084 8.036 0.048 1
1 1032 . 4 1 1 A 90 90 MET HA H 90 4.356 4.146 0.210 1
1 1040 . 4 1 1 A 90 90 MET C C 90 176.982 177.042 -0.060 1
1 1041 . 4 1 1 A 90 90 MET CA C 90 56.551 58.604 -2.053 1
1 1042 . 4 1 1 A 90 90 MET CB C 90 32.719 32.531 0.188 1
1 1045 . 4 1 1 A 90 90 MET N N 90 118.509 116.528 1.981 1
1 1046 . 4 1 1 A 91 91 ASP H H 91 8.261 7.542 0.719 1
1 1047 . 4 1 1 A 91 91 ASP HA H 91 4.524 4.629 -0.105 1
1 1050 . 4 1 1 A 91 91 ASP C C 91 176.643 176.028 0.615 1
1 1051 . 4 1 1 A 91 91 ASP CA C 91 54.981 54.301 0.680 1
1 1052 . 4 1 1 A 91 91 ASP CB C 91 40.870 41.818 -0.948 1
1 1053 . 4 1 1 A 91 91 ASP N N 91 120.771 118.762 2.009 1
1 1054 . 4 1 1 A 92 92 ALA H H 92 7.971 8.338 -0.367 1
1 1055 . 4 1 1 A 92 92 ALA HA H 92 4.200 4.324 -0.124 1
1 1059 . 4 1 1 A 92 92 ALA C C 92 177.929 176.499 1.430 1
1 1060 . 4 1 1 A 92 92 ALA CA C 92 53.184 51.468 1.716 1
1 1061 . 4 1 1 A 92 92 ALA CB C 92 18.890 19.942 -1.052 1
1 1062 . 4 1 1 A 92 92 ALA N N 92 123.057 123.530 -0.473 1
1 1063 . 4 1 1 A 93 93 TYR H H 93 8.019 8.526 -0.507 1
1 1064 . 4 1 1 A 93 93 TYR HA H 93 4.523 4.459 0.064 1
1 1071 . 4 1 1 A 93 93 TYR C C 93 176.279 174.871 1.408 1
1 1072 . 4 1 1 A 93 93 TYR CA C 93 58.401 57.889 0.512 1
1 1073 . 4 1 1 A 93 93 TYR CB C 93 38.669 38.902 -0.233 1
1 1078 . 4 1 1 A 93 93 TYR N N 93 118.337 118.764 -0.427 1
1 1079 . 4 1 1 A 94 94 SER H H 94 8.037 8.742 -0.705 1
1 1080 . 4 1 1 A 94 94 SER HA H 94 4.484 4.913 -0.429 1
1 1082 . 4 1 1 A 94 94 SER C C 94 174.554 173.680 0.874 1
1 1083 . 4 1 1 A 94 94 SER CA C 94 58.401 56.571 1.830 1
1 1084 . 4 1 1 A 94 94 SER CB C 94 63.806 64.441 -0.635 1
1 1085 . 4 1 1 A 94 94 SER N N 94 116.640 120.025 -3.385 1
1 1086 . 4 1 1 A 96 96 ASN HA H 96 4.770 4.764 0.006 1
1 1091 . 4 1 1 A 96 96 ASN C C 96 175.161 175.550 -0.389 1
1 1092 . 4 1 1 A 96 96 ASN CA C 96 53.395 54.031 -0.636 1
1 1093 . 4 1 1 A 96 96 ASN CB C 96 38.999 38.995 0.004 1
1 1095 . 4 1 1 A 97 97 SER H H 97 8.230 8.669 -0.439 1
1 1096 . 4 1 1 A 97 97 SER HA H 97 4.481 5.448 -0.967 1
1 1099 . 4 1 1 A 97 97 SER C C 97 174.482 173.397 1.085 1
1 1100 . 4 1 1 A 97 97 SER CA C 97 58.300 57.032 1.268 1
1 1101 . 4 1 1 A 97 97 SER CB C 97 63.697 66.520 -2.823 1
1 1102 . 4 1 1 A 97 97 SER N N 97 115.866 115.939 -0.073 1
1 1103 . 4 1 1 A 98 98 GLY H H 98 8.228 8.711 -0.483 1
1 1104 . 4 1 1 A 98 98 GLY HA2 H 98 4.098 4.565 -0.467 1
1 1105 . 4 1 1 A 98 98 GLY HA3 H 98 4.098 4.565 -0.467 1
1 1106 . 4 1 1 A 98 98 GLY C C 98 171.788 172.174 -0.386 1
1 1107 . 4 1 1 A 98 98 GLY CA C 98 44.803 46.186 -1.383 1
1 1108 . 4 1 1 A 98 98 GLY N N 98 110.658 112.699 -2.041 1
1 1109 . 4 1 1 A 99 99 PRO HA H 99 4.463 4.431 0.032 1
1 1116 . 4 1 1 A 99 99 PRO CA C 99 63.230 62.749 0.481 1
1 1117 . 4 1 1 A 99 99 PRO CB C 99 32.044 31.828 0.216 1
1 1120 . 4 1 1 A 100 100 SER H H 100 8.514 8.326 0.188 1
1 1121 . 4 1 1 A 100 100 SER CA C 100 58.450 58.111 0.339 1
1 1122 . 4 1 1 A 100 100 SER CB C 100 63.889 63.679 0.210 1
1 1 . 5 1 1 A 9 9 ASN H H 9 8.856 8.688 0.168 1
1 2 . 5 1 1 A 9 9 ASN HA H 9 4.694 4.871 -0.177 1
1 7 . 5 1 1 A 9 9 ASN CA C 9 53.401 53.632 -0.231 1
1 8 . 5 1 1 A 9 9 ASN CB C 9 38.757 38.598 0.159 1
1 10 . 5 1 1 A 10 10 ARG HA H 10 4.346 4.548 -0.202 1
1 17 . 5 1 1 A 10 10 ARG C C 10 175.405 174.763 0.642 1
1 18 . 5 1 1 A 10 10 ARG CA C 10 56.181 55.064 1.117 1
1 19 . 5 1 1 A 10 10 ARG CB C 10 31.171 29.774 1.397 1
1 22 . 5 1 1 A 11 11 PHE H H 11 8.310 8.271 0.039 1
1 23 . 5 1 1 A 11 11 PHE HA H 11 4.291 5.183 -0.892 1
1 31 . 5 1 1 A 11 11 PHE C C 11 174.458 173.540 0.918 1
1 32 . 5 1 1 A 11 11 PHE CA C 11 58.967 56.312 2.655 1
1 33 . 5 1 1 A 11 11 PHE CB C 11 40.138 42.225 -2.087 1
1 39 . 5 1 1 A 11 11 PHE N N 11 123.604 123.961 -0.357 1
1 40 . 5 1 1 A 12 12 LYS H H 12 7.307 8.369 -1.062 1
1 41 . 5 1 1 A 12 12 LYS HA H 12 4.165 4.658 -0.493 1
1 50 . 5 1 1 A 12 12 LYS C C 12 174.385 175.413 -1.028 1
1 51 . 5 1 1 A 12 12 LYS CA C 12 54.593 53.821 0.772 1
1 52 . 5 1 1 A 12 12 LYS CB C 12 34.712 35.911 -1.199 1
1 56 . 5 1 1 A 12 12 LYS N N 12 127.282 127.206 0.076 1
1 57 . 5 1 1 A 13 13 TRP H H 13 8.039 8.488 -0.449 1
1 58 . 5 1 1 A 13 13 TRP HA H 13 4.370 4.787 -0.417 1
1 67 . 5 1 1 A 13 13 TRP C C 13 177.857 176.396 1.461 1
1 68 . 5 1 1 A 13 13 TRP CA C 13 56.675 56.947 -0.272 1
1 69 . 5 1 1 A 13 13 TRP CB C 13 30.317 30.200 0.117 1
1 75 . 5 1 1 A 13 13 TRP N N 13 124.264 126.096 -1.832 1
1 77 . 5 1 1 A 14 14 GLY H H 14 9.815 8.705 1.110 1
1 78 . 5 1 1 A 14 14 GLY HA2 H 14 4.370 4.190 0.180 1
1 79 . 5 1 1 A 14 14 GLY HA3 H 14 4.335 4.206 0.129 1
1 80 . 5 1 1 A 14 14 GLY C C 14 172.904 174.780 -1.876 1
1 81 . 5 1 1 A 14 14 GLY CA C 14 44.157 43.910 0.247 1
1 82 . 5 1 1 A 14 14 GLY N N 14 115.294 108.811 6.483 1
1 83 . 5 1 1 A 15 15 PRO HA H 15 4.327 4.385 -0.058 1
1 90 . 5 1 1 A 15 15 PRO C C 15 179.726 178.830 0.896 1
1 91 . 5 1 1 A 15 15 PRO CA C 15 65.171 65.290 -0.119 1
1 92 . 5 1 1 A 15 15 PRO CB C 15 31.829 31.844 -0.015 1
1 95 . 5 1 1 A 16 16 ALA H H 16 9.214 8.146 1.068 1
1 96 . 5 1 1 A 16 16 ALA HA H 16 4.166 4.118 0.048 1
1 100 . 5 1 1 A 16 16 ALA C C 16 181.184 179.772 1.412 1
1 101 . 5 1 1 A 16 16 ALA CA C 16 55.370 55.249 0.121 1
1 102 . 5 1 1 A 16 16 ALA CB C 16 18.058 18.796 -0.738 1
1 103 . 5 1 1 A 16 16 ALA N N 16 122.414 119.806 2.608 1
1 104 . 5 1 1 A 17 17 SER H H 17 7.985 8.185 -0.200 1
1 105 . 5 1 1 A 17 17 SER HA H 17 4.317 4.125 0.192 1
1 107 . 5 1 1 A 17 17 SER C C 17 175.381 176.731 -1.350 1
1 108 . 5 1 1 A 17 17 SER CA C 17 63.163 62.079 1.084 1
1 109 . 5 1 1 A 17 17 SER CB C 17 64.055 63.057 0.998 1
1 110 . 5 1 1 A 17 17 SER N N 17 116.568 114.134 2.434 1
1 111 . 5 1 1 A 18 18 GLN H H 18 8.316 7.883 0.433 1
1 112 . 5 1 1 A 18 18 GLN HA H 18 3.323 3.496 -0.173 1
1 119 . 5 1 1 A 18 18 GLN C C 18 176.812 178.628 -1.816 1
1 120 . 5 1 1 A 18 18 GLN CA C 18 60.025 59.138 0.887 1
1 121 . 5 1 1 A 18 18 GLN CB C 18 28.686 28.467 0.219 1
1 123 . 5 1 1 A 18 18 GLN N N 18 119.002 121.059 -2.057 1
1 125 . 5 1 1 A 19 19 GLN H H 19 7.582 8.154 -0.572 1
1 126 . 5 1 1 A 19 19 GLN HA H 19 4.062 4.108 -0.046 1
1 133 . 5 1 1 A 19 19 GLN C C 19 178.488 178.456 0.032 1
1 134 . 5 1 1 A 19 19 GLN CA C 19 59.248 59.227 0.021 1
1 135 . 5 1 1 A 19 19 GLN CB C 19 28.203 28.139 0.064 1
1 137 . 5 1 1 A 19 19 GLN N N 19 116.221 118.842 -2.621 1
1 139 . 5 1 1 A 20 20 ILE H H 20 7.246 7.956 -0.710 1
1 140 . 5 1 1 A 20 20 ILE HA H 20 3.570 3.629 -0.059 1
1 150 . 5 1 1 A 20 20 ILE C C 20 178.999 178.554 0.445 1
1 151 . 5 1 1 A 20 20 ILE CA C 20 64.996 65.704 -0.708 1
1 152 . 5 1 1 A 20 20 ILE CB C 20 38.139 37.860 0.279 1
1 156 . 5 1 1 A 20 20 ILE N N 20 120.521 120.953 -0.432 1
1 157 . 5 1 1 A 21 21 LEU H H 21 8.034 7.804 0.230 1
1 158 . 5 1 1 A 21 21 LEU HA H 21 3.491 3.582 -0.091 1
1 168 . 5 1 1 A 21 21 LEU C C 21 178.196 178.303 -0.107 1
1 169 . 5 1 1 A 21 21 LEU CA C 21 57.944 57.450 0.494 1
1 170 . 5 1 1 A 21 21 LEU CB C 21 37.864 40.389 -2.525 1
1 174 . 5 1 1 A 21 21 LEU N N 21 121.259 118.688 2.571 1
1 175 . 5 1 1 A 22 22 TYR H H 22 8.479 7.577 0.902 1
1 176 . 5 1 1 A 22 22 TYR HA H 22 4.224 4.256 -0.032 1
1 183 . 5 1 1 A 22 22 TYR C C 22 179.630 178.605 1.025 1
1 184 . 5 1 1 A 22 22 TYR CA C 22 62.422 60.847 1.575 1
1 185 . 5 1 1 A 22 22 TYR CB C 22 37.434 37.646 -0.212 1
1 190 . 5 1 1 A 22 22 TYR N N 22 117.805 119.046 -1.241 1
1 191 . 5 1 1 A 23 23 GLN H H 23 7.707 8.410 -0.703 1
1 192 . 5 1 1 A 23 23 GLN HA H 23 4.166 4.055 0.111 1
1 199 . 5 1 1 A 23 23 GLN C C 23 178.633 178.516 0.117 1
1 200 . 5 1 1 A 23 23 GLN CA C 23 58.789 59.194 -0.405 1
1 201 . 5 1 1 A 23 23 GLN CB C 23 28.534 28.153 0.381 1
1 203 . 5 1 1 A 23 23 GLN N N 23 117.580 118.219 -0.639 1
1 205 . 5 1 1 A 24 24 ALA H H 24 8.155 7.892 0.263 1
1 206 . 5 1 1 A 24 24 ALA HA H 24 4.187 4.279 -0.092 1
1 210 . 5 1 1 A 24 24 ALA C C 24 180.018 179.560 0.458 1
1 211 . 5 1 1 A 24 24 ALA CA C 24 55.228 55.048 0.180 1
1 212 . 5 1 1 A 24 24 ALA CB C 24 19.468 18.638 0.830 1
1 213 . 5 1 1 A 24 24 ALA N N 24 122.813 122.068 0.745 1
1 214 . 5 1 1 A 25 25 TYR H H 25 8.995 8.376 0.619 1
1 215 . 5 1 1 A 25 25 TYR HA H 25 4.348 4.780 -0.432 1
1 222 . 5 1 1 A 25 25 TYR C C 25 175.792 177.465 -1.673 1
1 223 . 5 1 1 A 25 25 TYR CA C 25 61.681 61.478 0.203 1
1 224 . 5 1 1 A 25 25 TYR CB C 25 38.175 38.511 -0.336 1
1 229 . 5 1 1 A 25 25 TYR N N 25 121.343 120.553 0.790 1
1 230 . 5 1 1 A 26 26 ASP H H 26 7.260 8.897 -1.637 1
1 231 . 5 1 1 A 26 26 ASP HA H 26 4.373 4.462 -0.089 1
1 234 . 5 1 1 A 26 26 ASP C C 26 177.322 178.320 -0.998 1
1 235 . 5 1 1 A 26 26 ASP CA C 26 56.603 57.598 -0.995 1
1 236 . 5 1 1 A 26 26 ASP CB C 26 41.060 41.412 -0.352 1
1 237 . 5 1 1 A 26 26 ASP N N 26 114.020 119.267 -5.247 1
1 238 . 5 1 1 A 27 27 ARG H H 27 7.343 7.890 -0.547 1
1 239 . 5 1 1 A 27 27 ARG HA H 27 4.302 4.353 -0.051 1
1 246 . 5 1 1 A 27 27 ARG C C 27 176.546 176.244 0.302 1
1 247 . 5 1 1 A 27 27 ARG CA C 27 57.563 57.869 -0.306 1
1 248 . 5 1 1 A 27 27 ARG CB C 27 31.500 31.294 0.206 1
1 251 . 5 1 1 A 27 27 ARG N N 27 116.729 117.185 -0.456 1
1 252 . 5 1 1 A 28 28 GLN H H 28 8.306 7.991 0.315 1
1 253 . 5 1 1 A 28 28 GLN HA H 28 4.396 4.691 -0.295 1
1 260 . 5 1 1 A 28 28 GLN C C 28 172.831 175.199 -2.368 1
1 261 . 5 1 1 A 28 28 GLN CA C 28 55.355 54.374 0.981 1
1 262 . 5 1 1 A 28 28 GLN CB C 28 31.062 31.578 -0.516 1
1 264 . 5 1 1 A 28 28 GLN N N 28 121.612 118.371 3.241 1
1 266 . 5 1 1 A 29 29 LYS H H 29 8.354 8.527 -0.173 1
1 267 . 5 1 1 A 29 29 LYS HA H 29 4.099 3.596 0.503 1
1 276 . 5 1 1 A 29 29 LYS C C 29 176.084 176.523 -0.439 1
1 277 . 5 1 1 A 29 29 LYS CA C 29 57.873 57.776 0.097 1
1 278 . 5 1 1 A 29 29 LYS CB C 29 33.313 32.635 0.678 1
1 282 . 5 1 1 A 29 29 LYS N N 29 125.038 124.112 0.926 1
1 283 . 5 1 1 A 30 30 ASN H H 30 8.856 7.867 0.989 1
1 284 . 5 1 1 A 30 30 ASN HA H 30 4.958 5.056 -0.098 1
1 289 . 5 1 1 A 30 30 ASN C C 30 171.179 172.704 -1.525 1
1 290 . 5 1 1 A 30 30 ASN CA C 30 50.891 50.407 0.484 1
1 291 . 5 1 1 A 30 30 ASN CB C 30 39.907 39.225 0.682 1
1 292 . 5 1 1 A 30 30 ASN N N 30 115.764 117.582 -1.818 1
1 294 . 5 1 1 A 31 31 PRO HA H 31 4.299 4.433 -0.134 1
1 301 . 5 1 1 A 31 31 PRO C C 31 177.493 176.929 0.564 1
1 302 . 5 1 1 A 31 31 PRO CA C 31 62.489 62.575 -0.086 1
1 303 . 5 1 1 A 31 31 PRO CB C 31 31.216 31.906 -0.690 1
1 306 . 5 1 1 A 32 32 SER H H 32 9.368 8.442 0.926 1
1 307 . 5 1 1 A 32 32 SER HA H 32 4.372 4.706 -0.334 1
1 310 . 5 1 1 A 32 32 SER C C 32 174.821 175.695 -0.874 1
1 311 . 5 1 1 A 32 32 SER CA C 32 57.203 58.242 -1.039 1
1 312 . 5 1 1 A 32 32 SER CB C 32 65.594 64.294 1.300 1
1 313 . 5 1 1 A 32 32 SER N N 32 120.847 117.966 2.881 1
1 314 . 5 1 1 A 33 33 LYS H H 33 9.152 8.971 0.181 1
1 315 . 5 1 1 A 33 33 LYS HA H 33 3.719 3.929 -0.210 1
1 324 . 5 1 1 A 33 33 LYS C C 33 177.833 178.332 -0.499 1
1 325 . 5 1 1 A 33 33 LYS CA C 33 61.188 60.167 1.021 1
1 326 . 5 1 1 A 33 33 LYS CB C 33 32.572 32.149 0.423 1
1 330 . 5 1 1 A 33 33 LYS N N 33 122.966 124.701 -1.735 1
1 331 . 5 1 1 A 34 34 GLU H H 34 8.902 8.249 0.653 1
1 332 . 5 1 1 A 34 34 GLU HA H 34 4.089 4.074 0.015 1
1 337 . 5 1 1 A 34 34 GLU C C 34 180.286 179.132 1.154 1
1 338 . 5 1 1 A 34 34 GLU CA C 34 60.483 59.461 1.022 1
1 339 . 5 1 1 A 34 34 GLU CB C 34 28.835 29.290 -0.455 1
1 341 . 5 1 1 A 34 34 GLU N N 34 117.645 118.896 -1.251 1
1 342 . 5 1 1 A 35 35 GLU H H 35 7.673 8.131 -0.458 1
1 343 . 5 1 1 A 35 35 GLU HA H 35 4.023 3.990 0.033 1
1 348 . 5 1 1 A 35 35 GLU C C 35 180.237 179.194 1.043 1
1 349 . 5 1 1 A 35 35 GLU CA C 35 59.214 59.343 -0.129 1
1 350 . 5 1 1 A 35 35 GLU CB C 35 30.099 29.260 0.839 1
1 352 . 5 1 1 A 35 35 GLU N N 35 121.077 120.309 0.768 1
1 353 . 5 1 1 A 36 36 ARG H H 36 8.932 8.177 0.755 1
1 354 . 5 1 1 A 36 36 ARG HA H 36 3.928 3.762 0.166 1
1 362 . 5 1 1 A 36 36 ARG C C 36 178.464 178.979 -0.515 1
1 363 . 5 1 1 A 36 36 ARG CA C 36 60.974 60.098 0.876 1
1 364 . 5 1 1 A 36 36 ARG CB C 36 31.171 29.872 1.299 1
1 367 . 5 1 1 A 36 36 ARG N N 36 119.441 120.162 -0.721 1
1 369 . 5 1 1 A 37 37 GLU H H 37 8.756 8.313 0.443 1
1 370 . 5 1 1 A 37 37 GLU HA H 37 3.948 4.096 -0.148 1
1 375 . 5 1 1 A 37 37 GLU C C 37 179.606 179.036 0.570 1
1 376 . 5 1 1 A 37 37 GLU CA C 37 60.094 58.890 1.204 1
1 377 . 5 1 1 A 37 37 GLU CB C 37 29.110 29.278 -0.168 1
1 379 . 5 1 1 A 37 37 GLU N N 37 119.017 119.935 -0.918 1
1 380 . 5 1 1 A 38 38 ALA H H 38 7.733 8.004 -0.271 1
1 381 . 5 1 1 A 38 38 ALA HA H 38 4.325 4.126 0.199 1
1 385 . 5 1 1 A 38 38 ALA C C 38 180.820 178.416 2.404 1
1 386 . 5 1 1 A 38 38 ALA CA C 38 55.194 54.405 0.789 1
1 387 . 5 1 1 A 38 38 ALA CB C 38 17.654 18.546 -0.892 1
1 388 . 5 1 1 A 38 38 ALA N N 38 122.889 121.857 1.032 1
1 389 . 5 1 1 A 39 39 LEU H H 39 7.740 7.723 0.017 1
1 390 . 5 1 1 A 39 39 LEU HA H 39 4.176 4.297 -0.121 1
1 400 . 5 1 1 A 39 39 LEU C C 39 179.266 178.721 0.545 1
1 401 . 5 1 1 A 39 39 LEU CA C 39 57.944 56.075 1.869 1
1 402 . 5 1 1 A 39 39 LEU CB C 39 42.105 42.301 -0.196 1
1 406 . 5 1 1 A 39 39 LEU N N 39 119.783 116.567 3.216 1
1 407 . 5 1 1 A 40 40 VAL H H 40 8.451 8.230 0.221 1
1 408 . 5 1 1 A 40 40 VAL HA H 40 3.259 3.606 -0.347 1
1 416 . 5 1 1 A 40 40 VAL C C 40 177.153 177.799 -0.646 1
1 417 . 5 1 1 A 40 40 VAL CA C 40 67.254 66.882 0.372 1
1 418 . 5 1 1 A 40 40 VAL CB C 40 31.747 31.504 0.243 1
1 421 . 5 1 1 A 40 40 VAL N N 40 121.481 119.978 1.503 1
1 422 . 5 1 1 A 41 41 GLU H H 41 7.254 8.097 -0.843 1
1 423 . 5 1 1 A 41 41 GLU HA H 41 4.159 4.101 0.058 1
1 428 . 5 1 1 A 41 41 GLU C C 41 179.483 178.915 0.568 1
1 429 . 5 1 1 A 41 41 GLU CA C 41 59.248 59.511 -0.263 1
1 430 . 5 1 1 A 41 41 GLU CB C 41 29.358 29.248 0.110 1
1 432 . 5 1 1 A 41 41 GLU N N 41 116.549 119.798 -3.249 1
1 433 . 5 1 1 A 42 42 GLU H H 42 8.103 8.135 -0.032 1
1 434 . 5 1 1 A 42 42 GLU HA H 42 4.020 4.053 -0.033 1
1 439 . 5 1 1 A 42 42 GLU C C 42 180.115 178.800 1.315 1
1 440 . 5 1 1 A 42 42 GLU CA C 42 59.847 59.520 0.327 1
1 441 . 5 1 1 A 42 42 GLU CB C 42 30.218 29.384 0.834 1
1 443 . 5 1 1 A 42 42 GLU N N 42 119.578 119.234 0.344 1
1 444 . 5 1 1 A 43 43 CYS H H 43 8.955 8.107 0.848 1
1 445 . 5 1 1 A 43 43 CYS HA H 43 4.153 4.238 -0.085 1
1 448 . 5 1 1 A 43 43 CYS C C 43 176.498 177.637 -1.139 1
1 449 . 5 1 1 A 43 43 CYS CA C 43 64.856 62.471 2.385 1
1 450 . 5 1 1 A 43 43 CYS CB C 43 27.390 27.755 -0.365 1
1 451 . 5 1 1 A 43 43 CYS N N 43 118.199 118.925 -0.726 1
1 452 . 5 1 1 A 44 44 ASN H H 44 8.543 7.959 0.584 1
1 453 . 5 1 1 A 44 44 ASN HA H 44 4.635 4.444 0.191 1
1 458 . 5 1 1 A 44 44 ASN C C 44 178.633 177.585 1.048 1
1 459 . 5 1 1 A 44 44 ASN CA C 44 56.603 56.308 0.295 1
1 460 . 5 1 1 A 44 44 ASN CB C 44 37.187 38.241 -1.054 1
1 461 . 5 1 1 A 44 44 ASN N N 44 117.002 119.579 -2.577 1
1 463 . 5 1 1 A 45 45 ARG H H 45 8.296 8.134 0.162 1
1 464 . 5 1 1 A 45 45 ARG HA H 45 3.977 4.063 -0.086 1
1 471 . 5 1 1 A 45 45 ARG C C 45 178.149 178.181 -0.032 1
1 472 . 5 1 1 A 45 45 ARG CA C 45 60.589 59.163 1.426 1
1 473 . 5 1 1 A 45 45 ARG CB C 45 30.099 30.261 -0.162 1
1 476 . 5 1 1 A 45 45 ARG N N 45 121.021 120.837 0.184 1
1 477 . 5 1 1 A 46 46 ALA H H 46 7.914 8.543 -0.629 1
1 478 . 5 1 1 A 46 46 ALA HA H 46 4.128 4.119 0.009 1
1 482 . 5 1 1 A 46 46 ALA C C 46 181.208 180.251 0.957 1
1 483 . 5 1 1 A 46 46 ALA CA C 46 55.264 54.892 0.372 1
1 484 . 5 1 1 A 46 46 ALA CB C 46 18.759 18.592 0.167 1
1 485 . 5 1 1 A 46 46 ALA N N 46 121.570 120.796 0.774 1
1 486 . 5 1 1 A 47 47 GLU H H 47 8.730 8.670 0.060 1
1 487 . 5 1 1 A 47 47 GLU HA H 47 4.194 4.038 0.156 1
1 492 . 5 1 1 A 47 47 GLU C C 47 180.115 179.166 0.949 1
1 493 . 5 1 1 A 47 47 GLU CA C 47 58.401 59.170 -0.769 1
1 494 . 5 1 1 A 47 47 GLU CB C 47 29.523 29.273 0.250 1
1 496 . 5 1 1 A 47 47 GLU N N 47 117.532 118.091 -0.559 1
1 497 . 5 1 1 A 48 48 CYS H H 48 8.283 7.776 0.507 1
1 498 . 5 1 1 A 48 48 CYS HA H 48 4.002 4.124 -0.122 1
1 501 . 5 1 1 A 48 48 CYS C C 48 177.031 177.366 -0.335 1
1 502 . 5 1 1 A 48 48 CYS CA C 48 64.749 63.840 0.909 1
1 503 . 5 1 1 A 48 48 CYS CB C 48 25.907 27.278 -1.371 1
1 504 . 5 1 1 A 48 48 CYS N N 48 118.282 119.110 -0.828 1
1 505 . 5 1 1 A 49 49 LEU H H 49 8.181 8.101 0.080 1
1 506 . 5 1 1 A 49 49 LEU HA H 49 4.175 3.910 0.265 1
1 516 . 5 1 1 A 49 49 LEU C C 49 180.430 178.767 1.663 1
1 517 . 5 1 1 A 49 49 LEU CA C 49 57.873 58.179 -0.306 1
1 518 . 5 1 1 A 49 49 LEU CB C 49 41.539 41.777 -0.238 1
1 522 . 5 1 1 A 49 49 LEU N N 49 120.371 120.600 -0.229 1
1 523 . 5 1 1 A 50 50 GLN H H 50 7.934 8.547 -0.613 1
1 524 . 5 1 1 A 50 50 GLN HA H 50 4.102 4.079 0.023 1
1 531 . 5 1 1 A 50 50 GLN C C 50 177.322 177.339 -0.017 1
1 532 . 5 1 1 A 50 50 GLN CA C 50 58.156 58.654 -0.498 1
1 533 . 5 1 1 A 50 50 GLN CB C 50 28.616 28.488 0.128 1
1 535 . 5 1 1 A 50 50 GLN N N 50 118.175 117.372 0.803 1
1 537 . 5 1 1 A 51 51 ARG H H 51 7.632 7.722 -0.090 1
1 538 . 5 1 1 A 51 51 ARG HA H 51 4.347 4.353 -0.006 1
1 545 . 5 1 1 A 51 51 ARG C C 51 176.546 176.418 0.128 1
1 546 . 5 1 1 A 51 51 ARG CA C 51 56.286 56.004 0.282 1
1 547 . 5 1 1 A 51 51 ARG CB C 51 31.314 30.277 1.037 1
1 550 . 5 1 1 A 51 51 ARG N N 51 116.454 118.002 -1.548 1
1 551 . 5 1 1 A 52 52 GLY H H 52 7.949 8.366 -0.417 1
1 552 . 5 1 1 A 52 52 GLY HA2 H 52 4.033 3.967 0.066 1
1 553 . 5 1 1 A 52 52 GLY HA3 H 52 3.903 3.968 -0.065 1
1 554 . 5 1 1 A 52 52 GLY C C 52 174.385 174.296 0.089 1
1 555 . 5 1 1 A 52 52 GLY CA C 52 46.231 45.271 0.960 1
1 556 . 5 1 1 A 52 52 GLY N N 52 108.854 107.601 1.253 1
1 557 . 5 1 1 A 53 53 VAL H H 53 7.944 7.507 0.437 1
1 558 . 5 1 1 A 53 53 VAL HA H 53 4.250 4.038 0.212 1
1 566 . 5 1 1 A 53 53 VAL C C 53 175.525 175.080 0.445 1
1 567 . 5 1 1 A 53 53 VAL CA C 53 60.377 62.520 -2.143 1
1 568 . 5 1 1 A 53 53 VAL CB C 53 34.283 32.877 1.406 1
1 571 . 5 1 1 A 53 53 VAL N N 53 118.316 120.680 -2.364 1
1 572 . 5 1 1 A 54 54 SER H H 54 8.502 8.497 0.005 1
1 573 . 5 1 1 A 54 54 SER HA H 54 4.625 4.888 -0.263 1
1 576 . 5 1 1 A 54 54 SER C C 54 174.603 174.083 0.520 1
1 577 . 5 1 1 A 54 54 SER CA C 54 56.092 54.212 1.880 1
1 578 . 5 1 1 A 54 54 SER CB C 54 63.697 63.791 -0.094 1
1 579 . 5 1 1 A 54 54 SER N N 54 120.337 118.357 1.980 1
1 580 . 5 1 1 A 55 55 PRO HA H 55 4.624 4.524 0.100 1
1 587 . 5 1 1 A 55 55 PRO C C 55 177.322 177.712 -0.390 1
1 588 . 5 1 1 A 55 55 PRO CA C 55 64.431 64.225 0.206 1
1 589 . 5 1 1 A 55 55 PRO CB C 55 31.913 31.708 0.205 1
1 592 . 5 1 1 A 56 56 SER H H 56 7.931 8.254 -0.323 1
1 593 . 5 1 1 A 56 56 SER HA H 56 4.428 4.507 -0.079 1
1 596 . 5 1 1 A 56 56 SER C C 56 174.749 175.288 -0.539 1
1 597 . 5 1 1 A 56 56 SER CA C 56 59.130 59.559 -0.429 1
1 598 . 5 1 1 A 56 56 SER CB C 56 63.056 64.054 -0.998 1
1 599 . 5 1 1 A 56 56 SER N N 56 112.637 112.413 0.224 1
1 600 . 5 1 1 A 57 57 LYS H H 57 8.121 7.497 0.624 1
1 601 . 5 1 1 A 57 57 LYS HA H 57 4.467 4.549 -0.082 1
1 609 . 5 1 1 A 57 57 LYS C C 57 176.570 176.027 0.543 1
1 610 . 5 1 1 A 57 57 LYS CA C 57 55.264 54.927 0.337 1
1 611 . 5 1 1 A 57 57 LYS CB C 57 32.160 32.348 -0.188 1
1 615 . 5 1 1 A 57 57 LYS N N 57 123.185 118.108 5.077 1
1 616 . 5 1 1 A 58 58 ALA H H 58 7.886 7.879 0.007 1
1 617 . 5 1 1 A 58 58 ALA HA H 58 3.923 3.896 0.027 1
1 621 . 5 1 1 A 58 58 ALA C C 58 177.469 179.914 -2.445 1
1 622 . 5 1 1 A 58 58 ALA CA C 58 54.276 54.851 -0.575 1
1 623 . 5 1 1 A 58 58 ALA CB C 58 18.271 18.488 -0.217 1
1 624 . 5 1 1 A 58 58 ALA N N 58 123.941 122.621 1.320 1
1 625 . 5 1 1 A 59 59 HIS H H 59 8.077 7.860 0.217 1
1 626 . 5 1 1 A 59 59 HIS HA H 59 4.420 4.403 0.017 1
1 631 . 5 1 1 A 59 59 HIS C C 59 177.542 177.147 0.395 1
1 632 . 5 1 1 A 59 59 HIS CA C 59 57.767 58.463 -0.696 1
1 633 . 5 1 1 A 59 59 HIS CB C 59 29.852 28.704 1.148 1
1 636 . 5 1 1 A 59 59 HIS N N 59 115.566 115.619 -0.053 1
1 637 . 5 1 1 A 60 60 GLY H H 60 8.110 7.841 0.269 1
1 638 . 5 1 1 A 60 60 GLY HA2 H 60 3.873 3.561 0.312 1
1 639 . 5 1 1 A 60 60 GLY HA3 H 60 4.025 3.655 0.370 1
1 640 . 5 1 1 A 60 60 GLY C C 60 174.918 175.789 -0.871 1
1 641 . 5 1 1 A 60 60 GLY CA C 60 45.559 47.070 -1.511 1
1 642 . 5 1 1 A 60 60 GLY N N 60 109.216 109.785 -0.569 1
1 643 . 5 1 1 A 61 61 LEU H H 61 8.280 8.322 -0.042 1
1 644 . 5 1 1 A 61 61 LEU HA H 61 4.198 3.939 0.259 1
1 654 . 5 1 1 A 61 61 LEU C C 61 178.900 177.461 1.439 1
1 655 . 5 1 1 A 61 61 LEU CA C 61 55.758 57.926 -2.168 1
1 656 . 5 1 1 A 61 61 LEU CB C 61 42.544 41.729 0.815 1
1 660 . 5 1 1 A 61 61 LEU N N 61 120.521 123.239 -2.718 1
1 661 . 5 1 1 A 62 62 GLY H H 62 8.184 8.069 0.115 1
1 662 . 5 1 1 A 62 62 GLY HA2 H 62 3.978 3.845 0.133 1
1 663 . 5 1 1 A 62 62 GLY HA3 H 62 3.817 3.848 -0.031 1
1 664 . 5 1 1 A 62 62 GLY C C 62 176.012 175.223 0.789 1
1 665 . 5 1 1 A 62 62 GLY CA C 62 46.767 47.378 -0.611 1
1 666 . 5 1 1 A 62 62 GLY N N 62 108.987 108.251 0.736 1
1 667 . 5 1 1 A 63 63 SER HA H 63 4.322 4.288 0.034 1
1 670 . 5 1 1 A 63 63 SER C C 63 174.167 175.694 -1.527 1
1 671 . 5 1 1 A 63 63 SER CA C 63 59.919 60.729 -0.810 1
1 672 . 5 1 1 A 63 63 SER CB C 63 63.312 63.077 0.235 1
1 673 . 5 1 1 A 64 64 ASN H H 64 8.087 8.031 0.056 1
1 674 . 5 1 1 A 64 64 ASN HA H 64 4.850 4.749 0.101 1
1 679 . 5 1 1 A 64 64 ASN C C 64 173.899 174.992 -1.093 1
1 680 . 5 1 1 A 64 64 ASN CA C 64 53.218 53.156 0.062 1
1 681 . 5 1 1 A 64 64 ASN CB C 64 39.164 38.687 0.477 1
1 682 . 5 1 1 A 64 64 ASN N N 64 118.041 117.326 0.715 1
1 684 . 5 1 1 A 65 65 LEU H H 65 7.293 7.322 -0.029 1
1 685 . 5 1 1 A 65 65 LEU HA H 65 3.995 4.907 -0.912 1
1 695 . 5 1 1 A 65 65 LEU C C 65 175.696 174.871 0.825 1
1 696 . 5 1 1 A 65 65 LEU CA C 65 56.005 54.497 1.508 1
1 697 . 5 1 1 A 65 65 LEU CB C 65 43.120 44.162 -1.042 1
1 701 . 5 1 1 A 65 65 LEU N N 65 120.953 122.965 -2.012 1
1 702 . 5 1 1 A 66 66 VAL H H 66 9.517 9.039 0.478 1
1 703 . 5 1 1 A 66 66 VAL HA H 66 3.481 4.174 -0.693 1
1 711 . 5 1 1 A 66 66 VAL C C 66 175.429 174.984 0.445 1
1 712 . 5 1 1 A 66 66 VAL CA C 66 65.243 61.068 4.175 1
1 713 . 5 1 1 A 66 66 VAL CB C 66 31.335 33.381 -2.046 1
1 716 . 5 1 1 A 66 66 VAL N N 66 127.924 125.895 2.029 1
1 717 . 5 1 1 A 67 67 THR H H 67 6.253 8.198 -1.945 1
1 718 . 5 1 1 A 67 67 THR HA H 67 4.779 4.827 -0.048 1
1 723 . 5 1 1 A 67 67 THR C C 67 174.894 175.032 -0.138 1
1 724 . 5 1 1 A 67 67 THR CA C 67 58.719 59.379 -0.660 1
1 725 . 5 1 1 A 67 67 THR CB C 67 72.153 72.236 -0.083 1
1 727 . 5 1 1 A 67 67 THR N N 67 113.376 115.686 -2.310 1
1 728 . 5 1 1 A 68 68 GLU H H 68 9.348 8.865 0.483 1
1 729 . 5 1 1 A 68 68 GLU HA H 68 3.634 3.994 -0.360 1
1 734 . 5 1 1 A 68 68 GLU C C 68 177.809 178.291 -0.482 1
1 735 . 5 1 1 A 68 68 GLU CA C 68 61.505 59.984 1.521 1
1 736 . 5 1 1 A 68 68 GLU CB C 68 28.285 29.599 -1.314 1
1 738 . 5 1 1 A 68 68 GLU N N 68 124.534 122.269 2.265 1
1 739 . 5 1 1 A 69 69 VAL H H 69 8.126 7.863 0.263 1
1 740 . 5 1 1 A 69 69 VAL HA H 69 3.862 3.524 0.338 1
1 748 . 5 1 1 A 69 69 VAL C C 69 177.712 178.025 -0.313 1
1 749 . 5 1 1 A 69 69 VAL CA C 69 65.701 66.791 -1.090 1
1 750 . 5 1 1 A 69 69 VAL CB C 69 31.829 31.597 0.232 1
1 753 . 5 1 1 A 69 69 VAL N N 69 119.139 119.982 -0.843 1
1 754 . 5 1 1 A 70 70 ARG H H 70 7.235 8.149 -0.914 1
1 755 . 5 1 1 A 70 70 ARG HA H 70 4.265 3.941 0.324 1
1 762 . 5 1 1 A 70 70 ARG C C 70 180.430 179.333 1.097 1
1 763 . 5 1 1 A 70 70 ARG CA C 70 59.742 60.123 -0.381 1
1 764 . 5 1 1 A 70 70 ARG CB C 70 29.439 29.833 -0.394 1
1 767 . 5 1 1 A 70 70 ARG N N 70 119.541 119.323 0.218 1
1 768 . 5 1 1 A 71 71 VAL H H 71 8.144 7.973 0.171 1
1 769 . 5 1 1 A 71 71 VAL HA H 71 4.018 3.978 0.040 1
1 777 . 5 1 1 A 71 71 VAL C C 71 177.493 177.914 -0.421 1
1 778 . 5 1 1 A 71 71 VAL CA C 71 67.924 66.369 1.555 1
1 779 . 5 1 1 A 71 71 VAL CB C 71 32.289 31.590 0.699 1
1 782 . 5 1 1 A 71 71 VAL N N 71 120.755 119.930 0.825 1
1 783 . 5 1 1 A 72 72 TYR H H 72 9.411 8.442 0.969 1
1 784 . 5 1 1 A 72 72 TYR HA H 72 3.908 4.165 -0.257 1
1 791 . 5 1 1 A 72 72 TYR C C 72 178.464 177.997 0.467 1
1 792 . 5 1 1 A 72 72 TYR CA C 72 63.444 61.611 1.833 1
1 793 . 5 1 1 A 72 72 TYR CB C 72 38.211 38.543 -0.332 1
1 798 . 5 1 1 A 72 72 TYR N N 72 121.175 121.409 -0.234 1
1 799 . 5 1 1 A 73 73 ASN H H 73 8.816 8.655 0.161 1
1 800 . 5 1 1 A 73 73 ASN HA H 73 4.538 4.690 -0.152 1
1 805 . 5 1 1 A 73 73 ASN C C 73 176.958 178.026 -1.068 1
1 806 . 5 1 1 A 73 73 ASN CA C 73 56.109 56.539 -0.430 1
1 807 . 5 1 1 A 73 73 ASN CB C 73 38.422 38.968 -0.546 1
1 808 . 5 1 1 A 73 73 ASN N N 73 118.122 117.965 0.157 1
1 810 . 5 1 1 A 74 74 TRP H H 74 8.657 8.383 0.274 1
1 811 . 5 1 1 A 74 74 TRP HA H 74 4.111 4.418 -0.307 1
1 820 . 5 1 1 A 74 74 TRP C C 74 179.654 178.438 1.216 1
1 821 . 5 1 1 A 74 74 TRP CA C 74 62.950 61.309 1.641 1
1 822 . 5 1 1 A 74 74 TRP CB C 74 29.555 29.470 0.085 1
1 828 . 5 1 1 A 74 74 TRP N N 74 123.988 123.071 0.917 1
1 830 . 5 1 1 A 75 75 PHE H H 75 8.562 8.203 0.359 1
1 831 . 5 1 1 A 75 75 PHE HA H 75 3.821 4.448 -0.627 1
1 839 . 5 1 1 A 75 75 PHE C C 75 177.614 178.152 -0.538 1
1 840 . 5 1 1 A 75 75 PHE CA C 75 63.374 61.801 1.573 1
1 841 . 5 1 1 A 75 75 PHE CB C 75 39.648 38.224 1.424 1
1 847 . 5 1 1 A 75 75 PHE N N 75 118.325 117.498 0.827 1
1 848 . 5 1 1 A 76 76 ALA H H 76 8.305 8.055 0.250 1
1 849 . 5 1 1 A 76 76 ALA HA H 76 3.909 3.933 -0.024 1
1 853 . 5 1 1 A 76 76 ALA C C 76 180.868 179.590 1.278 1
1 854 . 5 1 1 A 76 76 ALA CA C 76 55.566 55.248 0.318 1
1 855 . 5 1 1 A 76 76 ALA CB C 76 17.820 18.148 -0.328 1
1 856 . 5 1 1 A 76 76 ALA N N 76 121.119 122.405 -1.286 1
1 857 . 5 1 1 A 77 77 ASN H H 77 8.335 8.182 0.153 1
1 858 . 5 1 1 A 77 77 ASN HA H 77 4.355 4.416 -0.061 1
1 863 . 5 1 1 A 77 77 ASN C C 77 177.105 177.607 -0.502 1
1 864 . 5 1 1 A 77 77 ASN CA C 77 56.145 55.892 0.253 1
1 865 . 5 1 1 A 77 77 ASN CB C 77 38.063 38.713 -0.650 1
1 866 . 5 1 1 A 77 77 ASN N N 77 117.433 116.147 1.286 1
1 868 . 5 1 1 A 78 78 ARG H H 78 7.664 7.289 0.375 1
1 869 . 5 1 1 A 78 78 ARG HA H 78 3.629 4.004 -0.375 1
1 876 . 5 1 1 A 78 78 ARG C C 78 179.216 178.272 0.944 1
1 877 . 5 1 1 A 78 78 ARG CA C 78 58.773 58.865 -0.092 1
1 878 . 5 1 1 A 78 78 ARG CB C 78 29.605 29.072 0.533 1
1 881 . 5 1 1 A 78 78 ARG N N 78 121.999 118.327 3.672 1
1 882 . 5 1 1 A 79 79 ARG H H 79 8.320 7.550 0.770 1
1 883 . 5 1 1 A 79 79 ARG HA H 79 4.307 4.251 0.056 1
1 890 . 5 1 1 A 79 79 ARG C C 79 180.406 178.600 1.806 1
1 891 . 5 1 1 A 79 79 ARG CA C 79 60.270 58.318 1.952 1
1 892 . 5 1 1 A 79 79 ARG CB C 79 31.335 30.480 0.855 1
1 895 . 5 1 1 A 79 79 ARG N N 79 118.139 118.026 0.113 1
1 896 . 5 1 1 A 80 80 LYS H H 80 7.759 7.836 -0.077 1
1 897 . 5 1 1 A 80 80 LYS HA H 80 4.052 4.207 -0.155 1
1 905 . 5 1 1 A 80 80 LYS C C 80 178.999 179.097 -0.098 1
1 906 . 5 1 1 A 80 80 LYS CA C 80 59.531 59.348 0.183 1
1 907 . 5 1 1 A 80 80 LYS CB C 80 32.374 32.250 0.124 1
1 911 . 5 1 1 A 80 80 LYS N N 80 120.899 119.047 1.852 1
1 912 . 5 1 1 A 81 81 GLU H H 81 8.041 8.179 -0.138 1
1 913 . 5 1 1 A 81 81 GLU HA H 81 4.044 4.186 -0.142 1
1 918 . 5 1 1 A 81 81 GLU C C 81 179.168 178.568 0.600 1
1 919 . 5 1 1 A 81 81 GLU CA C 81 59.036 59.496 -0.460 1
1 920 . 5 1 1 A 81 81 GLU CB C 81 29.561 29.166 0.395 1
1 922 . 5 1 1 A 81 81 GLU N N 81 120.193 118.340 1.853 1
1 923 . 5 1 1 A 82 82 GLU H H 82 8.131 8.007 0.124 1
1 924 . 5 1 1 A 82 82 GLU HA H 82 4.017 4.111 -0.094 1
1 929 . 5 1 1 A 82 82 GLU C C 82 178.343 177.778 0.565 1
1 930 . 5 1 1 A 82 82 GLU CA C 82 59.319 59.019 0.300 1
1 931 . 5 1 1 A 82 82 GLU CB C 82 29.770 28.804 0.966 1
1 933 . 5 1 1 A 82 82 GLU N N 82 119.626 118.154 1.472 1
1 934 . 5 1 1 A 83 83 ALA H H 83 7.935 7.681 0.254 1
1 935 . 5 1 1 A 83 83 ALA HA H 83 4.180 4.245 -0.065 1
1 939 . 5 1 1 A 83 83 ALA C C 83 179.994 179.396 0.598 1
1 940 . 5 1 1 A 83 83 ALA CA C 83 54.629 53.526 1.103 1
1 941 . 5 1 1 A 83 83 ALA CB C 83 18.090 19.011 -0.921 1
1 942 . 5 1 1 A 83 83 ALA N N 83 121.476 121.833 -0.357 1
1 943 . 5 1 1 A 84 84 PHE H H 84 8.043 8.238 -0.195 1
1 944 . 5 1 1 A 84 84 PHE HA H 84 4.420 4.022 0.398 1
1 952 . 5 1 1 A 84 84 PHE C C 84 177.250 177.121 0.129 1
1 953 . 5 1 1 A 84 84 PHE CA C 84 60.059 61.453 -1.394 1
1 954 . 5 1 1 A 84 84 PHE CB C 84 38.952 39.427 -0.475 1
1 960 . 5 1 1 A 84 84 PHE N N 84 119.074 120.336 -1.262 1
1 961 . 5 1 1 A 85 85 ARG H H 85 8.031 8.377 -0.346 1
1 962 . 5 1 1 A 85 85 ARG HA H 85 3.992 4.121 -0.129 1
1 968 . 5 1 1 A 85 85 ARG C C 85 178.319 178.129 0.190 1
1 969 . 5 1 1 A 85 85 ARG CA C 85 58.523 59.626 -1.103 1
1 970 . 5 1 1 A 85 85 ARG CB C 85 30.346 29.869 0.477 1
1 973 . 5 1 1 A 85 85 ARG N N 85 119.291 117.643 1.648 1
1 974 . 5 1 1 A 86 86 GLN H H 86 8.091 7.946 0.145 1
1 975 . 5 1 1 A 86 86 GLN HA H 86 4.148 4.324 -0.176 1
1 982 . 5 1 1 A 86 86 GLN C C 86 177.105 178.233 -1.128 1
1 983 . 5 1 1 A 86 86 GLN CA C 86 57.556 57.306 0.250 1
1 984 . 5 1 1 A 86 86 GLN CB C 86 28.855 29.516 -0.661 1
1 986 . 5 1 1 A 86 86 GLN N N 86 119.097 117.651 1.446 1
1 988 . 5 1 1 A 87 87 LYS H H 87 7.898 8.314 -0.416 1
1 989 . 5 1 1 A 87 87 LYS HA H 87 4.116 4.109 0.007 1
1 997 . 5 1 1 A 87 87 LYS C C 87 177.542 179.344 -1.802 1
1 998 . 5 1 1 A 87 87 LYS CA C 87 57.944 59.057 -1.113 1
1 999 . 5 1 1 A 87 87 LYS CB C 87 32.242 32.247 -0.005 1
1 1003 . 5 1 1 A 87 87 LYS N N 87 120.968 122.262 -1.294 1
1 1004 . 5 1 1 A 88 88 LEU H H 88 7.903 8.192 -0.289 1
1 1005 . 5 1 1 A 88 88 LEU HA H 88 4.144 4.267 -0.123 1
1 1015 . 5 1 1 A 88 88 LEU C C 88 178.221 177.989 0.232 1
1 1016 . 5 1 1 A 88 88 LEU CA C 88 56.145 56.867 -0.722 1
1 1017 . 5 1 1 A 88 88 LEU CB C 88 42.215 41.419 0.796 1
1 1021 . 5 1 1 A 88 88 LEU N N 88 120.558 117.368 3.190 1
1 1022 . 5 1 1 A 89 89 ALA H H 89 7.894 7.447 0.447 1
1 1023 . 5 1 1 A 89 89 ALA HA H 89 4.224 4.391 -0.167 1
1 1027 . 5 1 1 A 89 89 ALA C C 89 178.609 179.428 -0.819 1
1 1028 . 5 1 1 A 89 89 ALA CA C 89 53.392 53.694 -0.302 1
1 1029 . 5 1 1 A 89 89 ALA CB C 89 18.695 19.305 -0.610 1
1 1030 . 5 1 1 A 89 89 ALA N N 89 122.387 122.120 0.267 1
1 1031 . 5 1 1 A 90 90 MET H H 90 8.084 7.904 0.180 1
1 1032 . 5 1 1 A 90 90 MET HA H 90 4.356 4.223 0.133 1
1 1040 . 5 1 1 A 90 90 MET C C 90 176.982 176.342 0.640 1
1 1041 . 5 1 1 A 90 90 MET CA C 90 56.551 58.322 -1.771 1
1 1042 . 5 1 1 A 90 90 MET CB C 90 32.719 32.418 0.301 1
1 1045 . 5 1 1 A 90 90 MET N N 90 118.509 116.249 2.260 1
1 1046 . 5 1 1 A 91 91 ASP H H 91 8.261 7.571 0.690 1
1 1047 . 5 1 1 A 91 91 ASP HA H 91 4.524 4.576 -0.052 1
1 1050 . 5 1 1 A 91 91 ASP C C 91 176.643 175.908 0.735 1
1 1051 . 5 1 1 A 91 91 ASP CA C 91 54.981 54.056 0.925 1
1 1052 . 5 1 1 A 91 91 ASP CB C 91 40.870 41.450 -0.580 1
1 1053 . 5 1 1 A 91 91 ASP N N 91 120.771 120.003 0.768 1
1 1054 . 5 1 1 A 92 92 ALA H H 92 7.971 8.529 -0.558 1
1 1055 . 5 1 1 A 92 92 ALA HA H 92 4.200 5.052 -0.852 1
1 1059 . 5 1 1 A 92 92 ALA C C 92 177.929 176.784 1.145 1
1 1060 . 5 1 1 A 92 92 ALA CA C 92 53.184 51.111 2.073 1
1 1061 . 5 1 1 A 92 92 ALA CB C 92 18.890 20.955 -2.065 1
1 1062 . 5 1 1 A 92 92 ALA N N 92 123.057 124.881 -1.824 1
1 1063 . 5 1 1 A 93 93 TYR H H 93 8.019 8.443 -0.424 1
1 1064 . 5 1 1 A 93 93 TYR HA H 93 4.523 5.521 -0.998 1
1 1071 . 5 1 1 A 93 93 TYR C C 93 176.279 173.029 3.250 1
1 1072 . 5 1 1 A 93 93 TYR CA C 93 58.401 55.364 3.037 1
1 1073 . 5 1 1 A 93 93 TYR CB C 93 38.669 41.329 -2.660 1
1 1078 . 5 1 1 A 93 93 TYR N N 93 118.337 118.094 0.243 1
1 1079 . 5 1 1 A 94 94 SER H H 94 8.037 8.696 -0.659 1
1 1080 . 5 1 1 A 94 94 SER HA H 94 4.484 5.055 -0.571 1
1 1082 . 5 1 1 A 94 94 SER C C 94 174.554 174.572 -0.018 1
1 1083 . 5 1 1 A 94 94 SER CA C 94 58.401 56.879 1.522 1
1 1084 . 5 1 1 A 94 94 SER CB C 94 63.806 64.335 -0.529 1
1 1085 . 5 1 1 A 94 94 SER N N 94 116.640 115.134 1.506 1
1 1086 . 5 1 1 A 96 96 ASN HA H 96 4.770 4.479 0.291 1
1 1091 . 5 1 1 A 96 96 ASN C C 96 175.161 175.973 -0.812 1
1 1092 . 5 1 1 A 96 96 ASN CA C 96 53.395 56.601 -3.206 1
1 1093 . 5 1 1 A 96 96 ASN CB C 96 38.999 38.240 0.759 1
1 1095 . 5 1 1 A 97 97 SER H H 97 8.230 7.526 0.704 1
1 1096 . 5 1 1 A 97 97 SER HA H 97 4.481 4.374 0.107 1
1 1099 . 5 1 1 A 97 97 SER C C 97 174.482 175.417 -0.935 1
1 1100 . 5 1 1 A 97 97 SER CA C 97 58.300 58.138 0.162 1
1 1101 . 5 1 1 A 97 97 SER CB C 97 63.697 64.375 -0.678 1
1 1102 . 5 1 1 A 97 97 SER N N 97 115.866 113.502 2.364 1
1 1103 . 5 1 1 A 98 98 GLY H H 98 8.228 8.648 -0.420 1
1 1104 . 5 1 1 A 98 98 GLY HA2 H 98 4.098 3.840 0.258 1
1 1105 . 5 1 1 A 98 98 GLY HA3 H 98 4.098 3.842 0.256 1
1 1106 . 5 1 1 A 98 98 GLY C C 98 171.788 174.835 -3.047 1
1 1107 . 5 1 1 A 98 98 GLY CA C 98 44.803 47.949 -3.146 1
1 1108 . 5 1 1 A 98 98 GLY N N 98 110.658 109.402 1.256 1
1 1109 . 5 1 1 A 99 99 PRO HA H 99 4.463 4.628 -0.165 1
1 1116 . 5 1 1 A 99 99 PRO CA C 99 63.230 62.865 0.365 1
1 1117 . 5 1 1 A 99 99 PRO CB C 99 32.044 31.734 0.310 1
1 1120 . 5 1 1 A 100 100 SER H H 100 8.514 8.942 -0.428 1
1 1121 . 5 1 1 A 100 100 SER CA C 100 58.450 56.899 1.551 1
1 1122 . 5 1 1 A 100 100 SER CB C 100 63.889 66.068 -2.179 1
1 1 . 6 1 1 A 9 9 ASN H H 9 8.856 8.620 0.236 1
1 2 . 6 1 1 A 9 9 ASN HA H 9 4.694 4.810 -0.116 1
1 7 . 6 1 1 A 9 9 ASN CA C 9 53.401 53.205 0.196 1
1 8 . 6 1 1 A 9 9 ASN CB C 9 38.757 39.582 -0.825 1
1 10 . 6 1 1 A 10 10 ARG HA H 10 4.346 4.763 -0.417 1
1 17 . 6 1 1 A 10 10 ARG C C 10 175.405 175.481 -0.076 1
1 18 . 6 1 1 A 10 10 ARG CA C 10 56.181 54.822 1.359 1
1 19 . 6 1 1 A 10 10 ARG CB C 10 31.171 32.487 -1.316 1
1 22 . 6 1 1 A 11 11 PHE H H 11 8.310 8.894 -0.584 1
1 23 . 6 1 1 A 11 11 PHE HA H 11 4.291 4.490 -0.199 1
1 31 . 6 1 1 A 11 11 PHE C C 11 174.458 174.477 -0.019 1
1 32 . 6 1 1 A 11 11 PHE CA C 11 58.967 58.399 0.568 1
1 33 . 6 1 1 A 11 11 PHE CB C 11 40.138 38.849 1.289 1
1 39 . 6 1 1 A 11 11 PHE N N 11 123.604 124.258 -0.654 1
1 40 . 6 1 1 A 12 12 LYS H H 12 7.307 8.302 -0.995 1
1 41 . 6 1 1 A 12 12 LYS HA H 12 4.165 4.337 -0.172 1
1 50 . 6 1 1 A 12 12 LYS C C 12 174.385 176.089 -1.704 1
1 51 . 6 1 1 A 12 12 LYS CA C 12 54.593 54.947 -0.354 1
1 52 . 6 1 1 A 12 12 LYS CB C 12 34.712 33.557 1.155 1
1 56 . 6 1 1 A 12 12 LYS N N 12 127.282 128.084 -0.802 1
1 57 . 6 1 1 A 13 13 TRP H H 13 8.039 8.337 -0.298 1
1 58 . 6 1 1 A 13 13 TRP HA H 13 4.370 4.447 -0.077 1
1 67 . 6 1 1 A 13 13 TRP C C 13 177.857 176.563 1.294 1
1 68 . 6 1 1 A 13 13 TRP CA C 13 56.675 56.920 -0.245 1
1 69 . 6 1 1 A 13 13 TRP CB C 13 30.317 30.277 0.040 1
1 75 . 6 1 1 A 13 13 TRP N N 13 124.264 127.239 -2.975 1
1 77 . 6 1 1 A 14 14 GLY H H 14 9.815 9.013 0.802 1
1 78 . 6 1 1 A 14 14 GLY HA2 H 14 4.370 4.182 0.188 1
1 79 . 6 1 1 A 14 14 GLY HA3 H 14 4.335 4.212 0.123 1
1 80 . 6 1 1 A 14 14 GLY C C 14 172.904 174.657 -1.753 1
1 81 . 6 1 1 A 14 14 GLY CA C 14 44.157 43.808 0.349 1
1 82 . 6 1 1 A 14 14 GLY N N 14 115.294 108.538 6.756 1
1 83 . 6 1 1 A 15 15 PRO HA H 15 4.327 4.398 -0.071 1
1 90 . 6 1 1 A 15 15 PRO C C 15 179.726 178.536 1.190 1
1 91 . 6 1 1 A 15 15 PRO CA C 15 65.171 65.081 0.090 1
1 92 . 6 1 1 A 15 15 PRO CB C 15 31.829 31.983 -0.154 1
1 95 . 6 1 1 A 16 16 ALA H H 16 9.214 8.142 1.072 1
1 96 . 6 1 1 A 16 16 ALA HA H 16 4.166 4.140 0.026 1
1 100 . 6 1 1 A 16 16 ALA C C 16 181.184 179.468 1.716 1
1 101 . 6 1 1 A 16 16 ALA CA C 16 55.370 55.152 0.218 1
1 102 . 6 1 1 A 16 16 ALA CB C 16 18.058 18.956 -0.898 1
1 103 . 6 1 1 A 16 16 ALA N N 16 122.414 119.947 2.467 1
1 104 . 6 1 1 A 17 17 SER H H 17 7.985 8.249 -0.264 1
1 105 . 6 1 1 A 17 17 SER HA H 17 4.317 4.164 0.153 1
1 107 . 6 1 1 A 17 17 SER C C 17 175.381 176.798 -1.417 1
1 108 . 6 1 1 A 17 17 SER CA C 17 63.163 61.822 1.341 1
1 109 . 6 1 1 A 17 17 SER CB C 17 64.055 62.699 1.356 1
1 110 . 6 1 1 A 17 17 SER N N 17 116.568 112.756 3.812 1
1 111 . 6 1 1 A 18 18 GLN H H 18 8.316 7.810 0.506 1
1 112 . 6 1 1 A 18 18 GLN HA H 18 3.323 3.489 -0.166 1
1 119 . 6 1 1 A 18 18 GLN C C 18 176.812 178.633 -1.821 1
1 120 . 6 1 1 A 18 18 GLN CA C 18 60.025 59.103 0.922 1
1 121 . 6 1 1 A 18 18 GLN CB C 18 28.686 28.509 0.177 1
1 123 . 6 1 1 A 18 18 GLN N N 18 119.002 120.498 -1.496 1
1 125 . 6 1 1 A 19 19 GLN H H 19 7.582 8.171 -0.589 1
1 126 . 6 1 1 A 19 19 GLN HA H 19 4.062 4.094 -0.032 1
1 133 . 6 1 1 A 19 19 GLN C C 19 178.488 178.576 -0.088 1
1 134 . 6 1 1 A 19 19 GLN CA C 19 59.248 59.176 0.072 1
1 135 . 6 1 1 A 19 19 GLN CB C 19 28.203 28.240 -0.037 1
1 137 . 6 1 1 A 19 19 GLN N N 19 116.221 118.836 -2.615 1
1 139 . 6 1 1 A 20 20 ILE H H 20 7.246 7.886 -0.640 1
1 140 . 6 1 1 A 20 20 ILE HA H 20 3.570 3.615 -0.045 1
1 150 . 6 1 1 A 20 20 ILE C C 20 178.999 178.577 0.422 1
1 151 . 6 1 1 A 20 20 ILE CA C 20 64.996 65.508 -0.512 1
1 152 . 6 1 1 A 20 20 ILE CB C 20 38.139 37.650 0.489 1
1 156 . 6 1 1 A 20 20 ILE N N 20 120.521 120.832 -0.311 1
1 157 . 6 1 1 A 21 21 LEU H H 21 8.034 7.928 0.106 1
1 158 . 6 1 1 A 21 21 LEU HA H 21 3.491 3.524 -0.033 1
1 168 . 6 1 1 A 21 21 LEU C C 21 178.196 178.362 -0.166 1
1 169 . 6 1 1 A 21 21 LEU CA C 21 57.944 57.450 0.494 1
1 170 . 6 1 1 A 21 21 LEU CB C 21 37.864 40.276 -2.412 1
1 174 . 6 1 1 A 21 21 LEU N N 21 121.259 119.061 2.198 1
1 175 . 6 1 1 A 22 22 TYR H H 22 8.479 7.525 0.954 1
1 176 . 6 1 1 A 22 22 TYR HA H 22 4.224 4.292 -0.068 1
1 183 . 6 1 1 A 22 22 TYR C C 22 179.630 178.627 1.003 1
1 184 . 6 1 1 A 22 22 TYR CA C 22 62.422 60.687 1.735 1
1 185 . 6 1 1 A 22 22 TYR CB C 22 37.434 37.648 -0.214 1
1 190 . 6 1 1 A 22 22 TYR N N 22 117.805 119.009 -1.204 1
1 191 . 6 1 1 A 23 23 GLN H H 23 7.707 8.339 -0.632 1
1 192 . 6 1 1 A 23 23 GLN HA H 23 4.166 3.974 0.192 1
1 199 . 6 1 1 A 23 23 GLN C C 23 178.633 178.738 -0.105 1
1 200 . 6 1 1 A 23 23 GLN CA C 23 58.789 58.996 -0.207 1
1 201 . 6 1 1 A 23 23 GLN CB C 23 28.534 28.478 0.056 1
1 203 . 6 1 1 A 23 23 GLN N N 23 117.580 118.487 -0.907 1
1 205 . 6 1 1 A 24 24 ALA H H 24 8.155 7.729 0.426 1
1 206 . 6 1 1 A 24 24 ALA HA H 24 4.187 4.177 0.010 1
1 210 . 6 1 1 A 24 24 ALA C C 24 180.018 179.389 0.629 1
1 211 . 6 1 1 A 24 24 ALA CA C 24 55.228 55.161 0.067 1
1 212 . 6 1 1 A 24 24 ALA CB C 24 19.468 18.524 0.944 1
1 213 . 6 1 1 A 24 24 ALA N N 24 122.813 121.817 0.996 1
1 214 . 6 1 1 A 25 25 TYR H H 25 8.995 8.377 0.618 1
1 215 . 6 1 1 A 25 25 TYR HA H 25 4.348 4.786 -0.438 1
1 222 . 6 1 1 A 25 25 TYR C C 25 175.792 177.479 -1.687 1
1 223 . 6 1 1 A 25 25 TYR CA C 25 61.681 61.865 -0.184 1
1 224 . 6 1 1 A 25 25 TYR CB C 25 38.175 38.483 -0.308 1
1 229 . 6 1 1 A 25 25 TYR N N 25 121.343 120.242 1.101 1
1 230 . 6 1 1 A 26 26 ASP H H 26 7.260 8.847 -1.587 1
1 231 . 6 1 1 A 26 26 ASP HA H 26 4.373 4.460 -0.087 1
1 234 . 6 1 1 A 26 26 ASP C C 26 177.322 178.441 -1.119 1
1 235 . 6 1 1 A 26 26 ASP CA C 26 56.603 57.591 -0.988 1
1 236 . 6 1 1 A 26 26 ASP CB C 26 41.060 41.545 -0.485 1
1 237 . 6 1 1 A 26 26 ASP N N 26 114.020 119.291 -5.271 1
1 238 . 6 1 1 A 27 27 ARG H H 27 7.343 7.954 -0.611 1
1 239 . 6 1 1 A 27 27 ARG HA H 27 4.302 4.373 -0.071 1
1 246 . 6 1 1 A 27 27 ARG C C 27 176.546 176.252 0.294 1
1 247 . 6 1 1 A 27 27 ARG CA C 27 57.563 57.880 -0.317 1
1 248 . 6 1 1 A 27 27 ARG CB C 27 31.500 31.297 0.203 1
1 251 . 6 1 1 A 27 27 ARG N N 27 116.729 117.179 -0.450 1
1 252 . 6 1 1 A 28 28 GLN H H 28 8.306 8.004 0.302 1
1 253 . 6 1 1 A 28 28 GLN HA H 28 4.396 4.703 -0.307 1
1 260 . 6 1 1 A 28 28 GLN C C 28 172.831 175.210 -2.379 1
1 261 . 6 1 1 A 28 28 GLN CA C 28 55.355 54.411 0.944 1
1 262 . 6 1 1 A 28 28 GLN CB C 28 31.062 31.718 -0.656 1
1 264 . 6 1 1 A 28 28 GLN N N 28 121.612 118.392 3.220 1
1 266 . 6 1 1 A 29 29 LYS H H 29 8.354 8.503 -0.149 1
1 267 . 6 1 1 A 29 29 LYS HA H 29 4.099 3.526 0.573 1
1 276 . 6 1 1 A 29 29 LYS C C 29 176.084 176.389 -0.305 1
1 277 . 6 1 1 A 29 29 LYS CA C 29 57.873 57.696 0.177 1
1 278 . 6 1 1 A 29 29 LYS CB C 29 33.313 32.731 0.582 1
1 282 . 6 1 1 A 29 29 LYS N N 29 125.038 124.098 0.940 1
1 283 . 6 1 1 A 30 30 ASN H H 30 8.856 7.932 0.924 1
1 284 . 6 1 1 A 30 30 ASN HA H 30 4.958 5.062 -0.104 1
1 289 . 6 1 1 A 30 30 ASN C C 30 171.179 172.436 -1.257 1
1 290 . 6 1 1 A 30 30 ASN CA C 30 50.891 50.351 0.540 1
1 291 . 6 1 1 A 30 30 ASN CB C 30 39.907 39.258 0.649 1
1 292 . 6 1 1 A 30 30 ASN N N 30 115.764 117.828 -2.064 1
1 294 . 6 1 1 A 31 31 PRO HA H 31 4.299 4.496 -0.197 1
1 301 . 6 1 1 A 31 31 PRO C C 31 177.493 176.617 0.876 1
1 302 . 6 1 1 A 31 31 PRO CA C 31 62.489 62.544 -0.055 1
1 303 . 6 1 1 A 31 31 PRO CB C 31 31.216 32.058 -0.842 1
1 306 . 6 1 1 A 32 32 SER H H 32 9.368 8.504 0.864 1
1 307 . 6 1 1 A 32 32 SER HA H 32 4.372 4.792 -0.420 1
1 310 . 6 1 1 A 32 32 SER C C 32 174.821 175.724 -0.903 1
1 311 . 6 1 1 A 32 32 SER CA C 32 57.203 57.434 -0.231 1
1 312 . 6 1 1 A 32 32 SER CB C 32 65.594 64.709 0.885 1
1 313 . 6 1 1 A 32 32 SER N N 32 120.847 117.429 3.418 1
1 314 . 6 1 1 A 33 33 LYS H H 33 9.152 9.013 0.139 1
1 315 . 6 1 1 A 33 33 LYS HA H 33 3.719 3.924 -0.205 1
1 324 . 6 1 1 A 33 33 LYS C C 33 177.833 178.228 -0.395 1
1 325 . 6 1 1 A 33 33 LYS CA C 33 61.188 60.311 0.877 1
1 326 . 6 1 1 A 33 33 LYS CB C 33 32.572 32.359 0.213 1
1 330 . 6 1 1 A 33 33 LYS N N 33 122.966 124.635 -1.669 1
1 331 . 6 1 1 A 34 34 GLU H H 34 8.902 8.348 0.554 1
1 332 . 6 1 1 A 34 34 GLU HA H 34 4.089 4.066 0.023 1
1 337 . 6 1 1 A 34 34 GLU C C 34 180.286 179.379 0.907 1
1 338 . 6 1 1 A 34 34 GLU CA C 34 60.483 59.388 1.095 1
1 339 . 6 1 1 A 34 34 GLU CB C 34 28.835 29.306 -0.471 1
1 341 . 6 1 1 A 34 34 GLU N N 34 117.645 118.360 -0.715 1
1 342 . 6 1 1 A 35 35 GLU H H 35 7.673 8.190 -0.517 1
1 343 . 6 1 1 A 35 35 GLU HA H 35 4.023 3.959 0.064 1
1 348 . 6 1 1 A 35 35 GLU C C 35 180.237 179.170 1.067 1
1 349 . 6 1 1 A 35 35 GLU CA C 35 59.214 59.415 -0.201 1
1 350 . 6 1 1 A 35 35 GLU CB C 35 30.099 29.223 0.876 1
1 352 . 6 1 1 A 35 35 GLU N N 35 121.077 120.083 0.994 1
1 353 . 6 1 1 A 36 36 ARG H H 36 8.932 8.372 0.560 1
1 354 . 6 1 1 A 36 36 ARG HA H 36 3.928 3.797 0.131 1
1 362 . 6 1 1 A 36 36 ARG C C 36 178.464 179.189 -0.725 1
1 363 . 6 1 1 A 36 36 ARG CA C 36 60.974 60.180 0.794 1
1 364 . 6 1 1 A 36 36 ARG CB C 36 31.171 30.004 1.167 1
1 367 . 6 1 1 A 36 36 ARG N N 36 119.441 120.159 -0.718 1
1 369 . 6 1 1 A 37 37 GLU H H 37 8.756 8.398 0.358 1
1 370 . 6 1 1 A 37 37 GLU HA H 37 3.948 4.099 -0.151 1
1 375 . 6 1 1 A 37 37 GLU C C 37 179.606 179.083 0.523 1
1 376 . 6 1 1 A 37 37 GLU CA C 37 60.094 59.031 1.063 1
1 377 . 6 1 1 A 37 37 GLU CB C 37 29.110 29.284 -0.174 1
1 379 . 6 1 1 A 37 37 GLU N N 37 119.017 119.907 -0.890 1
1 380 . 6 1 1 A 38 38 ALA H H 38 7.733 8.093 -0.360 1
1 381 . 6 1 1 A 38 38 ALA HA H 38 4.325 4.127 0.198 1
1 385 . 6 1 1 A 38 38 ALA C C 38 180.820 178.526 2.294 1
1 386 . 6 1 1 A 38 38 ALA CA C 38 55.194 54.493 0.701 1
1 387 . 6 1 1 A 38 38 ALA CB C 38 17.654 18.586 -0.932 1
1 388 . 6 1 1 A 38 38 ALA N N 38 122.889 122.085 0.804 1
1 389 . 6 1 1 A 39 39 LEU H H 39 7.740 7.856 -0.116 1
1 390 . 6 1 1 A 39 39 LEU HA H 39 4.176 4.302 -0.126 1
1 400 . 6 1 1 A 39 39 LEU C C 39 179.266 178.723 0.543 1
1 401 . 6 1 1 A 39 39 LEU CA C 39 57.944 55.876 2.068 1
1 402 . 6 1 1 A 39 39 LEU CB C 39 42.105 42.596 -0.491 1
1 406 . 6 1 1 A 39 39 LEU N N 39 119.783 116.918 2.865 1
1 407 . 6 1 1 A 40 40 VAL H H 40 8.451 8.364 0.087 1
1 408 . 6 1 1 A 40 40 VAL HA H 40 3.259 3.731 -0.472 1
1 416 . 6 1 1 A 40 40 VAL C C 40 177.153 177.827 -0.674 1
1 417 . 6 1 1 A 40 40 VAL CA C 40 67.254 66.832 0.422 1
1 418 . 6 1 1 A 40 40 VAL CB C 40 31.747 31.616 0.131 1
1 421 . 6 1 1 A 40 40 VAL N N 40 121.481 119.864 1.617 1
1 422 . 6 1 1 A 41 41 GLU H H 41 7.254 8.027 -0.773 1
1 423 . 6 1 1 A 41 41 GLU HA H 41 4.159 4.135 0.024 1
1 428 . 6 1 1 A 41 41 GLU C C 41 179.483 178.922 0.561 1
1 429 . 6 1 1 A 41 41 GLU CA C 41 59.248 59.336 -0.088 1
1 430 . 6 1 1 A 41 41 GLU CB C 41 29.358 29.490 -0.132 1
1 432 . 6 1 1 A 41 41 GLU N N 41 116.549 119.919 -3.370 1
1 433 . 6 1 1 A 42 42 GLU H H 42 8.103 7.826 0.277 1
1 434 . 6 1 1 A 42 42 GLU HA H 42 4.020 4.051 -0.031 1
1 439 . 6 1 1 A 42 42 GLU C C 42 180.115 178.802 1.313 1
1 440 . 6 1 1 A 42 42 GLU CA C 42 59.847 59.517 0.330 1
1 441 . 6 1 1 A 42 42 GLU CB C 42 30.218 29.485 0.733 1
1 443 . 6 1 1 A 42 42 GLU N N 42 119.578 119.379 0.199 1
1 444 . 6 1 1 A 43 43 CYS H H 43 8.955 7.954 1.001 1
1 445 . 6 1 1 A 43 43 CYS HA H 43 4.153 4.232 -0.079 1
1 448 . 6 1 1 A 43 43 CYS C C 43 176.498 177.592 -1.094 1
1 449 . 6 1 1 A 43 43 CYS CA C 43 64.856 62.430 2.426 1
1 450 . 6 1 1 A 43 43 CYS CB C 43 27.390 27.828 -0.438 1
1 451 . 6 1 1 A 43 43 CYS N N 43 118.199 118.921 -0.722 1
1 452 . 6 1 1 A 44 44 ASN H H 44 8.543 8.376 0.167 1
1 453 . 6 1 1 A 44 44 ASN HA H 44 4.635 4.408 0.227 1
1 458 . 6 1 1 A 44 44 ASN C C 44 178.633 177.529 1.104 1
1 459 . 6 1 1 A 44 44 ASN CA C 44 56.603 56.417 0.186 1
1 460 . 6 1 1 A 44 44 ASN CB C 44 37.187 38.110 -0.923 1
1 461 . 6 1 1 A 44 44 ASN N N 44 117.002 119.668 -2.666 1
1 463 . 6 1 1 A 45 45 ARG H H 45 8.296 8.286 0.010 1
1 464 . 6 1 1 A 45 45 ARG HA H 45 3.977 4.056 -0.079 1
1 471 . 6 1 1 A 45 45 ARG C C 45 178.149 178.298 -0.149 1
1 472 . 6 1 1 A 45 45 ARG CA C 45 60.589 59.632 0.957 1
1 473 . 6 1 1 A 45 45 ARG CB C 45 30.099 30.209 -0.110 1
1 476 . 6 1 1 A 45 45 ARG N N 45 121.021 120.959 0.062 1
1 477 . 6 1 1 A 46 46 ALA H H 46 7.914 8.317 -0.403 1
1 478 . 6 1 1 A 46 46 ALA HA H 46 4.128 4.111 0.017 1
1 482 . 6 1 1 A 46 46 ALA C C 46 181.208 180.195 1.013 1
1 483 . 6 1 1 A 46 46 ALA CA C 46 55.264 55.133 0.131 1
1 484 . 6 1 1 A 46 46 ALA CB C 46 18.759 18.444 0.315 1
1 485 . 6 1 1 A 46 46 ALA N N 46 121.570 120.763 0.807 1
1 486 . 6 1 1 A 47 47 GLU H H 47 8.730 8.635 0.095 1
1 487 . 6 1 1 A 47 47 GLU HA H 47 4.194 4.039 0.155 1
1 492 . 6 1 1 A 47 47 GLU C C 47 180.115 179.272 0.843 1
1 493 . 6 1 1 A 47 47 GLU CA C 47 58.401 59.637 -1.236 1
1 494 . 6 1 1 A 47 47 GLU CB C 47 29.523 29.278 0.245 1
1 496 . 6 1 1 A 47 47 GLU N N 47 117.532 118.167 -0.635 1
1 497 . 6 1 1 A 48 48 CYS H H 48 8.283 7.856 0.427 1
1 498 . 6 1 1 A 48 48 CYS HA H 48 4.002 4.134 -0.132 1
1 501 . 6 1 1 A 48 48 CYS C C 48 177.031 177.346 -0.315 1
1 502 . 6 1 1 A 48 48 CYS CA C 48 64.749 63.888 0.861 1
1 503 . 6 1 1 A 48 48 CYS CB C 48 25.907 27.297 -1.390 1
1 504 . 6 1 1 A 48 48 CYS N N 48 118.282 119.185 -0.903 1
1 505 . 6 1 1 A 49 49 LEU H H 49 8.181 8.032 0.149 1
1 506 . 6 1 1 A 49 49 LEU HA H 49 4.175 3.910 0.265 1
1 516 . 6 1 1 A 49 49 LEU C C 49 180.430 178.799 1.631 1
1 517 . 6 1 1 A 49 49 LEU CA C 49 57.873 58.176 -0.303 1
1 518 . 6 1 1 A 49 49 LEU CB C 49 41.539 41.690 -0.151 1
1 522 . 6 1 1 A 49 49 LEU N N 49 120.371 120.957 -0.586 1
1 523 . 6 1 1 A 50 50 GLN H H 50 7.934 8.641 -0.707 1
1 524 . 6 1 1 A 50 50 GLN HA H 50 4.102 4.058 0.044 1
1 531 . 6 1 1 A 50 50 GLN C C 50 177.322 177.114 0.208 1
1 532 . 6 1 1 A 50 50 GLN CA C 50 58.156 58.685 -0.529 1
1 533 . 6 1 1 A 50 50 GLN CB C 50 28.616 28.629 -0.013 1
1 535 . 6 1 1 A 50 50 GLN N N 50 118.175 117.320 0.855 1
1 537 . 6 1 1 A 51 51 ARG H H 51 7.632 7.745 -0.113 1
1 538 . 6 1 1 A 51 51 ARG HA H 51 4.347 4.368 -0.021 1
1 545 . 6 1 1 A 51 51 ARG C C 51 176.546 176.460 0.086 1
1 546 . 6 1 1 A 51 51 ARG CA C 51 56.286 55.910 0.376 1
1 547 . 6 1 1 A 51 51 ARG CB C 51 31.314 30.156 1.158 1
1 550 . 6 1 1 A 51 51 ARG N N 51 116.454 117.726 -1.272 1
1 551 . 6 1 1 A 52 52 GLY H H 52 7.949 8.355 -0.406 1
1 552 . 6 1 1 A 52 52 GLY HA2 H 52 4.033 3.969 0.064 1
1 553 . 6 1 1 A 52 52 GLY HA3 H 52 3.903 3.970 -0.067 1
1 554 . 6 1 1 A 52 52 GLY C C 52 174.385 174.305 0.080 1
1 555 . 6 1 1 A 52 52 GLY CA C 52 46.231 45.275 0.956 1
1 556 . 6 1 1 A 52 52 GLY N N 52 108.854 107.584 1.270 1
1 557 . 6 1 1 A 53 53 VAL H H 53 7.944 7.516 0.428 1
1 558 . 6 1 1 A 53 53 VAL HA H 53 4.250 4.041 0.209 1
1 566 . 6 1 1 A 53 53 VAL C C 53 175.525 175.140 0.385 1
1 567 . 6 1 1 A 53 53 VAL CA C 53 60.377 62.528 -2.151 1
1 568 . 6 1 1 A 53 53 VAL CB C 53 34.283 32.879 1.404 1
1 571 . 6 1 1 A 53 53 VAL N N 53 118.316 120.773 -2.457 1
1 572 . 6 1 1 A 54 54 SER H H 54 8.502 8.503 -0.001 1
1 573 . 6 1 1 A 54 54 SER HA H 54 4.625 4.923 -0.298 1
1 576 . 6 1 1 A 54 54 SER C C 54 174.603 174.056 0.547 1
1 577 . 6 1 1 A 54 54 SER CA C 54 56.092 54.173 1.919 1
1 578 . 6 1 1 A 54 54 SER CB C 54 63.697 63.722 -0.025 1
1 579 . 6 1 1 A 54 54 SER N N 54 120.337 118.313 2.024 1
1 580 . 6 1 1 A 55 55 PRO HA H 55 4.624 4.517 0.107 1
1 587 . 6 1 1 A 55 55 PRO C C 55 177.322 177.583 -0.261 1
1 588 . 6 1 1 A 55 55 PRO CA C 55 64.431 64.116 0.315 1
1 589 . 6 1 1 A 55 55 PRO CB C 55 31.913 31.680 0.233 1
1 592 . 6 1 1 A 56 56 SER H H 56 7.931 8.341 -0.410 1
1 593 . 6 1 1 A 56 56 SER HA H 56 4.428 4.643 -0.215 1
1 596 . 6 1 1 A 56 56 SER C C 56 174.749 175.490 -0.741 1
1 597 . 6 1 1 A 56 56 SER CA C 56 59.130 59.317 -0.187 1
1 598 . 6 1 1 A 56 56 SER CB C 56 63.056 64.204 -1.148 1
1 599 . 6 1 1 A 56 56 SER N N 56 112.637 113.720 -1.083 1
1 600 . 6 1 1 A 57 57 LYS H H 57 8.121 7.547 0.574 1
1 601 . 6 1 1 A 57 57 LYS HA H 57 4.467 5.065 -0.598 1
1 609 . 6 1 1 A 57 57 LYS C C 57 176.570 176.096 0.474 1
1 610 . 6 1 1 A 57 57 LYS CA C 57 55.264 55.249 0.015 1
1 611 . 6 1 1 A 57 57 LYS CB C 57 32.160 32.410 -0.250 1
1 615 . 6 1 1 A 57 57 LYS N N 57 123.185 118.220 4.965 1
1 616 . 6 1 1 A 58 58 ALA H H 58 7.886 7.974 -0.088 1
1 617 . 6 1 1 A 58 58 ALA HA H 58 3.923 3.881 0.042 1
1 621 . 6 1 1 A 58 58 ALA C C 58 177.469 179.666 -2.197 1
1 622 . 6 1 1 A 58 58 ALA CA C 58 54.276 54.795 -0.519 1
1 623 . 6 1 1 A 58 58 ALA CB C 58 18.271 18.333 -0.062 1
1 624 . 6 1 1 A 58 58 ALA N N 58 123.941 122.922 1.019 1
1 625 . 6 1 1 A 59 59 HIS H H 59 8.077 8.189 -0.112 1
1 626 . 6 1 1 A 59 59 HIS HA H 59 4.420 4.386 0.034 1
1 631 . 6 1 1 A 59 59 HIS C C 59 177.542 177.530 0.012 1
1 632 . 6 1 1 A 59 59 HIS CA C 59 57.767 58.591 -0.824 1
1 633 . 6 1 1 A 59 59 HIS CB C 59 29.852 28.501 1.351 1
1 636 . 6 1 1 A 59 59 HIS N N 59 115.566 115.516 0.050 1
1 637 . 6 1 1 A 60 60 GLY H H 60 8.110 7.764 0.346 1
1 638 . 6 1 1 A 60 60 GLY HA2 H 60 3.873 3.398 0.475 1
1 639 . 6 1 1 A 60 60 GLY HA3 H 60 4.025 3.514 0.511 1
1 640 . 6 1 1 A 60 60 GLY C C 60 174.918 175.712 -0.794 1
1 641 . 6 1 1 A 60 60 GLY CA C 60 45.559 46.906 -1.347 1
1 642 . 6 1 1 A 60 60 GLY N N 60 109.216 110.264 -1.048 1
1 643 . 6 1 1 A 61 61 LEU H H 61 8.280 8.366 -0.086 1
1 644 . 6 1 1 A 61 61 LEU HA H 61 4.198 3.965 0.233 1
1 654 . 6 1 1 A 61 61 LEU C C 61 178.900 177.584 1.316 1
1 655 . 6 1 1 A 61 61 LEU CA C 61 55.758 57.832 -2.074 1
1 656 . 6 1 1 A 61 61 LEU CB C 61 42.544 41.907 0.637 1
1 660 . 6 1 1 A 61 61 LEU N N 61 120.521 122.991 -2.470 1
1 661 . 6 1 1 A 62 62 GLY H H 62 8.184 7.703 0.481 1
1 662 . 6 1 1 A 62 62 GLY HA2 H 62 3.978 3.815 0.163 1
1 663 . 6 1 1 A 62 62 GLY HA3 H 62 3.817 3.819 -0.002 1
1 664 . 6 1 1 A 62 62 GLY C C 62 176.012 174.887 1.125 1
1 665 . 6 1 1 A 62 62 GLY CA C 62 46.767 47.338 -0.571 1
1 666 . 6 1 1 A 62 62 GLY N N 62 108.987 108.469 0.518 1
1 667 . 6 1 1 A 63 63 SER HA H 63 4.322 4.213 0.109 1
1 670 . 6 1 1 A 63 63 SER C C 63 174.167 176.482 -2.315 1
1 671 . 6 1 1 A 63 63 SER CA C 63 59.919 61.283 -1.364 1
1 672 . 6 1 1 A 63 63 SER CB C 63 63.312 62.262 1.050 1
1 673 . 6 1 1 A 64 64 ASN H H 64 8.087 7.950 0.137 1
1 674 . 6 1 1 A 64 64 ASN HA H 64 4.850 5.084 -0.234 1
1 679 . 6 1 1 A 64 64 ASN C C 64 173.899 175.136 -1.237 1
1 680 . 6 1 1 A 64 64 ASN CA C 64 53.218 53.151 0.067 1
1 681 . 6 1 1 A 64 64 ASN CB C 64 39.164 38.789 0.375 1
1 682 . 6 1 1 A 64 64 ASN N N 64 118.041 118.553 -0.512 1
1 684 . 6 1 1 A 65 65 LEU H H 65 7.293 7.247 0.046 1
1 685 . 6 1 1 A 65 65 LEU HA H 65 3.995 4.570 -0.575 1
1 695 . 6 1 1 A 65 65 LEU C C 65 175.696 175.374 0.322 1
1 696 . 6 1 1 A 65 65 LEU CA C 65 56.005 54.575 1.430 1
1 697 . 6 1 1 A 65 65 LEU CB C 65 43.120 43.488 -0.368 1
1 701 . 6 1 1 A 65 65 LEU N N 65 120.953 121.115 -0.162 1
1 702 . 6 1 1 A 66 66 VAL H H 66 9.517 8.768 0.749 1
1 703 . 6 1 1 A 66 66 VAL HA H 66 3.481 4.192 -0.711 1
1 711 . 6 1 1 A 66 66 VAL C C 66 175.429 174.984 0.445 1
1 712 . 6 1 1 A 66 66 VAL CA C 66 65.243 61.462 3.781 1
1 713 . 6 1 1 A 66 66 VAL CB C 66 31.335 32.833 -1.498 1
1 716 . 6 1 1 A 66 66 VAL N N 66 127.924 127.195 0.729 1
1 717 . 6 1 1 A 67 67 THR H H 67 6.253 8.332 -2.079 1
1 718 . 6 1 1 A 67 67 THR HA H 67 4.779 4.674 0.105 1
1 723 . 6 1 1 A 67 67 THR C C 67 174.894 174.693 0.201 1
1 724 . 6 1 1 A 67 67 THR CA C 67 58.719 59.823 -1.104 1
1 725 . 6 1 1 A 67 67 THR CB C 67 72.153 71.250 0.903 1
1 727 . 6 1 1 A 67 67 THR N N 67 113.376 115.593 -2.217 1
1 728 . 6 1 1 A 68 68 GLU H H 68 9.348 8.870 0.478 1
1 729 . 6 1 1 A 68 68 GLU HA H 68 3.634 3.999 -0.365 1
1 734 . 6 1 1 A 68 68 GLU C C 68 177.809 178.334 -0.525 1
1 735 . 6 1 1 A 68 68 GLU CA C 68 61.505 60.108 1.397 1
1 736 . 6 1 1 A 68 68 GLU CB C 68 28.285 29.689 -1.404 1
1 738 . 6 1 1 A 68 68 GLU N N 68 124.534 122.193 2.341 1
1 739 . 6 1 1 A 69 69 VAL H H 69 8.126 7.936 0.190 1
1 740 . 6 1 1 A 69 69 VAL HA H 69 3.862 3.516 0.346 1
1 748 . 6 1 1 A 69 69 VAL C C 69 177.712 178.097 -0.385 1
1 749 . 6 1 1 A 69 69 VAL CA C 69 65.701 66.822 -1.121 1
1 750 . 6 1 1 A 69 69 VAL CB C 69 31.829 31.561 0.268 1
1 753 . 6 1 1 A 69 69 VAL N N 69 119.139 119.889 -0.750 1
1 754 . 6 1 1 A 70 70 ARG H H 70 7.235 8.266 -1.031 1
1 755 . 6 1 1 A 70 70 ARG HA H 70 4.265 4.034 0.231 1
1 762 . 6 1 1 A 70 70 ARG C C 70 180.430 179.586 0.844 1
1 763 . 6 1 1 A 70 70 ARG CA C 70 59.742 60.149 -0.407 1
1 764 . 6 1 1 A 70 70 ARG CB C 70 29.439 30.025 -0.586 1
1 767 . 6 1 1 A 70 70 ARG N N 70 119.541 119.162 0.379 1
1 768 . 6 1 1 A 71 71 VAL H H 71 8.144 8.203 -0.059 1
1 769 . 6 1 1 A 71 71 VAL HA H 71 4.018 4.003 0.015 1
1 777 . 6 1 1 A 71 71 VAL C C 71 177.493 178.389 -0.896 1
1 778 . 6 1 1 A 71 71 VAL CA C 71 67.924 66.781 1.143 1
1 779 . 6 1 1 A 71 71 VAL CB C 71 32.289 31.695 0.594 1
1 782 . 6 1 1 A 71 71 VAL N N 71 120.755 120.339 0.416 1
1 783 . 6 1 1 A 72 72 TYR H H 72 9.411 8.514 0.897 1
1 784 . 6 1 1 A 72 72 TYR HA H 72 3.908 4.180 -0.272 1
1 791 . 6 1 1 A 72 72 TYR C C 72 178.464 177.614 0.850 1
1 792 . 6 1 1 A 72 72 TYR CA C 72 63.444 62.248 1.196 1
1 793 . 6 1 1 A 72 72 TYR CB C 72 38.211 38.752 -0.541 1
1 798 . 6 1 1 A 72 72 TYR N N 72 121.175 121.056 0.119 1
1 799 . 6 1 1 A 73 73 ASN H H 73 8.816 8.830 -0.014 1
1 800 . 6 1 1 A 73 73 ASN HA H 73 4.538 4.578 -0.040 1
1 805 . 6 1 1 A 73 73 ASN C C 73 176.958 178.012 -1.054 1
1 806 . 6 1 1 A 73 73 ASN CA C 73 56.109 56.708 -0.599 1
1 807 . 6 1 1 A 73 73 ASN CB C 73 38.422 38.671 -0.249 1
1 808 . 6 1 1 A 73 73 ASN N N 73 118.122 117.630 0.492 1
1 810 . 6 1 1 A 74 74 TRP H H 74 8.657 8.478 0.179 1
1 811 . 6 1 1 A 74 74 TRP HA H 74 4.111 4.460 -0.349 1
1 820 . 6 1 1 A 74 74 TRP C C 74 179.654 178.351 1.303 1
1 821 . 6 1 1 A 74 74 TRP CA C 74 62.950 61.236 1.714 1
1 822 . 6 1 1 A 74 74 TRP CB C 74 29.555 29.748 -0.193 1
1 828 . 6 1 1 A 74 74 TRP N N 74 123.988 122.836 1.152 1
1 830 . 6 1 1 A 75 75 PHE H H 75 8.562 8.524 0.038 1
1 831 . 6 1 1 A 75 75 PHE HA H 75 3.821 4.322 -0.501 1
1 839 . 6 1 1 A 75 75 PHE C C 75 177.614 178.106 -0.492 1
1 840 . 6 1 1 A 75 75 PHE CA C 75 63.374 62.009 1.365 1
1 841 . 6 1 1 A 75 75 PHE CB C 75 39.648 37.950 1.698 1
1 847 . 6 1 1 A 75 75 PHE N N 75 118.325 117.254 1.071 1
1 848 . 6 1 1 A 76 76 ALA H H 76 8.305 8.096 0.209 1
1 849 . 6 1 1 A 76 76 ALA HA H 76 3.909 3.937 -0.028 1
1 853 . 6 1 1 A 76 76 ALA C C 76 180.868 179.390 1.478 1
1 854 . 6 1 1 A 76 76 ALA CA C 76 55.566 55.248 0.318 1
1 855 . 6 1 1 A 76 76 ALA CB C 76 17.820 18.152 -0.332 1
1 856 . 6 1 1 A 76 76 ALA N N 76 121.119 122.309 -1.190 1
1 857 . 6 1 1 A 77 77 ASN H H 77 8.335 8.185 0.150 1
1 858 . 6 1 1 A 77 77 ASN HA H 77 4.355 4.413 -0.058 1
1 863 . 6 1 1 A 77 77 ASN C C 77 177.105 177.595 -0.490 1
1 864 . 6 1 1 A 77 77 ASN CA C 77 56.145 56.122 0.023 1
1 865 . 6 1 1 A 77 77 ASN CB C 77 38.063 38.796 -0.733 1
1 866 . 6 1 1 A 77 77 ASN N N 77 117.433 116.358 1.075 1
1 868 . 6 1 1 A 78 78 ARG H H 78 7.664 7.401 0.263 1
1 869 . 6 1 1 A 78 78 ARG HA H 78 3.629 3.723 -0.094 1
1 876 . 6 1 1 A 78 78 ARG C C 78 179.216 177.586 1.630 1
1 877 . 6 1 1 A 78 78 ARG CA C 78 58.773 58.524 0.249 1
1 878 . 6 1 1 A 78 78 ARG CB C 78 29.605 29.284 0.321 1
1 881 . 6 1 1 A 78 78 ARG N N 78 121.999 118.302 3.697 1
1 882 . 6 1 1 A 79 79 ARG H H 79 8.320 7.429 0.891 1
1 883 . 6 1 1 A 79 79 ARG HA H 79 4.307 4.314 -0.007 1
1 890 . 6 1 1 A 79 79 ARG C C 79 180.406 178.256 2.150 1
1 891 . 6 1 1 A 79 79 ARG CA C 79 60.270 57.370 2.900 1
1 892 . 6 1 1 A 79 79 ARG CB C 79 31.335 30.709 0.626 1
1 895 . 6 1 1 A 79 79 ARG N N 79 118.139 118.000 0.139 1
1 896 . 6 1 1 A 80 80 LYS H H 80 7.759 7.885 -0.126 1
1 897 . 6 1 1 A 80 80 LYS HA H 80 4.052 4.163 -0.111 1
1 905 . 6 1 1 A 80 80 LYS C C 80 178.999 179.399 -0.400 1
1 906 . 6 1 1 A 80 80 LYS CA C 80 59.531 59.295 0.236 1
1 907 . 6 1 1 A 80 80 LYS CB C 80 32.374 32.497 -0.123 1
1 911 . 6 1 1 A 80 80 LYS N N 80 120.899 119.162 1.737 1
1 912 . 6 1 1 A 81 81 GLU H H 81 8.041 8.144 -0.103 1
1 913 . 6 1 1 A 81 81 GLU HA H 81 4.044 4.163 -0.119 1
1 918 . 6 1 1 A 81 81 GLU C C 81 179.168 178.478 0.690 1
1 919 . 6 1 1 A 81 81 GLU CA C 81 59.036 59.490 -0.454 1
1 920 . 6 1 1 A 81 81 GLU CB C 81 29.561 29.169 0.392 1
1 922 . 6 1 1 A 81 81 GLU N N 81 120.193 118.766 1.427 1
1 923 . 6 1 1 A 82 82 GLU H H 82 8.131 8.341 -0.210 1
1 924 . 6 1 1 A 82 82 GLU HA H 82 4.017 4.064 -0.047 1
1 929 . 6 1 1 A 82 82 GLU C C 82 178.343 178.342 0.001 1
1 930 . 6 1 1 A 82 82 GLU CA C 82 59.319 59.137 0.182 1
1 931 . 6 1 1 A 82 82 GLU CB C 82 29.770 29.237 0.533 1
1 933 . 6 1 1 A 82 82 GLU N N 82 119.626 118.486 1.140 1
1 934 . 6 1 1 A 83 83 ALA H H 83 7.935 7.726 0.209 1
1 935 . 6 1 1 A 83 83 ALA HA H 83 4.180 4.166 0.014 1
1 939 . 6 1 1 A 83 83 ALA C C 83 179.994 179.522 0.472 1
1 940 . 6 1 1 A 83 83 ALA CA C 83 54.629 54.049 0.580 1
1 941 . 6 1 1 A 83 83 ALA CB C 83 18.090 18.904 -0.814 1
1 942 . 6 1 1 A 83 83 ALA N N 83 121.476 122.319 -0.843 1
1 943 . 6 1 1 A 84 84 PHE H H 84 8.043 8.161 -0.118 1
1 944 . 6 1 1 A 84 84 PHE HA H 84 4.420 4.019 0.401 1
1 952 . 6 1 1 A 84 84 PHE C C 84 177.250 177.073 0.177 1
1 953 . 6 1 1 A 84 84 PHE CA C 84 60.059 61.878 -1.819 1
1 954 . 6 1 1 A 84 84 PHE CB C 84 38.952 39.444 -0.492 1
1 960 . 6 1 1 A 84 84 PHE N N 84 119.074 120.307 -1.233 1
1 961 . 6 1 1 A 85 85 ARG H H 85 8.031 7.899 0.132 1
1 962 . 6 1 1 A 85 85 ARG HA H 85 3.992 4.125 -0.133 1
1 968 . 6 1 1 A 85 85 ARG C C 85 178.319 178.576 -0.257 1
1 969 . 6 1 1 A 85 85 ARG CA C 85 58.523 59.573 -1.050 1
1 970 . 6 1 1 A 85 85 ARG CB C 85 30.346 30.002 0.344 1
1 973 . 6 1 1 A 85 85 ARG N N 85 119.291 117.810 1.481 1
1 974 . 6 1 1 A 86 86 GLN H H 86 8.091 7.841 0.250 1
1 975 . 6 1 1 A 86 86 GLN HA H 86 4.148 4.232 -0.084 1
1 982 . 6 1 1 A 86 86 GLN C C 86 177.105 178.352 -1.247 1
1 983 . 6 1 1 A 86 86 GLN CA C 86 57.556 57.929 -0.373 1
1 984 . 6 1 1 A 86 86 GLN CB C 86 28.855 29.159 -0.304 1
1 986 . 6 1 1 A 86 86 GLN N N 86 119.097 117.637 1.460 1
1 988 . 6 1 1 A 87 87 LYS H H 87 7.898 8.350 -0.452 1
1 989 . 6 1 1 A 87 87 LYS HA H 87 4.116 4.019 0.097 1
1 997 . 6 1 1 A 87 87 LYS C C 87 177.542 179.065 -1.523 1
1 998 . 6 1 1 A 87 87 LYS CA C 87 57.944 59.243 -1.299 1
1 999 . 6 1 1 A 87 87 LYS CB C 87 32.242 31.894 0.348 1
1 1003 . 6 1 1 A 87 87 LYS N N 87 120.968 121.989 -1.021 1
1 1004 . 6 1 1 A 88 88 LEU H H 88 7.903 7.957 -0.054 1
1 1005 . 6 1 1 A 88 88 LEU HA H 88 4.144 4.248 -0.104 1
1 1015 . 6 1 1 A 88 88 LEU C C 88 178.221 178.162 0.059 1
1 1016 . 6 1 1 A 88 88 LEU CA C 88 56.145 57.238 -1.093 1
1 1017 . 6 1 1 A 88 88 LEU CB C 88 42.215 41.489 0.726 1
1 1021 . 6 1 1 A 88 88 LEU N N 88 120.558 117.373 3.185 1
1 1022 . 6 1 1 A 89 89 ALA H H 89 7.894 7.709 0.185 1
1 1023 . 6 1 1 A 89 89 ALA HA H 89 4.224 4.322 -0.098 1
1 1027 . 6 1 1 A 89 89 ALA C C 89 178.609 179.620 -1.011 1
1 1028 . 6 1 1 A 89 89 ALA CA C 89 53.392 53.654 -0.262 1
1 1029 . 6 1 1 A 89 89 ALA CB C 89 18.695 19.178 -0.483 1
1 1030 . 6 1 1 A 89 89 ALA N N 89 122.387 122.506 -0.119 1
1 1031 . 6 1 1 A 90 90 MET H H 90 8.084 8.008 0.076 1
1 1032 . 6 1 1 A 90 90 MET HA H 90 4.356 4.141 0.215 1
1 1040 . 6 1 1 A 90 90 MET C C 90 176.982 176.438 0.544 1
1 1041 . 6 1 1 A 90 90 MET CA C 90 56.551 58.398 -1.847 1
1 1042 . 6 1 1 A 90 90 MET CB C 90 32.719 32.648 0.071 1
1 1045 . 6 1 1 A 90 90 MET N N 90 118.509 116.894 1.615 1
1 1046 . 6 1 1 A 91 91 ASP H H 91 8.261 7.641 0.620 1
1 1047 . 6 1 1 A 91 91 ASP HA H 91 4.524 4.538 -0.014 1
1 1050 . 6 1 1 A 91 91 ASP C C 91 176.643 175.640 1.003 1
1 1051 . 6 1 1 A 91 91 ASP CA C 91 54.981 53.946 1.035 1
1 1052 . 6 1 1 A 91 91 ASP CB C 91 40.870 41.299 -0.429 1
1 1053 . 6 1 1 A 91 91 ASP N N 91 120.771 120.336 0.435 1
1 1054 . 6 1 1 A 92 92 ALA H H 92 7.971 8.501 -0.530 1
1 1055 . 6 1 1 A 92 92 ALA HA H 92 4.200 4.618 -0.418 1
1 1059 . 6 1 1 A 92 92 ALA C C 92 177.929 176.783 1.146 1
1 1060 . 6 1 1 A 92 92 ALA CA C 92 53.184 50.575 2.609 1
1 1061 . 6 1 1 A 92 92 ALA CB C 92 18.890 20.367 -1.477 1
1 1062 . 6 1 1 A 92 92 ALA N N 92 123.057 124.940 -1.883 1
1 1063 . 6 1 1 A 93 93 TYR H H 93 8.019 8.129 -0.110 1
1 1064 . 6 1 1 A 93 93 TYR HA H 93 4.523 5.115 -0.592 1
1 1071 . 6 1 1 A 93 93 TYR C C 93 176.279 175.489 0.790 1
1 1072 . 6 1 1 A 93 93 TYR CA C 93 58.401 56.045 2.356 1
1 1073 . 6 1 1 A 93 93 TYR CB C 93 38.669 41.006 -2.337 1
1 1078 . 6 1 1 A 93 93 TYR N N 93 118.337 122.124 -3.787 1
1 1079 . 6 1 1 A 94 94 SER H H 94 8.037 8.858 -0.821 1
1 1080 . 6 1 1 A 94 94 SER HA H 94 4.484 4.754 -0.270 1
1 1082 . 6 1 1 A 94 94 SER C C 94 174.554 173.441 1.113 1
1 1083 . 6 1 1 A 94 94 SER CA C 94 58.401 57.908 0.493 1
1 1084 . 6 1 1 A 94 94 SER CB C 94 63.806 64.697 -0.891 1
1 1085 . 6 1 1 A 94 94 SER N N 94 116.640 117.238 -0.598 1
1 1086 . 6 1 1 A 96 96 ASN HA H 96 4.770 5.180 -0.410 1
1 1091 . 6 1 1 A 96 96 ASN C C 96 175.161 172.683 2.478 1
1 1092 . 6 1 1 A 96 96 ASN CA C 96 53.395 51.567 1.828 1
1 1093 . 6 1 1 A 96 96 ASN CB C 96 38.999 43.093 -4.094 1
1 1095 . 6 1 1 A 97 97 SER H H 97 8.230 8.686 -0.456 1
1 1096 . 6 1 1 A 97 97 SER HA H 97 4.481 4.802 -0.321 1
1 1099 . 6 1 1 A 97 97 SER C C 97 174.482 173.608 0.874 1
1 1100 . 6 1 1 A 97 97 SER CA C 97 58.300 56.895 1.405 1
1 1101 . 6 1 1 A 97 97 SER CB C 97 63.697 63.642 0.055 1
1 1102 . 6 1 1 A 97 97 SER N N 97 115.866 116.457 -0.591 1
1 1103 . 6 1 1 A 98 98 GLY H H 98 8.228 8.717 -0.489 1
1 1104 . 6 1 1 A 98 98 GLY HA2 H 98 4.098 4.114 -0.016 1
1 1105 . 6 1 1 A 98 98 GLY HA3 H 98 4.098 4.140 -0.042 1
1 1106 . 6 1 1 A 98 98 GLY C C 98 171.788 172.230 -0.442 1
1 1107 . 6 1 1 A 98 98 GLY CA C 98 44.803 44.425 0.378 1
1 1108 . 6 1 1 A 98 98 GLY N N 98 110.658 114.022 -3.364 1
1 1109 . 6 1 1 A 99 99 PRO HA H 99 4.463 4.641 -0.178 1
1 1116 . 6 1 1 A 99 99 PRO CA C 99 63.230 62.889 0.341 1
1 1117 . 6 1 1 A 99 99 PRO CB C 99 32.044 31.597 0.447 1
1 1120 . 6 1 1 A 100 100 SER H H 100 8.514 8.576 -0.062 1
1 1121 . 6 1 1 A 100 100 SER CA C 100 58.450 56.751 1.699 1
1 1122 . 6 1 1 A 100 100 SER CB C 100 63.889 65.342 -1.453 1
1 1 . 7 1 1 A 9 9 ASN H H 9 8.856 9.170 -0.314 1
1 2 . 7 1 1 A 9 9 ASN HA H 9 4.694 5.456 -0.762 1
1 7 . 7 1 1 A 9 9 ASN CA C 9 53.401 51.222 2.179 1
1 8 . 7 1 1 A 9 9 ASN CB C 9 38.757 42.722 -3.965 1
1 10 . 7 1 1 A 10 10 ARG HA H 10 4.346 4.466 -0.120 1
1 17 . 7 1 1 A 10 10 ARG C C 10 175.405 175.114 0.291 1
1 18 . 7 1 1 A 10 10 ARG CA C 10 56.181 55.374 0.807 1
1 19 . 7 1 1 A 10 10 ARG CB C 10 31.171 28.974 2.197 1
1 22 . 7 1 1 A 11 11 PHE H H 11 8.310 8.744 -0.434 1
1 23 . 7 1 1 A 11 11 PHE HA H 11 4.291 5.222 -0.931 1
1 31 . 7 1 1 A 11 11 PHE C C 11 174.458 173.365 1.093 1
1 32 . 7 1 1 A 11 11 PHE CA C 11 58.967 56.358 2.609 1
1 33 . 7 1 1 A 11 11 PHE CB C 11 40.138 42.339 -2.201 1
1 39 . 7 1 1 A 11 11 PHE N N 11 123.604 125.237 -1.633 1
1 40 . 7 1 1 A 12 12 LYS H H 12 7.307 8.440 -1.133 1
1 41 . 7 1 1 A 12 12 LYS HA H 12 4.165 4.507 -0.342 1
1 50 . 7 1 1 A 12 12 LYS C C 12 174.385 175.029 -0.644 1
1 51 . 7 1 1 A 12 12 LYS CA C 12 54.593 54.124 0.469 1
1 52 . 7 1 1 A 12 12 LYS CB C 12 34.712 36.136 -1.424 1
1 56 . 7 1 1 A 12 12 LYS N N 12 127.282 126.246 1.036 1
1 57 . 7 1 1 A 13 13 TRP H H 13 8.039 8.359 -0.320 1
1 58 . 7 1 1 A 13 13 TRP HA H 13 4.370 4.661 -0.291 1
1 67 . 7 1 1 A 13 13 TRP C C 13 177.857 176.685 1.172 1
1 68 . 7 1 1 A 13 13 TRP CA C 13 56.675 57.226 -0.551 1
1 69 . 7 1 1 A 13 13 TRP CB C 13 30.317 30.178 0.139 1
1 75 . 7 1 1 A 13 13 TRP N N 13 124.264 126.778 -2.514 1
1 77 . 7 1 1 A 14 14 GLY H H 14 9.815 8.610 1.205 1
1 78 . 7 1 1 A 14 14 GLY HA2 H 14 4.370 4.152 0.218 1
1 79 . 7 1 1 A 14 14 GLY HA3 H 14 4.335 4.177 0.158 1
1 80 . 7 1 1 A 14 14 GLY C C 14 172.904 174.659 -1.755 1
1 81 . 7 1 1 A 14 14 GLY CA C 14 44.157 44.038 0.119 1
1 82 . 7 1 1 A 14 14 GLY N N 14 115.294 109.475 5.819 1
1 83 . 7 1 1 A 15 15 PRO HA H 15 4.327 4.419 -0.092 1
1 90 . 7 1 1 A 15 15 PRO C C 15 179.726 178.707 1.019 1
1 91 . 7 1 1 A 15 15 PRO CA C 15 65.171 65.189 -0.018 1
1 92 . 7 1 1 A 15 15 PRO CB C 15 31.829 31.993 -0.164 1
1 95 . 7 1 1 A 16 16 ALA H H 16 9.214 8.113 1.101 1
1 96 . 7 1 1 A 16 16 ALA HA H 16 4.166 4.147 0.019 1
1 100 . 7 1 1 A 16 16 ALA C C 16 181.184 179.777 1.407 1
1 101 . 7 1 1 A 16 16 ALA CA C 16 55.370 55.211 0.159 1
1 102 . 7 1 1 A 16 16 ALA CB C 16 18.058 18.902 -0.844 1
1 103 . 7 1 1 A 16 16 ALA N N 16 122.414 119.944 2.470 1
1 104 . 7 1 1 A 17 17 SER H H 17 7.985 8.229 -0.244 1
1 105 . 7 1 1 A 17 17 SER HA H 17 4.317 4.135 0.182 1
1 107 . 7 1 1 A 17 17 SER C C 17 175.381 176.813 -1.432 1
1 108 . 7 1 1 A 17 17 SER CA C 17 63.163 62.191 0.972 1
1 109 . 7 1 1 A 17 17 SER CB C 17 64.055 62.989 1.066 1
1 110 . 7 1 1 A 17 17 SER N N 17 116.568 114.187 2.381 1
1 111 . 7 1 1 A 18 18 GLN H H 18 8.316 7.842 0.474 1
1 112 . 7 1 1 A 18 18 GLN HA H 18 3.323 3.486 -0.163 1
1 119 . 7 1 1 A 18 18 GLN C C 18 176.812 178.557 -1.745 1
1 120 . 7 1 1 A 18 18 GLN CA C 18 60.025 59.291 0.734 1
1 121 . 7 1 1 A 18 18 GLN CB C 18 28.686 28.557 0.129 1
1 123 . 7 1 1 A 18 18 GLN N N 18 119.002 120.933 -1.931 1
1 125 . 7 1 1 A 19 19 GLN H H 19 7.582 8.264 -0.682 1
1 126 . 7 1 1 A 19 19 GLN HA H 19 4.062 4.114 -0.052 1
1 133 . 7 1 1 A 19 19 GLN C C 19 178.488 178.497 -0.009 1
1 134 . 7 1 1 A 19 19 GLN CA C 19 59.248 59.202 0.046 1
1 135 . 7 1 1 A 19 19 GLN CB C 19 28.203 28.268 -0.065 1
1 137 . 7 1 1 A 19 19 GLN N N 19 116.221 118.838 -2.617 1
1 139 . 7 1 1 A 20 20 ILE H H 20 7.246 7.911 -0.665 1
1 140 . 7 1 1 A 20 20 ILE HA H 20 3.570 3.622 -0.052 1
1 150 . 7 1 1 A 20 20 ILE C C 20 178.999 178.510 0.489 1
1 151 . 7 1 1 A 20 20 ILE CA C 20 64.996 65.695 -0.699 1
1 152 . 7 1 1 A 20 20 ILE CB C 20 38.139 37.964 0.175 1
1 156 . 7 1 1 A 20 20 ILE N N 20 120.521 120.889 -0.368 1
1 157 . 7 1 1 A 21 21 LEU H H 21 8.034 7.884 0.150 1
1 158 . 7 1 1 A 21 21 LEU HA H 21 3.491 3.587 -0.096 1
1 168 . 7 1 1 A 21 21 LEU C C 21 178.196 178.641 -0.445 1
1 169 . 7 1 1 A 21 21 LEU CA C 21 57.944 57.518 0.426 1
1 170 . 7 1 1 A 21 21 LEU CB C 21 37.864 40.295 -2.431 1
1 174 . 7 1 1 A 21 21 LEU N N 21 121.259 118.723 2.536 1
1 175 . 7 1 1 A 22 22 TYR H H 22 8.479 7.663 0.816 1
1 176 . 7 1 1 A 22 22 TYR HA H 22 4.224 4.278 -0.054 1
1 183 . 7 1 1 A 22 22 TYR C C 22 179.630 178.584 1.046 1
1 184 . 7 1 1 A 22 22 TYR CA C 22 62.422 60.791 1.631 1
1 185 . 7 1 1 A 22 22 TYR CB C 22 37.434 37.709 -0.275 1
1 190 . 7 1 1 A 22 22 TYR N N 22 117.805 118.509 -0.704 1
1 191 . 7 1 1 A 23 23 GLN H H 23 7.707 8.363 -0.656 1
1 192 . 7 1 1 A 23 23 GLN HA H 23 4.166 4.044 0.122 1
1 199 . 7 1 1 A 23 23 GLN C C 23 178.633 178.518 0.115 1
1 200 . 7 1 1 A 23 23 GLN CA C 23 58.789 59.181 -0.392 1
1 201 . 7 1 1 A 23 23 GLN CB C 23 28.534 28.081 0.453 1
1 203 . 7 1 1 A 23 23 GLN N N 23 117.580 118.339 -0.759 1
1 205 . 7 1 1 A 24 24 ALA H H 24 8.155 7.829 0.326 1
1 206 . 7 1 1 A 24 24 ALA HA H 24 4.187 4.179 0.008 1
1 210 . 7 1 1 A 24 24 ALA C C 24 180.018 179.125 0.893 1
1 211 . 7 1 1 A 24 24 ALA CA C 24 55.228 55.198 0.030 1
1 212 . 7 1 1 A 24 24 ALA CB C 24 19.468 18.812 0.656 1
1 213 . 7 1 1 A 24 24 ALA N N 24 122.813 122.501 0.312 1
1 214 . 7 1 1 A 25 25 TYR H H 25 8.995 8.678 0.317 1
1 215 . 7 1 1 A 25 25 TYR HA H 25 4.348 4.646 -0.298 1
1 222 . 7 1 1 A 25 25 TYR C C 25 175.792 177.668 -1.876 1
1 223 . 7 1 1 A 25 25 TYR CA C 25 61.681 62.426 -0.745 1
1 224 . 7 1 1 A 25 25 TYR CB C 25 38.175 38.721 -0.546 1
1 229 . 7 1 1 A 25 25 TYR N N 25 121.343 120.277 1.066 1
1 230 . 7 1 1 A 26 26 ASP H H 26 7.260 8.581 -1.321 1
1 231 . 7 1 1 A 26 26 ASP HA H 26 4.373 4.483 -0.110 1
1 234 . 7 1 1 A 26 26 ASP C C 26 177.322 178.118 -0.796 1
1 235 . 7 1 1 A 26 26 ASP CA C 26 56.603 57.521 -0.918 1
1 236 . 7 1 1 A 26 26 ASP CB C 26 41.060 41.708 -0.648 1
1 237 . 7 1 1 A 26 26 ASP N N 26 114.020 119.094 -5.074 1
1 238 . 7 1 1 A 27 27 ARG H H 27 7.343 7.785 -0.442 1
1 239 . 7 1 1 A 27 27 ARG HA H 27 4.302 4.358 -0.056 1
1 246 . 7 1 1 A 27 27 ARG C C 27 176.546 176.277 0.269 1
1 247 . 7 1 1 A 27 27 ARG CA C 27 57.563 57.657 -0.094 1
1 248 . 7 1 1 A 27 27 ARG CB C 27 31.500 31.382 0.118 1
1 251 . 7 1 1 A 27 27 ARG N N 27 116.729 117.012 -0.283 1
1 252 . 7 1 1 A 28 28 GLN H H 28 8.306 8.174 0.132 1
1 253 . 7 1 1 A 28 28 GLN HA H 28 4.396 4.652 -0.256 1
1 260 . 7 1 1 A 28 28 GLN C C 28 172.831 175.363 -2.532 1
1 261 . 7 1 1 A 28 28 GLN CA C 28 55.355 54.654 0.701 1
1 262 . 7 1 1 A 28 28 GLN CB C 28 31.062 31.382 -0.320 1
1 264 . 7 1 1 A 28 28 GLN N N 28 121.612 118.398 3.214 1
1 266 . 7 1 1 A 29 29 LYS H H 29 8.354 8.471 -0.117 1
1 267 . 7 1 1 A 29 29 LYS HA H 29 4.099 3.461 0.638 1
1 276 . 7 1 1 A 29 29 LYS C C 29 176.084 176.399 -0.315 1
1 277 . 7 1 1 A 29 29 LYS CA C 29 57.873 57.942 -0.069 1
1 278 . 7 1 1 A 29 29 LYS CB C 29 33.313 32.698 0.615 1
1 282 . 7 1 1 A 29 29 LYS N N 29 125.038 124.530 0.508 1
1 283 . 7 1 1 A 30 30 ASN H H 30 8.856 8.048 0.808 1
1 284 . 7 1 1 A 30 30 ASN HA H 30 4.958 5.125 -0.167 1
1 289 . 7 1 1 A 30 30 ASN C C 30 171.179 172.644 -1.465 1
1 290 . 7 1 1 A 30 30 ASN CA C 30 50.891 50.374 0.517 1
1 291 . 7 1 1 A 30 30 ASN CB C 30 39.907 39.220 0.687 1
1 292 . 7 1 1 A 30 30 ASN N N 30 115.764 117.741 -1.977 1
1 294 . 7 1 1 A 31 31 PRO HA H 31 4.299 4.506 -0.207 1
1 301 . 7 1 1 A 31 31 PRO C C 31 177.493 176.694 0.799 1
1 302 . 7 1 1 A 31 31 PRO CA C 31 62.489 62.566 -0.077 1
1 303 . 7 1 1 A 31 31 PRO CB C 31 31.216 31.799 -0.583 1
1 306 . 7 1 1 A 32 32 SER H H 32 9.368 8.516 0.852 1
1 307 . 7 1 1 A 32 32 SER HA H 32 4.372 4.752 -0.380 1
1 310 . 7 1 1 A 32 32 SER C C 32 174.821 175.818 -0.997 1
1 311 . 7 1 1 A 32 32 SER CA C 32 57.203 57.449 -0.246 1
1 312 . 7 1 1 A 32 32 SER CB C 32 65.594 64.638 0.956 1
1 313 . 7 1 1 A 32 32 SER N N 32 120.847 117.595 3.252 1
1 314 . 7 1 1 A 33 33 LYS H H 33 9.152 9.014 0.138 1
1 315 . 7 1 1 A 33 33 LYS HA H 33 3.719 3.911 -0.192 1
1 324 . 7 1 1 A 33 33 LYS C C 33 177.833 178.153 -0.320 1
1 325 . 7 1 1 A 33 33 LYS CA C 33 61.188 60.309 0.879 1
1 326 . 7 1 1 A 33 33 LYS CB C 33 32.572 32.341 0.231 1
1 330 . 7 1 1 A 33 33 LYS N N 33 122.966 124.602 -1.636 1
1 331 . 7 1 1 A 34 34 GLU H H 34 8.902 8.313 0.589 1
1 332 . 7 1 1 A 34 34 GLU HA H 34 4.089 4.066 0.023 1
1 337 . 7 1 1 A 34 34 GLU C C 34 180.286 178.983 1.303 1
1 338 . 7 1 1 A 34 34 GLU CA C 34 60.483 59.619 0.864 1
1 339 . 7 1 1 A 34 34 GLU CB C 34 28.835 29.125 -0.290 1
1 341 . 7 1 1 A 34 34 GLU N N 34 117.645 118.581 -0.936 1
1 342 . 7 1 1 A 35 35 GLU H H 35 7.673 8.116 -0.443 1
1 343 . 7 1 1 A 35 35 GLU HA H 35 4.023 3.962 0.061 1
1 348 . 7 1 1 A 35 35 GLU C C 35 180.237 179.150 1.087 1
1 349 . 7 1 1 A 35 35 GLU CA C 35 59.214 59.317 -0.103 1
1 350 . 7 1 1 A 35 35 GLU CB C 35 30.099 29.320 0.779 1
1 352 . 7 1 1 A 35 35 GLU N N 35 121.077 120.476 0.601 1
1 353 . 7 1 1 A 36 36 ARG H H 36 8.932 8.227 0.705 1
1 354 . 7 1 1 A 36 36 ARG HA H 36 3.928 3.781 0.147 1
1 362 . 7 1 1 A 36 36 ARG C C 36 178.464 179.088 -0.624 1
1 363 . 7 1 1 A 36 36 ARG CA C 36 60.974 60.058 0.916 1
1 364 . 7 1 1 A 36 36 ARG CB C 36 31.171 29.815 1.356 1
1 367 . 7 1 1 A 36 36 ARG N N 36 119.441 120.066 -0.625 1
1 369 . 7 1 1 A 37 37 GLU H H 37 8.756 8.319 0.437 1
1 370 . 7 1 1 A 37 37 GLU HA H 37 3.948 4.110 -0.162 1
1 375 . 7 1 1 A 37 37 GLU C C 37 179.606 178.896 0.710 1
1 376 . 7 1 1 A 37 37 GLU CA C 37 60.094 58.888 1.206 1
1 377 . 7 1 1 A 37 37 GLU CB C 37 29.110 29.384 -0.274 1
1 379 . 7 1 1 A 37 37 GLU N N 37 119.017 119.949 -0.932 1
1 380 . 7 1 1 A 38 38 ALA H H 38 7.733 7.977 -0.244 1
1 381 . 7 1 1 A 38 38 ALA HA H 38 4.325 4.105 0.220 1
1 385 . 7 1 1 A 38 38 ALA C C 38 180.820 178.536 2.284 1
1 386 . 7 1 1 A 38 38 ALA CA C 38 55.194 54.606 0.588 1
1 387 . 7 1 1 A 38 38 ALA CB C 38 17.654 18.548 -0.894 1
1 388 . 7 1 1 A 38 38 ALA N N 38 122.889 121.919 0.970 1
1 389 . 7 1 1 A 39 39 LEU H H 39 7.740 7.682 0.058 1
1 390 . 7 1 1 A 39 39 LEU HA H 39 4.176 4.259 -0.083 1
1 400 . 7 1 1 A 39 39 LEU C C 39 179.266 178.835 0.431 1
1 401 . 7 1 1 A 39 39 LEU CA C 39 57.944 56.101 1.843 1
1 402 . 7 1 1 A 39 39 LEU CB C 39 42.105 42.343 -0.238 1
1 406 . 7 1 1 A 39 39 LEU N N 39 119.783 116.911 2.872 1
1 407 . 7 1 1 A 40 40 VAL H H 40 8.451 8.230 0.221 1
1 408 . 7 1 1 A 40 40 VAL HA H 40 3.259 3.619 -0.360 1
1 416 . 7 1 1 A 40 40 VAL C C 40 177.153 177.452 -0.299 1
1 417 . 7 1 1 A 40 40 VAL CA C 40 67.254 67.131 0.123 1
1 418 . 7 1 1 A 40 40 VAL CB C 40 31.747 31.375 0.372 1
1 421 . 7 1 1 A 40 40 VAL N N 40 121.481 119.961 1.520 1
1 422 . 7 1 1 A 41 41 GLU H H 41 7.254 8.001 -0.747 1
1 423 . 7 1 1 A 41 41 GLU HA H 41 4.159 4.133 0.026 1
1 428 . 7 1 1 A 41 41 GLU C C 41 179.483 178.733 0.750 1
1 429 . 7 1 1 A 41 41 GLU CA C 41 59.248 59.341 -0.093 1
1 430 . 7 1 1 A 41 41 GLU CB C 41 29.358 29.465 -0.107 1
1 432 . 7 1 1 A 41 41 GLU N N 41 116.549 119.873 -3.324 1
1 433 . 7 1 1 A 42 42 GLU H H 42 8.103 7.821 0.282 1
1 434 . 7 1 1 A 42 42 GLU HA H 42 4.020 4.051 -0.031 1
1 439 . 7 1 1 A 42 42 GLU C C 42 180.115 178.774 1.341 1
1 440 . 7 1 1 A 42 42 GLU CA C 42 59.847 59.532 0.315 1
1 441 . 7 1 1 A 42 42 GLU CB C 42 30.218 29.282 0.936 1
1 443 . 7 1 1 A 42 42 GLU N N 42 119.578 119.378 0.200 1
1 444 . 7 1 1 A 43 43 CYS H H 43 8.955 8.218 0.737 1
1 445 . 7 1 1 A 43 43 CYS HA H 43 4.153 4.235 -0.082 1
1 448 . 7 1 1 A 43 43 CYS C C 43 176.498 177.576 -1.078 1
1 449 . 7 1 1 A 43 43 CYS CA C 43 64.856 62.483 2.373 1
1 450 . 7 1 1 A 43 43 CYS CB C 43 27.390 27.842 -0.452 1
1 451 . 7 1 1 A 43 43 CYS N N 43 118.199 118.755 -0.556 1
1 452 . 7 1 1 A 44 44 ASN H H 44 8.543 7.894 0.649 1
1 453 . 7 1 1 A 44 44 ASN HA H 44 4.635 4.435 0.200 1
1 458 . 7 1 1 A 44 44 ASN C C 44 178.633 177.602 1.031 1
1 459 . 7 1 1 A 44 44 ASN CA C 44 56.603 56.323 0.280 1
1 460 . 7 1 1 A 44 44 ASN CB C 44 37.187 38.103 -0.916 1
1 461 . 7 1 1 A 44 44 ASN N N 44 117.002 119.433 -2.431 1
1 463 . 7 1 1 A 45 45 ARG H H 45 8.296 8.143 0.153 1
1 464 . 7 1 1 A 45 45 ARG HA H 45 3.977 4.065 -0.088 1
1 471 . 7 1 1 A 45 45 ARG C C 45 178.149 178.528 -0.379 1
1 472 . 7 1 1 A 45 45 ARG CA C 45 60.589 59.634 0.955 1
1 473 . 7 1 1 A 45 45 ARG CB C 45 30.099 30.157 -0.058 1
1 476 . 7 1 1 A 45 45 ARG N N 45 121.021 121.116 -0.095 1
1 477 . 7 1 1 A 46 46 ALA H H 46 7.914 8.189 -0.275 1
1 478 . 7 1 1 A 46 46 ALA HA H 46 4.128 4.120 0.008 1
1 482 . 7 1 1 A 46 46 ALA C C 46 181.208 180.188 1.020 1
1 483 . 7 1 1 A 46 46 ALA CA C 46 55.264 54.860 0.404 1
1 484 . 7 1 1 A 46 46 ALA CB C 46 18.759 18.717 0.042 1
1 485 . 7 1 1 A 46 46 ALA N N 46 121.570 120.772 0.798 1
1 486 . 7 1 1 A 47 47 GLU H H 47 8.730 8.527 0.203 1
1 487 . 7 1 1 A 47 47 GLU HA H 47 4.194 4.039 0.155 1
1 492 . 7 1 1 A 47 47 GLU C C 47 180.115 179.087 1.028 1
1 493 . 7 1 1 A 47 47 GLU CA C 47 58.401 59.212 -0.811 1
1 494 . 7 1 1 A 47 47 GLU CB C 47 29.523 29.313 0.210 1
1 496 . 7 1 1 A 47 47 GLU N N 47 117.532 118.317 -0.785 1
1 497 . 7 1 1 A 48 48 CYS H H 48 8.283 7.941 0.342 1
1 498 . 7 1 1 A 48 48 CYS HA H 48 4.002 4.109 -0.107 1
1 501 . 7 1 1 A 48 48 CYS C C 48 177.031 177.404 -0.373 1
1 502 . 7 1 1 A 48 48 CYS CA C 48 64.749 63.842 0.907 1
1 503 . 7 1 1 A 48 48 CYS CB C 48 25.907 27.246 -1.339 1
1 504 . 7 1 1 A 48 48 CYS N N 48 118.282 119.200 -0.918 1
1 505 . 7 1 1 A 49 49 LEU H H 49 8.181 8.056 0.125 1
1 506 . 7 1 1 A 49 49 LEU HA H 49 4.175 3.939 0.236 1
1 516 . 7 1 1 A 49 49 LEU C C 49 180.430 178.763 1.667 1
1 517 . 7 1 1 A 49 49 LEU CA C 49 57.873 58.181 -0.308 1
1 518 . 7 1 1 A 49 49 LEU CB C 49 41.539 41.710 -0.171 1
1 522 . 7 1 1 A 49 49 LEU N N 49 120.371 120.711 -0.340 1
1 523 . 7 1 1 A 50 50 GLN H H 50 7.934 8.569 -0.635 1
1 524 . 7 1 1 A 50 50 GLN HA H 50 4.102 4.081 0.021 1
1 531 . 7 1 1 A 50 50 GLN C C 50 177.322 177.215 0.107 1
1 532 . 7 1 1 A 50 50 GLN CA C 50 58.156 58.647 -0.491 1
1 533 . 7 1 1 A 50 50 GLN CB C 50 28.616 28.581 0.035 1
1 535 . 7 1 1 A 50 50 GLN N N 50 118.175 117.379 0.796 1
1 537 . 7 1 1 A 51 51 ARG H H 51 7.632 7.705 -0.073 1
1 538 . 7 1 1 A 51 51 ARG HA H 51 4.347 4.360 -0.013 1
1 545 . 7 1 1 A 51 51 ARG C C 51 176.546 176.430 0.116 1
1 546 . 7 1 1 A 51 51 ARG CA C 51 56.286 55.977 0.309 1
1 547 . 7 1 1 A 51 51 ARG CB C 51 31.314 30.277 1.037 1
1 550 . 7 1 1 A 51 51 ARG N N 51 116.454 117.846 -1.392 1
1 551 . 7 1 1 A 52 52 GLY H H 52 7.949 8.408 -0.459 1
1 552 . 7 1 1 A 52 52 GLY HA2 H 52 4.033 3.974 0.059 1
1 553 . 7 1 1 A 52 52 GLY HA3 H 52 3.903 3.975 -0.072 1
1 554 . 7 1 1 A 52 52 GLY C C 52 174.385 174.315 0.070 1
1 555 . 7 1 1 A 52 52 GLY CA C 52 46.231 45.261 0.970 1
1 556 . 7 1 1 A 52 52 GLY N N 52 108.854 107.598 1.256 1
1 557 . 7 1 1 A 53 53 VAL H H 53 7.944 7.552 0.392 1
1 558 . 7 1 1 A 53 53 VAL HA H 53 4.250 4.035 0.215 1
1 566 . 7 1 1 A 53 53 VAL C C 53 175.525 174.969 0.556 1
1 567 . 7 1 1 A 53 53 VAL CA C 53 60.377 62.528 -2.151 1
1 568 . 7 1 1 A 53 53 VAL CB C 53 34.283 32.881 1.402 1
1 571 . 7 1 1 A 53 53 VAL N N 53 118.316 120.756 -2.440 1
1 572 . 7 1 1 A 54 54 SER H H 54 8.502 8.506 -0.004 1
1 573 . 7 1 1 A 54 54 SER HA H 54 4.625 4.926 -0.301 1
1 576 . 7 1 1 A 54 54 SER C C 54 174.603 174.048 0.555 1
1 577 . 7 1 1 A 54 54 SER CA C 54 56.092 54.107 1.985 1
1 578 . 7 1 1 A 54 54 SER CB C 54 63.697 63.822 -0.125 1
1 579 . 7 1 1 A 54 54 SER N N 54 120.337 118.402 1.935 1
1 580 . 7 1 1 A 55 55 PRO HA H 55 4.624 4.519 0.105 1
1 587 . 7 1 1 A 55 55 PRO C C 55 177.322 177.435 -0.113 1
1 588 . 7 1 1 A 55 55 PRO CA C 55 64.431 64.180 0.251 1
1 589 . 7 1 1 A 55 55 PRO CB C 55 31.913 31.683 0.230 1
1 592 . 7 1 1 A 56 56 SER H H 56 7.931 8.446 -0.515 1
1 593 . 7 1 1 A 56 56 SER HA H 56 4.428 4.606 -0.178 1
1 596 . 7 1 1 A 56 56 SER C C 56 174.749 174.884 -0.135 1
1 597 . 7 1 1 A 56 56 SER CA C 56 59.130 59.248 -0.118 1
1 598 . 7 1 1 A 56 56 SER CB C 56 63.056 63.908 -0.852 1
1 599 . 7 1 1 A 56 56 SER N N 56 112.637 113.135 -0.498 1
1 600 . 7 1 1 A 57 57 LYS H H 57 8.121 7.581 0.540 1
1 601 . 7 1 1 A 57 57 LYS HA H 57 4.467 4.995 -0.528 1
1 609 . 7 1 1 A 57 57 LYS C C 57 176.570 176.152 0.418 1
1 610 . 7 1 1 A 57 57 LYS CA C 57 55.264 55.251 0.013 1
1 611 . 7 1 1 A 57 57 LYS CB C 57 32.160 32.485 -0.325 1
1 615 . 7 1 1 A 57 57 LYS N N 57 123.185 118.361 4.824 1
1 616 . 7 1 1 A 58 58 ALA H H 58 7.886 7.975 -0.089 1
1 617 . 7 1 1 A 58 58 ALA HA H 58 3.923 3.875 0.048 1
1 621 . 7 1 1 A 58 58 ALA C C 58 177.469 179.658 -2.189 1
1 622 . 7 1 1 A 58 58 ALA CA C 58 54.276 55.003 -0.727 1
1 623 . 7 1 1 A 58 58 ALA CB C 58 18.271 18.328 -0.057 1
1 624 . 7 1 1 A 58 58 ALA N N 58 123.941 122.984 0.957 1
1 625 . 7 1 1 A 59 59 HIS H H 59 8.077 8.246 -0.169 1
1 626 . 7 1 1 A 59 59 HIS HA H 59 4.420 4.437 -0.017 1
1 631 . 7 1 1 A 59 59 HIS C C 59 177.542 176.242 1.300 1
1 632 . 7 1 1 A 59 59 HIS CA C 59 57.767 58.586 -0.819 1
1 633 . 7 1 1 A 59 59 HIS CB C 59 29.852 28.613 1.239 1
1 636 . 7 1 1 A 59 59 HIS N N 59 115.566 115.470 0.096 1
1 637 . 7 1 1 A 60 60 GLY H H 60 8.110 7.761 0.349 1
1 638 . 7 1 1 A 60 60 GLY HA2 H 60 3.873 3.704 0.169 1
1 639 . 7 1 1 A 60 60 GLY HA3 H 60 4.025 3.826 0.199 1
1 640 . 7 1 1 A 60 60 GLY C C 60 174.918 174.520 0.398 1
1 641 . 7 1 1 A 60 60 GLY CA C 60 45.559 45.482 0.077 1
1 642 . 7 1 1 A 60 60 GLY N N 60 109.216 108.555 0.661 1
1 643 . 7 1 1 A 61 61 LEU H H 61 8.280 7.661 0.619 1
1 644 . 7 1 1 A 61 61 LEU HA H 61 4.198 4.393 -0.195 1
1 654 . 7 1 1 A 61 61 LEU C C 61 178.900 177.406 1.494 1
1 655 . 7 1 1 A 61 61 LEU CA C 61 55.758 55.092 0.666 1
1 656 . 7 1 1 A 61 61 LEU CB C 61 42.544 43.089 -0.545 1
1 660 . 7 1 1 A 61 61 LEU N N 61 120.521 118.621 1.900 1
1 661 . 7 1 1 A 62 62 GLY H H 62 8.184 8.133 0.051 1
1 662 . 7 1 1 A 62 62 GLY HA2 H 62 3.978 3.927 0.051 1
1 663 . 7 1 1 A 62 62 GLY HA3 H 62 3.817 3.928 -0.111 1
1 664 . 7 1 1 A 62 62 GLY C C 62 176.012 174.703 1.309 1
1 665 . 7 1 1 A 62 62 GLY CA C 62 46.767 47.183 -0.416 1
1 666 . 7 1 1 A 62 62 GLY N N 62 108.987 109.611 -0.624 1
1 667 . 7 1 1 A 63 63 SER HA H 63 4.322 4.259 0.063 1
1 670 . 7 1 1 A 63 63 SER C C 63 174.167 176.833 -2.666 1
1 671 . 7 1 1 A 63 63 SER CA C 63 59.919 61.225 -1.306 1
1 672 . 7 1 1 A 63 63 SER CB C 63 63.312 62.684 0.628 1
1 673 . 7 1 1 A 64 64 ASN H H 64 8.087 7.612 0.475 1
1 674 . 7 1 1 A 64 64 ASN HA H 64 4.850 4.839 0.011 1
1 679 . 7 1 1 A 64 64 ASN C C 64 173.899 175.524 -1.625 1
1 680 . 7 1 1 A 64 64 ASN CA C 64 53.218 55.142 -1.924 1
1 681 . 7 1 1 A 64 64 ASN CB C 64 39.164 38.351 0.813 1
1 682 . 7 1 1 A 64 64 ASN N N 64 118.041 118.011 0.030 1
1 684 . 7 1 1 A 65 65 LEU H H 65 7.293 7.228 0.065 1
1 685 . 7 1 1 A 65 65 LEU HA H 65 3.995 4.359 -0.364 1
1 695 . 7 1 1 A 65 65 LEU C C 65 175.696 175.983 -0.287 1
1 696 . 7 1 1 A 65 65 LEU CA C 65 56.005 55.804 0.201 1
1 697 . 7 1 1 A 65 65 LEU CB C 65 43.120 42.809 0.311 1
1 701 . 7 1 1 A 65 65 LEU N N 65 120.953 122.858 -1.905 1
1 702 . 7 1 1 A 66 66 VAL H H 66 9.517 8.973 0.544 1
1 703 . 7 1 1 A 66 66 VAL HA H 66 3.481 4.462 -0.981 1
1 711 . 7 1 1 A 66 66 VAL C C 66 175.429 175.125 0.304 1
1 712 . 7 1 1 A 66 66 VAL CA C 66 65.243 61.388 3.855 1
1 713 . 7 1 1 A 66 66 VAL CB C 66 31.335 33.331 -1.996 1
1 716 . 7 1 1 A 66 66 VAL N N 66 127.924 126.787 1.137 1
1 717 . 7 1 1 A 67 67 THR H H 67 6.253 8.319 -2.066 1
1 718 . 7 1 1 A 67 67 THR HA H 67 4.779 4.826 -0.047 1
1 723 . 7 1 1 A 67 67 THR C C 67 174.894 174.920 -0.026 1
1 724 . 7 1 1 A 67 67 THR CA C 67 58.719 59.413 -0.694 1
1 725 . 7 1 1 A 67 67 THR CB C 67 72.153 71.969 0.184 1
1 727 . 7 1 1 A 67 67 THR N N 67 113.376 116.745 -3.369 1
1 728 . 7 1 1 A 68 68 GLU H H 68 9.348 8.870 0.478 1
1 729 . 7 1 1 A 68 68 GLU HA H 68 3.634 4.000 -0.366 1
1 734 . 7 1 1 A 68 68 GLU C C 68 177.809 178.318 -0.509 1
1 735 . 7 1 1 A 68 68 GLU CA C 68 61.505 60.043 1.462 1
1 736 . 7 1 1 A 68 68 GLU CB C 68 28.285 29.613 -1.328 1
1 738 . 7 1 1 A 68 68 GLU N N 68 124.534 122.150 2.384 1
1 739 . 7 1 1 A 69 69 VAL H H 69 8.126 7.886 0.240 1
1 740 . 7 1 1 A 69 69 VAL HA H 69 3.862 3.520 0.342 1
1 748 . 7 1 1 A 69 69 VAL C C 69 177.712 178.073 -0.361 1
1 749 . 7 1 1 A 69 69 VAL CA C 69 65.701 66.790 -1.089 1
1 750 . 7 1 1 A 69 69 VAL CB C 69 31.829 31.541 0.288 1
1 753 . 7 1 1 A 69 69 VAL N N 69 119.139 119.878 -0.739 1
1 754 . 7 1 1 A 70 70 ARG H H 70 7.235 8.223 -0.988 1
1 755 . 7 1 1 A 70 70 ARG HA H 70 4.265 3.884 0.381 1
1 762 . 7 1 1 A 70 70 ARG C C 70 180.430 179.347 1.083 1
1 763 . 7 1 1 A 70 70 ARG CA C 70 59.742 60.094 -0.352 1
1 764 . 7 1 1 A 70 70 ARG CB C 70 29.439 29.771 -0.332 1
1 767 . 7 1 1 A 70 70 ARG N N 70 119.541 119.051 0.490 1
1 768 . 7 1 1 A 71 71 VAL H H 71 8.144 8.032 0.112 1
1 769 . 7 1 1 A 71 71 VAL HA H 71 4.018 4.001 0.017 1
1 777 . 7 1 1 A 71 71 VAL C C 71 177.493 178.277 -0.784 1
1 778 . 7 1 1 A 71 71 VAL CA C 71 67.924 66.667 1.257 1
1 779 . 7 1 1 A 71 71 VAL CB C 71 32.289 31.775 0.514 1
1 782 . 7 1 1 A 71 71 VAL N N 71 120.755 120.257 0.498 1
1 783 . 7 1 1 A 72 72 TYR H H 72 9.411 8.400 1.011 1
1 784 . 7 1 1 A 72 72 TYR HA H 72 3.908 4.226 -0.318 1
1 791 . 7 1 1 A 72 72 TYR C C 72 178.464 177.829 0.635 1
1 792 . 7 1 1 A 72 72 TYR CA C 72 63.444 62.203 1.241 1
1 793 . 7 1 1 A 72 72 TYR CB C 72 38.211 38.742 -0.531 1
1 798 . 7 1 1 A 72 72 TYR N N 72 121.175 121.417 -0.242 1
1 799 . 7 1 1 A 73 73 ASN H H 73 8.816 8.613 0.203 1
1 800 . 7 1 1 A 73 73 ASN HA H 73 4.538 4.569 -0.031 1
1 805 . 7 1 1 A 73 73 ASN C C 73 176.958 178.069 -1.111 1
1 806 . 7 1 1 A 73 73 ASN CA C 73 56.109 56.734 -0.625 1
1 807 . 7 1 1 A 73 73 ASN CB C 73 38.422 38.688 -0.266 1
1 808 . 7 1 1 A 73 73 ASN N N 73 118.122 117.752 0.370 1
1 810 . 7 1 1 A 74 74 TRP H H 74 8.657 8.340 0.317 1
1 811 . 7 1 1 A 74 74 TRP HA H 74 4.111 4.535 -0.424 1
1 820 . 7 1 1 A 74 74 TRP C C 74 179.654 178.422 1.232 1
1 821 . 7 1 1 A 74 74 TRP CA C 74 62.950 61.227 1.723 1
1 822 . 7 1 1 A 74 74 TRP CB C 74 29.555 29.596 -0.041 1
1 828 . 7 1 1 A 74 74 TRP N N 74 123.988 123.282 0.706 1
1 830 . 7 1 1 A 75 75 PHE H H 75 8.562 8.535 0.027 1
1 831 . 7 1 1 A 75 75 PHE HA H 75 3.821 4.478 -0.657 1
1 839 . 7 1 1 A 75 75 PHE C C 75 177.614 178.113 -0.499 1
1 840 . 7 1 1 A 75 75 PHE CA C 75 63.374 61.831 1.543 1
1 841 . 7 1 1 A 75 75 PHE CB C 75 39.648 38.237 1.411 1
1 847 . 7 1 1 A 75 75 PHE N N 75 118.325 117.508 0.817 1
1 848 . 7 1 1 A 76 76 ALA H H 76 8.305 8.249 0.056 1
1 849 . 7 1 1 A 76 76 ALA HA H 76 3.909 3.916 -0.007 1
1 853 . 7 1 1 A 76 76 ALA C C 76 180.868 179.517 1.351 1
1 854 . 7 1 1 A 76 76 ALA CA C 76 55.566 55.155 0.411 1
1 855 . 7 1 1 A 76 76 ALA CB C 76 17.820 17.831 -0.011 1
1 856 . 7 1 1 A 76 76 ALA N N 76 121.119 122.253 -1.134 1
1 857 . 7 1 1 A 77 77 ASN H H 77 8.335 8.221 0.114 1
1 858 . 7 1 1 A 77 77 ASN HA H 77 4.355 4.414 -0.059 1
1 863 . 7 1 1 A 77 77 ASN C C 77 177.105 177.710 -0.605 1
1 864 . 7 1 1 A 77 77 ASN CA C 77 56.145 56.157 -0.012 1
1 865 . 7 1 1 A 77 77 ASN CB C 77 38.063 38.733 -0.670 1
1 866 . 7 1 1 A 77 77 ASN N N 77 117.433 116.357 1.076 1
1 868 . 7 1 1 A 78 78 ARG H H 78 7.664 7.225 0.439 1
1 869 . 7 1 1 A 78 78 ARG HA H 78 3.629 3.772 -0.143 1
1 876 . 7 1 1 A 78 78 ARG C C 78 179.216 177.741 1.475 1
1 877 . 7 1 1 A 78 78 ARG CA C 78 58.773 58.510 0.263 1
1 878 . 7 1 1 A 78 78 ARG CB C 78 29.605 29.233 0.372 1
1 881 . 7 1 1 A 78 78 ARG N N 78 121.999 118.469 3.530 1
1 882 . 7 1 1 A 79 79 ARG H H 79 8.320 7.546 0.774 1
1 883 . 7 1 1 A 79 79 ARG HA H 79 4.307 4.697 -0.390 1
1 890 . 7 1 1 A 79 79 ARG C C 79 180.406 178.360 2.046 1
1 891 . 7 1 1 A 79 79 ARG CA C 79 60.270 57.496 2.774 1
1 892 . 7 1 1 A 79 79 ARG CB C 79 31.335 30.667 0.668 1
1 895 . 7 1 1 A 79 79 ARG N N 79 118.139 117.820 0.319 1
1 896 . 7 1 1 A 80 80 LYS H H 80 7.759 8.109 -0.350 1
1 897 . 7 1 1 A 80 80 LYS HA H 80 4.052 4.174 -0.122 1
1 905 . 7 1 1 A 80 80 LYS C C 80 178.999 179.350 -0.351 1
1 906 . 7 1 1 A 80 80 LYS CA C 80 59.531 59.366 0.165 1
1 907 . 7 1 1 A 80 80 LYS CB C 80 32.374 32.344 0.030 1
1 911 . 7 1 1 A 80 80 LYS N N 80 120.899 119.423 1.476 1
1 912 . 7 1 1 A 81 81 GLU H H 81 8.041 8.169 -0.128 1
1 913 . 7 1 1 A 81 81 GLU HA H 81 4.044 4.168 -0.124 1
1 918 . 7 1 1 A 81 81 GLU C C 81 179.168 178.495 0.673 1
1 919 . 7 1 1 A 81 81 GLU CA C 81 59.036 59.503 -0.467 1
1 920 . 7 1 1 A 81 81 GLU CB C 81 29.561 29.152 0.409 1
1 922 . 7 1 1 A 81 81 GLU N N 81 120.193 118.795 1.398 1
1 923 . 7 1 1 A 82 82 GLU H H 82 8.131 8.304 -0.173 1
1 924 . 7 1 1 A 82 82 GLU HA H 82 4.017 4.092 -0.075 1
1 929 . 7 1 1 A 82 82 GLU C C 82 178.343 178.505 -0.162 1
1 930 . 7 1 1 A 82 82 GLU CA C 82 59.319 59.157 0.162 1
1 931 . 7 1 1 A 82 82 GLU CB C 82 29.770 29.375 0.395 1
1 933 . 7 1 1 A 82 82 GLU N N 82 119.626 118.515 1.111 1
1 934 . 7 1 1 A 83 83 ALA H H 83 7.935 7.554 0.381 1
1 935 . 7 1 1 A 83 83 ALA HA H 83 4.180 4.150 0.030 1
1 939 . 7 1 1 A 83 83 ALA C C 83 179.994 179.708 0.286 1
1 940 . 7 1 1 A 83 83 ALA CA C 83 54.629 54.392 0.237 1
1 941 . 7 1 1 A 83 83 ALA CB C 83 18.090 18.705 -0.615 1
1 942 . 7 1 1 A 83 83 ALA N N 83 121.476 122.447 -0.971 1
1 943 . 7 1 1 A 84 84 PHE H H 84 8.043 8.133 -0.090 1
1 944 . 7 1 1 A 84 84 PHE HA H 84 4.420 4.052 0.368 1
1 952 . 7 1 1 A 84 84 PHE C C 84 177.250 177.060 0.190 1
1 953 . 7 1 1 A 84 84 PHE CA C 84 60.059 61.929 -1.870 1
1 954 . 7 1 1 A 84 84 PHE CB C 84 38.952 39.322 -0.370 1
1 960 . 7 1 1 A 84 84 PHE N N 84 119.074 120.458 -1.384 1
1 961 . 7 1 1 A 85 85 ARG H H 85 8.031 7.881 0.150 1
1 962 . 7 1 1 A 85 85 ARG HA H 85 3.992 4.118 -0.126 1
1 968 . 7 1 1 A 85 85 ARG C C 85 178.319 178.453 -0.134 1
1 969 . 7 1 1 A 85 85 ARG CA C 85 58.523 59.571 -1.048 1
1 970 . 7 1 1 A 85 85 ARG CB C 85 30.346 29.912 0.434 1
1 973 . 7 1 1 A 85 85 ARG N N 85 119.291 117.638 1.653 1
1 974 . 7 1 1 A 86 86 GLN H H 86 8.091 7.816 0.275 1
1 975 . 7 1 1 A 86 86 GLN HA H 86 4.148 4.280 -0.132 1
1 982 . 7 1 1 A 86 86 GLN C C 86 177.105 178.362 -1.257 1
1 983 . 7 1 1 A 86 86 GLN CA C 86 57.556 57.452 0.104 1
1 984 . 7 1 1 A 86 86 GLN CB C 86 28.855 29.425 -0.570 1
1 986 . 7 1 1 A 86 86 GLN N N 86 119.097 117.497 1.600 1
1 988 . 7 1 1 A 87 87 LYS H H 87 7.898 8.455 -0.557 1
1 989 . 7 1 1 A 87 87 LYS HA H 87 4.116 4.062 0.054 1
1 997 . 7 1 1 A 87 87 LYS C C 87 177.542 178.856 -1.314 1
1 998 . 7 1 1 A 87 87 LYS CA C 87 57.944 58.997 -1.053 1
1 999 . 7 1 1 A 87 87 LYS CB C 87 32.242 32.006 0.236 1
1 1003 . 7 1 1 A 87 87 LYS N N 87 120.968 122.051 -1.083 1
1 1004 . 7 1 1 A 88 88 LEU H H 88 7.903 8.247 -0.344 1
1 1005 . 7 1 1 A 88 88 LEU HA H 88 4.144 4.218 -0.074 1
1 1015 . 7 1 1 A 88 88 LEU C C 88 178.221 177.317 0.904 1
1 1016 . 7 1 1 A 88 88 LEU CA C 88 56.145 56.815 -0.670 1
1 1017 . 7 1 1 A 88 88 LEU CB C 88 42.215 41.172 1.043 1
1 1021 . 7 1 1 A 88 88 LEU N N 88 120.558 117.009 3.549 1
1 1022 . 7 1 1 A 89 89 ALA H H 89 7.894 7.495 0.399 1
1 1023 . 7 1 1 A 89 89 ALA HA H 89 4.224 4.352 -0.128 1
1 1027 . 7 1 1 A 89 89 ALA C C 89 178.609 178.883 -0.274 1
1 1028 . 7 1 1 A 89 89 ALA CA C 89 53.392 53.416 -0.024 1
1 1029 . 7 1 1 A 89 89 ALA CB C 89 18.695 19.635 -0.940 1
1 1030 . 7 1 1 A 89 89 ALA N N 89 122.387 121.612 0.775 1
1 1031 . 7 1 1 A 90 90 MET H H 90 8.084 7.950 0.134 1
1 1032 . 7 1 1 A 90 90 MET HA H 90 4.356 4.122 0.234 1
1 1040 . 7 1 1 A 90 90 MET C C 90 176.982 176.474 0.508 1
1 1041 . 7 1 1 A 90 90 MET CA C 90 56.551 58.525 -1.974 1
1 1042 . 7 1 1 A 90 90 MET CB C 90 32.719 32.763 -0.044 1
1 1045 . 7 1 1 A 90 90 MET N N 90 118.509 116.797 1.712 1
1 1046 . 7 1 1 A 91 91 ASP H H 91 8.261 7.206 1.055 1
1 1047 . 7 1 1 A 91 91 ASP HA H 91 4.524 4.454 0.070 1
1 1050 . 7 1 1 A 91 91 ASP C C 91 176.643 175.827 0.816 1
1 1051 . 7 1 1 A 91 91 ASP CA C 91 54.981 53.811 1.170 1
1 1052 . 7 1 1 A 91 91 ASP CB C 91 40.870 41.205 -0.335 1
1 1053 . 7 1 1 A 91 91 ASP N N 91 120.771 120.739 0.032 1
1 1054 . 7 1 1 A 92 92 ALA H H 92 7.971 8.271 -0.300 1
1 1055 . 7 1 1 A 92 92 ALA HA H 92 4.200 4.305 -0.105 1
1 1059 . 7 1 1 A 92 92 ALA C C 92 177.929 177.050 0.879 1
1 1060 . 7 1 1 A 92 92 ALA CA C 92 53.184 51.437 1.747 1
1 1061 . 7 1 1 A 92 92 ALA CB C 92 18.890 19.865 -0.975 1
1 1062 . 7 1 1 A 92 92 ALA N N 92 123.057 124.131 -1.074 1
1 1063 . 7 1 1 A 93 93 TYR H H 93 8.019 8.915 -0.896 1
1 1064 . 7 1 1 A 93 93 TYR HA H 93 4.523 4.233 0.290 1
1 1071 . 7 1 1 A 93 93 TYR C C 93 176.279 175.204 1.075 1
1 1072 . 7 1 1 A 93 93 TYR CA C 93 58.401 58.817 -0.416 1
1 1073 . 7 1 1 A 93 93 TYR CB C 93 38.669 36.213 2.456 1
1 1078 . 7 1 1 A 93 93 TYR N N 93 118.337 120.583 -2.246 1
1 1079 . 7 1 1 A 94 94 SER H H 94 8.037 7.883 0.154 1
1 1080 . 7 1 1 A 94 94 SER HA H 94 4.484 4.757 -0.273 1
1 1082 . 7 1 1 A 94 94 SER C C 94 174.554 174.499 0.055 1
1 1083 . 7 1 1 A 94 94 SER CA C 94 58.401 56.565 1.836 1
1 1084 . 7 1 1 A 94 94 SER CB C 94 63.806 66.002 -2.196 1
1 1085 . 7 1 1 A 94 94 SER N N 94 116.640 114.823 1.817 1
1 1086 . 7 1 1 A 96 96 ASN HA H 96 4.770 4.618 0.152 1
1 1091 . 7 1 1 A 96 96 ASN C C 96 175.161 174.319 0.842 1
1 1092 . 7 1 1 A 96 96 ASN CA C 96 53.395 53.910 -0.515 1
1 1093 . 7 1 1 A 96 96 ASN CB C 96 38.999 38.680 0.319 1
1 1095 . 7 1 1 A 97 97 SER H H 97 8.230 8.607 -0.377 1
1 1096 . 7 1 1 A 97 97 SER HA H 97 4.481 4.852 -0.371 1
1 1099 . 7 1 1 A 97 97 SER C C 97 174.482 173.608 0.874 1
1 1100 . 7 1 1 A 97 97 SER CA C 97 58.300 56.763 1.537 1
1 1101 . 7 1 1 A 97 97 SER CB C 97 63.697 66.169 -2.472 1
1 1102 . 7 1 1 A 97 97 SER N N 97 115.866 120.054 -4.188 1
1 1103 . 7 1 1 A 98 98 GLY H H 98 8.228 8.585 -0.357 1
1 1104 . 7 1 1 A 98 98 GLY HA2 H 98 4.098 3.996 0.102 1
1 1105 . 7 1 1 A 98 98 GLY HA3 H 98 4.098 3.997 0.101 1
1 1106 . 7 1 1 A 98 98 GLY C C 98 171.788 173.264 -1.476 1
1 1107 . 7 1 1 A 98 98 GLY CA C 98 44.803 45.332 -0.529 1
1 1108 . 7 1 1 A 98 98 GLY N N 98 110.658 114.213 -3.555 1
1 1109 . 7 1 1 A 99 99 PRO HA H 99 4.463 4.813 -0.350 1
1 1116 . 7 1 1 A 99 99 PRO CA C 99 63.230 62.793 0.437 1
1 1117 . 7 1 1 A 99 99 PRO CB C 99 32.044 31.999 0.045 1
1 1120 . 7 1 1 A 100 100 SER H H 100 8.514 8.964 -0.450 1
1 1121 . 7 1 1 A 100 100 SER CA C 100 58.450 57.766 0.684 1
1 1122 . 7 1 1 A 100 100 SER CB C 100 63.889 65.971 -2.082 1
1 1 . 8 1 1 A 9 9 ASN H H 9 8.856 7.742 1.114 1
1 2 . 8 1 1 A 9 9 ASN HA H 9 4.694 4.619 0.075 1
1 7 . 8 1 1 A 9 9 ASN CA C 9 53.401 54.074 -0.673 1
1 8 . 8 1 1 A 9 9 ASN CB C 9 38.757 38.434 0.323 1
1 10 . 8 1 1 A 10 10 ARG HA H 10 4.346 4.863 -0.517 1
1 17 . 8 1 1 A 10 10 ARG C C 10 175.405 175.267 0.138 1
1 18 . 8 1 1 A 10 10 ARG CA C 10 56.181 54.217 1.964 1
1 19 . 8 1 1 A 10 10 ARG CB C 10 31.171 33.986 -2.815 1
1 22 . 8 1 1 A 11 11 PHE H H 11 8.310 8.797 -0.487 1
1 23 . 8 1 1 A 11 11 PHE HA H 11 4.291 4.323 -0.032 1
1 31 . 8 1 1 A 11 11 PHE C C 11 174.458 174.239 0.219 1
1 32 . 8 1 1 A 11 11 PHE CA C 11 58.967 59.644 -0.677 1
1 33 . 8 1 1 A 11 11 PHE CB C 11 40.138 39.502 0.636 1
1 39 . 8 1 1 A 11 11 PHE N N 11 123.604 124.698 -1.094 1
1 40 . 8 1 1 A 12 12 LYS H H 12 7.307 8.287 -0.980 1
1 41 . 8 1 1 A 12 12 LYS HA H 12 4.165 4.480 -0.315 1
1 50 . 8 1 1 A 12 12 LYS C C 12 174.385 175.513 -1.128 1
1 51 . 8 1 1 A 12 12 LYS CA C 12 54.593 53.994 0.599 1
1 52 . 8 1 1 A 12 12 LYS CB C 12 34.712 35.048 -0.336 1
1 56 . 8 1 1 A 12 12 LYS N N 12 127.282 126.923 0.359 1
1 57 . 8 1 1 A 13 13 TRP H H 13 8.039 8.184 -0.145 1
1 58 . 8 1 1 A 13 13 TRP HA H 13 4.370 4.528 -0.158 1
1 67 . 8 1 1 A 13 13 TRP C C 13 177.857 176.510 1.347 1
1 68 . 8 1 1 A 13 13 TRP CA C 13 56.675 57.412 -0.737 1
1 69 . 8 1 1 A 13 13 TRP CB C 13 30.317 30.505 -0.188 1
1 75 . 8 1 1 A 13 13 TRP N N 13 124.264 127.114 -2.850 1
1 77 . 8 1 1 A 14 14 GLY H H 14 9.815 8.708 1.107 1
1 78 . 8 1 1 A 14 14 GLY HA2 H 14 4.370 4.207 0.163 1
1 79 . 8 1 1 A 14 14 GLY HA3 H 14 4.335 4.243 0.092 1
1 80 . 8 1 1 A 14 14 GLY C C 14 172.904 174.686 -1.782 1
1 81 . 8 1 1 A 14 14 GLY CA C 14 44.157 43.893 0.264 1
1 82 . 8 1 1 A 14 14 GLY N N 14 115.294 108.797 6.497 1
1 83 . 8 1 1 A 15 15 PRO HA H 15 4.327 4.392 -0.065 1
1 90 . 8 1 1 A 15 15 PRO C C 15 179.726 178.871 0.855 1
1 91 . 8 1 1 A 15 15 PRO CA C 15 65.171 65.248 -0.077 1
1 92 . 8 1 1 A 15 15 PRO CB C 15 31.829 31.946 -0.117 1
1 95 . 8 1 1 A 16 16 ALA H H 16 9.214 8.155 1.059 1
1 96 . 8 1 1 A 16 16 ALA HA H 16 4.166 4.117 0.049 1
1 100 . 8 1 1 A 16 16 ALA C C 16 181.184 179.688 1.496 1
1 101 . 8 1 1 A 16 16 ALA CA C 16 55.370 55.212 0.158 1
1 102 . 8 1 1 A 16 16 ALA CB C 16 18.058 18.729 -0.671 1
1 103 . 8 1 1 A 16 16 ALA N N 16 122.414 119.881 2.533 1
1 104 . 8 1 1 A 17 17 SER H H 17 7.985 8.214 -0.229 1
1 105 . 8 1 1 A 17 17 SER HA H 17 4.317 4.113 0.204 1
1 107 . 8 1 1 A 17 17 SER C C 17 175.381 176.707 -1.326 1
1 108 . 8 1 1 A 17 17 SER CA C 17 63.163 62.177 0.986 1
1 109 . 8 1 1 A 17 17 SER CB C 17 64.055 62.969 1.086 1
1 110 . 8 1 1 A 17 17 SER N N 17 116.568 114.239 2.329 1
1 111 . 8 1 1 A 18 18 GLN H H 18 8.316 7.875 0.441 1
1 112 . 8 1 1 A 18 18 GLN HA H 18 3.323 3.453 -0.130 1
1 119 . 8 1 1 A 18 18 GLN C C 18 176.812 178.587 -1.775 1
1 120 . 8 1 1 A 18 18 GLN CA C 18 60.025 59.287 0.738 1
1 121 . 8 1 1 A 18 18 GLN CB C 18 28.686 28.553 0.133 1
1 123 . 8 1 1 A 18 18 GLN N N 18 119.002 120.885 -1.883 1
1 125 . 8 1 1 A 19 19 GLN H H 19 7.582 8.254 -0.672 1
1 126 . 8 1 1 A 19 19 GLN HA H 19 4.062 4.102 -0.040 1
1 133 . 8 1 1 A 19 19 GLN C C 19 178.488 178.588 -0.100 1
1 134 . 8 1 1 A 19 19 GLN CA C 19 59.248 59.182 0.066 1
1 135 . 8 1 1 A 19 19 GLN CB C 19 28.203 28.285 -0.082 1
1 137 . 8 1 1 A 19 19 GLN N N 19 116.221 118.834 -2.613 1
1 139 . 8 1 1 A 20 20 ILE H H 20 7.246 7.973 -0.727 1
1 140 . 8 1 1 A 20 20 ILE HA H 20 3.570 3.609 -0.039 1
1 150 . 8 1 1 A 20 20 ILE C C 20 178.999 178.523 0.476 1
1 151 . 8 1 1 A 20 20 ILE CA C 20 64.996 65.536 -0.540 1
1 152 . 8 1 1 A 20 20 ILE CB C 20 38.139 37.668 0.471 1
1 156 . 8 1 1 A 20 20 ILE N N 20 120.521 120.829 -0.308 1
1 157 . 8 1 1 A 21 21 LEU H H 21 8.034 7.893 0.141 1
1 158 . 8 1 1 A 21 21 LEU HA H 21 3.491 3.558 -0.067 1
1 168 . 8 1 1 A 21 21 LEU C C 21 178.196 178.391 -0.195 1
1 169 . 8 1 1 A 21 21 LEU CA C 21 57.944 57.399 0.545 1
1 170 . 8 1 1 A 21 21 LEU CB C 21 37.864 40.342 -2.478 1
1 174 . 8 1 1 A 21 21 LEU N N 21 121.259 118.945 2.314 1
1 175 . 8 1 1 A 22 22 TYR H H 22 8.479 7.598 0.881 1
1 176 . 8 1 1 A 22 22 TYR HA H 22 4.224 4.257 -0.033 1
1 183 . 8 1 1 A 22 22 TYR C C 22 179.630 178.599 1.031 1
1 184 . 8 1 1 A 22 22 TYR CA C 22 62.422 60.722 1.700 1
1 185 . 8 1 1 A 22 22 TYR CB C 22 37.434 37.612 -0.178 1
1 190 . 8 1 1 A 22 22 TYR N N 22 117.805 118.868 -1.063 1
1 191 . 8 1 1 A 23 23 GLN H H 23 7.707 8.272 -0.565 1
1 192 . 8 1 1 A 23 23 GLN HA H 23 4.166 4.010 0.156 1
1 199 . 8 1 1 A 23 23 GLN C C 23 178.633 178.489 0.144 1
1 200 . 8 1 1 A 23 23 GLN CA C 23 58.789 59.186 -0.397 1
1 201 . 8 1 1 A 23 23 GLN CB C 23 28.534 28.087 0.447 1
1 203 . 8 1 1 A 23 23 GLN N N 23 117.580 118.348 -0.768 1
1 205 . 8 1 1 A 24 24 ALA H H 24 8.155 7.777 0.378 1
1 206 . 8 1 1 A 24 24 ALA HA H 24 4.187 4.195 -0.008 1
1 210 . 8 1 1 A 24 24 ALA C C 24 180.018 179.067 0.951 1
1 211 . 8 1 1 A 24 24 ALA CA C 24 55.228 55.183 0.045 1
1 212 . 8 1 1 A 24 24 ALA CB C 24 19.468 18.604 0.864 1
1 213 . 8 1 1 A 24 24 ALA N N 24 122.813 122.309 0.504 1
1 214 . 8 1 1 A 25 25 TYR H H 25 8.995 8.588 0.407 1
1 215 . 8 1 1 A 25 25 TYR HA H 25 4.348 4.766 -0.418 1
1 222 . 8 1 1 A 25 25 TYR C C 25 175.792 177.810 -2.018 1
1 223 . 8 1 1 A 25 25 TYR CA C 25 61.681 61.884 -0.203 1
1 224 . 8 1 1 A 25 25 TYR CB C 25 38.175 38.709 -0.534 1
1 229 . 8 1 1 A 25 25 TYR N N 25 121.343 120.047 1.296 1
1 230 . 8 1 1 A 26 26 ASP H H 26 7.260 8.766 -1.506 1
1 231 . 8 1 1 A 26 26 ASP HA H 26 4.373 4.497 -0.124 1
1 234 . 8 1 1 A 26 26 ASP C C 26 177.322 177.891 -0.569 1
1 235 . 8 1 1 A 26 26 ASP CA C 26 56.603 57.198 -0.595 1
1 236 . 8 1 1 A 26 26 ASP CB C 26 41.060 41.313 -0.253 1
1 237 . 8 1 1 A 26 26 ASP N N 26 114.020 119.584 -5.564 1
1 238 . 8 1 1 A 27 27 ARG H H 27 7.343 7.733 -0.390 1
1 239 . 8 1 1 A 27 27 ARG HA H 27 4.302 4.358 -0.056 1
1 246 . 8 1 1 A 27 27 ARG C C 27 176.546 176.401 0.145 1
1 247 . 8 1 1 A 27 27 ARG CA C 27 57.563 57.581 -0.018 1
1 248 . 8 1 1 A 27 27 ARG CB C 27 31.500 31.537 -0.037 1
1 251 . 8 1 1 A 27 27 ARG N N 27 116.729 116.751 -0.022 1
1 252 . 8 1 1 A 28 28 GLN H H 28 8.306 7.982 0.324 1
1 253 . 8 1 1 A 28 28 GLN HA H 28 4.396 4.700 -0.304 1
1 260 . 8 1 1 A 28 28 GLN C C 28 172.831 175.184 -2.353 1
1 261 . 8 1 1 A 28 28 GLN CA C 28 55.355 54.652 0.703 1
1 262 . 8 1 1 A 28 28 GLN CB C 28 31.062 31.419 -0.357 1
1 264 . 8 1 1 A 28 28 GLN N N 28 121.612 118.378 3.234 1
1 266 . 8 1 1 A 29 29 LYS H H 29 8.354 8.489 -0.135 1
1 267 . 8 1 1 A 29 29 LYS HA H 29 4.099 3.601 0.498 1
1 276 . 8 1 1 A 29 29 LYS C C 29 176.084 176.468 -0.384 1
1 277 . 8 1 1 A 29 29 LYS CA C 29 57.873 57.715 0.158 1
1 278 . 8 1 1 A 29 29 LYS CB C 29 33.313 32.736 0.577 1
1 282 . 8 1 1 A 29 29 LYS N N 29 125.038 123.959 1.079 1
1 283 . 8 1 1 A 30 30 ASN H H 30 8.856 7.852 1.004 1
1 284 . 8 1 1 A 30 30 ASN HA H 30 4.958 5.073 -0.115 1
1 289 . 8 1 1 A 30 30 ASN C C 30 171.179 172.698 -1.519 1
1 290 . 8 1 1 A 30 30 ASN CA C 30 50.891 50.418 0.473 1
1 291 . 8 1 1 A 30 30 ASN CB C 30 39.907 39.212 0.695 1
1 292 . 8 1 1 A 30 30 ASN N N 30 115.764 117.473 -1.709 1
1 294 . 8 1 1 A 31 31 PRO HA H 31 4.299 4.463 -0.164 1
1 301 . 8 1 1 A 31 31 PRO C C 31 177.493 176.703 0.790 1
1 302 . 8 1 1 A 31 31 PRO CA C 31 62.489 62.588 -0.099 1
1 303 . 8 1 1 A 31 31 PRO CB C 31 31.216 31.767 -0.551 1
1 306 . 8 1 1 A 32 32 SER H H 32 9.368 8.484 0.884 1
1 307 . 8 1 1 A 32 32 SER HA H 32 4.372 4.762 -0.390 1
1 310 . 8 1 1 A 32 32 SER C C 32 174.821 175.814 -0.993 1
1 311 . 8 1 1 A 32 32 SER CA C 32 57.203 57.811 -0.608 1
1 312 . 8 1 1 A 32 32 SER CB C 32 65.594 64.500 1.094 1
1 313 . 8 1 1 A 32 32 SER N N 32 120.847 117.580 3.267 1
1 314 . 8 1 1 A 33 33 LYS H H 33 9.152 8.973 0.179 1
1 315 . 8 1 1 A 33 33 LYS HA H 33 3.719 3.927 -0.208 1
1 324 . 8 1 1 A 33 33 LYS C C 33 177.833 178.258 -0.425 1
1 325 . 8 1 1 A 33 33 LYS CA C 33 61.188 60.207 0.981 1
1 326 . 8 1 1 A 33 33 LYS CB C 33 32.572 32.157 0.415 1
1 330 . 8 1 1 A 33 33 LYS N N 33 122.966 124.608 -1.642 1
1 331 . 8 1 1 A 34 34 GLU H H 34 8.902 8.266 0.636 1
1 332 . 8 1 1 A 34 34 GLU HA H 34 4.089 4.068 0.021 1
1 337 . 8 1 1 A 34 34 GLU C C 34 180.286 179.324 0.962 1
1 338 . 8 1 1 A 34 34 GLU CA C 34 60.483 59.345 1.138 1
1 339 . 8 1 1 A 34 34 GLU CB C 34 28.835 29.404 -0.569 1
1 341 . 8 1 1 A 34 34 GLU N N 34 117.645 118.806 -1.161 1
1 342 . 8 1 1 A 35 35 GLU H H 35 7.673 8.145 -0.472 1
1 343 . 8 1 1 A 35 35 GLU HA H 35 4.023 3.950 0.073 1
1 348 . 8 1 1 A 35 35 GLU C C 35 180.237 179.294 0.943 1
1 349 . 8 1 1 A 35 35 GLU CA C 35 59.214 59.284 -0.070 1
1 350 . 8 1 1 A 35 35 GLU CB C 35 30.099 29.299 0.800 1
1 352 . 8 1 1 A 35 35 GLU N N 35 121.077 120.061 1.016 1
1 353 . 8 1 1 A 36 36 ARG H H 36 8.932 8.318 0.614 1
1 354 . 8 1 1 A 36 36 ARG HA H 36 3.928 3.761 0.167 1
1 362 . 8 1 1 A 36 36 ARG C C 36 178.464 179.142 -0.678 1
1 363 . 8 1 1 A 36 36 ARG CA C 36 60.974 60.103 0.871 1
1 364 . 8 1 1 A 36 36 ARG CB C 36 31.171 29.919 1.252 1
1 367 . 8 1 1 A 36 36 ARG N N 36 119.441 120.025 -0.584 1
1 369 . 8 1 1 A 37 37 GLU H H 37 8.756 8.272 0.484 1
1 370 . 8 1 1 A 37 37 GLU HA H 37 3.948 4.104 -0.156 1
1 375 . 8 1 1 A 37 37 GLU C C 37 179.606 178.684 0.922 1
1 376 . 8 1 1 A 37 37 GLU CA C 37 60.094 59.022 1.072 1
1 377 . 8 1 1 A 37 37 GLU CB C 37 29.110 29.410 -0.300 1
1 379 . 8 1 1 A 37 37 GLU N N 37 119.017 119.557 -0.540 1
1 380 . 8 1 1 A 38 38 ALA H H 38 7.733 7.970 -0.237 1
1 381 . 8 1 1 A 38 38 ALA HA H 38 4.325 4.096 0.229 1
1 385 . 8 1 1 A 38 38 ALA C C 38 180.820 178.480 2.340 1
1 386 . 8 1 1 A 38 38 ALA CA C 38 55.194 54.538 0.656 1
1 387 . 8 1 1 A 38 38 ALA CB C 38 17.654 18.518 -0.864 1
1 388 . 8 1 1 A 38 38 ALA N N 38 122.889 122.090 0.799 1
1 389 . 8 1 1 A 39 39 LEU H H 39 7.740 7.856 -0.116 1
1 390 . 8 1 1 A 39 39 LEU HA H 39 4.176 4.253 -0.077 1
1 400 . 8 1 1 A 39 39 LEU C C 39 179.266 178.812 0.454 1
1 401 . 8 1 1 A 39 39 LEU CA C 39 57.944 56.235 1.709 1
1 402 . 8 1 1 A 39 39 LEU CB C 39 42.105 42.244 -0.139 1
1 406 . 8 1 1 A 39 39 LEU N N 39 119.783 116.837 2.946 1
1 407 . 8 1 1 A 40 40 VAL H H 40 8.451 8.337 0.114 1
1 408 . 8 1 1 A 40 40 VAL HA H 40 3.259 3.616 -0.357 1
1 416 . 8 1 1 A 40 40 VAL C C 40 177.153 177.691 -0.538 1
1 417 . 8 1 1 A 40 40 VAL CA C 40 67.254 66.892 0.362 1
1 418 . 8 1 1 A 40 40 VAL CB C 40 31.747 31.414 0.333 1
1 421 . 8 1 1 A 40 40 VAL N N 40 121.481 120.042 1.439 1
1 422 . 8 1 1 A 41 41 GLU H H 41 7.254 8.167 -0.913 1
1 423 . 8 1 1 A 41 41 GLU HA H 41 4.159 4.105 0.054 1
1 428 . 8 1 1 A 41 41 GLU C C 41 179.483 178.902 0.581 1
1 429 . 8 1 1 A 41 41 GLU CA C 41 59.248 59.421 -0.173 1
1 430 . 8 1 1 A 41 41 GLU CB C 41 29.358 29.266 0.092 1
1 432 . 8 1 1 A 41 41 GLU N N 41 116.549 119.787 -3.238 1
1 433 . 8 1 1 A 42 42 GLU H H 42 8.103 8.222 -0.119 1
1 434 . 8 1 1 A 42 42 GLU HA H 42 4.020 4.041 -0.021 1
1 439 . 8 1 1 A 42 42 GLU C C 42 180.115 178.794 1.321 1
1 440 . 8 1 1 A 42 42 GLU CA C 42 59.847 59.507 0.340 1
1 441 . 8 1 1 A 42 42 GLU CB C 42 30.218 29.269 0.949 1
1 443 . 8 1 1 A 42 42 GLU N N 42 119.578 119.347 0.231 1
1 444 . 8 1 1 A 43 43 CYS H H 43 8.955 8.191 0.764 1
1 445 . 8 1 1 A 43 43 CYS HA H 43 4.153 4.236 -0.083 1
1 448 . 8 1 1 A 43 43 CYS C C 43 176.498 177.597 -1.099 1
1 449 . 8 1 1 A 43 43 CYS CA C 43 64.856 62.351 2.505 1
1 450 . 8 1 1 A 43 43 CYS CB C 43 27.390 27.726 -0.336 1
1 451 . 8 1 1 A 43 43 CYS N N 43 118.199 118.797 -0.598 1
1 452 . 8 1 1 A 44 44 ASN H H 44 8.543 7.965 0.578 1
1 453 . 8 1 1 A 44 44 ASN HA H 44 4.635 4.400 0.235 1
1 458 . 8 1 1 A 44 44 ASN C C 44 178.633 177.594 1.039 1
1 459 . 8 1 1 A 44 44 ASN CA C 44 56.603 56.438 0.165 1
1 460 . 8 1 1 A 44 44 ASN CB C 44 37.187 38.111 -0.924 1
1 461 . 8 1 1 A 44 44 ASN N N 44 117.002 119.592 -2.590 1
1 463 . 8 1 1 A 45 45 ARG H H 45 8.296 8.165 0.131 1
1 464 . 8 1 1 A 45 45 ARG HA H 45 3.977 4.023 -0.046 1
1 471 . 8 1 1 A 45 45 ARG C C 45 178.149 178.158 -0.009 1
1 472 . 8 1 1 A 45 45 ARG CA C 45 60.589 59.510 1.079 1
1 473 . 8 1 1 A 45 45 ARG CB C 45 30.099 30.040 0.059 1
1 476 . 8 1 1 A 45 45 ARG N N 45 121.021 121.101 -0.080 1
1 477 . 8 1 1 A 46 46 ALA H H 46 7.914 8.257 -0.343 1
1 478 . 8 1 1 A 46 46 ALA HA H 46 4.128 4.111 0.017 1
1 482 . 8 1 1 A 46 46 ALA C C 46 181.208 180.257 0.951 1
1 483 . 8 1 1 A 46 46 ALA CA C 46 55.264 54.912 0.352 1
1 484 . 8 1 1 A 46 46 ALA CB C 46 18.759 18.522 0.237 1
1 485 . 8 1 1 A 46 46 ALA N N 46 121.570 120.686 0.884 1
1 486 . 8 1 1 A 47 47 GLU H H 47 8.730 8.639 0.091 1
1 487 . 8 1 1 A 47 47 GLU HA H 47 4.194 4.045 0.149 1
1 492 . 8 1 1 A 47 47 GLU C C 47 180.115 179.216 0.899 1
1 493 . 8 1 1 A 47 47 GLU CA C 47 58.401 59.297 -0.896 1
1 494 . 8 1 1 A 47 47 GLU CB C 47 29.523 29.264 0.259 1
1 496 . 8 1 1 A 47 47 GLU N N 47 117.532 118.129 -0.597 1
1 497 . 8 1 1 A 48 48 CYS H H 48 8.283 7.832 0.451 1
1 498 . 8 1 1 A 48 48 CYS HA H 48 4.002 4.116 -0.114 1
1 501 . 8 1 1 A 48 48 CYS C C 48 177.031 177.436 -0.405 1
1 502 . 8 1 1 A 48 48 CYS CA C 48 64.749 63.986 0.763 1
1 503 . 8 1 1 A 48 48 CYS CB C 48 25.907 27.566 -1.659 1
1 504 . 8 1 1 A 48 48 CYS N N 48 118.282 119.139 -0.857 1
1 505 . 8 1 1 A 49 49 LEU H H 49 8.181 8.111 0.070 1
1 506 . 8 1 1 A 49 49 LEU HA H 49 4.175 3.899 0.276 1
1 516 . 8 1 1 A 49 49 LEU C C 49 180.430 178.812 1.618 1
1 517 . 8 1 1 A 49 49 LEU CA C 49 57.873 58.172 -0.299 1
1 518 . 8 1 1 A 49 49 LEU CB C 49 41.539 41.837 -0.298 1
1 522 . 8 1 1 A 49 49 LEU N N 49 120.371 120.566 -0.195 1
1 523 . 8 1 1 A 50 50 GLN H H 50 7.934 8.655 -0.721 1
1 524 . 8 1 1 A 50 50 GLN HA H 50 4.102 4.080 0.022 1
1 531 . 8 1 1 A 50 50 GLN C C 50 177.322 177.235 0.087 1
1 532 . 8 1 1 A 50 50 GLN CA C 50 58.156 58.649 -0.493 1
1 533 . 8 1 1 A 50 50 GLN CB C 50 28.616 28.617 -0.001 1
1 535 . 8 1 1 A 50 50 GLN N N 50 118.175 117.487 0.688 1
1 537 . 8 1 1 A 51 51 ARG H H 51 7.632 7.661 -0.029 1
1 538 . 8 1 1 A 51 51 ARG HA H 51 4.347 4.363 -0.016 1
1 545 . 8 1 1 A 51 51 ARG C C 51 176.546 176.459 0.087 1
1 546 . 8 1 1 A 51 51 ARG CA C 51 56.286 55.888 0.398 1
1 547 . 8 1 1 A 51 51 ARG CB C 51 31.314 30.116 1.198 1
1 550 . 8 1 1 A 51 51 ARG N N 51 116.454 117.856 -1.402 1
1 551 . 8 1 1 A 52 52 GLY H H 52 7.949 8.357 -0.408 1
1 552 . 8 1 1 A 52 52 GLY HA2 H 52 4.033 3.970 0.063 1
1 553 . 8 1 1 A 52 52 GLY HA3 H 52 3.903 3.971 -0.068 1
1 554 . 8 1 1 A 52 52 GLY C C 52 174.385 174.209 0.176 1
1 555 . 8 1 1 A 52 52 GLY CA C 52 46.231 45.288 0.943 1
1 556 . 8 1 1 A 52 52 GLY N N 52 108.854 107.670 1.184 1
1 557 . 8 1 1 A 53 53 VAL H H 53 7.944 7.544 0.400 1
1 558 . 8 1 1 A 53 53 VAL HA H 53 4.250 4.065 0.185 1
1 566 . 8 1 1 A 53 53 VAL C C 53 175.525 175.082 0.443 1
1 567 . 8 1 1 A 53 53 VAL CA C 53 60.377 62.517 -2.140 1
1 568 . 8 1 1 A 53 53 VAL CB C 53 34.283 32.849 1.434 1
1 571 . 8 1 1 A 53 53 VAL N N 53 118.316 120.840 -2.524 1
1 572 . 8 1 1 A 54 54 SER H H 54 8.502 8.500 0.002 1
1 573 . 8 1 1 A 54 54 SER HA H 54 4.625 4.922 -0.297 1
1 576 . 8 1 1 A 54 54 SER C C 54 174.603 174.039 0.564 1
1 577 . 8 1 1 A 54 54 SER CA C 54 56.092 54.193 1.899 1
1 578 . 8 1 1 A 54 54 SER CB C 54 63.697 63.713 -0.016 1
1 579 . 8 1 1 A 54 54 SER N N 54 120.337 118.236 2.101 1
1 580 . 8 1 1 A 55 55 PRO HA H 55 4.624 4.523 0.101 1
1 587 . 8 1 1 A 55 55 PRO C C 55 177.322 177.693 -0.371 1
1 588 . 8 1 1 A 55 55 PRO CA C 55 64.431 64.206 0.225 1
1 589 . 8 1 1 A 55 55 PRO CB C 55 31.913 31.698 0.215 1
1 592 . 8 1 1 A 56 56 SER H H 56 7.931 8.298 -0.367 1
1 593 . 8 1 1 A 56 56 SER HA H 56 4.428 4.572 -0.144 1
1 596 . 8 1 1 A 56 56 SER C C 56 174.749 175.141 -0.392 1
1 597 . 8 1 1 A 56 56 SER CA C 56 59.130 59.368 -0.238 1
1 598 . 8 1 1 A 56 56 SER CB C 56 63.056 63.942 -0.886 1
1 599 . 8 1 1 A 56 56 SER N N 56 112.637 113.437 -0.800 1
1 600 . 8 1 1 A 57 57 LYS H H 57 8.121 7.628 0.493 1
1 601 . 8 1 1 A 57 57 LYS HA H 57 4.467 4.822 -0.355 1
1 609 . 8 1 1 A 57 57 LYS C C 57 176.570 176.145 0.425 1
1 610 . 8 1 1 A 57 57 LYS CA C 57 55.264 55.033 0.231 1
1 611 . 8 1 1 A 57 57 LYS CB C 57 32.160 32.561 -0.401 1
1 615 . 8 1 1 A 57 57 LYS N N 57 123.185 117.886 5.299 1
1 616 . 8 1 1 A 58 58 ALA H H 58 7.886 7.944 -0.058 1
1 617 . 8 1 1 A 58 58 ALA HA H 58 3.923 3.858 0.065 1
1 621 . 8 1 1 A 58 58 ALA C C 58 177.469 179.618 -2.149 1
1 622 . 8 1 1 A 58 58 ALA CA C 58 54.276 54.859 -0.583 1
1 623 . 8 1 1 A 58 58 ALA CB C 58 18.271 18.497 -0.226 1
1 624 . 8 1 1 A 58 58 ALA N N 58 123.941 122.701 1.240 1
1 625 . 8 1 1 A 59 59 HIS H H 59 8.077 8.086 -0.009 1
1 626 . 8 1 1 A 59 59 HIS HA H 59 4.420 4.396 0.024 1
1 631 . 8 1 1 A 59 59 HIS C C 59 177.542 177.539 0.003 1
1 632 . 8 1 1 A 59 59 HIS CA C 59 57.767 58.558 -0.791 1
1 633 . 8 1 1 A 59 59 HIS CB C 59 29.852 28.674 1.178 1
1 636 . 8 1 1 A 59 59 HIS N N 59 115.566 115.498 0.068 1
1 637 . 8 1 1 A 60 60 GLY H H 60 8.110 7.751 0.359 1
1 638 . 8 1 1 A 60 60 GLY HA2 H 60 3.873 3.439 0.434 1
1 639 . 8 1 1 A 60 60 GLY HA3 H 60 4.025 3.551 0.474 1
1 640 . 8 1 1 A 60 60 GLY C C 60 174.918 175.727 -0.809 1
1 641 . 8 1 1 A 60 60 GLY CA C 60 45.559 46.961 -1.402 1
1 642 . 8 1 1 A 60 60 GLY N N 60 109.216 110.332 -1.116 1
1 643 . 8 1 1 A 61 61 LEU H H 61 8.280 8.378 -0.098 1
1 644 . 8 1 1 A 61 61 LEU HA H 61 4.198 3.948 0.250 1
1 654 . 8 1 1 A 61 61 LEU C C 61 178.900 177.371 1.529 1
1 655 . 8 1 1 A 61 61 LEU CA C 61 55.758 57.953 -2.195 1
1 656 . 8 1 1 A 61 61 LEU CB C 61 42.544 41.843 0.701 1
1 660 . 8 1 1 A 61 61 LEU N N 61 120.521 123.209 -2.688 1
1 661 . 8 1 1 A 62 62 GLY H H 62 8.184 8.058 0.126 1
1 662 . 8 1 1 A 62 62 GLY HA2 H 62 3.978 3.815 0.163 1
1 663 . 8 1 1 A 62 62 GLY HA3 H 62 3.817 3.822 -0.005 1
1 664 . 8 1 1 A 62 62 GLY C C 62 176.012 175.256 0.756 1
1 665 . 8 1 1 A 62 62 GLY CA C 62 46.767 47.306 -0.539 1
1 666 . 8 1 1 A 62 62 GLY N N 62 108.987 108.441 0.546 1
1 667 . 8 1 1 A 63 63 SER HA H 63 4.322 4.250 0.072 1
1 670 . 8 1 1 A 63 63 SER C C 63 174.167 175.605 -1.438 1
1 671 . 8 1 1 A 63 63 SER CA C 63 59.919 62.267 -2.348 1
1 672 . 8 1 1 A 63 63 SER CB C 63 63.312 63.134 0.178 1
1 673 . 8 1 1 A 64 64 ASN H H 64 8.087 7.956 0.131 1
1 674 . 8 1 1 A 64 64 ASN HA H 64 4.850 5.125 -0.275 1
1 679 . 8 1 1 A 64 64 ASN C C 64 173.899 175.040 -1.141 1
1 680 . 8 1 1 A 64 64 ASN CA C 64 53.218 52.647 0.571 1
1 681 . 8 1 1 A 64 64 ASN CB C 64 39.164 38.883 0.281 1
1 682 . 8 1 1 A 64 64 ASN N N 64 118.041 116.998 1.043 1
1 684 . 8 1 1 A 65 65 LEU H H 65 7.293 7.204 0.089 1
1 685 . 8 1 1 A 65 65 LEU HA H 65 3.995 4.805 -0.810 1
1 695 . 8 1 1 A 65 65 LEU C C 65 175.696 175.013 0.683 1
1 696 . 8 1 1 A 65 65 LEU CA C 65 56.005 54.154 1.851 1
1 697 . 8 1 1 A 65 65 LEU CB C 65 43.120 44.096 -0.976 1
1 701 . 8 1 1 A 65 65 LEU N N 65 120.953 121.537 -0.584 1
1 702 . 8 1 1 A 66 66 VAL H H 66 9.517 8.843 0.674 1
1 703 . 8 1 1 A 66 66 VAL HA H 66 3.481 4.258 -0.777 1
1 711 . 8 1 1 A 66 66 VAL C C 66 175.429 174.988 0.441 1
1 712 . 8 1 1 A 66 66 VAL CA C 66 65.243 61.285 3.958 1
1 713 . 8 1 1 A 66 66 VAL CB C 66 31.335 33.243 -1.908 1
1 716 . 8 1 1 A 66 66 VAL N N 66 127.924 126.479 1.445 1
1 717 . 8 1 1 A 67 67 THR H H 67 6.253 8.369 -2.116 1
1 718 . 8 1 1 A 67 67 THR HA H 67 4.779 4.668 0.111 1
1 723 . 8 1 1 A 67 67 THR C C 67 174.894 174.691 0.203 1
1 724 . 8 1 1 A 67 67 THR CA C 67 58.719 59.821 -1.102 1
1 725 . 8 1 1 A 67 67 THR CB C 67 72.153 71.096 1.057 1
1 727 . 8 1 1 A 67 67 THR N N 67 113.376 115.923 -2.547 1
1 728 . 8 1 1 A 68 68 GLU H H 68 9.348 8.864 0.484 1
1 729 . 8 1 1 A 68 68 GLU HA H 68 3.634 3.994 -0.360 1
1 734 . 8 1 1 A 68 68 GLU C C 68 177.809 178.331 -0.522 1
1 735 . 8 1 1 A 68 68 GLU CA C 68 61.505 60.110 1.395 1
1 736 . 8 1 1 A 68 68 GLU CB C 68 28.285 29.687 -1.402 1
1 738 . 8 1 1 A 68 68 GLU N N 68 124.534 122.176 2.358 1
1 739 . 8 1 1 A 69 69 VAL H H 69 8.126 8.002 0.124 1
1 740 . 8 1 1 A 69 69 VAL HA H 69 3.862 3.517 0.345 1
1 748 . 8 1 1 A 69 69 VAL C C 69 177.712 178.097 -0.385 1
1 749 . 8 1 1 A 69 69 VAL CA C 69 65.701 66.831 -1.130 1
1 750 . 8 1 1 A 69 69 VAL CB C 69 31.829 31.576 0.253 1
1 753 . 8 1 1 A 69 69 VAL N N 69 119.139 119.819 -0.680 1
1 754 . 8 1 1 A 70 70 ARG H H 70 7.235 8.207 -0.972 1
1 755 . 8 1 1 A 70 70 ARG HA H 70 4.265 4.015 0.250 1
1 762 . 8 1 1 A 70 70 ARG C C 70 180.430 179.508 0.922 1
1 763 . 8 1 1 A 70 70 ARG CA C 70 59.742 60.175 -0.433 1
1 764 . 8 1 1 A 70 70 ARG CB C 70 29.439 29.970 -0.531 1
1 767 . 8 1 1 A 70 70 ARG N N 70 119.541 119.203 0.338 1
1 768 . 8 1 1 A 71 71 VAL H H 71 8.144 8.144 0.000 1
1 769 . 8 1 1 A 71 71 VAL HA H 71 4.018 3.969 0.049 1
1 777 . 8 1 1 A 71 71 VAL C C 71 177.493 178.146 -0.653 1
1 778 . 8 1 1 A 71 71 VAL CA C 71 67.924 66.688 1.236 1
1 779 . 8 1 1 A 71 71 VAL CB C 71 32.289 31.685 0.604 1
1 782 . 8 1 1 A 71 71 VAL N N 71 120.755 120.241 0.514 1
1 783 . 8 1 1 A 72 72 TYR H H 72 9.411 8.534 0.877 1
1 784 . 8 1 1 A 72 72 TYR HA H 72 3.908 4.264 -0.356 1
1 791 . 8 1 1 A 72 72 TYR C C 72 178.464 178.152 0.312 1
1 792 . 8 1 1 A 72 72 TYR CA C 72 63.444 61.898 1.546 1
1 793 . 8 1 1 A 72 72 TYR CB C 72 38.211 39.008 -0.797 1
1 798 . 8 1 1 A 72 72 TYR N N 72 121.175 121.321 -0.146 1
1 799 . 8 1 1 A 73 73 ASN H H 73 8.816 8.725 0.091 1
1 800 . 8 1 1 A 73 73 ASN HA H 73 4.538 4.728 -0.190 1
1 805 . 8 1 1 A 73 73 ASN C C 73 176.958 178.137 -1.179 1
1 806 . 8 1 1 A 73 73 ASN CA C 73 56.109 56.740 -0.631 1
1 807 . 8 1 1 A 73 73 ASN CB C 73 38.422 38.663 -0.241 1
1 808 . 8 1 1 A 73 73 ASN N N 73 118.122 117.702 0.420 1
1 810 . 8 1 1 A 74 74 TRP H H 74 8.657 8.357 0.300 1
1 811 . 8 1 1 A 74 74 TRP HA H 74 4.111 4.512 -0.401 1
1 820 . 8 1 1 A 74 74 TRP C C 74 179.654 178.469 1.185 1
1 821 . 8 1 1 A 74 74 TRP CA C 74 62.950 61.532 1.418 1
1 822 . 8 1 1 A 74 74 TRP CB C 74 29.555 29.599 -0.044 1
1 828 . 8 1 1 A 74 74 TRP N N 74 123.988 123.121 0.867 1
1 830 . 8 1 1 A 75 75 PHE H H 75 8.562 8.277 0.285 1
1 831 . 8 1 1 A 75 75 PHE HA H 75 3.821 4.412 -0.591 1
1 839 . 8 1 1 A 75 75 PHE C C 75 177.614 178.044 -0.430 1
1 840 . 8 1 1 A 75 75 PHE CA C 75 63.374 62.067 1.307 1
1 841 . 8 1 1 A 75 75 PHE CB C 75 39.648 38.696 0.952 1
1 847 . 8 1 1 A 75 75 PHE N N 75 118.325 116.989 1.336 1
1 848 . 8 1 1 A 76 76 ALA H H 76 8.305 8.383 -0.078 1
1 849 . 8 1 1 A 76 76 ALA HA H 76 3.909 3.948 -0.039 1
1 853 . 8 1 1 A 76 76 ALA C C 76 180.868 179.602 1.266 1
1 854 . 8 1 1 A 76 76 ALA CA C 76 55.566 55.205 0.361 1
1 855 . 8 1 1 A 76 76 ALA CB C 76 17.820 18.153 -0.333 1
1 856 . 8 1 1 A 76 76 ALA N N 76 121.119 122.608 -1.489 1
1 857 . 8 1 1 A 77 77 ASN H H 77 8.335 8.287 0.048 1
1 858 . 8 1 1 A 77 77 ASN HA H 77 4.355 4.344 0.011 1
1 863 . 8 1 1 A 77 77 ASN C C 77 177.105 177.703 -0.598 1
1 864 . 8 1 1 A 77 77 ASN CA C 77 56.145 56.210 -0.065 1
1 865 . 8 1 1 A 77 77 ASN CB C 77 38.063 38.583 -0.520 1
1 866 . 8 1 1 A 77 77 ASN N N 77 117.433 116.674 0.759 1
1 868 . 8 1 1 A 78 78 ARG H H 78 7.664 7.304 0.360 1
1 869 . 8 1 1 A 78 78 ARG HA H 78 3.629 4.135 -0.506 1
1 876 . 8 1 1 A 78 78 ARG C C 78 179.216 177.925 1.291 1
1 877 . 8 1 1 A 78 78 ARG CA C 78 58.773 59.026 -0.253 1
1 878 . 8 1 1 A 78 78 ARG CB C 78 29.605 29.143 0.462 1
1 881 . 8 1 1 A 78 78 ARG N N 78 121.999 118.508 3.491 1
1 882 . 8 1 1 A 79 79 ARG H H 79 8.320 7.635 0.685 1
1 883 . 8 1 1 A 79 79 ARG HA H 79 4.307 4.303 0.004 1
1 890 . 8 1 1 A 79 79 ARG C C 79 180.406 178.477 1.929 1
1 891 . 8 1 1 A 79 79 ARG CA C 79 60.270 57.745 2.525 1
1 892 . 8 1 1 A 79 79 ARG CB C 79 31.335 30.748 0.587 1
1 895 . 8 1 1 A 79 79 ARG N N 79 118.139 117.591 0.548 1
1 896 . 8 1 1 A 80 80 LYS H H 80 7.759 8.213 -0.454 1
1 897 . 8 1 1 A 80 80 LYS HA H 80 4.052 4.207 -0.155 1
1 905 . 8 1 1 A 80 80 LYS C C 80 178.999 179.108 -0.109 1
1 906 . 8 1 1 A 80 80 LYS CA C 80 59.531 59.381 0.150 1
1 907 . 8 1 1 A 80 80 LYS CB C 80 32.374 32.351 0.023 1
1 911 . 8 1 1 A 80 80 LYS N N 80 120.899 119.248 1.651 1
1 912 . 8 1 1 A 81 81 GLU H H 81 8.041 8.748 -0.707 1
1 913 . 8 1 1 A 81 81 GLU HA H 81 4.044 4.190 -0.146 1
1 918 . 8 1 1 A 81 81 GLU C C 81 179.168 178.629 0.539 1
1 919 . 8 1 1 A 81 81 GLU CA C 81 59.036 59.601 -0.565 1
1 920 . 8 1 1 A 81 81 GLU CB C 81 29.561 29.172 0.389 1
1 922 . 8 1 1 A 81 81 GLU N N 81 120.193 118.811 1.382 1
1 923 . 8 1 1 A 82 82 GLU H H 82 8.131 8.538 -0.407 1
1 924 . 8 1 1 A 82 82 GLU HA H 82 4.017 4.082 -0.065 1
1 929 . 8 1 1 A 82 82 GLU C C 82 178.343 178.103 0.240 1
1 930 . 8 1 1 A 82 82 GLU CA C 82 59.319 59.181 0.138 1
1 931 . 8 1 1 A 82 82 GLU CB C 82 29.770 28.946 0.824 1
1 933 . 8 1 1 A 82 82 GLU N N 82 119.626 118.965 0.661 1
1 934 . 8 1 1 A 83 83 ALA H H 83 7.935 7.601 0.334 1
1 935 . 8 1 1 A 83 83 ALA HA H 83 4.180 4.269 -0.089 1
1 939 . 8 1 1 A 83 83 ALA C C 83 179.994 179.369 0.625 1
1 940 . 8 1 1 A 83 83 ALA CA C 83 54.629 53.656 0.973 1
1 941 . 8 1 1 A 83 83 ALA CB C 83 18.090 19.293 -1.203 1
1 942 . 8 1 1 A 83 83 ALA N N 83 121.476 121.838 -0.362 1
1 943 . 8 1 1 A 84 84 PHE H H 84 8.043 7.870 0.173 1
1 944 . 8 1 1 A 84 84 PHE HA H 84 4.420 4.063 0.357 1
1 952 . 8 1 1 A 84 84 PHE C C 84 177.250 177.068 0.182 1
1 953 . 8 1 1 A 84 84 PHE CA C 84 60.059 61.690 -1.631 1
1 954 . 8 1 1 A 84 84 PHE CB C 84 38.952 39.439 -0.487 1
1 960 . 8 1 1 A 84 84 PHE N N 84 119.074 120.188 -1.114 1
1 961 . 8 1 1 A 85 85 ARG H H 85 8.031 7.878 0.153 1
1 962 . 8 1 1 A 85 85 ARG HA H 85 3.992 4.099 -0.107 1
1 968 . 8 1 1 A 85 85 ARG C C 85 178.319 178.493 -0.174 1
1 969 . 8 1 1 A 85 85 ARG CA C 85 58.523 59.563 -1.040 1
1 970 . 8 1 1 A 85 85 ARG CB C 85 30.346 29.947 0.399 1
1 973 . 8 1 1 A 85 85 ARG N N 85 119.291 117.650 1.641 1
1 974 . 8 1 1 A 86 86 GLN H H 86 8.091 8.095 -0.004 1
1 975 . 8 1 1 A 86 86 GLN HA H 86 4.148 4.243 -0.095 1
1 982 . 8 1 1 A 86 86 GLN C C 86 177.105 178.383 -1.278 1
1 983 . 8 1 1 A 86 86 GLN CA C 86 57.556 57.986 -0.430 1
1 984 . 8 1 1 A 86 86 GLN CB C 86 28.855 29.207 -0.352 1
1 986 . 8 1 1 A 86 86 GLN N N 86 119.097 117.607 1.490 1
1 988 . 8 1 1 A 87 87 LYS H H 87 7.898 8.317 -0.419 1
1 989 . 8 1 1 A 87 87 LYS HA H 87 4.116 4.033 0.083 1
1 997 . 8 1 1 A 87 87 LYS C C 87 177.542 179.244 -1.702 1
1 998 . 8 1 1 A 87 87 LYS CA C 87 57.944 59.231 -1.287 1
1 999 . 8 1 1 A 87 87 LYS CB C 87 32.242 31.883 0.359 1
1 1003 . 8 1 1 A 87 87 LYS N N 87 120.968 122.239 -1.271 1
1 1004 . 8 1 1 A 88 88 LEU H H 88 7.903 8.132 -0.229 1
1 1005 . 8 1 1 A 88 88 LEU HA H 88 4.144 4.303 -0.159 1
1 1015 . 8 1 1 A 88 88 LEU C C 88 178.221 178.248 -0.027 1
1 1016 . 8 1 1 A 88 88 LEU CA C 88 56.145 57.060 -0.915 1
1 1017 . 8 1 1 A 88 88 LEU CB C 88 42.215 41.465 0.750 1
1 1021 . 8 1 1 A 88 88 LEU N N 88 120.558 117.371 3.187 1
1 1022 . 8 1 1 A 89 89 ALA H H 89 7.894 7.592 0.302 1
1 1023 . 8 1 1 A 89 89 ALA HA H 89 4.224 4.310 -0.086 1
1 1027 . 8 1 1 A 89 89 ALA C C 89 178.609 179.261 -0.652 1
1 1028 . 8 1 1 A 89 89 ALA CA C 89 53.392 54.074 -0.682 1
1 1029 . 8 1 1 A 89 89 ALA CB C 89 18.695 19.226 -0.531 1
1 1030 . 8 1 1 A 89 89 ALA N N 89 122.387 122.273 0.114 1
1 1031 . 8 1 1 A 90 90 MET H H 90 8.084 7.968 0.116 1
1 1032 . 8 1 1 A 90 90 MET HA H 90 4.356 4.109 0.247 1
1 1040 . 8 1 1 A 90 90 MET C C 90 176.982 176.385 0.597 1
1 1041 . 8 1 1 A 90 90 MET CA C 90 56.551 58.073 -1.522 1
1 1042 . 8 1 1 A 90 90 MET CB C 90 32.719 31.772 0.947 1
1 1045 . 8 1 1 A 90 90 MET N N 90 118.509 116.410 2.099 1
1 1046 . 8 1 1 A 91 91 ASP H H 91 8.261 7.430 0.831 1
1 1047 . 8 1 1 A 91 91 ASP HA H 91 4.524 4.574 -0.050 1
1 1050 . 8 1 1 A 91 91 ASP C C 91 176.643 176.205 0.438 1
1 1051 . 8 1 1 A 91 91 ASP CA C 91 54.981 54.061 0.920 1
1 1052 . 8 1 1 A 91 91 ASP CB C 91 40.870 42.007 -1.137 1
1 1053 . 8 1 1 A 91 91 ASP N N 91 120.771 118.904 1.867 1
1 1054 . 8 1 1 A 92 92 ALA H H 92 7.971 8.664 -0.693 1
1 1055 . 8 1 1 A 92 92 ALA HA H 92 4.200 4.203 -0.003 1
1 1059 . 8 1 1 A 92 92 ALA C C 92 177.929 177.025 0.904 1
1 1060 . 8 1 1 A 92 92 ALA CA C 92 53.184 53.748 -0.564 1
1 1061 . 8 1 1 A 92 92 ALA CB C 92 18.890 19.761 -0.871 1
1 1062 . 8 1 1 A 92 92 ALA N N 92 123.057 124.057 -1.000 1
1 1063 . 8 1 1 A 93 93 TYR H H 93 8.019 7.841 0.178 1
1 1064 . 8 1 1 A 93 93 TYR HA H 93 4.523 5.347 -0.824 1
1 1071 . 8 1 1 A 93 93 TYR C C 93 176.279 174.849 1.430 1
1 1072 . 8 1 1 A 93 93 TYR CA C 93 58.401 56.667 1.734 1
1 1073 . 8 1 1 A 93 93 TYR CB C 93 38.669 39.972 -1.303 1
1 1078 . 8 1 1 A 93 93 TYR N N 93 118.337 114.874 3.463 1
1 1079 . 8 1 1 A 94 94 SER H H 94 8.037 8.749 -0.712 1
1 1080 . 8 1 1 A 94 94 SER HA H 94 4.484 4.957 -0.473 1
1 1082 . 8 1 1 A 94 94 SER C C 94 174.554 172.658 1.896 1
1 1083 . 8 1 1 A 94 94 SER CA C 94 58.401 57.692 0.709 1
1 1084 . 8 1 1 A 94 94 SER CB C 94 63.806 67.672 -3.866 1
1 1085 . 8 1 1 A 94 94 SER N N 94 116.640 118.997 -2.357 1
1 1086 . 8 1 1 A 96 96 ASN HA H 96 4.770 4.867 -0.097 1
1 1091 . 8 1 1 A 96 96 ASN C C 96 175.161 174.924 0.237 1
1 1092 . 8 1 1 A 96 96 ASN CA C 96 53.395 53.551 -0.156 1
1 1093 . 8 1 1 A 96 96 ASN CB C 96 38.999 39.474 -0.475 1
1 1095 . 8 1 1 A 97 97 SER H H 97 8.230 8.525 -0.295 1
1 1096 . 8 1 1 A 97 97 SER HA H 97 4.481 5.033 -0.552 1
1 1099 . 8 1 1 A 97 97 SER C C 97 174.482 174.108 0.374 1
1 1100 . 8 1 1 A 97 97 SER CA C 97 58.300 56.136 2.164 1
1 1101 . 8 1 1 A 97 97 SER CB C 97 63.697 65.963 -2.266 1
1 1102 . 8 1 1 A 97 97 SER N N 97 115.866 115.742 0.124 1
1 1103 . 8 1 1 A 98 98 GLY H H 98 8.228 8.556 -0.328 1
1 1104 . 8 1 1 A 98 98 GLY HA2 H 98 4.098 4.022 0.076 1
1 1105 . 8 1 1 A 98 98 GLY HA3 H 98 4.098 4.026 0.072 1
1 1106 . 8 1 1 A 98 98 GLY C C 98 171.788 173.023 -1.235 1
1 1107 . 8 1 1 A 98 98 GLY CA C 98 44.803 44.629 0.174 1
1 1108 . 8 1 1 A 98 98 GLY N N 98 110.658 112.921 -2.263 1
1 1109 . 8 1 1 A 99 99 PRO HA H 99 4.463 4.455 0.008 1
1 1116 . 8 1 1 A 99 99 PRO CA C 99 63.230 62.878 0.352 1
1 1117 . 8 1 1 A 99 99 PRO CB C 99 32.044 32.298 -0.254 1
1 1120 . 8 1 1 A 100 100 SER H H 100 8.514 8.483 0.031 1
1 1121 . 8 1 1 A 100 100 SER CA C 100 58.450 57.171 1.279 1
1 1122 . 8 1 1 A 100 100 SER CB C 100 63.889 64.707 -0.818 1
1 1 . 9 1 1 A 9 9 ASN H H 9 8.856 7.946 0.910 1
1 2 . 9 1 1 A 9 9 ASN HA H 9 4.694 5.268 -0.574 1
1 7 . 9 1 1 A 9 9 ASN CA C 9 53.401 51.154 2.247 1
1 8 . 9 1 1 A 9 9 ASN CB C 9 38.757 41.420 -2.663 1
1 10 . 9 1 1 A 10 10 ARG HA H 10 4.346 4.900 -0.554 1
1 17 . 9 1 1 A 10 10 ARG C C 10 175.405 175.669 -0.264 1
1 18 . 9 1 1 A 10 10 ARG CA C 10 56.181 54.778 1.403 1
1 19 . 9 1 1 A 10 10 ARG CB C 10 31.171 31.605 -0.434 1
1 22 . 9 1 1 A 11 11 PHE H H 11 8.310 8.999 -0.689 1
1 23 . 9 1 1 A 11 11 PHE HA H 11 4.291 4.437 -0.146 1
1 31 . 9 1 1 A 11 11 PHE C C 11 174.458 174.650 -0.192 1
1 32 . 9 1 1 A 11 11 PHE CA C 11 58.967 59.603 -0.636 1
1 33 . 9 1 1 A 11 11 PHE CB C 11 40.138 39.586 0.552 1
1 39 . 9 1 1 A 11 11 PHE N N 11 123.604 126.629 -3.025 1
1 40 . 9 1 1 A 12 12 LYS H H 12 7.307 7.785 -0.478 1
1 41 . 9 1 1 A 12 12 LYS HA H 12 4.165 4.454 -0.289 1
1 50 . 9 1 1 A 12 12 LYS C C 12 174.385 174.955 -0.570 1
1 51 . 9 1 1 A 12 12 LYS CA C 12 54.593 53.930 0.663 1
1 52 . 9 1 1 A 12 12 LYS CB C 12 34.712 36.042 -1.330 1
1 56 . 9 1 1 A 12 12 LYS N N 12 127.282 125.778 1.504 1
1 57 . 9 1 1 A 13 13 TRP H H 13 8.039 8.440 -0.401 1
1 58 . 9 1 1 A 13 13 TRP HA H 13 4.370 4.592 -0.222 1
1 67 . 9 1 1 A 13 13 TRP C C 13 177.857 177.042 0.815 1
1 68 . 9 1 1 A 13 13 TRP CA C 13 56.675 57.274 -0.599 1
1 69 . 9 1 1 A 13 13 TRP CB C 13 30.317 30.137 0.180 1
1 75 . 9 1 1 A 13 13 TRP N N 13 124.264 127.830 -3.566 1
1 77 . 9 1 1 A 14 14 GLY H H 14 9.815 8.724 1.091 1
1 78 . 9 1 1 A 14 14 GLY HA2 H 14 4.370 4.131 0.239 1
1 79 . 9 1 1 A 14 14 GLY HA3 H 14 4.335 4.164 0.171 1
1 80 . 9 1 1 A 14 14 GLY C C 14 172.904 174.782 -1.878 1
1 81 . 9 1 1 A 14 14 GLY CA C 14 44.157 44.219 -0.062 1
1 82 . 9 1 1 A 14 14 GLY N N 14 115.294 110.430 4.864 1
1 83 . 9 1 1 A 15 15 PRO HA H 15 4.327 4.421 -0.094 1
1 90 . 9 1 1 A 15 15 PRO C C 15 179.726 178.606 1.120 1
1 91 . 9 1 1 A 15 15 PRO CA C 15 65.171 65.197 -0.026 1
1 92 . 9 1 1 A 15 15 PRO CB C 15 31.829 31.959 -0.130 1
1 95 . 9 1 1 A 16 16 ALA H H 16 9.214 8.117 1.097 1
1 96 . 9 1 1 A 16 16 ALA HA H 16 4.166 4.143 0.023 1
1 100 . 9 1 1 A 16 16 ALA C C 16 181.184 179.845 1.339 1
1 101 . 9 1 1 A 16 16 ALA CA C 16 55.370 55.182 0.188 1
1 102 . 9 1 1 A 16 16 ALA CB C 16 18.058 18.773 -0.715 1
1 103 . 9 1 1 A 16 16 ALA N N 16 122.414 119.940 2.474 1
1 104 . 9 1 1 A 17 17 SER H H 17 7.985 8.140 -0.155 1
1 105 . 9 1 1 A 17 17 SER HA H 17 4.317 4.144 0.173 1
1 107 . 9 1 1 A 17 17 SER C C 17 175.381 176.967 -1.586 1
1 108 . 9 1 1 A 17 17 SER CA C 17 63.163 62.264 0.899 1
1 109 . 9 1 1 A 17 17 SER CB C 17 64.055 63.049 1.006 1
1 110 . 9 1 1 A 17 17 SER N N 17 116.568 114.228 2.340 1
1 111 . 9 1 1 A 18 18 GLN H H 18 8.316 7.916 0.400 1
1 112 . 9 1 1 A 18 18 GLN HA H 18 3.323 3.541 -0.218 1
1 119 . 9 1 1 A 18 18 GLN C C 18 176.812 178.633 -1.821 1
1 120 . 9 1 1 A 18 18 GLN CA C 18 60.025 59.334 0.691 1
1 121 . 9 1 1 A 18 18 GLN CB C 18 28.686 28.503 0.183 1
1 123 . 9 1 1 A 18 18 GLN N N 18 119.002 120.936 -1.934 1
1 125 . 9 1 1 A 19 19 GLN H H 19 7.582 8.227 -0.645 1
1 126 . 9 1 1 A 19 19 GLN HA H 19 4.062 4.115 -0.053 1
1 133 . 9 1 1 A 19 19 GLN C C 19 178.488 178.497 -0.009 1
1 134 . 9 1 1 A 19 19 GLN CA C 19 59.248 59.312 -0.064 1
1 135 . 9 1 1 A 19 19 GLN CB C 19 28.203 28.187 0.016 1
1 137 . 9 1 1 A 19 19 GLN N N 19 116.221 118.688 -2.467 1
1 139 . 9 1 1 A 20 20 ILE H H 20 7.246 7.946 -0.700 1
1 140 . 9 1 1 A 20 20 ILE HA H 20 3.570 3.628 -0.058 1
1 150 . 9 1 1 A 20 20 ILE C C 20 178.999 178.528 0.471 1
1 151 . 9 1 1 A 20 20 ILE CA C 20 64.996 65.701 -0.705 1
1 152 . 9 1 1 A 20 20 ILE CB C 20 38.139 37.843 0.296 1
1 156 . 9 1 1 A 20 20 ILE N N 20 120.521 121.081 -0.560 1
1 157 . 9 1 1 A 21 21 LEU H H 21 8.034 7.816 0.218 1
1 158 . 9 1 1 A 21 21 LEU HA H 21 3.491 3.544 -0.053 1
1 168 . 9 1 1 A 21 21 LEU C C 21 178.196 178.478 -0.282 1
1 169 . 9 1 1 A 21 21 LEU CA C 21 57.944 57.450 0.494 1
1 170 . 9 1 1 A 21 21 LEU CB C 21 37.864 40.361 -2.497 1
1 174 . 9 1 1 A 21 21 LEU N N 21 121.259 118.875 2.384 1
1 175 . 9 1 1 A 22 22 TYR H H 22 8.479 7.652 0.827 1
1 176 . 9 1 1 A 22 22 TYR HA H 22 4.224 4.260 -0.036 1
1 183 . 9 1 1 A 22 22 TYR C C 22 179.630 178.593 1.037 1
1 184 . 9 1 1 A 22 22 TYR CA C 22 62.422 60.780 1.642 1
1 185 . 9 1 1 A 22 22 TYR CB C 22 37.434 37.712 -0.278 1
1 190 . 9 1 1 A 22 22 TYR N N 22 117.805 118.717 -0.912 1
1 191 . 9 1 1 A 23 23 GLN H H 23 7.707 8.327 -0.620 1
1 192 . 9 1 1 A 23 23 GLN HA H 23 4.166 4.032 0.134 1
1 199 . 9 1 1 A 23 23 GLN C C 23 178.633 178.546 0.087 1
1 200 . 9 1 1 A 23 23 GLN CA C 23 58.789 59.173 -0.384 1
1 201 . 9 1 1 A 23 23 GLN CB C 23 28.534 28.102 0.432 1
1 203 . 9 1 1 A 23 23 GLN N N 23 117.580 118.337 -0.757 1
1 205 . 9 1 1 A 24 24 ALA H H 24 8.155 7.830 0.325 1
1 206 . 9 1 1 A 24 24 ALA HA H 24 4.187 4.174 0.013 1
1 210 . 9 1 1 A 24 24 ALA C C 24 180.018 179.025 0.993 1
1 211 . 9 1 1 A 24 24 ALA CA C 24 55.228 55.188 0.040 1
1 212 . 9 1 1 A 24 24 ALA CB C 24 19.468 18.701 0.767 1
1 213 . 9 1 1 A 24 24 ALA N N 24 122.813 122.412 0.401 1
1 214 . 9 1 1 A 25 25 TYR H H 25 8.995 8.604 0.391 1
1 215 . 9 1 1 A 25 25 TYR HA H 25 4.348 4.727 -0.379 1
1 222 . 9 1 1 A 25 25 TYR C C 25 175.792 177.332 -1.540 1
1 223 . 9 1 1 A 25 25 TYR CA C 25 61.681 62.188 -0.507 1
1 224 . 9 1 1 A 25 25 TYR CB C 25 38.175 38.625 -0.450 1
1 229 . 9 1 1 A 25 25 TYR N N 25 121.343 120.337 1.006 1
1 230 . 9 1 1 A 26 26 ASP H H 26 7.260 8.623 -1.363 1
1 231 . 9 1 1 A 26 26 ASP HA H 26 4.373 4.488 -0.115 1
1 234 . 9 1 1 A 26 26 ASP C C 26 177.322 178.168 -0.846 1
1 235 . 9 1 1 A 26 26 ASP CA C 26 56.603 57.467 -0.864 1
1 236 . 9 1 1 A 26 26 ASP CB C 26 41.060 41.668 -0.608 1
1 237 . 9 1 1 A 26 26 ASP N N 26 114.020 119.168 -5.148 1
1 238 . 9 1 1 A 27 27 ARG H H 27 7.343 7.786 -0.443 1
1 239 . 9 1 1 A 27 27 ARG HA H 27 4.302 4.362 -0.060 1
1 246 . 9 1 1 A 27 27 ARG C C 27 176.546 176.258 0.288 1
1 247 . 9 1 1 A 27 27 ARG CA C 27 57.563 57.668 -0.105 1
1 248 . 9 1 1 A 27 27 ARG CB C 27 31.500 31.377 0.123 1
1 251 . 9 1 1 A 27 27 ARG N N 27 116.729 117.001 -0.272 1
1 252 . 9 1 1 A 28 28 GLN H H 28 8.306 8.021 0.285 1
1 253 . 9 1 1 A 28 28 GLN HA H 28 4.396 4.656 -0.260 1
1 260 . 9 1 1 A 28 28 GLN C C 28 172.831 175.203 -2.372 1
1 261 . 9 1 1 A 28 28 GLN CA C 28 55.355 54.372 0.983 1
1 262 . 9 1 1 A 28 28 GLN CB C 28 31.062 31.791 -0.729 1
1 264 . 9 1 1 A 28 28 GLN N N 28 121.612 118.382 3.230 1
1 266 . 9 1 1 A 29 29 LYS H H 29 8.354 8.465 -0.111 1
1 267 . 9 1 1 A 29 29 LYS HA H 29 4.099 3.496 0.603 1
1 276 . 9 1 1 A 29 29 LYS C C 29 176.084 176.366 -0.282 1
1 277 . 9 1 1 A 29 29 LYS CA C 29 57.873 57.927 -0.054 1
1 278 . 9 1 1 A 29 29 LYS CB C 29 33.313 32.725 0.588 1
1 282 . 9 1 1 A 29 29 LYS N N 29 125.038 124.466 0.572 1
1 283 . 9 1 1 A 30 30 ASN H H 30 8.856 7.981 0.875 1
1 284 . 9 1 1 A 30 30 ASN HA H 30 4.958 5.076 -0.118 1
1 289 . 9 1 1 A 30 30 ASN C C 30 171.179 172.671 -1.492 1
1 290 . 9 1 1 A 30 30 ASN CA C 30 50.891 50.288 0.603 1
1 291 . 9 1 1 A 30 30 ASN CB C 30 39.907 39.144 0.763 1
1 292 . 9 1 1 A 30 30 ASN N N 30 115.764 117.781 -2.017 1
1 294 . 9 1 1 A 31 31 PRO HA H 31 4.299 4.455 -0.156 1
1 301 . 9 1 1 A 31 31 PRO C C 31 177.493 176.654 0.839 1
1 302 . 9 1 1 A 31 31 PRO CA C 31 62.489 62.583 -0.094 1
1 303 . 9 1 1 A 31 31 PRO CB C 31 31.216 31.628 -0.412 1
1 306 . 9 1 1 A 32 32 SER H H 32 9.368 8.505 0.863 1
1 307 . 9 1 1 A 32 32 SER HA H 32 4.372 4.765 -0.393 1
1 310 . 9 1 1 A 32 32 SER C C 32 174.821 175.801 -0.980 1
1 311 . 9 1 1 A 32 32 SER CA C 32 57.203 57.450 -0.247 1
1 312 . 9 1 1 A 32 32 SER CB C 32 65.594 64.744 0.850 1
1 313 . 9 1 1 A 32 32 SER N N 32 120.847 117.842 3.005 1
1 314 . 9 1 1 A 33 33 LYS H H 33 9.152 8.972 0.180 1
1 315 . 9 1 1 A 33 33 LYS HA H 33 3.719 3.888 -0.169 1
1 324 . 9 1 1 A 33 33 LYS C C 33 177.833 178.284 -0.451 1
1 325 . 9 1 1 A 33 33 LYS CA C 33 61.188 60.312 0.876 1
1 326 . 9 1 1 A 33 33 LYS CB C 33 32.572 32.400 0.172 1
1 330 . 9 1 1 A 33 33 LYS N N 33 122.966 124.759 -1.793 1
1 331 . 9 1 1 A 34 34 GLU H H 34 8.902 8.533 0.369 1
1 332 . 9 1 1 A 34 34 GLU HA H 34 4.089 4.024 0.065 1
1 337 . 9 1 1 A 34 34 GLU C C 34 180.286 179.208 1.078 1
1 338 . 9 1 1 A 34 34 GLU CA C 34 60.483 59.255 1.228 1
1 339 . 9 1 1 A 34 34 GLU CB C 34 28.835 29.191 -0.356 1
1 341 . 9 1 1 A 34 34 GLU N N 34 117.645 117.811 -0.166 1
1 342 . 9 1 1 A 35 35 GLU H H 35 7.673 8.149 -0.476 1
1 343 . 9 1 1 A 35 35 GLU HA H 35 4.023 3.938 0.085 1
1 348 . 9 1 1 A 35 35 GLU C C 35 180.237 179.257 0.980 1
1 349 . 9 1 1 A 35 35 GLU CA C 35 59.214 59.355 -0.141 1
1 350 . 9 1 1 A 35 35 GLU CB C 35 30.099 29.302 0.797 1
1 352 . 9 1 1 A 35 35 GLU N N 35 121.077 120.058 1.019 1
1 353 . 9 1 1 A 36 36 ARG H H 36 8.932 8.243 0.689 1
1 354 . 9 1 1 A 36 36 ARG HA H 36 3.928 3.811 0.117 1
1 362 . 9 1 1 A 36 36 ARG C C 36 178.464 179.112 -0.648 1
1 363 . 9 1 1 A 36 36 ARG CA C 36 60.974 59.989 0.985 1
1 364 . 9 1 1 A 36 36 ARG CB C 36 31.171 29.979 1.192 1
1 367 . 9 1 1 A 36 36 ARG N N 36 119.441 120.109 -0.668 1
1 369 . 9 1 1 A 37 37 GLU H H 37 8.756 8.366 0.390 1
1 370 . 9 1 1 A 37 37 GLU HA H 37 3.948 4.102 -0.154 1
1 375 . 9 1 1 A 37 37 GLU C C 37 179.606 178.560 1.046 1
1 376 . 9 1 1 A 37 37 GLU CA C 37 60.094 59.114 0.980 1
1 377 . 9 1 1 A 37 37 GLU CB C 37 29.110 29.333 -0.223 1
1 379 . 9 1 1 A 37 37 GLU N N 37 119.017 119.594 -0.577 1
1 380 . 9 1 1 A 38 38 ALA H H 38 7.733 8.047 -0.314 1
1 381 . 9 1 1 A 38 38 ALA HA H 38 4.325 4.092 0.233 1
1 385 . 9 1 1 A 38 38 ALA C C 38 180.820 178.657 2.163 1
1 386 . 9 1 1 A 38 38 ALA CA C 38 55.194 54.571 0.623 1
1 387 . 9 1 1 A 38 38 ALA CB C 38 17.654 18.531 -0.877 1
1 388 . 9 1 1 A 38 38 ALA N N 38 122.889 121.905 0.984 1
1 389 . 9 1 1 A 39 39 LEU H H 39 7.740 7.880 -0.140 1
1 390 . 9 1 1 A 39 39 LEU HA H 39 4.176 4.251 -0.075 1
1 400 . 9 1 1 A 39 39 LEU C C 39 179.266 178.827 0.439 1
1 401 . 9 1 1 A 39 39 LEU CA C 39 57.944 56.097 1.847 1
1 402 . 9 1 1 A 39 39 LEU CB C 39 42.105 42.331 -0.226 1
1 406 . 9 1 1 A 39 39 LEU N N 39 119.783 116.970 2.813 1
1 407 . 9 1 1 A 40 40 VAL H H 40 8.451 8.506 -0.055 1
1 408 . 9 1 1 A 40 40 VAL HA H 40 3.259 3.618 -0.359 1
1 416 . 9 1 1 A 40 40 VAL C C 40 177.153 177.749 -0.596 1
1 417 . 9 1 1 A 40 40 VAL CA C 40 67.254 66.927 0.327 1
1 418 . 9 1 1 A 40 40 VAL CB C 40 31.747 31.462 0.285 1
1 421 . 9 1 1 A 40 40 VAL N N 40 121.481 120.009 1.472 1
1 422 . 9 1 1 A 41 41 GLU H H 41 7.254 8.063 -0.809 1
1 423 . 9 1 1 A 41 41 GLU HA H 41 4.159 4.122 0.037 1
1 428 . 9 1 1 A 41 41 GLU C C 41 179.483 178.903 0.580 1
1 429 . 9 1 1 A 41 41 GLU CA C 41 59.248 59.416 -0.168 1
1 430 . 9 1 1 A 41 41 GLU CB C 41 29.358 29.328 0.030 1
1 432 . 9 1 1 A 41 41 GLU N N 41 116.549 119.812 -3.263 1
1 433 . 9 1 1 A 42 42 GLU H H 42 8.103 7.710 0.393 1
1 434 . 9 1 1 A 42 42 GLU HA H 42 4.020 4.051 -0.031 1
1 439 . 9 1 1 A 42 42 GLU C C 42 180.115 178.800 1.315 1
1 440 . 9 1 1 A 42 42 GLU CA C 42 59.847 59.519 0.328 1
1 441 . 9 1 1 A 42 42 GLU CB C 42 30.218 29.343 0.875 1
1 443 . 9 1 1 A 42 42 GLU N N 42 119.578 119.236 0.342 1
1 444 . 9 1 1 A 43 43 CYS H H 43 8.955 8.109 0.846 1
1 445 . 9 1 1 A 43 43 CYS HA H 43 4.153 4.254 -0.101 1
1 448 . 9 1 1 A 43 43 CYS C C 43 176.498 177.534 -1.036 1
1 449 . 9 1 1 A 43 43 CYS CA C 43 64.856 62.365 2.491 1
1 450 . 9 1 1 A 43 43 CYS CB C 43 27.390 27.762 -0.372 1
1 451 . 9 1 1 A 43 43 CYS N N 43 118.199 118.840 -0.641 1
1 452 . 9 1 1 A 44 44 ASN H H 44 8.543 7.946 0.597 1
1 453 . 9 1 1 A 44 44 ASN HA H 44 4.635 4.424 0.211 1
1 458 . 9 1 1 A 44 44 ASN C C 44 178.633 177.746 0.887 1
1 459 . 9 1 1 A 44 44 ASN CA C 44 56.603 56.230 0.373 1
1 460 . 9 1 1 A 44 44 ASN CB C 44 37.187 38.266 -1.079 1
1 461 . 9 1 1 A 44 44 ASN N N 44 117.002 119.532 -2.530 1
1 463 . 9 1 1 A 45 45 ARG H H 45 8.296 7.887 0.409 1
1 464 . 9 1 1 A 45 45 ARG HA H 45 3.977 4.059 -0.082 1
1 471 . 9 1 1 A 45 45 ARG C C 45 178.149 178.268 -0.119 1
1 472 . 9 1 1 A 45 45 ARG CA C 45 60.589 58.929 1.660 1
1 473 . 9 1 1 A 45 45 ARG CB C 45 30.099 30.271 -0.172 1
1 476 . 9 1 1 A 45 45 ARG N N 45 121.021 120.939 0.082 1
1 477 . 9 1 1 A 46 46 ALA H H 46 7.914 8.403 -0.489 1
1 478 . 9 1 1 A 46 46 ALA HA H 46 4.128 4.069 0.059 1
1 482 . 9 1 1 A 46 46 ALA C C 46 181.208 179.957 1.251 1
1 483 . 9 1 1 A 46 46 ALA CA C 46 55.264 54.967 0.297 1
1 484 . 9 1 1 A 46 46 ALA CB C 46 18.759 18.293 0.466 1
1 485 . 9 1 1 A 46 46 ALA N N 46 121.570 120.959 0.611 1
1 486 . 9 1 1 A 47 47 GLU H H 47 8.730 8.581 0.149 1
1 487 . 9 1 1 A 47 47 GLU HA H 47 4.194 4.052 0.142 1
1 492 . 9 1 1 A 47 47 GLU C C 47 180.115 179.040 1.075 1
1 493 . 9 1 1 A 47 47 GLU CA C 47 58.401 59.156 -0.755 1
1 494 . 9 1 1 A 47 47 GLU CB C 47 29.523 29.535 -0.012 1
1 496 . 9 1 1 A 47 47 GLU N N 47 117.532 117.928 -0.396 1
1 497 . 9 1 1 A 48 48 CYS H H 48 8.283 7.760 0.523 1
1 498 . 9 1 1 A 48 48 CYS HA H 48 4.002 4.132 -0.130 1
1 501 . 9 1 1 A 48 48 CYS C C 48 177.031 177.438 -0.407 1
1 502 . 9 1 1 A 48 48 CYS CA C 48 64.749 63.853 0.896 1
1 503 . 9 1 1 A 48 48 CYS CB C 48 25.907 27.274 -1.367 1
1 504 . 9 1 1 A 48 48 CYS N N 48 118.282 119.184 -0.902 1
1 505 . 9 1 1 A 49 49 LEU H H 49 8.181 8.024 0.157 1
1 506 . 9 1 1 A 49 49 LEU HA H 49 4.175 3.880 0.295 1
1 516 . 9 1 1 A 49 49 LEU C C 49 180.430 178.853 1.577 1
1 517 . 9 1 1 A 49 49 LEU CA C 49 57.873 58.189 -0.316 1
1 518 . 9 1 1 A 49 49 LEU CB C 49 41.539 41.780 -0.241 1
1 522 . 9 1 1 A 49 49 LEU N N 49 120.371 121.006 -0.635 1
1 523 . 9 1 1 A 50 50 GLN H H 50 7.934 8.563 -0.629 1
1 524 . 9 1 1 A 50 50 GLN HA H 50 4.102 4.070 0.032 1
1 531 . 9 1 1 A 50 50 GLN C C 50 177.322 177.235 0.087 1
1 532 . 9 1 1 A 50 50 GLN CA C 50 58.156 58.692 -0.536 1
1 533 . 9 1 1 A 50 50 GLN CB C 50 28.616 28.523 0.093 1
1 535 . 9 1 1 A 50 50 GLN N N 50 118.175 117.504 0.671 1
1 537 . 9 1 1 A 51 51 ARG H H 51 7.632 7.712 -0.080 1
1 538 . 9 1 1 A 51 51 ARG HA H 51 4.347 4.361 -0.014 1
1 545 . 9 1 1 A 51 51 ARG C C 51 176.546 176.456 0.090 1
1 546 . 9 1 1 A 51 51 ARG CA C 51 56.286 55.916 0.370 1
1 547 . 9 1 1 A 51 51 ARG CB C 51 31.314 30.154 1.160 1
1 550 . 9 1 1 A 51 51 ARG N N 51 116.454 117.855 -1.401 1
1 551 . 9 1 1 A 52 52 GLY H H 52 7.949 8.275 -0.326 1
1 552 . 9 1 1 A 52 52 GLY HA2 H 52 4.033 3.970 0.063 1
1 553 . 9 1 1 A 52 52 GLY HA3 H 52 3.903 3.971 -0.068 1
1 554 . 9 1 1 A 52 52 GLY C C 52 174.385 174.167 0.218 1
1 555 . 9 1 1 A 52 52 GLY CA C 52 46.231 45.287 0.944 1
1 556 . 9 1 1 A 52 52 GLY N N 52 108.854 107.673 1.181 1
1 557 . 9 1 1 A 53 53 VAL H H 53 7.944 7.511 0.433 1
1 558 . 9 1 1 A 53 53 VAL HA H 53 4.250 4.053 0.197 1
1 566 . 9 1 1 A 53 53 VAL C C 53 175.525 175.087 0.438 1
1 567 . 9 1 1 A 53 53 VAL CA C 53 60.377 62.517 -2.140 1
1 568 . 9 1 1 A 53 53 VAL CB C 53 34.283 32.850 1.433 1
1 571 . 9 1 1 A 53 53 VAL N N 53 118.316 120.830 -2.514 1
1 572 . 9 1 1 A 54 54 SER H H 54 8.502 8.504 -0.002 1
1 573 . 9 1 1 A 54 54 SER HA H 54 4.625 4.933 -0.308 1
1 576 . 9 1 1 A 54 54 SER C C 54 174.603 174.051 0.552 1
1 577 . 9 1 1 A 54 54 SER CA C 54 56.092 54.207 1.885 1
1 578 . 9 1 1 A 54 54 SER CB C 54 63.697 63.714 -0.017 1
1 579 . 9 1 1 A 54 54 SER N N 54 120.337 118.236 2.101 1
1 580 . 9 1 1 A 55 55 PRO HA H 55 4.624 4.532 0.092 1
1 587 . 9 1 1 A 55 55 PRO C C 55 177.322 177.517 -0.195 1
1 588 . 9 1 1 A 55 55 PRO CA C 55 64.431 64.185 0.246 1
1 589 . 9 1 1 A 55 55 PRO CB C 55 31.913 31.690 0.223 1
1 592 . 9 1 1 A 56 56 SER H H 56 7.931 8.317 -0.386 1
1 593 . 9 1 1 A 56 56 SER HA H 56 4.428 4.604 -0.176 1
1 596 . 9 1 1 A 56 56 SER C C 56 174.749 174.938 -0.189 1
1 597 . 9 1 1 A 56 56 SER CA C 56 59.130 59.350 -0.220 1
1 598 . 9 1 1 A 56 56 SER CB C 56 63.056 64.022 -0.966 1
1 599 . 9 1 1 A 56 56 SER N N 56 112.637 113.488 -0.851 1
1 600 . 9 1 1 A 57 57 LYS H H 57 8.121 7.688 0.433 1
1 601 . 9 1 1 A 57 57 LYS HA H 57 4.467 4.936 -0.469 1
1 609 . 9 1 1 A 57 57 LYS C C 57 176.570 176.258 0.312 1
1 610 . 9 1 1 A 57 57 LYS CA C 57 55.264 55.148 0.116 1
1 611 . 9 1 1 A 57 57 LYS CB C 57 32.160 32.807 -0.647 1
1 615 . 9 1 1 A 57 57 LYS N N 57 123.185 117.880 5.305 1
1 616 . 9 1 1 A 58 58 ALA H H 58 7.886 8.004 -0.118 1
1 617 . 9 1 1 A 58 58 ALA HA H 58 3.923 3.915 0.008 1
1 621 . 9 1 1 A 58 58 ALA C C 58 177.469 179.640 -2.171 1
1 622 . 9 1 1 A 58 58 ALA CA C 58 54.276 54.785 -0.509 1
1 623 . 9 1 1 A 58 58 ALA CB C 58 18.271 18.620 -0.349 1
1 624 . 9 1 1 A 58 58 ALA N N 58 123.941 122.787 1.154 1
1 625 . 9 1 1 A 59 59 HIS H H 59 8.077 8.085 -0.008 1
1 626 . 9 1 1 A 59 59 HIS HA H 59 4.420 4.431 -0.011 1
1 631 . 9 1 1 A 59 59 HIS C C 59 177.542 177.078 0.464 1
1 632 . 9 1 1 A 59 59 HIS CA C 59 57.767 58.430 -0.663 1
1 633 . 9 1 1 A 59 59 HIS CB C 59 29.852 28.591 1.261 1
1 636 . 9 1 1 A 59 59 HIS N N 59 115.566 115.854 -0.288 1
1 637 . 9 1 1 A 60 60 GLY H H 60 8.110 7.812 0.298 1
1 638 . 9 1 1 A 60 60 GLY HA2 H 60 3.873 3.446 0.427 1
1 639 . 9 1 1 A 60 60 GLY HA3 H 60 4.025 3.548 0.477 1
1 640 . 9 1 1 A 60 60 GLY C C 60 174.918 175.659 -0.741 1
1 641 . 9 1 1 A 60 60 GLY CA C 60 45.559 46.933 -1.374 1
1 642 . 9 1 1 A 60 60 GLY N N 60 109.216 109.626 -0.410 1
1 643 . 9 1 1 A 61 61 LEU H H 61 8.280 8.268 0.012 1
1 644 . 9 1 1 A 61 61 LEU HA H 61 4.198 3.931 0.267 1
1 654 . 9 1 1 A 61 61 LEU C C 61 178.900 177.544 1.356 1
1 655 . 9 1 1 A 61 61 LEU CA C 61 55.758 57.878 -2.120 1
1 656 . 9 1 1 A 61 61 LEU CB C 61 42.544 41.706 0.838 1
1 660 . 9 1 1 A 61 61 LEU N N 61 120.521 123.461 -2.940 1
1 661 . 9 1 1 A 62 62 GLY H H 62 8.184 8.066 0.118 1
1 662 . 9 1 1 A 62 62 GLY HA2 H 62 3.978 3.868 0.110 1
1 663 . 9 1 1 A 62 62 GLY HA3 H 62 3.817 3.872 -0.055 1
1 664 . 9 1 1 A 62 62 GLY C C 62 176.012 175.327 0.685 1
1 665 . 9 1 1 A 62 62 GLY CA C 62 46.767 47.289 -0.522 1
1 666 . 9 1 1 A 62 62 GLY N N 62 108.987 108.299 0.688 1
1 667 . 9 1 1 A 63 63 SER HA H 63 4.322 4.322 0.000 1
1 670 . 9 1 1 A 63 63 SER C C 63 174.167 175.091 -0.924 1
1 671 . 9 1 1 A 63 63 SER CA C 63 59.919 61.594 -1.675 1
1 672 . 9 1 1 A 63 63 SER CB C 63 63.312 62.857 0.455 1
1 673 . 9 1 1 A 64 64 ASN H H 64 8.087 8.440 -0.353 1
1 674 . 9 1 1 A 64 64 ASN HA H 64 4.850 5.174 -0.324 1
1 679 . 9 1 1 A 64 64 ASN C C 64 173.899 175.129 -1.230 1
1 680 . 9 1 1 A 64 64 ASN CA C 64 53.218 52.645 0.573 1
1 681 . 9 1 1 A 64 64 ASN CB C 64 39.164 38.656 0.508 1
1 682 . 9 1 1 A 64 64 ASN N N 64 118.041 117.645 0.396 1
1 684 . 9 1 1 A 65 65 LEU H H 65 7.293 7.489 -0.196 1
1 685 . 9 1 1 A 65 65 LEU HA H 65 3.995 4.657 -0.662 1
1 695 . 9 1 1 A 65 65 LEU C C 65 175.696 174.618 1.078 1
1 696 . 9 1 1 A 65 65 LEU CA C 65 56.005 54.483 1.522 1
1 697 . 9 1 1 A 65 65 LEU CB C 65 43.120 43.964 -0.844 1
1 701 . 9 1 1 A 65 65 LEU N N 65 120.953 121.719 -0.766 1
1 702 . 9 1 1 A 66 66 VAL H H 66 9.517 8.939 0.578 1
1 703 . 9 1 1 A 66 66 VAL HA H 66 3.481 4.279 -0.798 1
1 711 . 9 1 1 A 66 66 VAL C C 66 175.429 174.885 0.544 1
1 712 . 9 1 1 A 66 66 VAL CA C 66 65.243 61.093 4.150 1
1 713 . 9 1 1 A 66 66 VAL CB C 66 31.335 33.282 -1.947 1
1 716 . 9 1 1 A 66 66 VAL N N 66 127.924 125.946 1.978 1
1 717 . 9 1 1 A 67 67 THR H H 67 6.253 8.299 -2.046 1
1 718 . 9 1 1 A 67 67 THR HA H 67 4.779 4.707 0.072 1
1 723 . 9 1 1 A 67 67 THR C C 67 174.894 174.816 0.078 1
1 724 . 9 1 1 A 67 67 THR CA C 67 58.719 59.532 -0.813 1
1 725 . 9 1 1 A 67 67 THR CB C 67 72.153 71.735 0.418 1
1 727 . 9 1 1 A 67 67 THR N N 67 113.376 115.837 -2.461 1
1 728 . 9 1 1 A 68 68 GLU H H 68 9.348 8.865 0.483 1
1 729 . 9 1 1 A 68 68 GLU HA H 68 3.634 3.991 -0.357 1
1 734 . 9 1 1 A 68 68 GLU C C 68 177.809 178.335 -0.526 1
1 735 . 9 1 1 A 68 68 GLU CA C 68 61.505 60.106 1.399 1
1 736 . 9 1 1 A 68 68 GLU CB C 68 28.285 29.683 -1.398 1
1 738 . 9 1 1 A 68 68 GLU N N 68 124.534 122.153 2.381 1
1 739 . 9 1 1 A 69 69 VAL H H 69 8.126 7.992 0.134 1
1 740 . 9 1 1 A 69 69 VAL HA H 69 3.862 3.539 0.323 1
1 748 . 9 1 1 A 69 69 VAL C C 69 177.712 178.086 -0.374 1
1 749 . 9 1 1 A 69 69 VAL CA C 69 65.701 66.817 -1.116 1
1 750 . 9 1 1 A 69 69 VAL CB C 69 31.829 31.506 0.323 1
1 753 . 9 1 1 A 69 69 VAL N N 69 119.139 119.806 -0.667 1
1 754 . 9 1 1 A 70 70 ARG H H 70 7.235 7.838 -0.603 1
1 755 . 9 1 1 A 70 70 ARG HA H 70 4.265 4.043 0.222 1
1 762 . 9 1 1 A 70 70 ARG C C 70 180.430 179.440 0.990 1
1 763 . 9 1 1 A 70 70 ARG CA C 70 59.742 60.222 -0.480 1
1 764 . 9 1 1 A 70 70 ARG CB C 70 29.439 30.044 -0.605 1
1 767 . 9 1 1 A 70 70 ARG N N 70 119.541 119.451 0.090 1
1 768 . 9 1 1 A 71 71 VAL H H 71 8.144 8.050 0.094 1
1 769 . 9 1 1 A 71 71 VAL HA H 71 4.018 3.993 0.025 1
1 777 . 9 1 1 A 71 71 VAL C C 71 177.493 177.975 -0.482 1
1 778 . 9 1 1 A 71 71 VAL CA C 71 67.924 66.574 1.350 1
1 779 . 9 1 1 A 71 71 VAL CB C 71 32.289 31.884 0.405 1
1 782 . 9 1 1 A 71 71 VAL N N 71 120.755 120.101 0.654 1
1 783 . 9 1 1 A 72 72 TYR H H 72 9.411 8.507 0.904 1
1 784 . 9 1 1 A 72 72 TYR HA H 72 3.908 4.244 -0.336 1
1 791 . 9 1 1 A 72 72 TYR C C 72 178.464 178.045 0.419 1
1 792 . 9 1 1 A 72 72 TYR CA C 72 63.444 61.802 1.642 1
1 793 . 9 1 1 A 72 72 TYR CB C 72 38.211 38.887 -0.676 1
1 798 . 9 1 1 A 72 72 TYR N N 72 121.175 121.467 -0.292 1
1 799 . 9 1 1 A 73 73 ASN H H 73 8.816 8.607 0.209 1
1 800 . 9 1 1 A 73 73 ASN HA H 73 4.538 4.693 -0.155 1
1 805 . 9 1 1 A 73 73 ASN C C 73 176.958 178.093 -1.135 1
1 806 . 9 1 1 A 73 73 ASN CA C 73 56.109 56.684 -0.575 1
1 807 . 9 1 1 A 73 73 ASN CB C 73 38.422 38.495 -0.073 1
1 808 . 9 1 1 A 73 73 ASN N N 73 118.122 117.806 0.316 1
1 810 . 9 1 1 A 74 74 TRP H H 74 8.657 8.330 0.327 1
1 811 . 9 1 1 A 74 74 TRP HA H 74 4.111 4.512 -0.401 1
1 820 . 9 1 1 A 74 74 TRP C C 74 179.654 178.534 1.120 1
1 821 . 9 1 1 A 74 74 TRP CA C 74 62.950 61.352 1.598 1
1 822 . 9 1 1 A 74 74 TRP CB C 74 29.555 29.611 -0.056 1
1 828 . 9 1 1 A 74 74 TRP N N 74 123.988 122.944 1.044 1
1 830 . 9 1 1 A 75 75 PHE H H 75 8.562 8.513 0.049 1
1 831 . 9 1 1 A 75 75 PHE HA H 75 3.821 4.417 -0.596 1
1 839 . 9 1 1 A 75 75 PHE C C 75 177.614 178.061 -0.447 1
1 840 . 9 1 1 A 75 75 PHE CA C 75 63.374 62.076 1.298 1
1 841 . 9 1 1 A 75 75 PHE CB C 75 39.648 38.428 1.220 1
1 847 . 9 1 1 A 75 75 PHE N N 75 118.325 117.186 1.139 1
1 848 . 9 1 1 A 76 76 ALA H H 76 8.305 8.209 0.096 1
1 849 . 9 1 1 A 76 76 ALA HA H 76 3.909 3.913 -0.004 1
1 853 . 9 1 1 A 76 76 ALA C C 76 180.868 179.726 1.142 1
1 854 . 9 1 1 A 76 76 ALA CA C 76 55.566 55.235 0.331 1
1 855 . 9 1 1 A 76 76 ALA CB C 76 17.820 18.061 -0.241 1
1 856 . 9 1 1 A 76 76 ALA N N 76 121.119 122.440 -1.321 1
1 857 . 9 1 1 A 77 77 ASN H H 77 8.335 7.989 0.346 1
1 858 . 9 1 1 A 77 77 ASN HA H 77 4.355 4.356 -0.001 1
1 863 . 9 1 1 A 77 77 ASN C C 77 177.105 177.831 -0.726 1
1 864 . 9 1 1 A 77 77 ASN CA C 77 56.145 56.163 -0.018 1
1 865 . 9 1 1 A 77 77 ASN CB C 77 38.063 38.551 -0.488 1
1 866 . 9 1 1 A 77 77 ASN N N 77 117.433 116.375 1.058 1
1 868 . 9 1 1 A 78 78 ARG H H 78 7.664 7.130 0.534 1
1 869 . 9 1 1 A 78 78 ARG HA H 78 3.629 3.793 -0.164 1
1 876 . 9 1 1 A 78 78 ARG C C 78 179.216 177.590 1.626 1
1 877 . 9 1 1 A 78 78 ARG CA C 78 58.773 58.629 0.144 1
1 878 . 9 1 1 A 78 78 ARG CB C 78 29.605 29.276 0.329 1
1 881 . 9 1 1 A 78 78 ARG N N 78 121.999 118.494 3.505 1
1 882 . 9 1 1 A 79 79 ARG H H 79 8.320 7.629 0.691 1
1 883 . 9 1 1 A 79 79 ARG HA H 79 4.307 4.382 -0.075 1
1 890 . 9 1 1 A 79 79 ARG C C 79 180.406 177.929 2.477 1
1 891 . 9 1 1 A 79 79 ARG CA C 79 60.270 57.013 3.257 1
1 892 . 9 1 1 A 79 79 ARG CB C 79 31.335 30.836 0.499 1
1 895 . 9 1 1 A 79 79 ARG N N 79 118.139 117.674 0.465 1
1 896 . 9 1 1 A 80 80 LYS H H 80 7.759 8.020 -0.261 1
1 897 . 9 1 1 A 80 80 LYS HA H 80 4.052 4.128 -0.076 1
1 905 . 9 1 1 A 80 80 LYS C C 80 178.999 179.086 -0.087 1
1 906 . 9 1 1 A 80 80 LYS CA C 80 59.531 58.933 0.598 1
1 907 . 9 1 1 A 80 80 LYS CB C 80 32.374 32.291 0.083 1
1 911 . 9 1 1 A 80 80 LYS N N 80 120.899 118.628 2.271 1
1 912 . 9 1 1 A 81 81 GLU H H 81 8.041 8.111 -0.070 1
1 913 . 9 1 1 A 81 81 GLU HA H 81 4.044 4.209 -0.165 1
1 918 . 9 1 1 A 81 81 GLU C C 81 179.168 178.740 0.428 1
1 919 . 9 1 1 A 81 81 GLU CA C 81 59.036 59.595 -0.559 1
1 920 . 9 1 1 A 81 81 GLU CB C 81 29.561 29.186 0.375 1
1 922 . 9 1 1 A 81 81 GLU N N 81 120.193 118.266 1.927 1
1 923 . 9 1 1 A 82 82 GLU H H 82 8.131 8.480 -0.349 1
1 924 . 9 1 1 A 82 82 GLU HA H 82 4.017 4.055 -0.038 1
1 929 . 9 1 1 A 82 82 GLU C C 82 178.343 178.384 -0.041 1
1 930 . 9 1 1 A 82 82 GLU CA C 82 59.319 59.334 -0.015 1
1 931 . 9 1 1 A 82 82 GLU CB C 82 29.770 29.181 0.589 1
1 933 . 9 1 1 A 82 82 GLU N N 82 119.626 119.112 0.514 1
1 934 . 9 1 1 A 83 83 ALA H H 83 7.935 7.656 0.279 1
1 935 . 9 1 1 A 83 83 ALA HA H 83 4.180 4.168 0.012 1
1 939 . 9 1 1 A 83 83 ALA C C 83 179.994 179.515 0.479 1
1 940 . 9 1 1 A 83 83 ALA CA C 83 54.629 54.235 0.394 1
1 941 . 9 1 1 A 83 83 ALA CB C 83 18.090 18.971 -0.881 1
1 942 . 9 1 1 A 83 83 ALA N N 83 121.476 121.767 -0.291 1
1 943 . 9 1 1 A 84 84 PHE H H 84 8.043 8.333 -0.290 1
1 944 . 9 1 1 A 84 84 PHE HA H 84 4.420 4.070 0.350 1
1 952 . 9 1 1 A 84 84 PHE C C 84 177.250 177.104 0.146 1
1 953 . 9 1 1 A 84 84 PHE CA C 84 60.059 62.075 -2.016 1
1 954 . 9 1 1 A 84 84 PHE CB C 84 38.952 39.408 -0.456 1
1 960 . 9 1 1 A 84 84 PHE N N 84 119.074 120.469 -1.395 1
1 961 . 9 1 1 A 85 85 ARG H H 85 8.031 7.869 0.162 1
1 962 . 9 1 1 A 85 85 ARG HA H 85 3.992 4.111 -0.119 1
1 968 . 9 1 1 A 85 85 ARG C C 85 178.319 178.337 -0.018 1
1 969 . 9 1 1 A 85 85 ARG CA C 85 58.523 59.570 -1.047 1
1 970 . 9 1 1 A 85 85 ARG CB C 85 30.346 29.908 0.438 1
1 973 . 9 1 1 A 85 85 ARG N N 85 119.291 117.818 1.473 1
1 974 . 9 1 1 A 86 86 GLN H H 86 8.091 7.886 0.205 1
1 975 . 9 1 1 A 86 86 GLN HA H 86 4.148 4.262 -0.114 1
1 982 . 9 1 1 A 86 86 GLN C C 86 177.105 178.406 -1.301 1
1 983 . 9 1 1 A 86 86 GLN CA C 86 57.556 57.718 -0.162 1
1 984 . 9 1 1 A 86 86 GLN CB C 86 28.855 29.353 -0.498 1
1 986 . 9 1 1 A 86 86 GLN N N 86 119.097 117.629 1.468 1
1 988 . 9 1 1 A 87 87 LYS H H 87 7.898 8.229 -0.331 1
1 989 . 9 1 1 A 87 87 LYS HA H 87 4.116 4.148 -0.032 1
1 997 . 9 1 1 A 87 87 LYS C C 87 177.542 179.451 -1.909 1
1 998 . 9 1 1 A 87 87 LYS CA C 87 57.944 59.135 -1.191 1
1 999 . 9 1 1 A 87 87 LYS CB C 87 32.242 32.233 0.009 1
1 1003 . 9 1 1 A 87 87 LYS N N 87 120.968 121.930 -0.962 1
1 1004 . 9 1 1 A 88 88 LEU H H 88 7.903 8.165 -0.262 1
1 1005 . 9 1 1 A 88 88 LEU HA H 88 4.144 4.284 -0.140 1
1 1015 . 9 1 1 A 88 88 LEU C C 88 178.221 178.196 0.025 1
1 1016 . 9 1 1 A 88 88 LEU CA C 88 56.145 57.194 -1.049 1
1 1017 . 9 1 1 A 88 88 LEU CB C 88 42.215 41.518 0.697 1
1 1021 . 9 1 1 A 88 88 LEU N N 88 120.558 117.704 2.854 1
1 1022 . 9 1 1 A 89 89 ALA H H 89 7.894 7.756 0.138 1
1 1023 . 9 1 1 A 89 89 ALA HA H 89 4.224 4.336 -0.112 1
1 1027 . 9 1 1 A 89 89 ALA C C 89 178.609 179.050 -0.441 1
1 1028 . 9 1 1 A 89 89 ALA CA C 89 53.392 53.502 -0.110 1
1 1029 . 9 1 1 A 89 89 ALA CB C 89 18.695 19.213 -0.518 1
1 1030 . 9 1 1 A 89 89 ALA N N 89 122.387 122.170 0.217 1
1 1031 . 9 1 1 A 90 90 MET H H 90 8.084 7.722 0.362 1
1 1032 . 9 1 1 A 90 90 MET HA H 90 4.356 4.370 -0.014 1
1 1040 . 9 1 1 A 90 90 MET C C 90 176.982 175.687 1.295 1
1 1041 . 9 1 1 A 90 90 MET CA C 90 56.551 56.573 -0.022 1
1 1042 . 9 1 1 A 90 90 MET CB C 90 32.719 32.715 0.004 1
1 1045 . 9 1 1 A 90 90 MET N N 90 118.509 114.221 4.288 1
1 1046 . 9 1 1 A 91 91 ASP H H 91 8.261 7.355 0.906 1
1 1047 . 9 1 1 A 91 91 ASP HA H 91 4.524 4.794 -0.270 1
1 1050 . 9 1 1 A 91 91 ASP C C 91 176.643 175.735 0.908 1
1 1051 . 9 1 1 A 91 91 ASP CA C 91 54.981 52.970 2.011 1
1 1052 . 9 1 1 A 91 91 ASP CB C 91 40.870 42.798 -1.928 1
1 1053 . 9 1 1 A 91 91 ASP N N 91 120.771 121.234 -0.463 1
1 1054 . 9 1 1 A 92 92 ALA H H 92 7.971 8.592 -0.621 1
1 1055 . 9 1 1 A 92 92 ALA HA H 92 4.200 4.382 -0.182 1
1 1059 . 9 1 1 A 92 92 ALA C C 92 177.929 176.770 1.159 1
1 1060 . 9 1 1 A 92 92 ALA CA C 92 53.184 53.035 0.149 1
1 1061 . 9 1 1 A 92 92 ALA CB C 92 18.890 20.305 -1.415 1
1 1062 . 9 1 1 A 92 92 ALA N N 92 123.057 123.339 -0.282 1
1 1063 . 9 1 1 A 93 93 TYR H H 93 8.019 8.000 0.019 1
1 1064 . 9 1 1 A 93 93 TYR HA H 93 4.523 4.829 -0.306 1
1 1071 . 9 1 1 A 93 93 TYR C C 93 176.279 175.512 0.767 1
1 1072 . 9 1 1 A 93 93 TYR CA C 93 58.401 56.186 2.215 1
1 1073 . 9 1 1 A 93 93 TYR CB C 93 38.669 39.162 -0.493 1
1 1078 . 9 1 1 A 93 93 TYR N N 93 118.337 120.619 -2.282 1
1 1079 . 9 1 1 A 94 94 SER H H 94 8.037 8.453 -0.416 1
1 1080 . 9 1 1 A 94 94 SER HA H 94 4.484 4.440 0.044 1
1 1082 . 9 1 1 A 94 94 SER C C 94 174.554 174.996 -0.442 1
1 1083 . 9 1 1 A 94 94 SER CA C 94 58.401 59.540 -1.139 1
1 1084 . 9 1 1 A 94 94 SER CB C 94 63.806 64.252 -0.446 1
1 1085 . 9 1 1 A 94 94 SER N N 94 116.640 122.662 -6.022 1
1 1086 . 9 1 1 A 96 96 ASN HA H 96 4.770 5.210 -0.440 1
1 1091 . 9 1 1 A 96 96 ASN C C 96 175.161 172.879 2.282 1
1 1092 . 9 1 1 A 96 96 ASN CA C 96 53.395 52.729 0.666 1
1 1093 . 9 1 1 A 96 96 ASN CB C 96 38.999 42.347 -3.348 1
1 1095 . 9 1 1 A 97 97 SER H H 97 8.230 8.663 -0.433 1
1 1096 . 9 1 1 A 97 97 SER HA H 97 4.481 5.222 -0.741 1
1 1099 . 9 1 1 A 97 97 SER C C 97 174.482 174.679 -0.197 1
1 1100 . 9 1 1 A 97 97 SER CA C 97 58.300 56.891 1.409 1
1 1101 . 9 1 1 A 97 97 SER CB C 97 63.697 64.354 -0.657 1
1 1102 . 9 1 1 A 97 97 SER N N 97 115.866 117.504 -1.638 1
1 1103 . 9 1 1 A 98 98 GLY H H 98 8.228 8.609 -0.381 1
1 1104 . 9 1 1 A 98 98 GLY HA2 H 98 4.098 4.035 0.063 1
1 1105 . 9 1 1 A 98 98 GLY HA3 H 98 4.098 4.051 0.047 1
1 1106 . 9 1 1 A 98 98 GLY C C 98 171.788 174.176 -2.388 1
1 1107 . 9 1 1 A 98 98 GLY CA C 98 44.803 44.505 0.298 1
1 1108 . 9 1 1 A 98 98 GLY N N 98 110.658 110.547 0.111 1
1 1109 . 9 1 1 A 99 99 PRO HA H 99 4.463 4.355 0.108 1
1 1116 . 9 1 1 A 99 99 PRO CA C 99 63.230 65.118 -1.888 1
1 1117 . 9 1 1 A 99 99 PRO CB C 99 32.044 31.925 0.119 1
1 1120 . 9 1 1 A 100 100 SER H H 100 8.514 8.319 0.195 1
1 1121 . 9 1 1 A 100 100 SER CA C 100 58.450 61.731 -3.281 1
1 1122 . 9 1 1 A 100 100 SER CB C 100 63.889 62.801 1.088 1
1 1 . 10 1 1 A 9 9 ASN H H 9 8.856 8.856 0.000 1
1 2 . 10 1 1 A 9 9 ASN HA H 9 4.694 5.131 -0.437 1
1 7 . 10 1 1 A 9 9 ASN CA C 9 53.401 52.755 0.646 1
1 8 . 10 1 1 A 9 9 ASN CB C 9 38.757 39.764 -1.007 1
1 10 . 10 1 1 A 10 10 ARG HA H 10 4.346 4.935 -0.589 1
1 17 . 10 1 1 A 10 10 ARG C C 10 175.405 175.441 -0.036 1
1 18 . 10 1 1 A 10 10 ARG CA C 10 56.181 55.228 0.953 1
1 19 . 10 1 1 A 10 10 ARG CB C 10 31.171 32.215 -1.044 1
1 22 . 10 1 1 A 11 11 PHE H H 11 8.310 8.943 -0.633 1
1 23 . 10 1 1 A 11 11 PHE HA H 11 4.291 5.030 -0.739 1
1 31 . 10 1 1 A 11 11 PHE C C 11 174.458 172.742 1.716 1
1 32 . 10 1 1 A 11 11 PHE CA C 11 58.967 57.534 1.433 1
1 33 . 10 1 1 A 11 11 PHE CB C 11 40.138 42.665 -2.527 1
1 39 . 10 1 1 A 11 11 PHE N N 11 123.604 124.460 -0.856 1
1 40 . 10 1 1 A 12 12 LYS H H 12 7.307 8.237 -0.930 1
1 41 . 10 1 1 A 12 12 LYS HA H 12 4.165 4.717 -0.552 1
1 50 . 10 1 1 A 12 12 LYS C C 12 174.385 175.310 -0.925 1
1 51 . 10 1 1 A 12 12 LYS CA C 12 54.593 53.915 0.678 1
1 52 . 10 1 1 A 12 12 LYS CB C 12 34.712 35.921 -1.209 1
1 56 . 10 1 1 A 12 12 LYS N N 12 127.282 126.282 1.000 1
1 57 . 10 1 1 A 13 13 TRP H H 13 8.039 8.492 -0.453 1
1 58 . 10 1 1 A 13 13 TRP HA H 13 4.370 4.722 -0.352 1
1 67 . 10 1 1 A 13 13 TRP C C 13 177.857 176.521 1.336 1
1 68 . 10 1 1 A 13 13 TRP CA C 13 56.675 57.110 -0.435 1
1 69 . 10 1 1 A 13 13 TRP CB C 13 30.317 30.538 -0.221 1
1 75 . 10 1 1 A 13 13 TRP N N 13 124.264 127.213 -2.949 1
1 77 . 10 1 1 A 14 14 GLY H H 14 9.815 8.670 1.145 1
1 78 . 10 1 1 A 14 14 GLY HA2 H 14 4.370 4.191 0.179 1
1 79 . 10 1 1 A 14 14 GLY HA3 H 14 4.335 4.214 0.121 1
1 80 . 10 1 1 A 14 14 GLY C C 14 172.904 174.768 -1.864 1
1 81 . 10 1 1 A 14 14 GLY CA C 14 44.157 43.861 0.296 1
1 82 . 10 1 1 A 14 14 GLY N N 14 115.294 108.738 6.556 1
1 83 . 10 1 1 A 15 15 PRO HA H 15 4.327 4.390 -0.063 1
1 90 . 10 1 1 A 15 15 PRO C C 15 179.726 178.935 0.791 1
1 91 . 10 1 1 A 15 15 PRO CA C 15 65.171 65.434 -0.263 1
1 92 . 10 1 1 A 15 15 PRO CB C 15 31.829 31.777 0.052 1
1 95 . 10 1 1 A 16 16 ALA H H 16 9.214 8.137 1.077 1
1 96 . 10 1 1 A 16 16 ALA HA H 16 4.166 4.103 0.063 1
1 100 . 10 1 1 A 16 16 ALA C C 16 181.184 179.741 1.443 1
1 101 . 10 1 1 A 16 16 ALA CA C 16 55.370 55.253 0.117 1
1 102 . 10 1 1 A 16 16 ALA CB C 16 18.058 18.709 -0.651 1
1 103 . 10 1 1 A 16 16 ALA N N 16 122.414 119.549 2.865 1
1 104 . 10 1 1 A 17 17 SER H H 17 7.985 8.208 -0.223 1
1 105 . 10 1 1 A 17 17 SER HA H 17 4.317 4.122 0.195 1
1 107 . 10 1 1 A 17 17 SER C C 17 175.381 176.805 -1.424 1
1 108 . 10 1 1 A 17 17 SER CA C 17 63.163 62.042 1.121 1
1 109 . 10 1 1 A 17 17 SER CB C 17 64.055 63.069 0.986 1
1 110 . 10 1 1 A 17 17 SER N N 17 116.568 114.193 2.375 1
1 111 . 10 1 1 A 18 18 GLN H H 18 8.316 7.917 0.399 1
1 112 . 10 1 1 A 18 18 GLN HA H 18 3.323 3.491 -0.168 1
1 119 . 10 1 1 A 18 18 GLN C C 18 176.812 178.626 -1.814 1
1 120 . 10 1 1 A 18 18 GLN CA C 18 60.025 59.190 0.835 1
1 121 . 10 1 1 A 18 18 GLN CB C 18 28.686 28.487 0.199 1
1 123 . 10 1 1 A 18 18 GLN N N 18 119.002 120.959 -1.957 1
1 125 . 10 1 1 A 19 19 GLN H H 19 7.582 7.735 -0.153 1
1 126 . 10 1 1 A 19 19 GLN HA H 19 4.062 4.096 -0.034 1
1 133 . 10 1 1 A 19 19 GLN C C 19 178.488 178.456 0.032 1
1 134 . 10 1 1 A 19 19 GLN CA C 19 59.248 59.212 0.036 1
1 135 . 10 1 1 A 19 19 GLN CB C 19 28.203 28.261 -0.058 1
1 137 . 10 1 1 A 19 19 GLN N N 19 116.221 118.699 -2.478 1
1 139 . 10 1 1 A 20 20 ILE H H 20 7.246 7.953 -0.707 1
1 140 . 10 1 1 A 20 20 ILE HA H 20 3.570 3.612 -0.042 1
1 150 . 10 1 1 A 20 20 ILE C C 20 178.999 178.541 0.458 1
1 151 . 10 1 1 A 20 20 ILE CA C 20 64.996 65.649 -0.653 1
1 152 . 10 1 1 A 20 20 ILE CB C 20 38.139 37.922 0.217 1
1 156 . 10 1 1 A 20 20 ILE N N 20 120.521 120.929 -0.408 1
1 157 . 10 1 1 A 21 21 LEU H H 21 8.034 7.894 0.140 1
1 158 . 10 1 1 A 21 21 LEU HA H 21 3.491 3.555 -0.064 1
1 168 . 10 1 1 A 21 21 LEU C C 21 178.196 178.515 -0.319 1
1 169 . 10 1 1 A 21 21 LEU CA C 21 57.944 57.454 0.490 1
1 170 . 10 1 1 A 21 21 LEU CB C 21 37.864 40.332 -2.468 1
1 174 . 10 1 1 A 21 21 LEU N N 21 121.259 118.832 2.427 1
1 175 . 10 1 1 A 22 22 TYR H H 22 8.479 7.663 0.816 1
1 176 . 10 1 1 A 22 22 TYR HA H 22 4.224 4.308 -0.084 1
1 183 . 10 1 1 A 22 22 TYR C C 22 179.630 178.595 1.035 1
1 184 . 10 1 1 A 22 22 TYR CA C 22 62.422 60.806 1.616 1
1 185 . 10 1 1 A 22 22 TYR CB C 22 37.434 37.704 -0.270 1
1 190 . 10 1 1 A 22 22 TYR N N 22 117.805 118.702 -0.897 1
1 191 . 10 1 1 A 23 23 GLN H H 23 7.707 8.312 -0.605 1
1 192 . 10 1 1 A 23 23 GLN HA H 23 4.166 4.040 0.126 1
1 199 . 10 1 1 A 23 23 GLN C C 23 178.633 178.512 0.121 1
1 200 . 10 1 1 A 23 23 GLN CA C 23 58.789 59.204 -0.415 1
1 201 . 10 1 1 A 23 23 GLN CB C 23 28.534 28.118 0.416 1
1 203 . 10 1 1 A 23 23 GLN N N 23 117.580 118.338 -0.758 1
1 205 . 10 1 1 A 24 24 ALA H H 24 8.155 7.849 0.306 1
1 206 . 10 1 1 A 24 24 ALA HA H 24 4.187 4.232 -0.045 1
1 210 . 10 1 1 A 24 24 ALA C C 24 180.018 179.120 0.898 1
1 211 . 10 1 1 A 24 24 ALA CA C 24 55.228 55.194 0.034 1
1 212 . 10 1 1 A 24 24 ALA CB C 24 19.468 18.672 0.796 1
1 213 . 10 1 1 A 24 24 ALA N N 24 122.813 122.448 0.365 1
1 214 . 10 1 1 A 25 25 TYR H H 25 8.995 8.623 0.372 1
1 215 . 10 1 1 A 25 25 TYR HA H 25 4.348 4.715 -0.367 1
1 222 . 10 1 1 A 25 25 TYR C C 25 175.792 177.762 -1.970 1
1 223 . 10 1 1 A 25 25 TYR CA C 25 61.681 61.805 -0.124 1
1 224 . 10 1 1 A 25 25 TYR CB C 25 38.175 38.650 -0.475 1
1 229 . 10 1 1 A 25 25 TYR N N 25 121.343 120.343 1.000 1
1 230 . 10 1 1 A 26 26 ASP H H 26 7.260 8.717 -1.457 1
1 231 . 10 1 1 A 26 26 ASP HA H 26 4.373 4.491 -0.118 1
1 234 . 10 1 1 A 26 26 ASP C C 26 177.322 177.911 -0.589 1
1 235 . 10 1 1 A 26 26 ASP CA C 26 56.603 57.244 -0.641 1
1 236 . 10 1 1 A 26 26 ASP CB C 26 41.060 41.203 -0.143 1
1 237 . 10 1 1 A 26 26 ASP N N 26 114.020 119.238 -5.218 1
1 238 . 10 1 1 A 27 27 ARG H H 27 7.343 7.658 -0.315 1
1 239 . 10 1 1 A 27 27 ARG HA H 27 4.302 4.353 -0.051 1
1 246 . 10 1 1 A 27 27 ARG C C 27 176.546 176.410 0.136 1
1 247 . 10 1 1 A 27 27 ARG CA C 27 57.563 57.569 -0.006 1
1 248 . 10 1 1 A 27 27 ARG CB C 27 31.500 31.502 -0.002 1
1 251 . 10 1 1 A 27 27 ARG N N 27 116.729 116.825 -0.096 1
1 252 . 10 1 1 A 28 28 GLN H H 28 8.306 7.963 0.343 1
1 253 . 10 1 1 A 28 28 GLN HA H 28 4.396 4.719 -0.323 1
1 260 . 10 1 1 A 28 28 GLN C C 28 172.831 175.235 -2.404 1
1 261 . 10 1 1 A 28 28 GLN CA C 28 55.355 54.631 0.724 1
1 262 . 10 1 1 A 28 28 GLN CB C 28 31.062 31.381 -0.319 1
1 264 . 10 1 1 A 28 28 GLN N N 28 121.612 118.381 3.231 1
1 266 . 10 1 1 A 29 29 LYS H H 29 8.354 8.492 -0.138 1
1 267 . 10 1 1 A 29 29 LYS HA H 29 4.099 3.538 0.561 1
1 276 . 10 1 1 A 29 29 LYS C C 29 176.084 176.359 -0.275 1
1 277 . 10 1 1 A 29 29 LYS CA C 29 57.873 57.839 0.034 1
1 278 . 10 1 1 A 29 29 LYS CB C 29 33.313 32.674 0.639 1
1 282 . 10 1 1 A 29 29 LYS N N 29 125.038 123.963 1.075 1
1 283 . 10 1 1 A 30 30 ASN H H 30 8.856 8.016 0.840 1
1 284 . 10 1 1 A 30 30 ASN HA H 30 4.958 5.130 -0.172 1
1 289 . 10 1 1 A 30 30 ASN C C 30 171.179 172.707 -1.528 1
1 290 . 10 1 1 A 30 30 ASN CA C 30 50.891 50.368 0.523 1
1 291 . 10 1 1 A 30 30 ASN CB C 30 39.907 39.249 0.658 1
1 292 . 10 1 1 A 30 30 ASN N N 30 115.764 117.592 -1.828 1
1 294 . 10 1 1 A 31 31 PRO HA H 31 4.299 4.421 -0.122 1
1 301 . 10 1 1 A 31 31 PRO C C 31 177.493 177.020 0.473 1
1 302 . 10 1 1 A 31 31 PRO CA C 31 62.489 62.564 -0.075 1
1 303 . 10 1 1 A 31 31 PRO CB C 31 31.216 31.872 -0.656 1
1 306 . 10 1 1 A 32 32 SER H H 32 9.368 8.451 0.917 1
1 307 . 10 1 1 A 32 32 SER HA H 32 4.372 4.688 -0.316 1
1 310 . 10 1 1 A 32 32 SER C C 32 174.821 175.701 -0.880 1
1 311 . 10 1 1 A 32 32 SER CA C 32 57.203 58.284 -1.081 1
1 312 . 10 1 1 A 32 32 SER CB C 32 65.594 64.190 1.404 1
1 313 . 10 1 1 A 32 32 SER N N 32 120.847 117.764 3.083 1
1 314 . 10 1 1 A 33 33 LYS H H 33 9.152 8.963 0.189 1
1 315 . 10 1 1 A 33 33 LYS HA H 33 3.719 3.937 -0.218 1
1 324 . 10 1 1 A 33 33 LYS C C 33 177.833 178.311 -0.478 1
1 325 . 10 1 1 A 33 33 LYS CA C 33 61.188 60.043 1.145 1
1 326 . 10 1 1 A 33 33 LYS CB C 33 32.572 32.145 0.427 1
1 330 . 10 1 1 A 33 33 LYS N N 33 122.966 124.689 -1.723 1
1 331 . 10 1 1 A 34 34 GLU H H 34 8.902 8.129 0.773 1
1 332 . 10 1 1 A 34 34 GLU HA H 34 4.089 4.096 -0.007 1
1 337 . 10 1 1 A 34 34 GLU C C 34 180.286 179.248 1.038 1
1 338 . 10 1 1 A 34 34 GLU CA C 34 60.483 59.421 1.062 1
1 339 . 10 1 1 A 34 34 GLU CB C 34 28.835 29.593 -0.758 1
1 341 . 10 1 1 A 34 34 GLU N N 34 117.645 119.116 -1.471 1
1 342 . 10 1 1 A 35 35 GLU H H 35 7.673 8.127 -0.454 1
1 343 . 10 1 1 A 35 35 GLU HA H 35 4.023 3.987 0.036 1
1 348 . 10 1 1 A 35 35 GLU C C 35 180.237 179.192 1.045 1
1 349 . 10 1 1 A 35 35 GLU CA C 35 59.214 59.181 0.033 1
1 350 . 10 1 1 A 35 35 GLU CB C 35 30.099 29.216 0.883 1
1 352 . 10 1 1 A 35 35 GLU N N 35 121.077 120.341 0.736 1
1 353 . 10 1 1 A 36 36 ARG H H 36 8.932 8.173 0.759 1
1 354 . 10 1 1 A 36 36 ARG HA H 36 3.928 3.759 0.169 1
1 362 . 10 1 1 A 36 36 ARG C C 36 178.464 179.137 -0.673 1
1 363 . 10 1 1 A 36 36 ARG CA C 36 60.974 60.153 0.821 1
1 364 . 10 1 1 A 36 36 ARG CB C 36 31.171 29.853 1.318 1
1 367 . 10 1 1 A 36 36 ARG N N 36 119.441 120.169 -0.728 1
1 369 . 10 1 1 A 37 37 GLU H H 37 8.756 8.219 0.537 1
1 370 . 10 1 1 A 37 37 GLU HA H 37 3.948 4.110 -0.162 1
1 375 . 10 1 1 A 37 37 GLU C C 37 179.606 179.137 0.469 1
1 376 . 10 1 1 A 37 37 GLU CA C 37 60.094 59.005 1.089 1
1 377 . 10 1 1 A 37 37 GLU CB C 37 29.110 29.359 -0.249 1
1 379 . 10 1 1 A 37 37 GLU N N 37 119.017 119.919 -0.902 1
1 380 . 10 1 1 A 38 38 ALA H H 38 7.733 8.037 -0.304 1
1 381 . 10 1 1 A 38 38 ALA HA H 38 4.325 4.119 0.206 1
1 385 . 10 1 1 A 38 38 ALA C C 38 180.820 178.504 2.316 1
1 386 . 10 1 1 A 38 38 ALA CA C 38 55.194 54.439 0.755 1
1 387 . 10 1 1 A 38 38 ALA CB C 38 17.654 18.578 -0.924 1
1 388 . 10 1 1 A 38 38 ALA N N 38 122.889 122.095 0.794 1
1 389 . 10 1 1 A 39 39 LEU H H 39 7.740 7.751 -0.011 1
1 390 . 10 1 1 A 39 39 LEU HA H 39 4.176 4.295 -0.119 1
1 400 . 10 1 1 A 39 39 LEU C C 39 179.266 178.718 0.548 1
1 401 . 10 1 1 A 39 39 LEU CA C 39 57.944 55.982 1.962 1
1 402 . 10 1 1 A 39 39 LEU CB C 39 42.105 42.555 -0.450 1
1 406 . 10 1 1 A 39 39 LEU N N 39 119.783 116.919 2.864 1
1 407 . 10 1 1 A 40 40 VAL H H 40 8.451 8.355 0.096 1
1 408 . 10 1 1 A 40 40 VAL HA H 40 3.259 3.712 -0.453 1
1 416 . 10 1 1 A 40 40 VAL C C 40 177.153 177.834 -0.681 1
1 417 . 10 1 1 A 40 40 VAL CA C 40 67.254 66.974 0.280 1
1 418 . 10 1 1 A 40 40 VAL CB C 40 31.747 31.581 0.166 1
1 421 . 10 1 1 A 40 40 VAL N N 40 121.481 119.757 1.724 1
1 422 . 10 1 1 A 41 41 GLU H H 41 7.254 7.988 -0.734 1
1 423 . 10 1 1 A 41 41 GLU HA H 41 4.159 4.134 0.025 1
1 428 . 10 1 1 A 41 41 GLU C C 41 179.483 178.732 0.751 1
1 429 . 10 1 1 A 41 41 GLU CA C 41 59.248 59.341 -0.093 1
1 430 . 10 1 1 A 41 41 GLU CB C 41 29.358 29.470 -0.112 1
1 432 . 10 1 1 A 41 41 GLU N N 41 116.549 119.904 -3.355 1
1 433 . 10 1 1 A 42 42 GLU H H 42 8.103 7.819 0.284 1
1 434 . 10 1 1 A 42 42 GLU HA H 42 4.020 4.050 -0.030 1
1 439 . 10 1 1 A 42 42 GLU C C 42 180.115 178.777 1.338 1
1 440 . 10 1 1 A 42 42 GLU CA C 42 59.847 59.531 0.316 1
1 441 . 10 1 1 A 42 42 GLU CB C 42 30.218 29.178 1.040 1
1 443 . 10 1 1 A 42 42 GLU N N 42 119.578 119.376 0.202 1
1 444 . 10 1 1 A 43 43 CYS H H 43 8.955 8.015 0.940 1
1 445 . 10 1 1 A 43 43 CYS HA H 43 4.153 4.231 -0.078 1
1 448 . 10 1 1 A 43 43 CYS C C 43 176.498 177.583 -1.085 1
1 449 . 10 1 1 A 43 43 CYS CA C 43 64.856 62.522 2.334 1
1 450 . 10 1 1 A 43 43 CYS CB C 43 27.390 27.886 -0.496 1
1 451 . 10 1 1 A 43 43 CYS N N 43 118.199 118.695 -0.496 1
1 452 . 10 1 1 A 44 44 ASN H H 44 8.543 7.871 0.672 1
1 453 . 10 1 1 A 44 44 ASN HA H 44 4.635 4.418 0.217 1
1 458 . 10 1 1 A 44 44 ASN C C 44 178.633 177.527 1.106 1
1 459 . 10 1 1 A 44 44 ASN CA C 44 56.603 56.392 0.211 1
1 460 . 10 1 1 A 44 44 ASN CB C 44 37.187 38.115 -0.928 1
1 461 . 10 1 1 A 44 44 ASN N N 44 117.002 119.670 -2.668 1
1 463 . 10 1 1 A 45 45 ARG H H 45 8.296 8.184 0.112 1
1 464 . 10 1 1 A 45 45 ARG HA H 45 3.977 4.061 -0.084 1
1 471 . 10 1 1 A 45 45 ARG C C 45 178.149 178.315 -0.166 1
1 472 . 10 1 1 A 45 45 ARG CA C 45 60.589 59.633 0.956 1
1 473 . 10 1 1 A 45 45 ARG CB C 45 30.099 30.153 -0.054 1
1 476 . 10 1 1 A 45 45 ARG N N 45 121.021 121.040 -0.019 1
1 477 . 10 1 1 A 46 46 ALA H H 46 7.914 8.198 -0.284 1
1 478 . 10 1 1 A 46 46 ALA HA H 46 4.128 4.135 -0.007 1
1 482 . 10 1 1 A 46 46 ALA C C 46 181.208 180.235 0.973 1
1 483 . 10 1 1 A 46 46 ALA CA C 46 55.264 54.910 0.354 1
1 484 . 10 1 1 A 46 46 ALA CB C 46 18.759 18.401 0.358 1
1 485 . 10 1 1 A 46 46 ALA N N 46 121.570 120.729 0.841 1
1 486 . 10 1 1 A 47 47 GLU H H 47 8.730 8.630 0.100 1
1 487 . 10 1 1 A 47 47 GLU HA H 47 4.194 4.040 0.154 1
1 492 . 10 1 1 A 47 47 GLU C C 47 180.115 179.127 0.988 1
1 493 . 10 1 1 A 47 47 GLU CA C 47 58.401 59.660 -1.259 1
1 494 . 10 1 1 A 47 47 GLU CB C 47 29.523 29.274 0.249 1
1 496 . 10 1 1 A 47 47 GLU N N 47 117.532 118.188 -0.656 1
1 497 . 10 1 1 A 48 48 CYS H H 48 8.283 7.851 0.432 1
1 498 . 10 1 1 A 48 48 CYS HA H 48 4.002 4.137 -0.135 1
1 501 . 10 1 1 A 48 48 CYS C C 48 177.031 177.417 -0.386 1
1 502 . 10 1 1 A 48 48 CYS CA C 48 64.749 63.867 0.882 1
1 503 . 10 1 1 A 48 48 CYS CB C 48 25.907 27.191 -1.284 1
1 504 . 10 1 1 A 48 48 CYS N N 48 118.282 119.160 -0.878 1
1 505 . 10 1 1 A 49 49 LEU H H 49 8.181 8.088 0.093 1
1 506 . 10 1 1 A 49 49 LEU HA H 49 4.175 3.891 0.284 1
1 516 . 10 1 1 A 49 49 LEU C C 49 180.430 178.782 1.648 1
1 517 . 10 1 1 A 49 49 LEU CA C 49 57.873 58.169 -0.296 1
1 518 . 10 1 1 A 49 49 LEU CB C 49 41.539 41.842 -0.303 1
1 522 . 10 1 1 A 49 49 LEU N N 49 120.371 120.685 -0.314 1
1 523 . 10 1 1 A 50 50 GLN H H 50 7.934 8.682 -0.748 1
1 524 . 10 1 1 A 50 50 GLN HA H 50 4.102 4.065 0.037 1
1 531 . 10 1 1 A 50 50 GLN C C 50 177.322 177.227 0.095 1
1 532 . 10 1 1 A 50 50 GLN CA C 50 58.156 58.679 -0.523 1
1 533 . 10 1 1 A 50 50 GLN CB C 50 28.616 28.608 0.008 1
1 535 . 10 1 1 A 50 50 GLN N N 50 118.175 117.316 0.859 1
1 537 . 10 1 1 A 51 51 ARG H H 51 7.632 7.737 -0.105 1
1 538 . 10 1 1 A 51 51 ARG HA H 51 4.347 4.353 -0.006 1
1 545 . 10 1 1 A 51 51 ARG C C 51 176.546 176.449 0.097 1
1 546 . 10 1 1 A 51 51 ARG CA C 51 56.286 55.910 0.376 1
1 547 . 10 1 1 A 51 51 ARG CB C 51 31.314 30.149 1.165 1
1 550 . 10 1 1 A 51 51 ARG N N 51 116.454 117.841 -1.387 1
1 551 . 10 1 1 A 52 52 GLY H H 52 7.949 8.280 -0.331 1
1 552 . 10 1 1 A 52 52 GLY HA2 H 52 4.033 3.966 0.067 1
1 553 . 10 1 1 A 52 52 GLY HA3 H 52 3.903 3.968 -0.065 1
1 554 . 10 1 1 A 52 52 GLY C C 52 174.385 174.188 0.197 1
1 555 . 10 1 1 A 52 52 GLY CA C 52 46.231 45.285 0.946 1
1 556 . 10 1 1 A 52 52 GLY N N 52 108.854 107.668 1.186 1
1 557 . 10 1 1 A 53 53 VAL H H 53 7.944 7.527 0.417 1
1 558 . 10 1 1 A 53 53 VAL HA H 53 4.250 4.066 0.184 1
1 566 . 10 1 1 A 53 53 VAL C C 53 175.525 175.083 0.442 1
1 567 . 10 1 1 A 53 53 VAL CA C 53 60.377 62.501 -2.124 1
1 568 . 10 1 1 A 53 53 VAL CB C 53 34.283 32.844 1.439 1
1 571 . 10 1 1 A 53 53 VAL N N 53 118.316 120.753 -2.437 1
1 572 . 10 1 1 A 54 54 SER H H 54 8.502 8.498 0.004 1
1 573 . 10 1 1 A 54 54 SER HA H 54 4.625 4.899 -0.274 1
1 576 . 10 1 1 A 54 54 SER C C 54 174.603 174.048 0.555 1
1 577 . 10 1 1 A 54 54 SER CA C 54 56.092 54.203 1.889 1
1 578 . 10 1 1 A 54 54 SER CB C 54 63.697 63.711 -0.014 1
1 579 . 10 1 1 A 54 54 SER N N 54 120.337 118.373 1.964 1
1 580 . 10 1 1 A 55 55 PRO HA H 55 4.624 4.526 0.098 1
1 587 . 10 1 1 A 55 55 PRO C C 55 177.322 177.674 -0.352 1
1 588 . 10 1 1 A 55 55 PRO CA C 55 64.431 64.217 0.214 1
1 589 . 10 1 1 A 55 55 PRO CB C 55 31.913 31.707 0.206 1
1 592 . 10 1 1 A 56 56 SER H H 56 7.931 8.303 -0.372 1
1 593 . 10 1 1 A 56 56 SER HA H 56 4.428 4.577 -0.149 1
1 596 . 10 1 1 A 56 56 SER C C 56 174.749 175.152 -0.403 1
1 597 . 10 1 1 A 56 56 SER CA C 56 59.130 59.371 -0.241 1
1 598 . 10 1 1 A 56 56 SER CB C 56 63.056 63.946 -0.890 1
1 599 . 10 1 1 A 56 56 SER N N 56 112.637 113.426 -0.789 1
1 600 . 10 1 1 A 57 57 LYS H H 57 8.121 7.638 0.483 1
1 601 . 10 1 1 A 57 57 LYS HA H 57 4.467 4.870 -0.403 1
1 609 . 10 1 1 A 57 57 LYS C C 57 176.570 176.179 0.391 1
1 610 . 10 1 1 A 57 57 LYS CA C 57 55.264 54.990 0.274 1
1 611 . 10 1 1 A 57 57 LYS CB C 57 32.160 32.568 -0.408 1
1 615 . 10 1 1 A 57 57 LYS N N 57 123.185 117.892 5.293 1
1 616 . 10 1 1 A 58 58 ALA H H 58 7.886 7.967 -0.081 1
1 617 . 10 1 1 A 58 58 ALA HA H 58 3.923 3.897 0.026 1
1 621 . 10 1 1 A 58 58 ALA C C 58 177.469 179.591 -2.122 1
1 622 . 10 1 1 A 58 58 ALA CA C 58 54.276 54.865 -0.589 1
1 623 . 10 1 1 A 58 58 ALA CB C 58 18.271 18.607 -0.336 1
1 624 . 10 1 1 A 58 58 ALA N N 58 123.941 122.889 1.052 1
1 625 . 10 1 1 A 59 59 HIS H H 59 8.077 8.105 -0.028 1
1 626 . 10 1 1 A 59 59 HIS HA H 59 4.420 4.418 0.002 1
1 631 . 10 1 1 A 59 59 HIS C C 59 177.542 177.565 -0.023 1
1 632 . 10 1 1 A 59 59 HIS CA C 59 57.767 58.567 -0.800 1
1 633 . 10 1 1 A 59 59 HIS CB C 59 29.852 28.802 1.050 1
1 636 . 10 1 1 A 59 59 HIS N N 59 115.566 115.582 -0.016 1
1 637 . 10 1 1 A 60 60 GLY H H 60 8.110 7.672 0.438 1
1 638 . 10 1 1 A 60 60 GLY HA2 H 60 3.873 3.418 0.455 1
1 639 . 10 1 1 A 60 60 GLY HA3 H 60 4.025 3.535 0.490 1
1 640 . 10 1 1 A 60 60 GLY C C 60 174.918 175.524 -0.606 1
1 641 . 10 1 1 A 60 60 GLY CA C 60 45.559 46.970 -1.411 1
1 642 . 10 1 1 A 60 60 GLY N N 60 109.216 110.265 -1.049 1
1 643 . 10 1 1 A 61 61 LEU H H 61 8.280 8.379 -0.099 1
1 644 . 10 1 1 A 61 61 LEU HA H 61 4.198 3.954 0.244 1
1 654 . 10 1 1 A 61 61 LEU C C 61 178.900 177.578 1.322 1
1 655 . 10 1 1 A 61 61 LEU CA C 61 55.758 57.762 -2.004 1
1 656 . 10 1 1 A 61 61 LEU CB C 61 42.544 41.711 0.833 1
1 660 . 10 1 1 A 61 61 LEU N N 61 120.521 122.962 -2.441 1
1 661 . 10 1 1 A 62 62 GLY H H 62 8.184 8.125 0.059 1
1 662 . 10 1 1 A 62 62 GLY HA2 H 62 3.978 3.825 0.153 1
1 663 . 10 1 1 A 62 62 GLY HA3 H 62 3.817 3.830 -0.013 1
1 664 . 10 1 1 A 62 62 GLY C C 62 176.012 175.380 0.632 1
1 665 . 10 1 1 A 62 62 GLY CA C 62 46.767 47.265 -0.498 1
1 666 . 10 1 1 A 62 62 GLY N N 62 108.987 108.602 0.385 1
1 667 . 10 1 1 A 63 63 SER HA H 63 4.322 4.278 0.044 1
1 670 . 10 1 1 A 63 63 SER C C 63 174.167 175.673 -1.506 1
1 671 . 10 1 1 A 63 63 SER CA C 63 59.919 61.041 -1.122 1
1 672 . 10 1 1 A 63 63 SER CB C 63 63.312 63.296 0.016 1
1 673 . 10 1 1 A 64 64 ASN H H 64 8.087 8.196 -0.109 1
1 674 . 10 1 1 A 64 64 ASN HA H 64 4.850 4.864 -0.014 1
1 679 . 10 1 1 A 64 64 ASN C C 64 173.899 175.190 -1.291 1
1 680 . 10 1 1 A 64 64 ASN CA C 64 53.218 53.361 -0.143 1
1 681 . 10 1 1 A 64 64 ASN CB C 64 39.164 39.010 0.154 1
1 682 . 10 1 1 A 64 64 ASN N N 64 118.041 117.441 0.600 1
1 684 . 10 1 1 A 65 65 LEU H H 65 7.293 7.555 -0.262 1
1 685 . 10 1 1 A 65 65 LEU HA H 65 3.995 4.501 -0.506 1
1 695 . 10 1 1 A 65 65 LEU C C 65 175.696 175.608 0.088 1
1 696 . 10 1 1 A 65 65 LEU CA C 65 56.005 55.193 0.812 1
1 697 . 10 1 1 A 65 65 LEU CB C 65 43.120 43.206 -0.086 1
1 701 . 10 1 1 A 65 65 LEU N N 65 120.953 123.110 -2.157 1
1 702 . 10 1 1 A 66 66 VAL H H 66 9.517 8.981 0.536 1
1 703 . 10 1 1 A 66 66 VAL HA H 66 3.481 4.491 -1.010 1
1 711 . 10 1 1 A 66 66 VAL C C 66 175.429 174.992 0.437 1
1 712 . 10 1 1 A 66 66 VAL CA C 66 65.243 61.510 3.733 1
1 713 . 10 1 1 A 66 66 VAL CB C 66 31.335 33.253 -1.918 1
1 716 . 10 1 1 A 66 66 VAL N N 66 127.924 126.668 1.256 1
1 717 . 10 1 1 A 67 67 THR H H 67 6.253 8.308 -2.055 1
1 718 . 10 1 1 A 67 67 THR HA H 67 4.779 4.729 0.050 1
1 723 . 10 1 1 A 67 67 THR C C 67 174.894 174.759 0.135 1
1 724 . 10 1 1 A 67 67 THR CA C 67 58.719 59.544 -0.825 1
1 725 . 10 1 1 A 67 67 THR CB C 67 72.153 71.780 0.373 1
1 727 . 10 1 1 A 67 67 THR N N 67 113.376 115.913 -2.537 1
1 728 . 10 1 1 A 68 68 GLU H H 68 9.348 8.865 0.483 1
1 729 . 10 1 1 A 68 68 GLU HA H 68 3.634 4.009 -0.375 1
1 734 . 10 1 1 A 68 68 GLU C C 68 177.809 178.315 -0.506 1
1 735 . 10 1 1 A 68 68 GLU CA C 68 61.505 60.010 1.495 1
1 736 . 10 1 1 A 68 68 GLU CB C 68 28.285 29.554 -1.269 1
1 738 . 10 1 1 A 68 68 GLU N N 68 124.534 122.160 2.374 1
1 739 . 10 1 1 A 69 69 VAL H H 69 8.126 7.928 0.198 1
1 740 . 10 1 1 A 69 69 VAL HA H 69 3.862 3.514 0.348 1
1 748 . 10 1 1 A 69 69 VAL C C 69 177.712 178.022 -0.310 1
1 749 . 10 1 1 A 69 69 VAL CA C 69 65.701 66.785 -1.084 1
1 750 . 10 1 1 A 69 69 VAL CB C 69 31.829 31.539 0.290 1
1 753 . 10 1 1 A 69 69 VAL N N 69 119.139 120.024 -0.885 1
1 754 . 10 1 1 A 70 70 ARG H H 70 7.235 7.820 -0.585 1
1 755 . 10 1 1 A 70 70 ARG HA H 70 4.265 3.831 0.434 1
1 762 . 10 1 1 A 70 70 ARG C C 70 180.430 179.390 1.040 1
1 763 . 10 1 1 A 70 70 ARG CA C 70 59.742 60.042 -0.300 1
1 764 . 10 1 1 A 70 70 ARG CB C 70 29.439 29.835 -0.396 1
1 767 . 10 1 1 A 70 70 ARG N N 70 119.541 119.209 0.332 1
1 768 . 10 1 1 A 71 71 VAL H H 71 8.144 8.005 0.139 1
1 769 . 10 1 1 A 71 71 VAL HA H 71 4.018 3.911 0.107 1
1 777 . 10 1 1 A 71 71 VAL C C 71 177.493 178.340 -0.847 1
1 778 . 10 1 1 A 71 71 VAL CA C 71 67.924 66.672 1.252 1
1 779 . 10 1 1 A 71 71 VAL CB C 71 32.289 31.753 0.536 1
1 782 . 10 1 1 A 71 71 VAL N N 71 120.755 120.313 0.442 1
1 783 . 10 1 1 A 72 72 TYR H H 72 9.411 8.402 1.009 1
1 784 . 10 1 1 A 72 72 TYR HA H 72 3.908 4.169 -0.261 1
1 791 . 10 1 1 A 72 72 TYR C C 72 178.464 177.574 0.890 1
1 792 . 10 1 1 A 72 72 TYR CA C 72 63.444 62.312 1.132 1
1 793 . 10 1 1 A 72 72 TYR CB C 72 38.211 38.697 -0.486 1
1 798 . 10 1 1 A 72 72 TYR N N 72 121.175 121.171 0.004 1
1 799 . 10 1 1 A 73 73 ASN H H 73 8.816 8.702 0.114 1
1 800 . 10 1 1 A 73 73 ASN HA H 73 4.538 4.501 0.037 1
1 805 . 10 1 1 A 73 73 ASN C C 73 176.958 177.944 -0.986 1
1 806 . 10 1 1 A 73 73 ASN CA C 73 56.109 56.625 -0.516 1
1 807 . 10 1 1 A 73 73 ASN CB C 73 38.422 38.678 -0.256 1
1 808 . 10 1 1 A 73 73 ASN N N 73 118.122 117.884 0.238 1
1 810 . 10 1 1 A 74 74 TRP H H 74 8.657 8.435 0.222 1
1 811 . 10 1 1 A 74 74 TRP HA H 74 4.111 4.443 -0.332 1
1 820 . 10 1 1 A 74 74 TRP C C 74 179.654 178.482 1.172 1
1 821 . 10 1 1 A 74 74 TRP CA C 74 62.950 61.232 1.718 1
1 822 . 10 1 1 A 74 74 TRP CB C 74 29.555 29.694 -0.139 1
1 828 . 10 1 1 A 74 74 TRP N N 74 123.988 123.036 0.952 1
1 830 . 10 1 1 A 75 75 PHE H H 75 8.562 8.632 -0.070 1
1 831 . 10 1 1 A 75 75 PHE HA H 75 3.821 4.402 -0.581 1
1 839 . 10 1 1 A 75 75 PHE C C 75 177.614 178.149 -0.535 1
1 840 . 10 1 1 A 75 75 PHE CA C 75 63.374 61.923 1.451 1
1 841 . 10 1 1 A 75 75 PHE CB C 75 39.648 38.386 1.262 1
1 847 . 10 1 1 A 75 75 PHE N N 75 118.325 117.731 0.594 1
1 848 . 10 1 1 A 76 76 ALA H H 76 8.305 8.087 0.218 1
1 849 . 10 1 1 A 76 76 ALA HA H 76 3.909 4.022 -0.113 1
1 853 . 10 1 1 A 76 76 ALA C C 76 180.868 179.395 1.473 1
1 854 . 10 1 1 A 76 76 ALA CA C 76 55.566 55.163 0.403 1
1 855 . 10 1 1 A 76 76 ALA CB C 76 17.820 17.979 -0.159 1
1 856 . 10 1 1 A 76 76 ALA N N 76 121.119 121.812 -0.693 1
1 857 . 10 1 1 A 77 77 ASN H H 77 8.335 8.198 0.137 1
1 858 . 10 1 1 A 77 77 ASN HA H 77 4.355 4.449 -0.094 1
1 863 . 10 1 1 A 77 77 ASN C C 77 177.105 177.674 -0.569 1
1 864 . 10 1 1 A 77 77 ASN CA C 77 56.145 56.205 -0.060 1
1 865 . 10 1 1 A 77 77 ASN CB C 77 38.063 39.309 -1.246 1
1 866 . 10 1 1 A 77 77 ASN N N 77 117.433 116.797 0.636 1
1 868 . 10 1 1 A 78 78 ARG H H 78 7.664 7.196 0.468 1
1 869 . 10 1 1 A 78 78 ARG HA H 78 3.629 3.746 -0.117 1
1 876 . 10 1 1 A 78 78 ARG C C 78 179.216 178.521 0.695 1
1 877 . 10 1 1 A 78 78 ARG CA C 78 58.773 58.574 0.199 1
1 878 . 10 1 1 A 78 78 ARG CB C 78 29.605 29.032 0.573 1
1 881 . 10 1 1 A 78 78 ARG N N 78 121.999 118.242 3.757 1
1 882 . 10 1 1 A 79 79 ARG H H 79 8.320 7.710 0.610 1
1 883 . 10 1 1 A 79 79 ARG HA H 79 4.307 4.195 0.112 1
1 890 . 10 1 1 A 79 79 ARG C C 79 180.406 178.818 1.588 1
1 891 . 10 1 1 A 79 79 ARG CA C 79 60.270 58.805 1.465 1
1 892 . 10 1 1 A 79 79 ARG CB C 79 31.335 30.381 0.954 1
1 895 . 10 1 1 A 79 79 ARG N N 79 118.139 118.813 -0.674 1
1 896 . 10 1 1 A 80 80 LYS H H 80 7.759 7.888 -0.129 1
1 897 . 10 1 1 A 80 80 LYS HA H 80 4.052 4.158 -0.106 1
1 905 . 10 1 1 A 80 80 LYS C C 80 178.999 179.232 -0.233 1
1 906 . 10 1 1 A 80 80 LYS CA C 80 59.531 59.580 -0.049 1
1 907 . 10 1 1 A 80 80 LYS CB C 80 32.374 32.156 0.218 1
1 911 . 10 1 1 A 80 80 LYS N N 80 120.899 119.437 1.462 1
1 912 . 10 1 1 A 81 81 GLU H H 81 8.041 8.296 -0.255 1
1 913 . 10 1 1 A 81 81 GLU HA H 81 4.044 4.145 -0.101 1
1 918 . 10 1 1 A 81 81 GLU C C 81 179.168 178.381 0.787 1
1 919 . 10 1 1 A 81 81 GLU CA C 81 59.036 59.548 -0.512 1
1 920 . 10 1 1 A 81 81 GLU CB C 81 29.561 29.196 0.365 1
1 922 . 10 1 1 A 81 81 GLU N N 81 120.193 118.409 1.784 1
1 923 . 10 1 1 A 82 82 GLU H H 82 8.131 8.202 -0.071 1
1 924 . 10 1 1 A 82 82 GLU HA H 82 4.017 4.081 -0.064 1
1 929 . 10 1 1 A 82 82 GLU C C 82 178.343 177.989 0.354 1
1 930 . 10 1 1 A 82 82 GLU CA C 82 59.319 59.160 0.159 1
1 931 . 10 1 1 A 82 82 GLU CB C 82 29.770 29.151 0.619 1
1 933 . 10 1 1 A 82 82 GLU N N 82 119.626 118.482 1.144 1
1 934 . 10 1 1 A 83 83 ALA H H 83 7.935 7.761 0.174 1
1 935 . 10 1 1 A 83 83 ALA HA H 83 4.180 4.254 -0.074 1
1 939 . 10 1 1 A 83 83 ALA C C 83 179.994 179.421 0.573 1
1 940 . 10 1 1 A 83 83 ALA CA C 83 54.629 53.659 0.970 1
1 941 . 10 1 1 A 83 83 ALA CB C 83 18.090 19.014 -0.924 1
1 942 . 10 1 1 A 83 83 ALA N N 83 121.476 121.686 -0.210 1
1 943 . 10 1 1 A 84 84 PHE H H 84 8.043 8.136 -0.093 1
1 944 . 10 1 1 A 84 84 PHE HA H 84 4.420 4.014 0.406 1
1 952 . 10 1 1 A 84 84 PHE C C 84 177.250 177.077 0.173 1
1 953 . 10 1 1 A 84 84 PHE CA C 84 60.059 61.469 -1.410 1
1 954 . 10 1 1 A 84 84 PHE CB C 84 38.952 39.419 -0.467 1
1 960 . 10 1 1 A 84 84 PHE N N 84 119.074 120.370 -1.296 1
1 961 . 10 1 1 A 85 85 ARG H H 85 8.031 7.896 0.135 1
1 962 . 10 1 1 A 85 85 ARG HA H 85 3.992 4.119 -0.127 1
1 968 . 10 1 1 A 85 85 ARG C C 85 178.319 178.297 0.022 1
1 969 . 10 1 1 A 85 85 ARG CA C 85 58.523 59.546 -1.023 1
1 970 . 10 1 1 A 85 85 ARG CB C 85 30.346 29.952 0.394 1
1 973 . 10 1 1 A 85 85 ARG N N 85 119.291 117.657 1.634 1
1 974 . 10 1 1 A 86 86 GLN H H 86 8.091 7.988 0.103 1
1 975 . 10 1 1 A 86 86 GLN HA H 86 4.148 4.259 -0.111 1
1 982 . 10 1 1 A 86 86 GLN C C 86 177.105 178.318 -1.213 1
1 983 . 10 1 1 A 86 86 GLN CA C 86 57.556 57.465 0.091 1
1 984 . 10 1 1 A 86 86 GLN CB C 86 28.855 29.426 -0.571 1
1 986 . 10 1 1 A 86 86 GLN N N 86 119.097 117.611 1.486 1
1 988 . 10 1 1 A 87 87 LYS H H 87 7.898 8.279 -0.381 1
1 989 . 10 1 1 A 87 87 LYS HA H 87 4.116 4.008 0.108 1
1 997 . 10 1 1 A 87 87 LYS C C 87 177.542 179.421 -1.879 1
1 998 . 10 1 1 A 87 87 LYS CA C 87 57.944 59.472 -1.528 1
1 999 . 10 1 1 A 87 87 LYS CB C 87 32.242 32.036 0.206 1
1 1003 . 10 1 1 A 87 87 LYS N N 87 120.968 121.935 -0.967 1
1 1004 . 10 1 1 A 88 88 LEU H H 88 7.903 7.861 0.042 1
1 1005 . 10 1 1 A 88 88 LEU HA H 88 4.144 3.977 0.167 1
1 1015 . 10 1 1 A 88 88 LEU C C 88 178.221 178.478 -0.257 1
1 1016 . 10 1 1 A 88 88 LEU CA C 88 56.145 57.411 -1.266 1
1 1017 . 10 1 1 A 88 88 LEU CB C 88 42.215 41.495 0.720 1
1 1021 . 10 1 1 A 88 88 LEU N N 88 120.558 117.435 3.123 1
1 1022 . 10 1 1 A 89 89 ALA H H 89 7.894 7.696 0.198 1
1 1023 . 10 1 1 A 89 89 ALA HA H 89 4.224 4.316 -0.092 1
1 1027 . 10 1 1 A 89 89 ALA C C 89 178.609 179.895 -1.286 1
1 1028 . 10 1 1 A 89 89 ALA CA C 89 53.392 54.611 -1.219 1
1 1029 . 10 1 1 A 89 89 ALA CB C 89 18.695 18.868 -0.173 1
1 1030 . 10 1 1 A 89 89 ALA N N 89 122.387 122.542 -0.155 1
1 1031 . 10 1 1 A 90 90 MET H H 90 8.084 7.792 0.292 1
1 1032 . 10 1 1 A 90 90 MET HA H 90 4.356 4.250 0.106 1
1 1040 . 10 1 1 A 90 90 MET C C 90 176.982 176.225 0.757 1
1 1041 . 10 1 1 A 90 90 MET CA C 90 56.551 58.309 -1.758 1
1 1042 . 10 1 1 A 90 90 MET CB C 90 32.719 32.642 0.077 1
1 1045 . 10 1 1 A 90 90 MET N N 90 118.509 115.896 2.613 1
1 1046 . 10 1 1 A 91 91 ASP H H 91 8.261 7.746 0.515 1
1 1047 . 10 1 1 A 91 91 ASP HA H 91 4.524 4.464 0.060 1
1 1050 . 10 1 1 A 91 91 ASP C C 91 176.643 175.684 0.959 1
1 1051 . 10 1 1 A 91 91 ASP CA C 91 54.981 54.001 0.980 1
1 1052 . 10 1 1 A 91 91 ASP CB C 91 40.870 41.319 -0.449 1
1 1053 . 10 1 1 A 91 91 ASP N N 91 120.771 119.839 0.932 1
1 1054 . 10 1 1 A 92 92 ALA H H 92 7.971 8.436 -0.465 1
1 1055 . 10 1 1 A 92 92 ALA HA H 92 4.200 4.472 -0.272 1
1 1059 . 10 1 1 A 92 92 ALA C C 92 177.929 175.971 1.958 1
1 1060 . 10 1 1 A 92 92 ALA CA C 92 53.184 50.649 2.535 1
1 1061 . 10 1 1 A 92 92 ALA CB C 92 18.890 21.614 -2.724 1
1 1062 . 10 1 1 A 92 92 ALA N N 92 123.057 124.650 -1.593 1
1 1063 . 10 1 1 A 93 93 TYR H H 93 8.019 8.457 -0.438 1
1 1064 . 10 1 1 A 93 93 TYR HA H 93 4.523 4.881 -0.358 1
1 1071 . 10 1 1 A 93 93 TYR C C 93 176.279 175.883 0.396 1
1 1072 . 10 1 1 A 93 93 TYR CA C 93 58.401 56.964 1.437 1
1 1073 . 10 1 1 A 93 93 TYR CB C 93 38.669 41.655 -2.986 1
1 1078 . 10 1 1 A 93 93 TYR N N 93 118.337 116.877 1.460 1
1 1079 . 10 1 1 A 94 94 SER H H 94 8.037 8.723 -0.686 1
1 1080 . 10 1 1 A 94 94 SER HA H 94 4.484 4.124 0.360 1
1 1082 . 10 1 1 A 94 94 SER C C 94 174.554 175.102 -0.548 1
1 1083 . 10 1 1 A 94 94 SER CA C 94 58.401 60.460 -2.059 1
1 1084 . 10 1 1 A 94 94 SER CB C 94 63.806 62.965 0.841 1
1 1085 . 10 1 1 A 94 94 SER N N 94 116.640 118.315 -1.675 1
1 1086 . 10 1 1 A 96 96 ASN HA H 96 4.770 4.667 0.103 1
1 1091 . 10 1 1 A 96 96 ASN C C 96 175.161 175.539 -0.378 1
1 1092 . 10 1 1 A 96 96 ASN CA C 96 53.395 55.992 -2.597 1
1 1093 . 10 1 1 A 96 96 ASN CB C 96 38.999 38.473 0.526 1
1 1095 . 10 1 1 A 97 97 SER H H 97 8.230 8.003 0.227 1
1 1096 . 10 1 1 A 97 97 SER HA H 97 4.481 4.913 -0.432 1
1 1099 . 10 1 1 A 97 97 SER C C 97 174.482 172.599 1.883 1
1 1100 . 10 1 1 A 97 97 SER CA C 97 58.300 57.142 1.158 1
1 1101 . 10 1 1 A 97 97 SER CB C 97 63.697 66.567 -2.870 1
1 1102 . 10 1 1 A 97 97 SER N N 97 115.866 111.782 4.084 1
1 1103 . 10 1 1 A 98 98 GLY H H 98 8.228 8.635 -0.407 1
1 1104 . 10 1 1 A 98 98 GLY HA2 H 98 4.098 4.341 -0.243 1
1 1105 . 10 1 1 A 98 98 GLY HA3 H 98 4.098 4.341 -0.243 1
1 1106 . 10 1 1 A 98 98 GLY C C 98 171.788 172.582 -0.794 1
1 1107 . 10 1 1 A 98 98 GLY CA C 98 44.803 43.764 1.039 1
1 1108 . 10 1 1 A 98 98 GLY N N 98 110.658 107.186 3.472 1
1 1109 . 10 1 1 A 99 99 PRO HA H 99 4.463 4.729 -0.266 1
1 1116 . 10 1 1 A 99 99 PRO CA C 99 63.230 62.291 0.939 1
1 1117 . 10 1 1 A 99 99 PRO CB C 99 32.044 29.469 2.575 1
1 1120 . 10 1 1 A 100 100 SER H H 100 8.514 8.400 0.114 1
1 1121 . 10 1 1 A 100 100 SER CA C 100 58.450 58.052 0.398 1
1 1122 . 10 1 1 A 100 100 SER CB C 100 63.889 62.751 1.138 1
1 1 . 11 1 1 A 9 9 ASN H H 9 8.856 8.144 0.712 1
1 2 . 11 1 1 A 9 9 ASN HA H 9 4.694 4.472 0.222 1
1 7 . 11 1 1 A 9 9 ASN CA C 9 53.401 54.045 -0.644 1
1 8 . 11 1 1 A 9 9 ASN CB C 9 38.757 36.289 2.468 1
1 10 . 11 1 1 A 10 10 ARG HA H 10 4.346 4.769 -0.423 1
1 17 . 11 1 1 A 10 10 ARG C C 10 175.405 174.961 0.444 1
1 18 . 11 1 1 A 10 10 ARG CA C 10 56.181 54.923 1.258 1
1 19 . 11 1 1 A 10 10 ARG CB C 10 31.171 30.729 0.442 1
1 22 . 11 1 1 A 11 11 PHE H H 11 8.310 8.312 -0.002 1
1 23 . 11 1 1 A 11 11 PHE HA H 11 4.291 4.811 -0.520 1
1 31 . 11 1 1 A 11 11 PHE C C 11 174.458 172.824 1.634 1
1 32 . 11 1 1 A 11 11 PHE CA C 11 58.967 58.274 0.693 1
1 33 . 11 1 1 A 11 11 PHE CB C 11 40.138 42.069 -1.931 1
1 39 . 11 1 1 A 11 11 PHE N N 11 123.604 125.622 -2.018 1
1 40 . 11 1 1 A 12 12 LYS H H 12 7.307 8.570 -1.263 1
1 41 . 11 1 1 A 12 12 LYS HA H 12 4.165 4.512 -0.347 1
1 50 . 11 1 1 A 12 12 LYS C C 12 174.385 175.653 -1.268 1
1 51 . 11 1 1 A 12 12 LYS CA C 12 54.593 53.894 0.699 1
1 52 . 11 1 1 A 12 12 LYS CB C 12 34.712 35.111 -0.399 1
1 56 . 11 1 1 A 12 12 LYS N N 12 127.282 127.872 -0.590 1
1 57 . 11 1 1 A 13 13 TRP H H 13 8.039 8.231 -0.192 1
1 58 . 11 1 1 A 13 13 TRP HA H 13 4.370 4.539 -0.169 1
1 67 . 11 1 1 A 13 13 TRP C C 13 177.857 177.009 0.848 1
1 68 . 11 1 1 A 13 13 TRP CA C 13 56.675 57.388 -0.713 1
1 69 . 11 1 1 A 13 13 TRP CB C 13 30.317 30.470 -0.153 1
1 75 . 11 1 1 A 13 13 TRP N N 13 124.264 127.375 -3.111 1
1 77 . 11 1 1 A 14 14 GLY H H 14 9.815 8.681 1.134 1
1 78 . 11 1 1 A 14 14 GLY HA2 H 14 4.370 4.156 0.214 1
1 79 . 11 1 1 A 14 14 GLY HA3 H 14 4.335 4.193 0.142 1
1 80 . 11 1 1 A 14 14 GLY C C 14 172.904 174.820 -1.916 1
1 81 . 11 1 1 A 14 14 GLY CA C 14 44.157 44.151 0.006 1
1 82 . 11 1 1 A 14 14 GLY N N 14 115.294 110.530 4.764 1
1 83 . 11 1 1 A 15 15 PRO HA H 15 4.327 4.409 -0.082 1
1 90 . 11 1 1 A 15 15 PRO C C 15 179.726 178.982 0.744 1
1 91 . 11 1 1 A 15 15 PRO CA C 15 65.171 65.450 -0.279 1
1 92 . 11 1 1 A 15 15 PRO CB C 15 31.829 31.778 0.051 1
1 95 . 11 1 1 A 16 16 ALA H H 16 9.214 8.148 1.066 1
1 96 . 11 1 1 A 16 16 ALA HA H 16 4.166 4.111 0.055 1
1 100 . 11 1 1 A 16 16 ALA C C 16 181.184 179.927 1.257 1
1 101 . 11 1 1 A 16 16 ALA CA C 16 55.370 55.215 0.155 1
1 102 . 11 1 1 A 16 16 ALA CB C 16 18.058 18.537 -0.479 1
1 103 . 11 1 1 A 16 16 ALA N N 16 122.414 119.636 2.778 1
1 104 . 11 1 1 A 17 17 SER H H 17 7.985 8.167 -0.182 1
1 105 . 11 1 1 A 17 17 SER HA H 17 4.317 4.147 0.170 1
1 107 . 11 1 1 A 17 17 SER C C 17 175.381 176.815 -1.434 1
1 108 . 11 1 1 A 17 17 SER CA C 17 63.163 62.164 0.999 1
1 109 . 11 1 1 A 17 17 SER CB C 17 64.055 62.980 1.075 1
1 110 . 11 1 1 A 17 17 SER N N 17 116.568 114.027 2.541 1
1 111 . 11 1 1 A 18 18 GLN H H 18 8.316 7.917 0.399 1
1 112 . 11 1 1 A 18 18 GLN HA H 18 3.323 3.518 -0.195 1
1 119 . 11 1 1 A 18 18 GLN C C 18 176.812 178.629 -1.817 1
1 120 . 11 1 1 A 18 18 GLN CA C 18 60.025 59.141 0.884 1
1 121 . 11 1 1 A 18 18 GLN CB C 18 28.686 28.465 0.221 1
1 123 . 11 1 1 A 18 18 GLN N N 18 119.002 121.099 -2.097 1
1 125 . 11 1 1 A 19 19 GLN H H 19 7.582 7.697 -0.115 1
1 126 . 11 1 1 A 19 19 GLN HA H 19 4.062 4.112 -0.050 1
1 133 . 11 1 1 A 19 19 GLN C C 19 178.488 178.538 -0.050 1
1 134 . 11 1 1 A 19 19 GLN CA C 19 59.248 59.205 0.043 1
1 135 . 11 1 1 A 19 19 GLN CB C 19 28.203 28.267 -0.064 1
1 137 . 11 1 1 A 19 19 GLN N N 19 116.221 118.848 -2.627 1
1 139 . 11 1 1 A 20 20 ILE H H 20 7.246 7.991 -0.745 1
1 140 . 11 1 1 A 20 20 ILE HA H 20 3.570 3.635 -0.065 1
1 150 . 11 1 1 A 20 20 ILE C C 20 178.999 178.470 0.529 1
1 151 . 11 1 1 A 20 20 ILE CA C 20 64.996 65.436 -0.440 1
1 152 . 11 1 1 A 20 20 ILE CB C 20 38.139 37.593 0.546 1
1 156 . 11 1 1 A 20 20 ILE N N 20 120.521 120.966 -0.445 1
1 157 . 11 1 1 A 21 21 LEU H H 21 8.034 7.938 0.096 1
1 158 . 11 1 1 A 21 21 LEU HA H 21 3.491 3.547 -0.056 1
1 168 . 11 1 1 A 21 21 LEU C C 21 178.196 178.480 -0.284 1
1 169 . 11 1 1 A 21 21 LEU CA C 21 57.944 57.418 0.526 1
1 170 . 11 1 1 A 21 21 LEU CB C 21 37.864 40.432 -2.568 1
1 174 . 11 1 1 A 21 21 LEU N N 21 121.259 119.202 2.057 1
1 175 . 11 1 1 A 22 22 TYR H H 22 8.479 7.621 0.858 1
1 176 . 11 1 1 A 22 22 TYR HA H 22 4.224 4.285 -0.061 1
1 183 . 11 1 1 A 22 22 TYR C C 22 179.630 178.687 0.943 1
1 184 . 11 1 1 A 22 22 TYR CA C 22 62.422 60.765 1.657 1
1 185 . 11 1 1 A 22 22 TYR CB C 22 37.434 37.687 -0.253 1
1 190 . 11 1 1 A 22 22 TYR N N 22 117.805 118.599 -0.794 1
1 191 . 11 1 1 A 23 23 GLN H H 23 7.707 8.335 -0.628 1
1 192 . 11 1 1 A 23 23 GLN HA H 23 4.166 4.045 0.121 1
1 199 . 11 1 1 A 23 23 GLN C C 23 178.633 178.789 -0.156 1
1 200 . 11 1 1 A 23 23 GLN CA C 23 58.789 59.164 -0.375 1
1 201 . 11 1 1 A 23 23 GLN CB C 23 28.534 28.107 0.427 1
1 203 . 11 1 1 A 23 23 GLN N N 23 117.580 118.358 -0.778 1
1 205 . 11 1 1 A 24 24 ALA H H 24 8.155 7.823 0.332 1
1 206 . 11 1 1 A 24 24 ALA HA H 24 4.187 4.178 0.009 1
1 210 . 11 1 1 A 24 24 ALA C C 24 180.018 179.280 0.738 1
1 211 . 11 1 1 A 24 24 ALA CA C 24 55.228 55.140 0.088 1
1 212 . 11 1 1 A 24 24 ALA CB C 24 19.468 18.472 0.996 1
1 213 . 11 1 1 A 24 24 ALA N N 24 122.813 122.428 0.385 1
1 214 . 11 1 1 A 25 25 TYR H H 25 8.995 8.521 0.474 1
1 215 . 11 1 1 A 25 25 TYR HA H 25 4.348 4.807 -0.459 1
1 222 . 11 1 1 A 25 25 TYR C C 25 175.792 177.360 -1.568 1
1 223 . 11 1 1 A 25 25 TYR CA C 25 61.681 61.871 -0.190 1
1 224 . 11 1 1 A 25 25 TYR CB C 25 38.175 38.553 -0.378 1
1 229 . 11 1 1 A 25 25 TYR N N 25 121.343 120.075 1.268 1
1 230 . 11 1 1 A 26 26 ASP H H 26 7.260 8.879 -1.619 1
1 231 . 11 1 1 A 26 26 ASP HA H 26 4.373 4.449 -0.076 1
1 234 . 11 1 1 A 26 26 ASP C C 26 177.322 178.673 -1.351 1
1 235 . 11 1 1 A 26 26 ASP CA C 26 56.603 57.758 -1.155 1
1 236 . 11 1 1 A 26 26 ASP CB C 26 41.060 41.748 -0.688 1
1 237 . 11 1 1 A 26 26 ASP N N 26 114.020 119.394 -5.374 1
1 238 . 11 1 1 A 27 27 ARG H H 27 7.343 7.891 -0.548 1
1 239 . 11 1 1 A 27 27 ARG HA H 27 4.302 4.379 -0.077 1
1 246 . 11 1 1 A 27 27 ARG C C 27 176.546 176.268 0.278 1
1 247 . 11 1 1 A 27 27 ARG CA C 27 57.563 57.919 -0.356 1
1 248 . 11 1 1 A 27 27 ARG CB C 27 31.500 31.222 0.278 1
1 251 . 11 1 1 A 27 27 ARG N N 27 116.729 117.428 -0.699 1
1 252 . 11 1 1 A 28 28 GLN H H 28 8.306 8.009 0.297 1
1 253 . 11 1 1 A 28 28 GLN HA H 28 4.396 4.694 -0.298 1
1 260 . 11 1 1 A 28 28 GLN C C 28 172.831 175.255 -2.424 1
1 261 . 11 1 1 A 28 28 GLN CA C 28 55.355 54.547 0.808 1
1 262 . 11 1 1 A 28 28 GLN CB C 28 31.062 31.453 -0.391 1
1 264 . 11 1 1 A 28 28 GLN N N 28 121.612 118.366 3.246 1
1 266 . 11 1 1 A 29 29 LYS H H 29 8.354 8.471 -0.117 1
1 267 . 11 1 1 A 29 29 LYS HA H 29 4.099 3.482 0.617 1
1 276 . 11 1 1 A 29 29 LYS C C 29 176.084 176.781 -0.697 1
1 277 . 11 1 1 A 29 29 LYS CA C 29 57.873 57.978 -0.105 1
1 278 . 11 1 1 A 29 29 LYS CB C 29 33.313 32.699 0.614 1
1 282 . 11 1 1 A 29 29 LYS N N 29 125.038 124.234 0.804 1
1 283 . 11 1 1 A 30 30 ASN H H 30 8.856 8.177 0.679 1
1 284 . 11 1 1 A 30 30 ASN HA H 30 4.958 4.957 0.001 1
1 289 . 11 1 1 A 30 30 ASN C C 30 171.179 173.889 -2.710 1
1 290 . 11 1 1 A 30 30 ASN CA C 30 50.891 50.620 0.271 1
1 291 . 11 1 1 A 30 30 ASN CB C 30 39.907 38.754 1.153 1
1 292 . 11 1 1 A 30 30 ASN N N 30 115.764 114.522 1.242 1
1 294 . 11 1 1 A 31 31 PRO HA H 31 4.299 4.428 -0.129 1
1 301 . 11 1 1 A 31 31 PRO C C 31 177.493 176.725 0.768 1
1 302 . 11 1 1 A 31 31 PRO CA C 31 62.489 62.577 -0.088 1
1 303 . 11 1 1 A 31 31 PRO CB C 31 31.216 31.665 -0.449 1
1 306 . 11 1 1 A 32 32 SER H H 32 9.368 8.483 0.885 1
1 307 . 11 1 1 A 32 32 SER HA H 32 4.372 4.750 -0.378 1
1 310 . 11 1 1 A 32 32 SER C C 32 174.821 175.749 -0.928 1
1 311 . 11 1 1 A 32 32 SER CA C 32 57.203 57.818 -0.615 1
1 312 . 11 1 1 A 32 32 SER CB C 32 65.594 64.496 1.098 1
1 313 . 11 1 1 A 32 32 SER N N 32 120.847 117.864 2.983 1
1 314 . 11 1 1 A 33 33 LYS H H 33 9.152 8.969 0.183 1
1 315 . 11 1 1 A 33 33 LYS HA H 33 3.719 3.853 -0.134 1
1 324 . 11 1 1 A 33 33 LYS C C 33 177.833 178.230 -0.397 1
1 325 . 11 1 1 A 33 33 LYS CA C 33 61.188 60.318 0.870 1
1 326 . 11 1 1 A 33 33 LYS CB C 33 32.572 32.400 0.172 1
1 330 . 11 1 1 A 33 33 LYS N N 33 122.966 124.724 -1.758 1
1 331 . 11 1 1 A 34 34 GLU H H 34 8.902 8.488 0.414 1
1 332 . 11 1 1 A 34 34 GLU HA H 34 4.089 4.055 0.034 1
1 337 . 11 1 1 A 34 34 GLU C C 34 180.286 178.916 1.370 1
1 338 . 11 1 1 A 34 34 GLU CA C 34 60.483 59.690 0.793 1
1 339 . 11 1 1 A 34 34 GLU CB C 34 28.835 29.144 -0.309 1
1 341 . 11 1 1 A 34 34 GLU N N 34 117.645 118.041 -0.396 1
1 342 . 11 1 1 A 35 35 GLU H H 35 7.673 8.136 -0.463 1
1 343 . 11 1 1 A 35 35 GLU HA H 35 4.023 3.974 0.049 1
1 348 . 11 1 1 A 35 35 GLU C C 35 180.237 179.225 1.012 1
1 349 . 11 1 1 A 35 35 GLU CA C 35 59.214 59.233 -0.019 1
1 350 . 11 1 1 A 35 35 GLU CB C 35 30.099 29.308 0.791 1
1 352 . 11 1 1 A 35 35 GLU N N 35 121.077 120.682 0.395 1
1 353 . 11 1 1 A 36 36 ARG H H 36 8.932 8.274 0.658 1
1 354 . 11 1 1 A 36 36 ARG HA H 36 3.928 3.748 0.180 1
1 362 . 11 1 1 A 36 36 ARG C C 36 178.464 178.975 -0.511 1
1 363 . 11 1 1 A 36 36 ARG CA C 36 60.974 60.096 0.878 1
1 364 . 11 1 1 A 36 36 ARG CB C 36 31.171 29.821 1.350 1
1 367 . 11 1 1 A 36 36 ARG N N 36 119.441 120.067 -0.626 1
1 369 . 11 1 1 A 37 37 GLU H H 37 8.756 8.409 0.347 1
1 370 . 11 1 1 A 37 37 GLU HA H 37 3.948 4.110 -0.162 1
1 375 . 11 1 1 A 37 37 GLU C C 37 179.606 178.834 0.772 1
1 376 . 11 1 1 A 37 37 GLU CA C 37 60.094 58.885 1.209 1
1 377 . 11 1 1 A 37 37 GLU CB C 37 29.110 29.394 -0.284 1
1 379 . 11 1 1 A 37 37 GLU N N 37 119.017 119.949 -0.932 1
1 380 . 11 1 1 A 38 38 ALA H H 38 7.733 7.976 -0.243 1
1 381 . 11 1 1 A 38 38 ALA HA H 38 4.325 4.098 0.227 1
1 385 . 11 1 1 A 38 38 ALA C C 38 180.820 178.612 2.208 1
1 386 . 11 1 1 A 38 38 ALA CA C 38 55.194 54.515 0.679 1
1 387 . 11 1 1 A 38 38 ALA CB C 38 17.654 18.527 -0.873 1
1 388 . 11 1 1 A 38 38 ALA N N 38 122.889 121.953 0.936 1
1 389 . 11 1 1 A 39 39 LEU H H 39 7.740 7.612 0.128 1
1 390 . 11 1 1 A 39 39 LEU HA H 39 4.176 4.276 -0.100 1
1 400 . 11 1 1 A 39 39 LEU C C 39 179.266 178.856 0.410 1
1 401 . 11 1 1 A 39 39 LEU CA C 39 57.944 56.268 1.676 1
1 402 . 11 1 1 A 39 39 LEU CB C 39 42.105 42.285 -0.180 1
1 406 . 11 1 1 A 39 39 LEU N N 39 119.783 116.922 2.861 1
1 407 . 11 1 1 A 40 40 VAL H H 40 8.451 8.306 0.145 1
1 408 . 11 1 1 A 40 40 VAL HA H 40 3.259 3.604 -0.345 1
1 416 . 11 1 1 A 40 40 VAL C C 40 177.153 177.547 -0.394 1
1 417 . 11 1 1 A 40 40 VAL CA C 40 67.254 67.132 0.122 1
1 418 . 11 1 1 A 40 40 VAL CB C 40 31.747 31.437 0.310 1
1 421 . 11 1 1 A 40 40 VAL N N 40 121.481 119.944 1.537 1
1 422 . 11 1 1 A 41 41 GLU H H 41 7.254 8.141 -0.887 1
1 423 . 11 1 1 A 41 41 GLU HA H 41 4.159 4.127 0.032 1
1 428 . 11 1 1 A 41 41 GLU C C 41 179.483 178.824 0.659 1
1 429 . 11 1 1 A 41 41 GLU CA C 41 59.248 59.328 -0.080 1
1 430 . 11 1 1 A 41 41 GLU CB C 41 29.358 29.492 -0.134 1
1 432 . 11 1 1 A 41 41 GLU N N 41 116.549 119.886 -3.337 1
1 433 . 11 1 1 A 42 42 GLU H H 42 8.103 7.817 0.286 1
1 434 . 11 1 1 A 42 42 GLU HA H 42 4.020 4.048 -0.028 1
1 439 . 11 1 1 A 42 42 GLU C C 42 180.115 178.806 1.309 1
1 440 . 11 1 1 A 42 42 GLU CA C 42 59.847 59.516 0.331 1
1 441 . 11 1 1 A 42 42 GLU CB C 42 30.218 29.450 0.768 1
1 443 . 11 1 1 A 42 42 GLU N N 42 119.578 119.380 0.198 1
1 444 . 11 1 1 A 43 43 CYS H H 43 8.955 8.149 0.806 1
1 445 . 11 1 1 A 43 43 CYS HA H 43 4.153 4.248 -0.095 1
1 448 . 11 1 1 A 43 43 CYS C C 43 176.498 177.635 -1.137 1
1 449 . 11 1 1 A 43 43 CYS CA C 43 64.856 62.386 2.470 1
1 450 . 11 1 1 A 43 43 CYS CB C 43 27.390 27.899 -0.509 1
1 451 . 11 1 1 A 43 43 CYS N N 43 118.199 118.922 -0.723 1
1 452 . 11 1 1 A 44 44 ASN H H 44 8.543 8.304 0.239 1
1 453 . 11 1 1 A 44 44 ASN HA H 44 4.635 4.402 0.233 1
1 458 . 11 1 1 A 44 44 ASN C C 44 178.633 177.520 1.113 1
1 459 . 11 1 1 A 44 44 ASN CA C 44 56.603 56.388 0.215 1
1 460 . 11 1 1 A 44 44 ASN CB C 44 37.187 38.159 -0.972 1
1 461 . 11 1 1 A 44 44 ASN N N 44 117.002 119.682 -2.680 1
1 463 . 11 1 1 A 45 45 ARG H H 45 8.296 8.259 0.037 1
1 464 . 11 1 1 A 45 45 ARG HA H 45 3.977 4.064 -0.087 1
1 471 . 11 1 1 A 45 45 ARG C C 45 178.149 178.308 -0.159 1
1 472 . 11 1 1 A 45 45 ARG CA C 45 60.589 59.552 1.037 1
1 473 . 11 1 1 A 45 45 ARG CB C 45 30.099 30.242 -0.143 1
1 476 . 11 1 1 A 45 45 ARG N N 45 121.021 121.026 -0.005 1
1 477 . 11 1 1 A 46 46 ALA H H 46 7.914 8.324 -0.410 1
1 478 . 11 1 1 A 46 46 ALA HA H 46 4.128 4.125 0.003 1
1 482 . 11 1 1 A 46 46 ALA C C 46 181.208 180.204 1.004 1
1 483 . 11 1 1 A 46 46 ALA CA C 46 55.264 54.930 0.334 1
1 484 . 11 1 1 A 46 46 ALA CB C 46 18.759 18.336 0.423 1
1 485 . 11 1 1 A 46 46 ALA N N 46 121.570 120.773 0.797 1
1 486 . 11 1 1 A 47 47 GLU H H 47 8.730 8.677 0.053 1
1 487 . 11 1 1 A 47 47 GLU HA H 47 4.194 4.055 0.139 1
1 492 . 11 1 1 A 47 47 GLU C C 47 180.115 179.114 1.001 1
1 493 . 11 1 1 A 47 47 GLU CA C 47 58.401 59.524 -1.123 1
1 494 . 11 1 1 A 47 47 GLU CB C 47 29.523 29.354 0.169 1
1 496 . 11 1 1 A 47 47 GLU N N 47 117.532 118.269 -0.737 1
1 497 . 11 1 1 A 48 48 CYS H H 48 8.283 7.932 0.351 1
1 498 . 11 1 1 A 48 48 CYS HA H 48 4.002 4.119 -0.117 1
1 501 . 11 1 1 A 48 48 CYS C C 48 177.031 177.393 -0.362 1
1 502 . 11 1 1 A 48 48 CYS CA C 48 64.749 64.022 0.727 1
1 503 . 11 1 1 A 48 48 CYS CB C 48 25.907 27.250 -1.343 1
1 504 . 11 1 1 A 48 48 CYS N N 48 118.282 119.088 -0.806 1
1 505 . 11 1 1 A 49 49 LEU H H 49 8.181 8.042 0.139 1
1 506 . 11 1 1 A 49 49 LEU HA H 49 4.175 3.893 0.282 1
1 516 . 11 1 1 A 49 49 LEU C C 49 180.430 178.716 1.714 1
1 517 . 11 1 1 A 49 49 LEU CA C 49 57.873 58.182 -0.309 1
1 518 . 11 1 1 A 49 49 LEU CB C 49 41.539 41.709 -0.170 1
1 522 . 11 1 1 A 49 49 LEU N N 49 120.371 120.904 -0.533 1
1 523 . 11 1 1 A 50 50 GLN H H 50 7.934 8.674 -0.740 1
1 524 . 11 1 1 A 50 50 GLN HA H 50 4.102 4.071 0.031 1
1 531 . 11 1 1 A 50 50 GLN C C 50 177.322 177.275 0.047 1
1 532 . 11 1 1 A 50 50 GLN CA C 50 58.156 58.693 -0.537 1
1 533 . 11 1 1 A 50 50 GLN CB C 50 28.616 28.512 0.104 1
1 535 . 11 1 1 A 50 50 GLN N N 50 118.175 117.516 0.659 1
1 537 . 11 1 1 A 51 51 ARG H H 51 7.632 7.665 -0.033 1
1 538 . 11 1 1 A 51 51 ARG HA H 51 4.347 4.362 -0.015 1
1 545 . 11 1 1 A 51 51 ARG C C 51 176.546 176.482 0.064 1
1 546 . 11 1 1 A 51 51 ARG CA C 51 56.286 55.931 0.355 1
1 547 . 11 1 1 A 51 51 ARG CB C 51 31.314 30.214 1.100 1
1 550 . 11 1 1 A 51 51 ARG N N 51 116.454 117.853 -1.399 1
1 551 . 11 1 1 A 52 52 GLY H H 52 7.949 8.245 -0.296 1
1 552 . 11 1 1 A 52 52 GLY HA2 H 52 4.033 3.971 0.062 1
1 553 . 11 1 1 A 52 52 GLY HA3 H 52 3.903 3.972 -0.069 1
1 554 . 11 1 1 A 52 52 GLY C C 52 174.385 174.208 0.177 1
1 555 . 11 1 1 A 52 52 GLY CA C 52 46.231 45.289 0.942 1
1 556 . 11 1 1 A 52 52 GLY N N 52 108.854 107.551 1.303 1
1 557 . 11 1 1 A 53 53 VAL H H 53 7.944 7.542 0.402 1
1 558 . 11 1 1 A 53 53 VAL HA H 53 4.250 4.069 0.181 1
1 566 . 11 1 1 A 53 53 VAL C C 53 175.525 175.144 0.381 1
1 567 . 11 1 1 A 53 53 VAL CA C 53 60.377 62.520 -2.143 1
1 568 . 11 1 1 A 53 53 VAL CB C 53 34.283 32.850 1.433 1
1 571 . 11 1 1 A 53 53 VAL N N 53 118.316 120.816 -2.500 1
1 572 . 11 1 1 A 54 54 SER H H 54 8.502 8.508 -0.006 1
1 573 . 11 1 1 A 54 54 SER HA H 54 4.625 4.937 -0.312 1
1 576 . 11 1 1 A 54 54 SER C C 54 174.603 174.098 0.505 1
1 577 . 11 1 1 A 54 54 SER CA C 54 56.092 54.202 1.890 1
1 578 . 11 1 1 A 54 54 SER CB C 54 63.697 63.727 -0.030 1
1 579 . 11 1 1 A 54 54 SER N N 54 120.337 118.284 2.053 1
1 580 . 11 1 1 A 55 55 PRO HA H 55 4.624 4.542 0.082 1
1 587 . 11 1 1 A 55 55 PRO C C 55 177.322 177.754 -0.432 1
1 588 . 11 1 1 A 55 55 PRO CA C 55 64.431 64.260 0.171 1
1 589 . 11 1 1 A 55 55 PRO CB C 55 31.913 31.729 0.184 1
1 592 . 11 1 1 A 56 56 SER H H 56 7.931 8.284 -0.353 1
1 593 . 11 1 1 A 56 56 SER HA H 56 4.428 4.485 -0.057 1
1 596 . 11 1 1 A 56 56 SER C C 56 174.749 175.355 -0.606 1
1 597 . 11 1 1 A 56 56 SER CA C 56 59.130 59.562 -0.432 1
1 598 . 11 1 1 A 56 56 SER CB C 56 63.056 63.861 -0.805 1
1 599 . 11 1 1 A 56 56 SER N N 56 112.637 112.816 -0.179 1
1 600 . 11 1 1 A 57 57 LYS H H 57 8.121 7.623 0.498 1
1 601 . 11 1 1 A 57 57 LYS HA H 57 4.467 5.145 -0.678 1
1 609 . 11 1 1 A 57 57 LYS C C 57 176.570 176.304 0.266 1
1 610 . 11 1 1 A 57 57 LYS CA C 57 55.264 55.228 0.036 1
1 611 . 11 1 1 A 57 57 LYS CB C 57 32.160 32.622 -0.462 1
1 615 . 11 1 1 A 57 57 LYS N N 57 123.185 118.036 5.149 1
1 616 . 11 1 1 A 58 58 ALA H H 58 7.886 7.990 -0.104 1
1 617 . 11 1 1 A 58 58 ALA HA H 58 3.923 3.944 -0.021 1
1 621 . 11 1 1 A 58 58 ALA C C 58 177.469 179.913 -2.444 1
1 622 . 11 1 1 A 58 58 ALA CA C 58 54.276 54.957 -0.681 1
1 623 . 11 1 1 A 58 58 ALA CB C 58 18.271 18.279 -0.008 1
1 624 . 11 1 1 A 58 58 ALA N N 58 123.941 123.007 0.934 1
1 625 . 11 1 1 A 59 59 HIS H H 59 8.077 8.326 -0.249 1
1 626 . 11 1 1 A 59 59 HIS HA H 59 4.420 4.397 0.023 1
1 631 . 11 1 1 A 59 59 HIS C C 59 177.542 176.204 1.338 1
1 632 . 11 1 1 A 59 59 HIS CA C 59 57.767 58.556 -0.789 1
1 633 . 11 1 1 A 59 59 HIS CB C 59 29.852 28.580 1.272 1
1 636 . 11 1 1 A 59 59 HIS N N 59 115.566 115.333 0.233 1
1 637 . 11 1 1 A 60 60 GLY H H 60 8.110 7.817 0.293 1
1 638 . 11 1 1 A 60 60 GLY HA2 H 60 3.873 3.645 0.228 1
1 639 . 11 1 1 A 60 60 GLY HA3 H 60 4.025 3.766 0.259 1
1 640 . 11 1 1 A 60 60 GLY C C 60 174.918 174.554 0.364 1
1 641 . 11 1 1 A 60 60 GLY CA C 60 45.559 46.006 -0.447 1
1 642 . 11 1 1 A 60 60 GLY N N 60 109.216 108.481 0.735 1
1 643 . 11 1 1 A 61 61 LEU H H 61 8.280 7.472 0.808 1
1 644 . 11 1 1 A 61 61 LEU HA H 61 4.198 4.428 -0.230 1
1 654 . 11 1 1 A 61 61 LEU C C 61 178.900 177.575 1.325 1
1 655 . 11 1 1 A 61 61 LEU CA C 61 55.758 54.901 0.857 1
1 656 . 11 1 1 A 61 61 LEU CB C 61 42.544 43.426 -0.882 1
1 660 . 11 1 1 A 61 61 LEU N N 61 120.521 117.714 2.807 1
1 661 . 11 1 1 A 62 62 GLY H H 62 8.184 8.162 0.022 1
1 662 . 11 1 1 A 62 62 GLY HA2 H 62 3.978 3.885 0.093 1
1 663 . 11 1 1 A 62 62 GLY HA3 H 62 3.817 3.890 -0.073 1
1 664 . 11 1 1 A 62 62 GLY C C 62 176.012 175.290 0.722 1
1 665 . 11 1 1 A 62 62 GLY CA C 62 46.767 47.305 -0.538 1
1 666 . 11 1 1 A 62 62 GLY N N 62 108.987 110.186 -1.199 1
1 667 . 11 1 1 A 63 63 SER HA H 63 4.322 4.245 0.077 1
1 670 . 11 1 1 A 63 63 SER C C 63 174.167 175.644 -1.477 1
1 671 . 11 1 1 A 63 63 SER CA C 63 59.919 62.066 -2.147 1
1 672 . 11 1 1 A 63 63 SER CB C 63 63.312 62.962 0.350 1
1 673 . 11 1 1 A 64 64 ASN H H 64 8.087 7.671 0.416 1
1 674 . 11 1 1 A 64 64 ASN HA H 64 4.850 5.049 -0.199 1
1 679 . 11 1 1 A 64 64 ASN C C 64 173.899 175.117 -1.218 1
1 680 . 11 1 1 A 64 64 ASN CA C 64 53.218 54.414 -1.196 1
1 681 . 11 1 1 A 64 64 ASN CB C 64 39.164 38.477 0.687 1
1 682 . 11 1 1 A 64 64 ASN N N 64 118.041 116.819 1.222 1
1 684 . 11 1 1 A 65 65 LEU H H 65 7.293 7.089 0.204 1
1 685 . 11 1 1 A 65 65 LEU HA H 65 3.995 4.327 -0.332 1
1 695 . 11 1 1 A 65 65 LEU C C 65 175.696 175.136 0.560 1
1 696 . 11 1 1 A 65 65 LEU CA C 65 56.005 55.312 0.693 1
1 697 . 11 1 1 A 65 65 LEU CB C 65 43.120 42.805 0.315 1
1 701 . 11 1 1 A 65 65 LEU N N 65 120.953 122.843 -1.890 1
1 702 . 11 1 1 A 66 66 VAL H H 66 9.517 8.560 0.957 1
1 703 . 11 1 1 A 66 66 VAL HA H 66 3.481 4.346 -0.865 1
1 711 . 11 1 1 A 66 66 VAL C C 66 175.429 174.830 0.599 1
1 712 . 11 1 1 A 66 66 VAL CA C 66 65.243 60.902 4.341 1
1 713 . 11 1 1 A 66 66 VAL CB C 66 31.335 33.479 -2.144 1
1 716 . 11 1 1 A 66 66 VAL N N 66 127.924 126.485 1.439 1
1 717 . 11 1 1 A 67 67 THR H H 67 6.253 8.295 -2.042 1
1 718 . 11 1 1 A 67 67 THR HA H 67 4.779 4.706 0.073 1
1 723 . 11 1 1 A 67 67 THR C C 67 174.894 174.764 0.130 1
1 724 . 11 1 1 A 67 67 THR CA C 67 58.719 59.592 -0.873 1
1 725 . 11 1 1 A 67 67 THR CB C 67 72.153 71.759 0.394 1
1 727 . 11 1 1 A 67 67 THR N N 67 113.376 116.066 -2.690 1
1 728 . 11 1 1 A 68 68 GLU H H 68 9.348 8.867 0.481 1
1 729 . 11 1 1 A 68 68 GLU HA H 68 3.634 4.020 -0.386 1
1 734 . 11 1 1 A 68 68 GLU C C 68 177.809 178.339 -0.530 1
1 735 . 11 1 1 A 68 68 GLU CA C 68 61.505 60.004 1.501 1
1 736 . 11 1 1 A 68 68 GLU CB C 68 28.285 29.610 -1.325 1
1 738 . 11 1 1 A 68 68 GLU N N 68 124.534 122.163 2.371 1
1 739 . 11 1 1 A 69 69 VAL H H 69 8.126 7.914 0.212 1
1 740 . 11 1 1 A 69 69 VAL HA H 69 3.862 3.538 0.324 1
1 748 . 11 1 1 A 69 69 VAL C C 69 177.712 178.107 -0.395 1
1 749 . 11 1 1 A 69 69 VAL CA C 69 65.701 66.807 -1.106 1
1 750 . 11 1 1 A 69 69 VAL CB C 69 31.829 31.658 0.171 1
1 753 . 11 1 1 A 69 69 VAL N N 69 119.139 119.956 -0.817 1
1 754 . 11 1 1 A 70 70 ARG H H 70 7.235 8.330 -1.095 1
1 755 . 11 1 1 A 70 70 ARG HA H 70 4.265 4.075 0.190 1
1 762 . 11 1 1 A 70 70 ARG C C 70 180.430 179.419 1.011 1
1 763 . 11 1 1 A 70 70 ARG CA C 70 59.742 60.243 -0.501 1
1 764 . 11 1 1 A 70 70 ARG CB C 70 29.439 29.941 -0.502 1
1 767 . 11 1 1 A 70 70 ARG N N 70 119.541 119.070 0.471 1
1 768 . 11 1 1 A 71 71 VAL H H 71 8.144 8.162 -0.018 1
1 769 . 11 1 1 A 71 71 VAL HA H 71 4.018 4.055 -0.037 1
1 777 . 11 1 1 A 71 71 VAL C C 71 177.493 178.075 -0.582 1
1 778 . 11 1 1 A 71 71 VAL CA C 71 67.924 66.501 1.423 1
1 779 . 11 1 1 A 71 71 VAL CB C 71 32.289 31.705 0.584 1
1 782 . 11 1 1 A 71 71 VAL N N 71 120.755 120.316 0.439 1
1 783 . 11 1 1 A 72 72 TYR H H 72 9.411 8.479 0.932 1
1 784 . 11 1 1 A 72 72 TYR HA H 72 3.908 4.224 -0.316 1
1 791 . 11 1 1 A 72 72 TYR C C 72 178.464 178.128 0.336 1
1 792 . 11 1 1 A 72 72 TYR CA C 72 63.444 61.752 1.692 1
1 793 . 11 1 1 A 72 72 TYR CB C 72 38.211 38.786 -0.575 1
1 798 . 11 1 1 A 72 72 TYR N N 72 121.175 121.429 -0.254 1
1 799 . 11 1 1 A 73 73 ASN H H 73 8.816 8.704 0.112 1
1 800 . 11 1 1 A 73 73 ASN HA H 73 4.538 4.620 -0.082 1
1 805 . 11 1 1 A 73 73 ASN C C 73 176.958 178.006 -1.048 1
1 806 . 11 1 1 A 73 73 ASN CA C 73 56.109 56.678 -0.569 1
1 807 . 11 1 1 A 73 73 ASN CB C 73 38.422 38.697 -0.275 1
1 808 . 11 1 1 A 73 73 ASN N N 73 118.122 117.846 0.276 1
1 810 . 11 1 1 A 74 74 TRP H H 74 8.657 8.390 0.267 1
1 811 . 11 1 1 A 74 74 TRP HA H 74 4.111 4.487 -0.376 1
1 820 . 11 1 1 A 74 74 TRP C C 74 179.654 178.498 1.156 1
1 821 . 11 1 1 A 74 74 TRP CA C 74 62.950 61.367 1.583 1
1 822 . 11 1 1 A 74 74 TRP CB C 74 29.555 29.678 -0.123 1
1 828 . 11 1 1 A 74 74 TRP N N 74 123.988 123.024 0.964 1
1 830 . 11 1 1 A 75 75 PHE H H 75 8.562 8.399 0.163 1
1 831 . 11 1 1 A 75 75 PHE HA H 75 3.821 4.416 -0.595 1
1 839 . 11 1 1 A 75 75 PHE C C 75 177.614 178.068 -0.454 1
1 840 . 11 1 1 A 75 75 PHE CA C 75 63.374 62.057 1.317 1
1 841 . 11 1 1 A 75 75 PHE CB C 75 39.648 38.471 1.177 1
1 847 . 11 1 1 A 75 75 PHE N N 75 118.325 117.168 1.157 1
1 848 . 11 1 1 A 76 76 ALA H H 76 8.305 8.292 0.013 1
1 849 . 11 1 1 A 76 76 ALA HA H 76 3.909 3.894 0.015 1
1 853 . 11 1 1 A 76 76 ALA C C 76 180.868 179.690 1.178 1
1 854 . 11 1 1 A 76 76 ALA CA C 76 55.566 55.160 0.406 1
1 855 . 11 1 1 A 76 76 ALA CB C 76 17.820 18.062 -0.242 1
1 856 . 11 1 1 A 76 76 ALA N N 76 121.119 122.443 -1.324 1
1 857 . 11 1 1 A 77 77 ASN H H 77 8.335 7.947 0.388 1
1 858 . 11 1 1 A 77 77 ASN HA H 77 4.355 4.348 0.007 1
1 863 . 11 1 1 A 77 77 ASN C C 77 177.105 177.537 -0.432 1
1 864 . 11 1 1 A 77 77 ASN CA C 77 56.145 56.136 0.009 1
1 865 . 11 1 1 A 77 77 ASN CB C 77 38.063 38.640 -0.577 1
1 866 . 11 1 1 A 77 77 ASN N N 77 117.433 116.394 1.039 1
1 868 . 11 1 1 A 78 78 ARG H H 78 7.664 7.237 0.427 1
1 869 . 11 1 1 A 78 78 ARG HA H 78 3.629 3.776 -0.147 1
1 876 . 11 1 1 A 78 78 ARG C C 78 179.216 177.190 2.026 1
1 877 . 11 1 1 A 78 78 ARG CA C 78 58.773 58.416 0.357 1
1 878 . 11 1 1 A 78 78 ARG CB C 78 29.605 29.339 0.266 1
1 881 . 11 1 1 A 78 78 ARG N N 78 121.999 118.632 3.367 1
1 882 . 11 1 1 A 79 79 ARG H H 79 8.320 7.558 0.762 1
1 883 . 11 1 1 A 79 79 ARG HA H 79 4.307 4.441 -0.134 1
1 890 . 11 1 1 A 79 79 ARG C C 79 180.406 178.355 2.051 1
1 891 . 11 1 1 A 79 79 ARG CA C 79 60.270 57.022 3.248 1
1 892 . 11 1 1 A 79 79 ARG CB C 79 31.335 30.737 0.598 1
1 895 . 11 1 1 A 79 79 ARG N N 79 118.139 117.817 0.322 1
1 896 . 11 1 1 A 80 80 LYS H H 80 7.759 8.142 -0.383 1
1 897 . 11 1 1 A 80 80 LYS HA H 80 4.052 4.106 -0.054 1
1 905 . 11 1 1 A 80 80 LYS C C 80 178.999 178.574 0.425 1
1 906 . 11 1 1 A 80 80 LYS CA C 80 59.531 59.030 0.501 1
1 907 . 11 1 1 A 80 80 LYS CB C 80 32.374 31.953 0.421 1
1 911 . 11 1 1 A 80 80 LYS N N 80 120.899 118.525 2.374 1
1 912 . 11 1 1 A 81 81 GLU H H 81 8.041 8.144 -0.103 1
1 913 . 11 1 1 A 81 81 GLU HA H 81 4.044 4.175 -0.131 1
1 918 . 11 1 1 A 81 81 GLU C C 81 179.168 178.607 0.561 1
1 919 . 11 1 1 A 81 81 GLU CA C 81 59.036 59.597 -0.561 1
1 920 . 11 1 1 A 81 81 GLU CB C 81 29.561 29.167 0.394 1
1 922 . 11 1 1 A 81 81 GLU N N 81 120.193 120.406 -0.213 1
1 923 . 11 1 1 A 82 82 GLU H H 82 8.131 8.602 -0.471 1
1 924 . 11 1 1 A 82 82 GLU HA H 82 4.017 4.094 -0.077 1
1 929 . 11 1 1 A 82 82 GLU C C 82 178.343 178.138 0.205 1
1 930 . 11 1 1 A 82 82 GLU CA C 82 59.319 59.311 0.008 1
1 931 . 11 1 1 A 82 82 GLU CB C 82 29.770 29.060 0.710 1
1 933 . 11 1 1 A 82 82 GLU N N 82 119.626 118.762 0.864 1
1 934 . 11 1 1 A 83 83 ALA H H 83 7.935 7.649 0.286 1
1 935 . 11 1 1 A 83 83 ALA HA H 83 4.180 4.233 -0.053 1
1 939 . 11 1 1 A 83 83 ALA C C 83 179.994 179.419 0.575 1
1 940 . 11 1 1 A 83 83 ALA CA C 83 54.629 53.701 0.928 1
1 941 . 11 1 1 A 83 83 ALA CB C 83 18.090 18.972 -0.882 1
1 942 . 11 1 1 A 83 83 ALA N N 83 121.476 122.011 -0.535 1
1 943 . 11 1 1 A 84 84 PHE H H 84 8.043 8.133 -0.090 1
1 944 . 11 1 1 A 84 84 PHE HA H 84 4.420 4.052 0.368 1
1 952 . 11 1 1 A 84 84 PHE C C 84 177.250 177.067 0.183 1
1 953 . 11 1 1 A 84 84 PHE CA C 84 60.059 61.723 -1.664 1
1 954 . 11 1 1 A 84 84 PHE CB C 84 38.952 39.290 -0.338 1
1 960 . 11 1 1 A 84 84 PHE N N 84 119.074 120.546 -1.472 1
1 961 . 11 1 1 A 85 85 ARG H H 85 8.031 8.386 -0.355 1
1 962 . 11 1 1 A 85 85 ARG HA H 85 3.992 4.109 -0.117 1
1 968 . 11 1 1 A 85 85 ARG C C 85 178.319 178.813 -0.494 1
1 969 . 11 1 1 A 85 85 ARG CA C 85 58.523 59.649 -1.126 1
1 970 . 11 1 1 A 85 85 ARG CB C 85 30.346 30.076 0.270 1
1 973 . 11 1 1 A 85 85 ARG N N 85 119.291 117.648 1.643 1
1 974 . 11 1 1 A 86 86 GLN H H 86 8.091 7.930 0.161 1
1 975 . 11 1 1 A 86 86 GLN HA H 86 4.148 4.172 -0.024 1
1 982 . 11 1 1 A 86 86 GLN C C 86 177.105 178.318 -1.213 1
1 983 . 11 1 1 A 86 86 GLN CA C 86 57.556 57.971 -0.415 1
1 984 . 11 1 1 A 86 86 GLN CB C 86 28.855 28.889 -0.034 1
1 986 . 11 1 1 A 86 86 GLN N N 86 119.097 117.837 1.260 1
1 988 . 11 1 1 A 87 87 LYS H H 87 7.898 8.372 -0.474 1
1 989 . 11 1 1 A 87 87 LYS HA H 87 4.116 4.008 0.108 1
1 997 . 11 1 1 A 87 87 LYS C C 87 177.542 179.130 -1.588 1
1 998 . 11 1 1 A 87 87 LYS CA C 87 57.944 59.362 -1.418 1
1 999 . 11 1 1 A 87 87 LYS CB C 87 32.242 31.825 0.417 1
1 1003 . 11 1 1 A 87 87 LYS N N 87 120.968 121.736 -0.768 1
1 1004 . 11 1 1 A 88 88 LEU H H 88 7.903 8.175 -0.272 1
1 1005 . 11 1 1 A 88 88 LEU HA H 88 4.144 4.250 -0.106 1
1 1015 . 11 1 1 A 88 88 LEU C C 88 178.221 177.716 0.505 1
1 1016 . 11 1 1 A 88 88 LEU CA C 88 56.145 57.044 -0.899 1
1 1017 . 11 1 1 A 88 88 LEU CB C 88 42.215 41.438 0.777 1
1 1021 . 11 1 1 A 88 88 LEU N N 88 120.558 117.142 3.416 1
1 1022 . 11 1 1 A 89 89 ALA H H 89 7.894 7.631 0.263 1
1 1023 . 11 1 1 A 89 89 ALA HA H 89 4.224 4.162 0.062 1
1 1027 . 11 1 1 A 89 89 ALA C C 89 178.609 178.257 0.352 1
1 1028 . 11 1 1 A 89 89 ALA CA C 89 53.392 52.746 0.646 1
1 1029 . 11 1 1 A 89 89 ALA CB C 89 18.695 19.449 -0.754 1
1 1030 . 11 1 1 A 89 89 ALA N N 89 122.387 121.656 0.731 1
1 1031 . 11 1 1 A 90 90 MET H H 90 8.084 7.860 0.224 1
1 1032 . 11 1 1 A 90 90 MET HA H 90 4.356 4.393 -0.037 1
1 1040 . 11 1 1 A 90 90 MET C C 90 176.982 176.333 0.649 1
1 1041 . 11 1 1 A 90 90 MET CA C 90 56.551 55.208 1.343 1
1 1042 . 11 1 1 A 90 90 MET CB C 90 32.719 32.183 0.536 1
1 1045 . 11 1 1 A 90 90 MET N N 90 118.509 115.936 2.573 1
1 1046 . 11 1 1 A 91 91 ASP H H 91 8.261 7.917 0.344 1
1 1047 . 11 1 1 A 91 91 ASP HA H 91 4.524 4.802 -0.278 1
1 1050 . 11 1 1 A 91 91 ASP C C 91 176.643 175.195 1.448 1
1 1051 . 11 1 1 A 91 91 ASP CA C 91 54.981 53.913 1.068 1
1 1052 . 11 1 1 A 91 91 ASP CB C 91 40.870 42.182 -1.312 1
1 1053 . 11 1 1 A 91 91 ASP N N 91 120.771 117.661 3.110 1
1 1054 . 11 1 1 A 92 92 ALA H H 92 7.971 7.420 0.551 1
1 1055 . 11 1 1 A 92 92 ALA HA H 92 4.200 4.606 -0.406 1
1 1059 . 11 1 1 A 92 92 ALA C C 92 177.929 176.132 1.797 1
1 1060 . 11 1 1 A 92 92 ALA CA C 92 53.184 50.127 3.057 1
1 1061 . 11 1 1 A 92 92 ALA CB C 92 18.890 21.877 -2.987 1
1 1062 . 11 1 1 A 92 92 ALA N N 92 123.057 121.460 1.597 1
1 1063 . 11 1 1 A 93 93 TYR H H 93 8.019 8.547 -0.528 1
1 1064 . 11 1 1 A 93 93 TYR HA H 93 4.523 4.366 0.157 1
1 1071 . 11 1 1 A 93 93 TYR C C 93 176.279 175.121 1.158 1
1 1072 . 11 1 1 A 93 93 TYR CA C 93 58.401 58.560 -0.159 1
1 1073 . 11 1 1 A 93 93 TYR CB C 93 38.669 38.437 0.232 1
1 1078 . 11 1 1 A 93 93 TYR N N 93 118.337 118.405 -0.068 1
1 1079 . 11 1 1 A 94 94 SER H H 94 8.037 8.843 -0.806 1
1 1080 . 11 1 1 A 94 94 SER HA H 94 4.484 4.891 -0.407 1
1 1082 . 11 1 1 A 94 94 SER C C 94 174.554 172.913 1.641 1
1 1083 . 11 1 1 A 94 94 SER CA C 94 58.401 56.758 1.643 1
1 1084 . 11 1 1 A 94 94 SER CB C 94 63.806 65.711 -1.905 1
1 1085 . 11 1 1 A 94 94 SER N N 94 116.640 117.652 -1.012 1
1 1086 . 11 1 1 A 96 96 ASN HA H 96 4.770 4.695 0.075 1
1 1091 . 11 1 1 A 96 96 ASN C C 96 175.161 175.946 -0.785 1
1 1092 . 11 1 1 A 96 96 ASN CA C 96 53.395 55.440 -2.045 1
1 1093 . 11 1 1 A 96 96 ASN CB C 96 38.999 39.099 -0.100 1
1 1095 . 11 1 1 A 97 97 SER H H 97 8.230 7.780 0.450 1
1 1096 . 11 1 1 A 97 97 SER HA H 97 4.481 4.328 0.153 1
1 1099 . 11 1 1 A 97 97 SER C C 97 174.482 175.009 -0.527 1
1 1100 . 11 1 1 A 97 97 SER CA C 97 58.300 59.346 -1.046 1
1 1101 . 11 1 1 A 97 97 SER CB C 97 63.697 63.479 0.218 1
1 1102 . 11 1 1 A 97 97 SER N N 97 115.866 113.095 2.771 1
1 1103 . 11 1 1 A 98 98 GLY H H 98 8.228 8.844 -0.616 1
1 1104 . 11 1 1 A 98 98 GLY HA2 H 98 4.098 3.927 0.171 1
1 1105 . 11 1 1 A 98 98 GLY HA3 H 98 4.098 3.928 0.170 1
1 1106 . 11 1 1 A 98 98 GLY C C 98 171.788 174.451 -2.663 1
1 1107 . 11 1 1 A 98 98 GLY CA C 98 44.803 46.684 -1.881 1
1 1108 . 11 1 1 A 98 98 GLY N N 98 110.658 111.814 -1.156 1
1 1109 . 11 1 1 A 99 99 PRO HA H 99 4.463 4.731 -0.268 1
1 1116 . 11 1 1 A 99 99 PRO CA C 99 63.230 62.565 0.665 1
1 1117 . 11 1 1 A 99 99 PRO CB C 99 32.044 33.456 -1.412 1
1 1120 . 11 1 1 A 100 100 SER H H 100 8.514 8.512 0.002 1
1 1121 . 11 1 1 A 100 100 SER CA C 100 58.450 57.603 0.847 1
1 1122 . 11 1 1 A 100 100 SER CB C 100 63.889 65.707 -1.818 1
1 1 . 12 1 1 A 9 9 ASN H H 9 8.856 8.943 -0.087 1
1 2 . 12 1 1 A 9 9 ASN HA H 9 4.694 4.645 0.049 1
1 7 . 12 1 1 A 9 9 ASN CA C 9 53.401 55.825 -2.424 1
1 8 . 12 1 1 A 9 9 ASN CB C 9 38.757 39.250 -0.493 1
1 10 . 12 1 1 A 10 10 ARG HA H 10 4.346 4.608 -0.262 1
1 17 . 12 1 1 A 10 10 ARG C C 10 175.405 175.911 -0.506 1
1 18 . 12 1 1 A 10 10 ARG CA C 10 56.181 55.793 0.388 1
1 19 . 12 1 1 A 10 10 ARG CB C 10 31.171 31.437 -0.266 1
1 22 . 12 1 1 A 11 11 PHE H H 11 8.310 8.860 -0.550 1
1 23 . 12 1 1 A 11 11 PHE HA H 11 4.291 4.851 -0.560 1
1 31 . 12 1 1 A 11 11 PHE C C 11 174.458 173.976 0.482 1
1 32 . 12 1 1 A 11 11 PHE CA C 11 58.967 56.009 2.958 1
1 33 . 12 1 1 A 11 11 PHE CB C 11 40.138 40.568 -0.430 1
1 39 . 12 1 1 A 11 11 PHE N N 11 123.604 118.508 5.096 1
1 40 . 12 1 1 A 12 12 LYS H H 12 7.307 8.226 -0.919 1
1 41 . 12 1 1 A 12 12 LYS HA H 12 4.165 4.448 -0.283 1
1 50 . 12 1 1 A 12 12 LYS C C 12 174.385 175.688 -1.303 1
1 51 . 12 1 1 A 12 12 LYS CA C 12 54.593 54.153 0.440 1
1 52 . 12 1 1 A 12 12 LYS CB C 12 34.712 34.718 -0.006 1
1 56 . 12 1 1 A 12 12 LYS N N 12 127.282 119.831 7.451 1
1 57 . 12 1 1 A 13 13 TRP H H 13 8.039 8.185 -0.146 1
1 58 . 12 1 1 A 13 13 TRP HA H 13 4.370 4.384 -0.014 1
1 67 . 12 1 1 A 13 13 TRP C C 13 177.857 176.588 1.269 1
1 68 . 12 1 1 A 13 13 TRP CA C 13 56.675 57.300 -0.625 1
1 69 . 12 1 1 A 13 13 TRP CB C 13 30.317 30.431 -0.114 1
1 75 . 12 1 1 A 13 13 TRP N N 13 124.264 127.214 -2.950 1
1 77 . 12 1 1 A 14 14 GLY H H 14 9.815 8.626 1.189 1
1 78 . 12 1 1 A 14 14 GLY HA2 H 14 4.370 4.177 0.193 1
1 79 . 12 1 1 A 14 14 GLY HA3 H 14 4.335 4.203 0.132 1
1 80 . 12 1 1 A 14 14 GLY C C 14 172.904 174.730 -1.826 1
1 81 . 12 1 1 A 14 14 GLY CA C 14 44.157 43.875 0.282 1
1 82 . 12 1 1 A 14 14 GLY N N 14 115.294 108.776 6.518 1
1 83 . 12 1 1 A 15 15 PRO HA H 15 4.327 4.380 -0.053 1
1 90 . 12 1 1 A 15 15 PRO C C 15 179.726 178.928 0.798 1
1 91 . 12 1 1 A 15 15 PRO CA C 15 65.171 65.377 -0.206 1
1 92 . 12 1 1 A 15 15 PRO CB C 15 31.829 31.800 0.029 1
1 95 . 12 1 1 A 16 16 ALA H H 16 9.214 8.135 1.079 1
1 96 . 12 1 1 A 16 16 ALA HA H 16 4.166 4.108 0.058 1
1 100 . 12 1 1 A 16 16 ALA C C 16 181.184 179.761 1.423 1
1 101 . 12 1 1 A 16 16 ALA CA C 16 55.370 55.253 0.117 1
1 102 . 12 1 1 A 16 16 ALA CB C 16 18.058 18.809 -0.751 1
1 103 . 12 1 1 A 16 16 ALA N N 16 122.414 119.551 2.863 1
1 104 . 12 1 1 A 17 17 SER H H 17 7.985 8.178 -0.193 1
1 105 . 12 1 1 A 17 17 SER HA H 17 4.317 4.123 0.194 1
1 107 . 12 1 1 A 17 17 SER C C 17 175.381 176.742 -1.361 1
1 108 . 12 1 1 A 17 17 SER CA C 17 63.163 62.171 0.992 1
1 109 . 12 1 1 A 17 17 SER CB C 17 64.055 62.951 1.104 1
1 110 . 12 1 1 A 17 17 SER N N 17 116.568 114.131 2.437 1
1 111 . 12 1 1 A 18 18 GLN H H 18 8.316 7.855 0.461 1
1 112 . 12 1 1 A 18 18 GLN HA H 18 3.323 3.483 -0.160 1
1 119 . 12 1 1 A 18 18 GLN C C 18 176.812 178.613 -1.801 1
1 120 . 12 1 1 A 18 18 GLN CA C 18 60.025 59.308 0.717 1
1 121 . 12 1 1 A 18 18 GLN CB C 18 28.686 28.543 0.143 1
1 123 . 12 1 1 A 18 18 GLN N N 18 119.002 120.925 -1.923 1
1 125 . 12 1 1 A 19 19 GLN H H 19 7.582 8.252 -0.670 1
1 126 . 12 1 1 A 19 19 GLN HA H 19 4.062 4.098 -0.036 1
1 133 . 12 1 1 A 19 19 GLN C C 19 178.488 178.447 0.041 1
1 134 . 12 1 1 A 19 19 GLN CA C 19 59.248 59.207 0.041 1
1 135 . 12 1 1 A 19 19 GLN CB C 19 28.203 28.261 -0.058 1
1 137 . 12 1 1 A 19 19 GLN N N 19 116.221 118.835 -2.614 1
1 139 . 12 1 1 A 20 20 ILE H H 20 7.246 7.971 -0.725 1
1 140 . 12 1 1 A 20 20 ILE HA H 20 3.570 3.618 -0.048 1
1 150 . 12 1 1 A 20 20 ILE C C 20 178.999 178.539 0.460 1
1 151 . 12 1 1 A 20 20 ILE CA C 20 64.996 65.651 -0.655 1
1 152 . 12 1 1 A 20 20 ILE CB C 20 38.139 37.839 0.300 1
1 156 . 12 1 1 A 20 20 ILE N N 20 120.521 120.937 -0.416 1
1 157 . 12 1 1 A 21 21 LEU H H 21 8.034 7.935 0.099 1
1 158 . 12 1 1 A 21 21 LEU HA H 21 3.491 3.578 -0.087 1
1 168 . 12 1 1 A 21 21 LEU C C 21 178.196 178.512 -0.316 1
1 169 . 12 1 1 A 21 21 LEU CA C 21 57.944 57.479 0.465 1
1 170 . 12 1 1 A 21 21 LEU CB C 21 37.864 40.378 -2.514 1
1 174 . 12 1 1 A 21 21 LEU N N 21 121.259 118.860 2.399 1
1 175 . 12 1 1 A 22 22 TYR H H 22 8.479 7.631 0.848 1
1 176 . 12 1 1 A 22 22 TYR HA H 22 4.224 4.286 -0.062 1
1 183 . 12 1 1 A 22 22 TYR C C 22 179.630 178.592 1.038 1
1 184 . 12 1 1 A 22 22 TYR CA C 22 62.422 60.784 1.638 1
1 185 . 12 1 1 A 22 22 TYR CB C 22 37.434 37.758 -0.324 1
1 190 . 12 1 1 A 22 22 TYR N N 22 117.805 118.646 -0.841 1
1 191 . 12 1 1 A 23 23 GLN H H 23 7.707 8.352 -0.645 1
1 192 . 12 1 1 A 23 23 GLN HA H 23 4.166 4.016 0.150 1
1 199 . 12 1 1 A 23 23 GLN C C 23 178.633 178.463 0.170 1
1 200 . 12 1 1 A 23 23 GLN CA C 23 58.789 59.175 -0.386 1
1 201 . 12 1 1 A 23 23 GLN CB C 23 28.534 28.012 0.522 1
1 203 . 12 1 1 A 23 23 GLN N N 23 117.580 118.339 -0.759 1
1 205 . 12 1 1 A 24 24 ALA H H 24 8.155 7.776 0.379 1
1 206 . 12 1 1 A 24 24 ALA HA H 24 4.187 4.157 0.030 1
1 210 . 12 1 1 A 24 24 ALA C C 24 180.018 178.964 1.054 1
1 211 . 12 1 1 A 24 24 ALA CA C 24 55.228 55.230 -0.002 1
1 212 . 12 1 1 A 24 24 ALA CB C 24 19.468 18.948 0.520 1
1 213 . 12 1 1 A 24 24 ALA N N 24 122.813 122.637 0.176 1
1 214 . 12 1 1 A 25 25 TYR H H 25 8.995 8.720 0.275 1
1 215 . 12 1 1 A 25 25 TYR HA H 25 4.348 4.725 -0.377 1
1 222 . 12 1 1 A 25 25 TYR C C 25 175.792 177.556 -1.764 1
1 223 . 12 1 1 A 25 25 TYR CA C 25 61.681 62.276 -0.595 1
1 224 . 12 1 1 A 25 25 TYR CB C 25 38.175 38.928 -0.753 1
1 229 . 12 1 1 A 25 25 TYR N N 25 121.343 119.746 1.597 1
1 230 . 12 1 1 A 26 26 ASP H H 26 7.260 8.670 -1.410 1
1 231 . 12 1 1 A 26 26 ASP HA H 26 4.373 4.434 -0.061 1
1 234 . 12 1 1 A 26 26 ASP C C 26 177.322 178.706 -1.384 1
1 235 . 12 1 1 A 26 26 ASP CA C 26 56.603 57.746 -1.143 1
1 236 . 12 1 1 A 26 26 ASP CB C 26 41.060 41.637 -0.577 1
1 237 . 12 1 1 A 26 26 ASP N N 26 114.020 119.357 -5.337 1
1 238 . 12 1 1 A 27 27 ARG H H 27 7.343 7.836 -0.493 1
1 239 . 12 1 1 A 27 27 ARG HA H 27 4.302 4.370 -0.068 1
1 246 . 12 1 1 A 27 27 ARG C C 27 176.546 176.288 0.258 1
1 247 . 12 1 1 A 27 27 ARG CA C 27 57.563 57.975 -0.412 1
1 248 . 12 1 1 A 27 27 ARG CB C 27 31.500 31.229 0.271 1
1 251 . 12 1 1 A 27 27 ARG N N 27 116.729 117.204 -0.475 1
1 252 . 12 1 1 A 28 28 GLN H H 28 8.306 7.983 0.323 1
1 253 . 12 1 1 A 28 28 GLN HA H 28 4.396 4.721 -0.325 1
1 260 . 12 1 1 A 28 28 GLN C C 28 172.831 175.187 -2.356 1
1 261 . 12 1 1 A 28 28 GLN CA C 28 55.355 54.497 0.858 1
1 262 . 12 1 1 A 28 28 GLN CB C 28 31.062 31.539 -0.477 1
1 264 . 12 1 1 A 28 28 GLN N N 28 121.612 117.978 3.634 1
1 266 . 12 1 1 A 29 29 LYS H H 29 8.354 8.523 -0.169 1
1 267 . 12 1 1 A 29 29 LYS HA H 29 4.099 3.528 0.571 1
1 276 . 12 1 1 A 29 29 LYS C C 29 176.084 176.319 -0.235 1
1 277 . 12 1 1 A 29 29 LYS CA C 29 57.873 57.709 0.164 1
1 278 . 12 1 1 A 29 29 LYS CB C 29 33.313 32.718 0.595 1
1 282 . 12 1 1 A 29 29 LYS N N 29 125.038 123.885 1.153 1
1 283 . 12 1 1 A 30 30 ASN H H 30 8.856 7.937 0.919 1
1 284 . 12 1 1 A 30 30 ASN HA H 30 4.958 5.068 -0.110 1
1 289 . 12 1 1 A 30 30 ASN C C 30 171.179 172.683 -1.504 1
1 290 . 12 1 1 A 30 30 ASN CA C 30 50.891 50.291 0.600 1
1 291 . 12 1 1 A 30 30 ASN CB C 30 39.907 39.019 0.888 1
1 292 . 12 1 1 A 30 30 ASN N N 30 115.764 117.610 -1.846 1
1 294 . 12 1 1 A 31 31 PRO HA H 31 4.299 4.452 -0.153 1
1 301 . 12 1 1 A 31 31 PRO C C 31 177.493 176.687 0.806 1
1 302 . 12 1 1 A 31 31 PRO CA C 31 62.489 62.536 -0.047 1
1 303 . 12 1 1 A 31 31 PRO CB C 31 31.216 31.766 -0.550 1
1 306 . 12 1 1 A 32 32 SER H H 32 9.368 8.520 0.848 1
1 307 . 12 1 1 A 32 32 SER HA H 32 4.372 4.738 -0.366 1
1 310 . 12 1 1 A 32 32 SER C C 32 174.821 175.787 -0.966 1
1 311 . 12 1 1 A 32 32 SER CA C 32 57.203 57.807 -0.604 1
1 312 . 12 1 1 A 32 32 SER CB C 32 65.594 64.533 1.061 1
1 313 . 12 1 1 A 32 32 SER N N 32 120.847 117.556 3.291 1
1 314 . 12 1 1 A 33 33 LYS H H 33 9.152 9.014 0.138 1
1 315 . 12 1 1 A 33 33 LYS HA H 33 3.719 3.932 -0.213 1
1 324 . 12 1 1 A 33 33 LYS C C 33 177.833 178.302 -0.469 1
1 325 . 12 1 1 A 33 33 LYS CA C 33 61.188 60.138 1.050 1
1 326 . 12 1 1 A 33 33 LYS CB C 33 32.572 32.141 0.431 1
1 330 . 12 1 1 A 33 33 LYS N N 33 122.966 124.593 -1.627 1
1 331 . 12 1 1 A 34 34 GLU H H 34 8.902 8.059 0.843 1
1 332 . 12 1 1 A 34 34 GLU HA H 34 4.089 4.110 -0.021 1
1 337 . 12 1 1 A 34 34 GLU C C 34 180.286 179.344 0.942 1
1 338 . 12 1 1 A 34 34 GLU CA C 34 60.483 59.350 1.133 1
1 339 . 12 1 1 A 34 34 GLU CB C 34 28.835 29.588 -0.753 1
1 341 . 12 1 1 A 34 34 GLU N N 34 117.645 119.175 -1.530 1
1 342 . 12 1 1 A 35 35 GLU H H 35 7.673 8.196 -0.523 1
1 343 . 12 1 1 A 35 35 GLU HA H 35 4.023 3.953 0.070 1
1 348 . 12 1 1 A 35 35 GLU C C 35 180.237 179.038 1.199 1
1 349 . 12 1 1 A 35 35 GLU CA C 35 59.214 59.257 -0.043 1
1 350 . 12 1 1 A 35 35 GLU CB C 35 30.099 29.199 0.900 1
1 352 . 12 1 1 A 35 35 GLU N N 35 121.077 120.087 0.990 1
1 353 . 12 1 1 A 36 36 ARG H H 36 8.932 8.202 0.730 1
1 354 . 12 1 1 A 36 36 ARG HA H 36 3.928 3.779 0.149 1
1 362 . 12 1 1 A 36 36 ARG C C 36 178.464 179.084 -0.620 1
1 363 . 12 1 1 A 36 36 ARG CA C 36 60.974 59.941 1.033 1
1 364 . 12 1 1 A 36 36 ARG CB C 36 31.171 29.951 1.220 1
1 367 . 12 1 1 A 36 36 ARG N N 36 119.441 120.025 -0.584 1
1 369 . 12 1 1 A 37 37 GLU H H 37 8.756 8.186 0.570 1
1 370 . 12 1 1 A 37 37 GLU HA H 37 3.948 4.090 -0.142 1
1 375 . 12 1 1 A 37 37 GLU C C 37 179.606 178.912 0.694 1
1 376 . 12 1 1 A 37 37 GLU CA C 37 60.094 59.072 1.022 1
1 377 . 12 1 1 A 37 37 GLU CB C 37 29.110 29.201 -0.091 1
1 379 . 12 1 1 A 37 37 GLU N N 37 119.017 119.611 -0.594 1
1 380 . 12 1 1 A 38 38 ALA H H 38 7.733 8.067 -0.334 1
1 381 . 12 1 1 A 38 38 ALA HA H 38 4.325 4.112 0.213 1
1 385 . 12 1 1 A 38 38 ALA C C 38 180.820 178.631 2.189 1
1 386 . 12 1 1 A 38 38 ALA CA C 38 55.194 54.505 0.689 1
1 387 . 12 1 1 A 38 38 ALA CB C 38 17.654 18.659 -1.005 1
1 388 . 12 1 1 A 38 38 ALA N N 38 122.889 121.901 0.988 1
1 389 . 12 1 1 A 39 39 LEU H H 39 7.740 7.956 -0.216 1
1 390 . 12 1 1 A 39 39 LEU HA H 39 4.176 4.289 -0.113 1
1 400 . 12 1 1 A 39 39 LEU C C 39 179.266 178.734 0.532 1
1 401 . 12 1 1 A 39 39 LEU CA C 39 57.944 56.049 1.895 1
1 402 . 12 1 1 A 39 39 LEU CB C 39 42.105 42.443 -0.338 1
1 406 . 12 1 1 A 39 39 LEU N N 39 119.783 117.127 2.656 1
1 407 . 12 1 1 A 40 40 VAL H H 40 8.451 8.325 0.126 1
1 408 . 12 1 1 A 40 40 VAL HA H 40 3.259 3.611 -0.352 1
1 416 . 12 1 1 A 40 40 VAL C C 40 177.153 177.782 -0.629 1
1 417 . 12 1 1 A 40 40 VAL CA C 40 67.254 66.942 0.312 1
1 418 . 12 1 1 A 40 40 VAL CB C 40 31.747 31.467 0.280 1
1 421 . 12 1 1 A 40 40 VAL N N 40 121.481 119.901 1.580 1
1 422 . 12 1 1 A 41 41 GLU H H 41 7.254 8.029 -0.775 1
1 423 . 12 1 1 A 41 41 GLU HA H 41 4.159 4.127 0.032 1
1 428 . 12 1 1 A 41 41 GLU C C 41 179.483 178.902 0.581 1
1 429 . 12 1 1 A 41 41 GLU CA C 41 59.248 59.419 -0.171 1
1 430 . 12 1 1 A 41 41 GLU CB C 41 29.358 29.331 0.027 1
1 432 . 12 1 1 A 41 41 GLU N N 41 116.549 119.830 -3.281 1
1 433 . 12 1 1 A 42 42 GLU H H 42 8.103 7.715 0.388 1
1 434 . 12 1 1 A 42 42 GLU HA H 42 4.020 4.050 -0.030 1
1 439 . 12 1 1 A 42 42 GLU C C 42 180.115 178.792 1.323 1
1 440 . 12 1 1 A 42 42 GLU CA C 42 59.847 59.519 0.328 1
1 441 . 12 1 1 A 42 42 GLU CB C 42 30.218 29.413 0.805 1
1 443 . 12 1 1 A 42 42 GLU N N 42 119.578 119.238 0.340 1
1 444 . 12 1 1 A 43 43 CYS H H 43 8.955 8.062 0.893 1
1 445 . 12 1 1 A 43 43 CYS HA H 43 4.153 4.229 -0.076 1
1 448 . 12 1 1 A 43 43 CYS C C 43 176.498 177.607 -1.109 1
1 449 . 12 1 1 A 43 43 CYS CA C 43 64.856 62.532 2.324 1
1 450 . 12 1 1 A 43 43 CYS CB C 43 27.390 27.612 -0.222 1
1 451 . 12 1 1 A 43 43 CYS N N 43 118.199 118.798 -0.599 1
1 452 . 12 1 1 A 44 44 ASN H H 44 8.543 7.943 0.600 1
1 453 . 12 1 1 A 44 44 ASN HA H 44 4.635 4.418 0.217 1
1 458 . 12 1 1 A 44 44 ASN C C 44 178.633 177.507 1.126 1
1 459 . 12 1 1 A 44 44 ASN CA C 44 56.603 56.352 0.251 1
1 460 . 12 1 1 A 44 44 ASN CB C 44 37.187 38.100 -0.913 1
1 461 . 12 1 1 A 44 44 ASN N N 44 117.002 119.604 -2.602 1
1 463 . 12 1 1 A 45 45 ARG H H 45 8.296 8.205 0.091 1
1 464 . 12 1 1 A 45 45 ARG HA H 45 3.977 4.061 -0.084 1
1 471 . 12 1 1 A 45 45 ARG C C 45 178.149 178.225 -0.076 1
1 472 . 12 1 1 A 45 45 ARG CA C 45 60.589 59.632 0.957 1
1 473 . 12 1 1 A 45 45 ARG CB C 45 30.099 30.157 -0.058 1
1 476 . 12 1 1 A 45 45 ARG N N 45 121.021 121.081 -0.060 1
1 477 . 12 1 1 A 46 46 ALA H H 46 7.914 8.292 -0.378 1
1 478 . 12 1 1 A 46 46 ALA HA H 46 4.128 4.134 -0.006 1
1 482 . 12 1 1 A 46 46 ALA C C 46 181.208 180.311 0.897 1
1 483 . 12 1 1 A 46 46 ALA CA C 46 55.264 55.019 0.245 1
1 484 . 12 1 1 A 46 46 ALA CB C 46 18.759 18.368 0.391 1
1 485 . 12 1 1 A 46 46 ALA N N 46 121.570 120.741 0.829 1
1 486 . 12 1 1 A 47 47 GLU H H 47 8.730 8.642 0.088 1
1 487 . 12 1 1 A 47 47 GLU HA H 47 4.194 4.025 0.169 1
1 492 . 12 1 1 A 47 47 GLU C C 47 180.115 178.997 1.118 1
1 493 . 12 1 1 A 47 47 GLU CA C 47 58.401 59.658 -1.257 1
1 494 . 12 1 1 A 47 47 GLU CB C 47 29.523 29.324 0.199 1
1 496 . 12 1 1 A 47 47 GLU N N 47 117.532 118.124 -0.592 1
1 497 . 12 1 1 A 48 48 CYS H H 48 8.283 7.891 0.392 1
1 498 . 12 1 1 A 48 48 CYS HA H 48 4.002 4.123 -0.121 1
1 501 . 12 1 1 A 48 48 CYS C C 48 177.031 177.462 -0.431 1
1 502 . 12 1 1 A 48 48 CYS CA C 48 64.749 63.867 0.882 1
1 503 . 12 1 1 A 48 48 CYS CB C 48 25.907 27.165 -1.258 1
1 504 . 12 1 1 A 48 48 CYS N N 48 118.282 119.215 -0.933 1
1 505 . 12 1 1 A 49 49 LEU H H 49 8.181 8.097 0.084 1
1 506 . 12 1 1 A 49 49 LEU HA H 49 4.175 3.891 0.284 1
1 516 . 12 1 1 A 49 49 LEU C C 49 180.430 178.818 1.612 1
1 517 . 12 1 1 A 49 49 LEU CA C 49 57.873 58.177 -0.304 1
1 518 . 12 1 1 A 49 49 LEU CB C 49 41.539 41.758 -0.219 1
1 522 . 12 1 1 A 49 49 LEU N N 49 120.371 120.854 -0.483 1
1 523 . 12 1 1 A 50 50 GLN H H 50 7.934 8.649 -0.715 1
1 524 . 12 1 1 A 50 50 GLN HA H 50 4.102 4.060 0.042 1
1 531 . 12 1 1 A 50 50 GLN C C 50 177.322 177.119 0.203 1
1 532 . 12 1 1 A 50 50 GLN CA C 50 58.156 58.654 -0.498 1
1 533 . 12 1 1 A 50 50 GLN CB C 50 28.616 28.610 0.006 1
1 535 . 12 1 1 A 50 50 GLN N N 50 118.175 117.485 0.690 1
1 537 . 12 1 1 A 51 51 ARG H H 51 7.632 7.738 -0.106 1
1 538 . 12 1 1 A 51 51 ARG HA H 51 4.347 4.361 -0.014 1
1 545 . 12 1 1 A 51 51 ARG C C 51 176.546 176.459 0.087 1
1 546 . 12 1 1 A 51 51 ARG CA C 51 56.286 55.886 0.400 1
1 547 . 12 1 1 A 51 51 ARG CB C 51 31.314 30.131 1.183 1
1 550 . 12 1 1 A 51 51 ARG N N 51 116.454 117.776 -1.322 1
1 551 . 12 1 1 A 52 52 GLY H H 52 7.949 8.397 -0.448 1
1 552 . 12 1 1 A 52 52 GLY HA2 H 52 4.033 3.968 0.065 1
1 553 . 12 1 1 A 52 52 GLY HA3 H 52 3.903 3.969 -0.066 1
1 554 . 12 1 1 A 52 52 GLY C C 52 174.385 174.207 0.178 1
1 555 . 12 1 1 A 52 52 GLY CA C 52 46.231 45.287 0.944 1
1 556 . 12 1 1 A 52 52 GLY N N 52 108.854 107.672 1.182 1
1 557 . 12 1 1 A 53 53 VAL H H 53 7.944 7.544 0.400 1
1 558 . 12 1 1 A 53 53 VAL HA H 53 4.250 4.040 0.210 1
1 566 . 12 1 1 A 53 53 VAL C C 53 175.525 174.956 0.569 1
1 567 . 12 1 1 A 53 53 VAL CA C 53 60.377 62.520 -2.143 1
1 568 . 12 1 1 A 53 53 VAL CB C 53 34.283 32.847 1.436 1
1 571 . 12 1 1 A 53 53 VAL N N 53 118.316 120.852 -2.536 1
1 572 . 12 1 1 A 54 54 SER H H 54 8.502 8.501 0.001 1
1 573 . 12 1 1 A 54 54 SER HA H 54 4.625 4.924 -0.299 1
1 576 . 12 1 1 A 54 54 SER C C 54 174.603 174.039 0.564 1
1 577 . 12 1 1 A 54 54 SER CA C 54 56.092 54.148 1.944 1
1 578 . 12 1 1 A 54 54 SER CB C 54 63.697 63.817 -0.120 1
1 579 . 12 1 1 A 54 54 SER N N 54 120.337 118.287 2.050 1
1 580 . 12 1 1 A 55 55 PRO HA H 55 4.624 4.527 0.097 1
1 587 . 12 1 1 A 55 55 PRO C C 55 177.322 177.301 0.021 1
1 588 . 12 1 1 A 55 55 PRO CA C 55 64.431 64.205 0.226 1
1 589 . 12 1 1 A 55 55 PRO CB C 55 31.913 31.698 0.215 1
1 592 . 12 1 1 A 56 56 SER H H 56 7.931 8.436 -0.505 1
1 593 . 12 1 1 A 56 56 SER HA H 56 4.428 4.596 -0.168 1
1 596 . 12 1 1 A 56 56 SER C C 56 174.749 174.886 -0.137 1
1 597 . 12 1 1 A 56 56 SER CA C 56 59.130 59.041 0.089 1
1 598 . 12 1 1 A 56 56 SER CB C 56 63.056 63.910 -0.854 1
1 599 . 12 1 1 A 56 56 SER N N 56 112.637 112.891 -0.254 1
1 600 . 12 1 1 A 57 57 LYS H H 57 8.121 7.630 0.491 1
1 601 . 12 1 1 A 57 57 LYS HA H 57 4.467 4.903 -0.436 1
1 609 . 12 1 1 A 57 57 LYS C C 57 176.570 176.171 0.399 1
1 610 . 12 1 1 A 57 57 LYS CA C 57 55.264 55.028 0.236 1
1 611 . 12 1 1 A 57 57 LYS CB C 57 32.160 32.474 -0.314 1
1 615 . 12 1 1 A 57 57 LYS N N 57 123.185 118.091 5.094 1
1 616 . 12 1 1 A 58 58 ALA H H 58 7.886 7.934 -0.048 1
1 617 . 12 1 1 A 58 58 ALA HA H 58 3.923 3.912 0.011 1
1 621 . 12 1 1 A 58 58 ALA C C 58 177.469 179.848 -2.379 1
1 622 . 12 1 1 A 58 58 ALA CA C 58 54.276 54.905 -0.629 1
1 623 . 12 1 1 A 58 58 ALA CB C 58 18.271 18.583 -0.312 1
1 624 . 12 1 1 A 58 58 ALA N N 58 123.941 122.672 1.269 1
1 625 . 12 1 1 A 59 59 HIS H H 59 8.077 8.167 -0.090 1
1 626 . 12 1 1 A 59 59 HIS HA H 59 4.420 4.412 0.008 1
1 631 . 12 1 1 A 59 59 HIS C C 59 177.542 177.469 0.073 1
1 632 . 12 1 1 A 59 59 HIS CA C 59 57.767 58.569 -0.802 1
1 633 . 12 1 1 A 59 59 HIS CB C 59 29.852 28.558 1.294 1
1 636 . 12 1 1 A 59 59 HIS N N 59 115.566 115.464 0.102 1
1 637 . 12 1 1 A 60 60 GLY H H 60 8.110 7.613 0.497 1
1 638 . 12 1 1 A 60 60 GLY HA2 H 60 3.873 3.402 0.471 1
1 639 . 12 1 1 A 60 60 GLY HA3 H 60 4.025 3.516 0.509 1
1 640 . 12 1 1 A 60 60 GLY C C 60 174.918 175.649 -0.731 1
1 641 . 12 1 1 A 60 60 GLY CA C 60 45.559 46.997 -1.438 1
1 642 . 12 1 1 A 60 60 GLY N N 60 109.216 110.315 -1.099 1
1 643 . 12 1 1 A 61 61 LEU H H 61 8.280 8.530 -0.250 1
1 644 . 12 1 1 A 61 61 LEU HA H 61 4.198 3.927 0.271 1
1 654 . 12 1 1 A 61 61 LEU C C 61 178.900 177.557 1.343 1
1 655 . 12 1 1 A 61 61 LEU CA C 61 55.758 57.943 -2.185 1
1 656 . 12 1 1 A 61 61 LEU CB C 61 42.544 41.717 0.827 1
1 660 . 12 1 1 A 61 61 LEU N N 61 120.521 123.047 -2.526 1
1 661 . 12 1 1 A 62 62 GLY H H 62 8.184 8.070 0.114 1
1 662 . 12 1 1 A 62 62 GLY HA2 H 62 3.978 3.840 0.138 1
1 663 . 12 1 1 A 62 62 GLY HA3 H 62 3.817 3.842 -0.025 1
1 664 . 12 1 1 A 62 62 GLY C C 62 176.012 175.345 0.667 1
1 665 . 12 1 1 A 62 62 GLY CA C 62 46.767 47.339 -0.572 1
1 666 . 12 1 1 A 62 62 GLY N N 62 108.987 108.344 0.643 1
1 667 . 12 1 1 A 63 63 SER HA H 63 4.322 4.293 0.029 1
1 670 . 12 1 1 A 63 63 SER C C 63 174.167 176.239 -2.072 1
1 671 . 12 1 1 A 63 63 SER CA C 63 59.919 60.741 -0.822 1
1 672 . 12 1 1 A 63 63 SER CB C 63 63.312 63.146 0.166 1
1 673 . 12 1 1 A 64 64 ASN H H 64 8.087 8.206 -0.119 1
1 674 . 12 1 1 A 64 64 ASN HA H 64 4.850 5.047 -0.197 1
1 679 . 12 1 1 A 64 64 ASN C C 64 173.899 175.084 -1.185 1
1 680 . 12 1 1 A 64 64 ASN CA C 64 53.218 52.626 0.592 1
1 681 . 12 1 1 A 64 64 ASN CB C 64 39.164 38.575 0.589 1
1 682 . 12 1 1 A 64 64 ASN N N 64 118.041 118.260 -0.219 1
1 684 . 12 1 1 A 65 65 LEU H H 65 7.293 7.525 -0.232 1
1 685 . 12 1 1 A 65 65 LEU HA H 65 3.995 4.465 -0.470 1
1 695 . 12 1 1 A 65 65 LEU C C 65 175.696 175.774 -0.078 1
1 696 . 12 1 1 A 65 65 LEU CA C 65 56.005 55.309 0.696 1
1 697 . 12 1 1 A 65 65 LEU CB C 65 43.120 43.045 0.075 1
1 701 . 12 1 1 A 65 65 LEU N N 65 120.953 121.052 -0.099 1
1 702 . 12 1 1 A 66 66 VAL H H 66 9.517 8.883 0.634 1
1 703 . 12 1 1 A 66 66 VAL HA H 66 3.481 4.442 -0.961 1
1 711 . 12 1 1 A 66 66 VAL C C 66 175.429 175.073 0.356 1
1 712 . 12 1 1 A 66 66 VAL CA C 66 65.243 61.422 3.821 1
1 713 . 12 1 1 A 66 66 VAL CB C 66 31.335 33.109 -1.774 1
1 716 . 12 1 1 A 66 66 VAL N N 66 127.924 126.777 1.147 1
1 717 . 12 1 1 A 67 67 THR H H 67 6.253 8.341 -2.088 1
1 718 . 12 1 1 A 67 67 THR HA H 67 4.779 4.691 0.088 1
1 723 . 12 1 1 A 67 67 THR C C 67 174.894 174.698 0.196 1
1 724 . 12 1 1 A 67 67 THR CA C 67 58.719 59.695 -0.976 1
1 725 . 12 1 1 A 67 67 THR CB C 67 72.153 71.661 0.492 1
1 727 . 12 1 1 A 67 67 THR N N 67 113.376 115.862 -2.486 1
1 728 . 12 1 1 A 68 68 GLU H H 68 9.348 8.869 0.479 1
1 729 . 12 1 1 A 68 68 GLU HA H 68 3.634 4.017 -0.383 1
1 734 . 12 1 1 A 68 68 GLU C C 68 177.809 178.333 -0.524 1
1 735 . 12 1 1 A 68 68 GLU CA C 68 61.505 60.127 1.378 1
1 736 . 12 1 1 A 68 68 GLU CB C 68 28.285 29.685 -1.400 1
1 738 . 12 1 1 A 68 68 GLU N N 68 124.534 122.180 2.354 1
1 739 . 12 1 1 A 69 69 VAL H H 69 8.126 7.941 0.185 1
1 740 . 12 1 1 A 69 69 VAL HA H 69 3.862 3.551 0.311 1
1 748 . 12 1 1 A 69 69 VAL C C 69 177.712 178.081 -0.369 1
1 749 . 12 1 1 A 69 69 VAL CA C 69 65.701 66.804 -1.103 1
1 750 . 12 1 1 A 69 69 VAL CB C 69 31.829 31.521 0.308 1
1 753 . 12 1 1 A 69 69 VAL N N 69 119.139 119.840 -0.701 1
1 754 . 12 1 1 A 70 70 ARG H H 70 7.235 7.840 -0.605 1
1 755 . 12 1 1 A 70 70 ARG HA H 70 4.265 3.938 0.327 1
1 762 . 12 1 1 A 70 70 ARG C C 70 180.430 179.526 0.904 1
1 763 . 12 1 1 A 70 70 ARG CA C 70 59.742 60.128 -0.386 1
1 764 . 12 1 1 A 70 70 ARG CB C 70 29.439 29.929 -0.490 1
1 767 . 12 1 1 A 70 70 ARG N N 70 119.541 119.254 0.287 1
1 768 . 12 1 1 A 71 71 VAL H H 71 8.144 8.052 0.092 1
1 769 . 12 1 1 A 71 71 VAL HA H 71 4.018 3.969 0.049 1
1 777 . 12 1 1 A 71 71 VAL C C 71 177.493 178.303 -0.810 1
1 778 . 12 1 1 A 71 71 VAL CA C 71 67.924 66.732 1.192 1
1 779 . 12 1 1 A 71 71 VAL CB C 71 32.289 31.808 0.481 1
1 782 . 12 1 1 A 71 71 VAL N N 71 120.755 120.372 0.383 1
1 783 . 12 1 1 A 72 72 TYR H H 72 9.411 8.492 0.919 1
1 784 . 12 1 1 A 72 72 TYR HA H 72 3.908 4.226 -0.318 1
1 791 . 12 1 1 A 72 72 TYR C C 72 178.464 177.891 0.573 1
1 792 . 12 1 1 A 72 72 TYR CA C 72 63.444 62.162 1.282 1
1 793 . 12 1 1 A 72 72 TYR CB C 72 38.211 38.865 -0.654 1
1 798 . 12 1 1 A 72 72 TYR N N 72 121.175 121.082 0.093 1
1 799 . 12 1 1 A 73 73 ASN H H 73 8.816 8.761 0.055 1
1 800 . 12 1 1 A 73 73 ASN HA H 73 4.538 4.646 -0.108 1
1 805 . 12 1 1 A 73 73 ASN C C 73 176.958 178.070 -1.112 1
1 806 . 12 1 1 A 73 73 ASN CA C 73 56.109 56.756 -0.647 1
1 807 . 12 1 1 A 73 73 ASN CB C 73 38.422 38.631 -0.209 1
1 808 . 12 1 1 A 73 73 ASN N N 73 118.122 117.746 0.376 1
1 810 . 12 1 1 A 74 74 TRP H H 74 8.657 8.365 0.292 1
1 811 . 12 1 1 A 74 74 TRP HA H 74 4.111 4.504 -0.393 1
1 820 . 12 1 1 A 74 74 TRP C C 74 179.654 178.501 1.153 1
1 821 . 12 1 1 A 74 74 TRP CA C 74 62.950 61.304 1.646 1
1 822 . 12 1 1 A 74 74 TRP CB C 74 29.555 29.710 -0.155 1
1 828 . 12 1 1 A 74 74 TRP N N 74 123.988 122.945 1.043 1
1 830 . 12 1 1 A 75 75 PHE H H 75 8.562 8.696 -0.134 1
1 831 . 12 1 1 A 75 75 PHE HA H 75 3.821 4.437 -0.616 1
1 839 . 12 1 1 A 75 75 PHE C C 75 177.614 178.163 -0.549 1
1 840 . 12 1 1 A 75 75 PHE CA C 75 63.374 62.052 1.322 1
1 841 . 12 1 1 A 75 75 PHE CB C 75 39.648 38.392 1.256 1
1 847 . 12 1 1 A 75 75 PHE N N 75 118.325 117.131 1.194 1
1 848 . 12 1 1 A 76 76 ALA H H 76 8.305 8.281 0.024 1
1 849 . 12 1 1 A 76 76 ALA HA H 76 3.909 3.933 -0.024 1
1 853 . 12 1 1 A 76 76 ALA C C 76 180.868 179.570 1.298 1
1 854 . 12 1 1 A 76 76 ALA CA C 76 55.566 55.199 0.367 1
1 855 . 12 1 1 A 76 76 ALA CB C 76 17.820 18.143 -0.323 1
1 856 . 12 1 1 A 76 76 ALA N N 76 121.119 122.478 -1.359 1
1 857 . 12 1 1 A 77 77 ASN H H 77 8.335 8.060 0.275 1
1 858 . 12 1 1 A 77 77 ASN HA H 77 4.355 4.363 -0.008 1
1 863 . 12 1 1 A 77 77 ASN C C 77 177.105 177.690 -0.585 1
1 864 . 12 1 1 A 77 77 ASN CA C 77 56.145 55.970 0.175 1
1 865 . 12 1 1 A 77 77 ASN CB C 77 38.063 38.520 -0.457 1
1 866 . 12 1 1 A 77 77 ASN N N 77 117.433 116.387 1.046 1
1 868 . 12 1 1 A 78 78 ARG H H 78 7.664 7.212 0.452 1
1 869 . 12 1 1 A 78 78 ARG HA H 78 3.629 3.778 -0.149 1
1 876 . 12 1 1 A 78 78 ARG C C 78 179.216 177.513 1.703 1
1 877 . 12 1 1 A 78 78 ARG CA C 78 58.773 58.585 0.188 1
1 878 . 12 1 1 A 78 78 ARG CB C 78 29.605 29.357 0.248 1
1 881 . 12 1 1 A 78 78 ARG N N 78 121.999 118.443 3.556 1
1 882 . 12 1 1 A 79 79 ARG H H 79 8.320 7.446 0.874 1
1 883 . 12 1 1 A 79 79 ARG HA H 79 4.307 4.333 -0.026 1
1 890 . 12 1 1 A 79 79 ARG C C 79 180.406 178.845 1.561 1
1 891 . 12 1 1 A 79 79 ARG CA C 79 60.270 57.723 2.547 1
1 892 . 12 1 1 A 79 79 ARG CB C 79 31.335 30.735 0.600 1
1 895 . 12 1 1 A 79 79 ARG N N 79 118.139 117.763 0.376 1
1 896 . 12 1 1 A 80 80 LYS H H 80 7.759 7.902 -0.143 1
1 897 . 12 1 1 A 80 80 LYS HA H 80 4.052 4.084 -0.032 1
1 905 . 12 1 1 A 80 80 LYS C C 80 178.999 178.633 0.366 1
1 906 . 12 1 1 A 80 80 LYS CA C 80 59.531 59.044 0.487 1
1 907 . 12 1 1 A 80 80 LYS CB C 80 32.374 31.935 0.439 1
1 911 . 12 1 1 A 80 80 LYS N N 80 120.899 118.861 2.038 1
1 912 . 12 1 1 A 81 81 GLU H H 81 8.041 8.047 -0.006 1
1 913 . 12 1 1 A 81 81 GLU HA H 81 4.044 4.163 -0.119 1
1 918 . 12 1 1 A 81 81 GLU C C 81 179.168 178.597 0.571 1
1 919 . 12 1 1 A 81 81 GLU CA C 81 59.036 59.582 -0.546 1
1 920 . 12 1 1 A 81 81 GLU CB C 81 29.561 29.174 0.387 1
1 922 . 12 1 1 A 81 81 GLU N N 81 120.193 119.992 0.201 1
1 923 . 12 1 1 A 82 82 GLU H H 82 8.131 8.503 -0.372 1
1 924 . 12 1 1 A 82 82 GLU HA H 82 4.017 4.083 -0.066 1
1 929 . 12 1 1 A 82 82 GLU C C 82 178.343 178.128 0.215 1
1 930 . 12 1 1 A 82 82 GLU CA C 82 59.319 59.371 -0.052 1
1 931 . 12 1 1 A 82 82 GLU CB C 82 29.770 29.105 0.665 1
1 933 . 12 1 1 A 82 82 GLU N N 82 119.626 118.664 0.962 1
1 934 . 12 1 1 A 83 83 ALA H H 83 7.935 7.868 0.067 1
1 935 . 12 1 1 A 83 83 ALA HA H 83 4.180 4.230 -0.050 1
1 939 . 12 1 1 A 83 83 ALA C C 83 179.994 179.410 0.584 1
1 940 . 12 1 1 A 83 83 ALA CA C 83 54.629 53.690 0.939 1
1 941 . 12 1 1 A 83 83 ALA CB C 83 18.090 18.979 -0.889 1
1 942 . 12 1 1 A 83 83 ALA N N 83 121.476 121.970 -0.494 1
1 943 . 12 1 1 A 84 84 PHE H H 84 8.043 8.139 -0.096 1
1 944 . 12 1 1 A 84 84 PHE HA H 84 4.420 4.052 0.368 1
1 952 . 12 1 1 A 84 84 PHE C C 84 177.250 177.096 0.154 1
1 953 . 12 1 1 A 84 84 PHE CA C 84 60.059 61.693 -1.634 1
1 954 . 12 1 1 A 84 84 PHE CB C 84 38.952 39.312 -0.360 1
1 960 . 12 1 1 A 84 84 PHE N N 84 119.074 120.546 -1.472 1
1 961 . 12 1 1 A 85 85 ARG H H 85 8.031 8.378 -0.347 1
1 962 . 12 1 1 A 85 85 ARG HA H 85 3.992 4.120 -0.128 1
1 968 . 12 1 1 A 85 85 ARG C C 85 178.319 178.328 -0.009 1
1 969 . 12 1 1 A 85 85 ARG CA C 85 58.523 59.623 -1.100 1
1 970 . 12 1 1 A 85 85 ARG CB C 85 30.346 30.002 0.344 1
1 973 . 12 1 1 A 85 85 ARG N N 85 119.291 117.451 1.840 1
1 974 . 12 1 1 A 86 86 GLN H H 86 8.091 7.765 0.326 1
1 975 . 12 1 1 A 86 86 GLN HA H 86 4.148 4.288 -0.140 1
1 982 . 12 1 1 A 86 86 GLN C C 86 177.105 178.232 -1.127 1
1 983 . 12 1 1 A 86 86 GLN CA C 86 57.556 57.363 0.193 1
1 984 . 12 1 1 A 86 86 GLN CB C 86 28.855 29.407 -0.552 1
1 986 . 12 1 1 A 86 86 GLN N N 86 119.097 117.611 1.486 1
1 988 . 12 1 1 A 87 87 LYS H H 87 7.898 8.272 -0.374 1
1 989 . 12 1 1 A 87 87 LYS HA H 87 4.116 4.004 0.112 1
1 997 . 12 1 1 A 87 87 LYS C C 87 177.542 179.364 -1.822 1
1 998 . 12 1 1 A 87 87 LYS CA C 87 57.944 59.221 -1.277 1
1 999 . 12 1 1 A 87 87 LYS CB C 87 32.242 31.851 0.391 1
1 1003 . 12 1 1 A 87 87 LYS N N 87 120.968 122.082 -1.114 1
1 1004 . 12 1 1 A 88 88 LEU H H 88 7.903 8.223 -0.320 1
1 1005 . 12 1 1 A 88 88 LEU HA H 88 4.144 4.155 -0.011 1
1 1015 . 12 1 1 A 88 88 LEU C C 88 178.221 178.149 0.072 1
1 1016 . 12 1 1 A 88 88 LEU CA C 88 56.145 57.188 -1.043 1
1 1017 . 12 1 1 A 88 88 LEU CB C 88 42.215 41.440 0.775 1
1 1021 . 12 1 1 A 88 88 LEU N N 88 120.558 117.237 3.321 1
1 1022 . 12 1 1 A 89 89 ALA H H 89 7.894 7.443 0.451 1
1 1023 . 12 1 1 A 89 89 ALA HA H 89 4.224 4.323 -0.099 1
1 1027 . 12 1 1 A 89 89 ALA C C 89 178.609 179.370 -0.761 1
1 1028 . 12 1 1 A 89 89 ALA CA C 89 53.392 53.516 -0.124 1
1 1029 . 12 1 1 A 89 89 ALA CB C 89 18.695 19.281 -0.586 1
1 1030 . 12 1 1 A 89 89 ALA N N 89 122.387 122.034 0.353 1
1 1031 . 12 1 1 A 90 90 MET H H 90 8.084 8.010 0.074 1
1 1032 . 12 1 1 A 90 90 MET HA H 90 4.356 4.126 0.230 1
1 1040 . 12 1 1 A 90 90 MET C C 90 176.982 178.032 -1.050 1
1 1041 . 12 1 1 A 90 90 MET CA C 90 56.551 58.388 -1.837 1
1 1042 . 12 1 1 A 90 90 MET CB C 90 32.719 32.792 -0.073 1
1 1045 . 12 1 1 A 90 90 MET N N 90 118.509 116.882 1.627 1
1 1046 . 12 1 1 A 91 91 ASP H H 91 8.261 7.879 0.382 1
1 1047 . 12 1 1 A 91 91 ASP HA H 91 4.524 4.259 0.265 1
1 1050 . 12 1 1 A 91 91 ASP C C 91 176.643 175.491 1.152 1
1 1051 . 12 1 1 A 91 91 ASP CA C 91 54.981 57.475 -2.494 1
1 1052 . 12 1 1 A 91 91 ASP CB C 91 40.870 40.808 0.062 1
1 1053 . 12 1 1 A 91 91 ASP N N 91 120.771 119.216 1.555 1
1 1054 . 12 1 1 A 92 92 ALA H H 92 7.971 7.573 0.398 1
1 1055 . 12 1 1 A 92 92 ALA HA H 92 4.200 4.637 -0.437 1
1 1059 . 12 1 1 A 92 92 ALA C C 92 177.929 176.206 1.723 1
1 1060 . 12 1 1 A 92 92 ALA CA C 92 53.184 50.370 2.814 1
1 1061 . 12 1 1 A 92 92 ALA CB C 92 18.890 21.110 -2.220 1
1 1062 . 12 1 1 A 92 92 ALA N N 92 123.057 119.801 3.256 1
1 1063 . 12 1 1 A 93 93 TYR H H 93 8.019 8.772 -0.753 1
1 1064 . 12 1 1 A 93 93 TYR HA H 93 4.523 4.515 0.008 1
1 1071 . 12 1 1 A 93 93 TYR C C 93 176.279 176.199 0.080 1
1 1072 . 12 1 1 A 93 93 TYR CA C 93 58.401 59.504 -1.103 1
1 1073 . 12 1 1 A 93 93 TYR CB C 93 38.669 39.110 -0.441 1
1 1078 . 12 1 1 A 93 93 TYR N N 93 118.337 121.183 -2.846 1
1 1079 . 12 1 1 A 94 94 SER H H 94 8.037 8.714 -0.677 1
1 1080 . 12 1 1 A 94 94 SER HA H 94 4.484 4.563 -0.079 1
1 1082 . 12 1 1 A 94 94 SER C C 94 174.554 173.939 0.615 1
1 1083 . 12 1 1 A 94 94 SER CA C 94 58.401 57.704 0.697 1
1 1084 . 12 1 1 A 94 94 SER CB C 94 63.806 64.279 -0.473 1
1 1085 . 12 1 1 A 94 94 SER N N 94 116.640 118.796 -2.156 1
1 1086 . 12 1 1 A 96 96 ASN HA H 96 4.770 5.411 -0.641 1
1 1091 . 12 1 1 A 96 96 ASN C C 96 175.161 173.221 1.940 1
1 1092 . 12 1 1 A 96 96 ASN CA C 96 53.395 52.389 1.006 1
1 1093 . 12 1 1 A 96 96 ASN CB C 96 38.999 41.614 -2.615 1
1 1095 . 12 1 1 A 97 97 SER H H 97 8.230 8.610 -0.380 1
1 1096 . 12 1 1 A 97 97 SER HA H 97 4.481 5.225 -0.744 1
1 1099 . 12 1 1 A 97 97 SER C C 97 174.482 173.710 0.772 1
1 1100 . 12 1 1 A 97 97 SER CA C 97 58.300 57.539 0.761 1
1 1101 . 12 1 1 A 97 97 SER CB C 97 63.697 67.476 -3.779 1
1 1102 . 12 1 1 A 97 97 SER N N 97 115.866 113.950 1.916 1
1 1103 . 12 1 1 A 98 98 GLY H H 98 8.228 8.279 -0.051 1
1 1104 . 12 1 1 A 98 98 GLY HA2 H 98 4.098 4.170 -0.072 1
1 1105 . 12 1 1 A 98 98 GLY HA3 H 98 4.098 4.173 -0.075 1
1 1106 . 12 1 1 A 98 98 GLY C C 98 171.788 172.522 -0.734 1
1 1107 . 12 1 1 A 98 98 GLY CA C 98 44.803 46.053 -1.250 1
1 1108 . 12 1 1 A 98 98 GLY N N 98 110.658 109.551 1.107 1
1 1109 . 12 1 1 A 99 99 PRO HA H 99 4.463 4.667 -0.204 1
1 1116 . 12 1 1 A 99 99 PRO CA C 99 63.230 62.669 0.561 1
1 1117 . 12 1 1 A 99 99 PRO CB C 99 32.044 31.876 0.168 1
1 1120 . 12 1 1 A 100 100 SER H H 100 8.514 8.985 -0.471 1
1 1121 . 12 1 1 A 100 100 SER CA C 100 58.450 60.571 -2.121 1
1 1122 . 12 1 1 A 100 100 SER CB C 100 63.889 63.560 0.329 1
1 1 . 13 1 1 A 9 9 ASN H H 9 8.856 7.909 0.947 1
1 2 . 13 1 1 A 9 9 ASN HA H 9 4.694 4.722 -0.028 1
1 7 . 13 1 1 A 9 9 ASN CA C 9 53.401 53.258 0.143 1
1 8 . 13 1 1 A 9 9 ASN CB C 9 38.757 39.450 -0.693 1
1 10 . 13 1 1 A 10 10 ARG HA H 10 4.346 4.814 -0.468 1
1 17 . 13 1 1 A 10 10 ARG C C 10 175.405 175.617 -0.212 1
1 18 . 13 1 1 A 10 10 ARG CA C 10 56.181 54.601 1.580 1
1 19 . 13 1 1 A 10 10 ARG CB C 10 31.171 32.541 -1.370 1
1 22 . 13 1 1 A 11 11 PHE H H 11 8.310 8.775 -0.465 1
1 23 . 13 1 1 A 11 11 PHE HA H 11 4.291 4.440 -0.149 1
1 31 . 13 1 1 A 11 11 PHE C C 11 174.458 174.306 0.152 1
1 32 . 13 1 1 A 11 11 PHE CA C 11 58.967 59.300 -0.333 1
1 33 . 13 1 1 A 11 11 PHE CB C 11 40.138 39.253 0.885 1
1 39 . 13 1 1 A 11 11 PHE N N 11 123.604 123.571 0.033 1
1 40 . 13 1 1 A 12 12 LYS H H 12 7.307 8.416 -1.109 1
1 41 . 13 1 1 A 12 12 LYS HA H 12 4.165 4.598 -0.433 1
1 50 . 13 1 1 A 12 12 LYS C C 12 174.385 175.489 -1.104 1
1 51 . 13 1 1 A 12 12 LYS CA C 12 54.593 54.114 0.479 1
1 52 . 13 1 1 A 12 12 LYS CB C 12 34.712 35.541 -0.829 1
1 56 . 13 1 1 A 12 12 LYS N N 12 127.282 126.946 0.336 1
1 57 . 13 1 1 A 13 13 TRP H H 13 8.039 8.330 -0.291 1
1 58 . 13 1 1 A 13 13 TRP HA H 13 4.370 4.526 -0.156 1
1 67 . 13 1 1 A 13 13 TRP C C 13 177.857 176.508 1.349 1
1 68 . 13 1 1 A 13 13 TRP CA C 13 56.675 57.582 -0.907 1
1 69 . 13 1 1 A 13 13 TRP CB C 13 30.317 30.486 -0.169 1
1 75 . 13 1 1 A 13 13 TRP N N 13 124.264 127.063 -2.799 1
1 77 . 13 1 1 A 14 14 GLY H H 14 9.815 8.710 1.105 1
1 78 . 13 1 1 A 14 14 GLY HA2 H 14 4.370 4.229 0.141 1
1 79 . 13 1 1 A 14 14 GLY HA3 H 14 4.335 4.246 0.089 1
1 80 . 13 1 1 A 14 14 GLY C C 14 172.904 174.786 -1.882 1
1 81 . 13 1 1 A 14 14 GLY CA C 14 44.157 43.884 0.273 1
1 82 . 13 1 1 A 14 14 GLY N N 14 115.294 108.826 6.468 1
1 83 . 13 1 1 A 15 15 PRO HA H 15 4.327 4.388 -0.061 1
1 90 . 13 1 1 A 15 15 PRO C C 15 179.726 178.927 0.799 1
1 91 . 13 1 1 A 15 15 PRO CA C 15 65.171 65.384 -0.213 1
1 92 . 13 1 1 A 15 15 PRO CB C 15 31.829 31.805 0.024 1
1 95 . 13 1 1 A 16 16 ALA H H 16 9.214 8.135 1.079 1
1 96 . 13 1 1 A 16 16 ALA HA H 16 4.166 4.103 0.063 1
1 100 . 13 1 1 A 16 16 ALA C C 16 181.184 179.803 1.381 1
1 101 . 13 1 1 A 16 16 ALA CA C 16 55.370 55.187 0.183 1
1 102 . 13 1 1 A 16 16 ALA CB C 16 18.058 18.533 -0.475 1
1 103 . 13 1 1 A 16 16 ALA N N 16 122.414 119.646 2.768 1
1 104 . 13 1 1 A 17 17 SER H H 17 7.985 8.170 -0.185 1
1 105 . 13 1 1 A 17 17 SER HA H 17 4.317 4.128 0.189 1
1 107 . 13 1 1 A 17 17 SER C C 17 175.381 176.790 -1.409 1
1 108 . 13 1 1 A 17 17 SER CA C 17 63.163 62.230 0.933 1
1 109 . 13 1 1 A 17 17 SER CB C 17 64.055 62.891 1.164 1
1 110 . 13 1 1 A 17 17 SER N N 17 116.568 114.031 2.537 1
1 111 . 13 1 1 A 18 18 GLN H H 18 8.316 7.861 0.455 1
1 112 . 13 1 1 A 18 18 GLN HA H 18 3.323 3.491 -0.168 1
1 119 . 13 1 1 A 18 18 GLN C C 18 176.812 178.613 -1.801 1
1 120 . 13 1 1 A 18 18 GLN CA C 18 60.025 59.287 0.738 1
1 121 . 13 1 1 A 18 18 GLN CB C 18 28.686 28.458 0.228 1
1 123 . 13 1 1 A 18 18 GLN N N 18 119.002 120.957 -1.955 1
1 125 . 13 1 1 A 19 19 GLN H H 19 7.582 8.154 -0.572 1
1 126 . 13 1 1 A 19 19 GLN HA H 19 4.062 4.124 -0.062 1
1 133 . 13 1 1 A 19 19 GLN C C 19 178.488 178.503 -0.015 1
1 134 . 13 1 1 A 19 19 GLN CA C 19 59.248 59.217 0.031 1
1 135 . 13 1 1 A 19 19 GLN CB C 19 28.203 28.212 -0.009 1
1 137 . 13 1 1 A 19 19 GLN N N 19 116.221 118.689 -2.468 1
1 139 . 13 1 1 A 20 20 ILE H H 20 7.246 7.929 -0.683 1
1 140 . 13 1 1 A 20 20 ILE HA H 20 3.570 3.629 -0.059 1
1 150 . 13 1 1 A 20 20 ILE C C 20 178.999 178.586 0.413 1
1 151 . 13 1 1 A 20 20 ILE CA C 20 64.996 65.591 -0.595 1
1 152 . 13 1 1 A 20 20 ILE CB C 20 38.139 37.779 0.360 1
1 156 . 13 1 1 A 20 20 ILE N N 20 120.521 121.075 -0.554 1
1 157 . 13 1 1 A 21 21 LEU H H 21 8.034 7.910 0.124 1
1 158 . 13 1 1 A 21 21 LEU HA H 21 3.491 3.569 -0.078 1
1 168 . 13 1 1 A 21 21 LEU C C 21 178.196 178.567 -0.371 1
1 169 . 13 1 1 A 21 21 LEU CA C 21 57.944 57.510 0.434 1
1 170 . 13 1 1 A 21 21 LEU CB C 21 37.864 40.317 -2.453 1
1 174 . 13 1 1 A 21 21 LEU N N 21 121.259 119.122 2.137 1
1 175 . 13 1 1 A 22 22 TYR H H 22 8.479 7.627 0.852 1
1 176 . 13 1 1 A 22 22 TYR HA H 22 4.224 4.293 -0.069 1
1 183 . 13 1 1 A 22 22 TYR C C 22 179.630 178.598 1.032 1
1 184 . 13 1 1 A 22 22 TYR CA C 22 62.422 60.789 1.633 1
1 185 . 13 1 1 A 22 22 TYR CB C 22 37.434 37.756 -0.322 1
1 190 . 13 1 1 A 22 22 TYR N N 22 117.805 118.408 -0.603 1
1 191 . 13 1 1 A 23 23 GLN H H 23 7.707 8.411 -0.704 1
1 192 . 13 1 1 A 23 23 GLN HA H 23 4.166 4.018 0.148 1
1 199 . 13 1 1 A 23 23 GLN C C 23 178.633 178.605 0.028 1
1 200 . 13 1 1 A 23 23 GLN CA C 23 58.789 59.178 -0.389 1
1 201 . 13 1 1 A 23 23 GLN CB C 23 28.534 28.068 0.466 1
1 203 . 13 1 1 A 23 23 GLN N N 23 117.580 118.354 -0.774 1
1 205 . 13 1 1 A 24 24 ALA H H 24 8.155 7.834 0.321 1
1 206 . 13 1 1 A 24 24 ALA HA H 24 4.187 4.198 -0.011 1
1 210 . 13 1 1 A 24 24 ALA C C 24 180.018 179.165 0.853 1
1 211 . 13 1 1 A 24 24 ALA CA C 24 55.228 55.184 0.044 1
1 212 . 13 1 1 A 24 24 ALA CB C 24 19.468 18.604 0.864 1
1 213 . 13 1 1 A 24 24 ALA N N 24 122.813 122.488 0.325 1
1 214 . 13 1 1 A 25 25 TYR H H 25 8.995 8.633 0.362 1
1 215 . 13 1 1 A 25 25 TYR HA H 25 4.348 4.791 -0.443 1
1 222 . 13 1 1 A 25 25 TYR C C 25 175.792 177.366 -1.574 1
1 223 . 13 1 1 A 25 25 TYR CA C 25 61.681 62.152 -0.471 1
1 224 . 13 1 1 A 25 25 TYR CB C 25 38.175 38.548 -0.373 1
1 229 . 13 1 1 A 25 25 TYR N N 25 121.343 120.315 1.028 1
1 230 . 13 1 1 A 26 26 ASP H H 26 7.260 8.722 -1.462 1
1 231 . 13 1 1 A 26 26 ASP HA H 26 4.373 4.502 -0.129 1
1 234 . 13 1 1 A 26 26 ASP C C 26 177.322 178.233 -0.911 1
1 235 . 13 1 1 A 26 26 ASP CA C 26 56.603 57.494 -0.891 1
1 236 . 13 1 1 A 26 26 ASP CB C 26 41.060 41.774 -0.714 1
1 237 . 13 1 1 A 26 26 ASP N N 26 114.020 119.199 -5.179 1
1 238 . 13 1 1 A 27 27 ARG H H 27 7.343 7.697 -0.354 1
1 239 . 13 1 1 A 27 27 ARG HA H 27 4.302 4.373 -0.071 1
1 246 . 13 1 1 A 27 27 ARG C C 27 176.546 176.218 0.328 1
1 247 . 13 1 1 A 27 27 ARG CA C 27 57.563 57.670 -0.107 1
1 248 . 13 1 1 A 27 27 ARG CB C 27 31.500 31.352 0.148 1
1 251 . 13 1 1 A 27 27 ARG N N 27 116.729 116.809 -0.080 1
1 252 . 13 1 1 A 28 28 GLN H H 28 8.306 7.974 0.332 1
1 253 . 13 1 1 A 28 28 GLN HA H 28 4.396 4.685 -0.289 1
1 260 . 13 1 1 A 28 28 GLN C C 28 172.831 175.195 -2.364 1
1 261 . 13 1 1 A 28 28 GLN CA C 28 55.355 54.316 1.039 1
1 262 . 13 1 1 A 28 28 GLN CB C 28 31.062 31.775 -0.713 1
1 264 . 13 1 1 A 28 28 GLN N N 28 121.612 118.408 3.204 1
1 266 . 13 1 1 A 29 29 LYS H H 29 8.354 8.542 -0.188 1
1 267 . 13 1 1 A 29 29 LYS HA H 29 4.099 3.504 0.595 1
1 276 . 13 1 1 A 29 29 LYS C C 29 176.084 176.440 -0.356 1
1 277 . 13 1 1 A 29 29 LYS CA C 29 57.873 57.778 0.095 1
1 278 . 13 1 1 A 29 29 LYS CB C 29 33.313 32.738 0.575 1
1 282 . 13 1 1 A 29 29 LYS N N 29 125.038 124.105 0.933 1
1 283 . 13 1 1 A 30 30 ASN H H 30 8.856 8.023 0.833 1
1 284 . 13 1 1 A 30 30 ASN HA H 30 4.958 5.089 -0.131 1
1 289 . 13 1 1 A 30 30 ASN C C 30 171.179 172.668 -1.489 1
1 290 . 13 1 1 A 30 30 ASN CA C 30 50.891 50.302 0.589 1
1 291 . 13 1 1 A 30 30 ASN CB C 30 39.907 39.149 0.758 1
1 292 . 13 1 1 A 30 30 ASN N N 30 115.764 117.576 -1.812 1
1 294 . 13 1 1 A 31 31 PRO HA H 31 4.299 4.418 -0.119 1
1 301 . 13 1 1 A 31 31 PRO C C 31 177.493 176.734 0.759 1
1 302 . 13 1 1 A 31 31 PRO CA C 31 62.489 62.553 -0.064 1
1 303 . 13 1 1 A 31 31 PRO CB C 31 31.216 31.711 -0.495 1
1 306 . 13 1 1 A 32 32 SER H H 32 9.368 8.451 0.917 1
1 307 . 13 1 1 A 32 32 SER HA H 32 4.372 4.754 -0.382 1
1 310 . 13 1 1 A 32 32 SER C C 32 174.821 175.750 -0.929 1
1 311 . 13 1 1 A 32 32 SER CA C 32 57.203 57.790 -0.587 1
1 312 . 13 1 1 A 32 32 SER CB C 32 65.594 64.420 1.174 1
1 313 . 13 1 1 A 32 32 SER N N 32 120.847 118.197 2.650 1
1 314 . 13 1 1 A 33 33 LYS H H 33 9.152 8.970 0.182 1
1 315 . 13 1 1 A 33 33 LYS HA H 33 3.719 3.883 -0.164 1
1 324 . 13 1 1 A 33 33 LYS C C 33 177.833 178.320 -0.487 1
1 325 . 13 1 1 A 33 33 LYS CA C 33 61.188 60.318 0.870 1
1 326 . 13 1 1 A 33 33 LYS CB C 33 32.572 32.399 0.173 1
1 330 . 13 1 1 A 33 33 LYS N N 33 122.966 124.766 -1.800 1
1 331 . 13 1 1 A 34 34 GLU H H 34 8.902 8.542 0.360 1
1 332 . 13 1 1 A 34 34 GLU HA H 34 4.089 4.024 0.065 1
1 337 . 13 1 1 A 34 34 GLU C C 34 180.286 179.251 1.035 1
1 338 . 13 1 1 A 34 34 GLU CA C 34 60.483 59.193 1.290 1
1 339 . 13 1 1 A 34 34 GLU CB C 34 28.835 29.279 -0.444 1
1 341 . 13 1 1 A 34 34 GLU N N 34 117.645 117.804 -0.159 1
1 342 . 13 1 1 A 35 35 GLU H H 35 7.673 8.194 -0.521 1
1 343 . 13 1 1 A 35 35 GLU HA H 35 4.023 3.951 0.072 1
1 348 . 13 1 1 A 35 35 GLU C C 35 180.237 179.257 0.980 1
1 349 . 13 1 1 A 35 35 GLU CA C 35 59.214 59.415 -0.201 1
1 350 . 13 1 1 A 35 35 GLU CB C 35 30.099 29.284 0.815 1
1 352 . 13 1 1 A 35 35 GLU N N 35 121.077 120.056 1.021 1
1 353 . 13 1 1 A 36 36 ARG H H 36 8.932 8.446 0.486 1
1 354 . 13 1 1 A 36 36 ARG HA H 36 3.928 3.768 0.160 1
1 362 . 13 1 1 A 36 36 ARG C C 36 178.464 179.089 -0.625 1
1 363 . 13 1 1 A 36 36 ARG CA C 36 60.974 59.991 0.983 1
1 364 . 13 1 1 A 36 36 ARG CB C 36 31.171 29.962 1.209 1
1 367 . 13 1 1 A 36 36 ARG N N 36 119.441 120.112 -0.671 1
1 369 . 13 1 1 A 37 37 GLU H H 37 8.756 8.498 0.258 1
1 370 . 13 1 1 A 37 37 GLU HA H 37 3.948 4.095 -0.147 1
1 375 . 13 1 1 A 37 37 GLU C C 37 179.606 178.636 0.970 1
1 376 . 13 1 1 A 37 37 GLU CA C 37 60.094 59.029 1.065 1
1 377 . 13 1 1 A 37 37 GLU CB C 37 29.110 29.409 -0.299 1
1 379 . 13 1 1 A 37 37 GLU N N 37 119.017 119.579 -0.562 1
1 380 . 13 1 1 A 38 38 ALA H H 38 7.733 8.083 -0.350 1
1 381 . 13 1 1 A 38 38 ALA HA H 38 4.325 4.097 0.228 1
1 385 . 13 1 1 A 38 38 ALA C C 38 180.820 178.637 2.183 1
1 386 . 13 1 1 A 38 38 ALA CA C 38 55.194 54.485 0.709 1
1 387 . 13 1 1 A 38 38 ALA CB C 38 17.654 18.509 -0.855 1
1 388 . 13 1 1 A 38 38 ALA N N 38 122.889 122.086 0.803 1
1 389 . 13 1 1 A 39 39 LEU H H 39 7.740 7.902 -0.162 1
1 390 . 13 1 1 A 39 39 LEU HA H 39 4.176 4.290 -0.114 1
1 400 . 13 1 1 A 39 39 LEU C C 39 179.266 178.867 0.399 1
1 401 . 13 1 1 A 39 39 LEU CA C 39 57.944 56.098 1.846 1
1 402 . 13 1 1 A 39 39 LEU CB C 39 42.105 42.293 -0.188 1
1 406 . 13 1 1 A 39 39 LEU N N 39 119.783 116.967 2.816 1
1 407 . 13 1 1 A 40 40 VAL H H 40 8.451 8.531 -0.080 1
1 408 . 13 1 1 A 40 40 VAL HA H 40 3.259 3.607 -0.348 1
1 416 . 13 1 1 A 40 40 VAL C C 40 177.153 177.679 -0.526 1
1 417 . 13 1 1 A 40 40 VAL CA C 40 67.254 66.946 0.308 1
1 418 . 13 1 1 A 40 40 VAL CB C 40 31.747 31.478 0.269 1
1 421 . 13 1 1 A 40 40 VAL N N 40 121.481 120.064 1.417 1
1 422 . 13 1 1 A 41 41 GLU H H 41 7.254 8.097 -0.843 1
1 423 . 13 1 1 A 41 41 GLU HA H 41 4.159 4.108 0.051 1
1 428 . 13 1 1 A 41 41 GLU C C 41 179.483 178.811 0.672 1
1 429 . 13 1 1 A 41 41 GLU CA C 41 59.248 59.349 -0.101 1
1 430 . 13 1 1 A 41 41 GLU CB C 41 29.358 29.317 0.041 1
1 432 . 13 1 1 A 41 41 GLU N N 41 116.549 119.813 -3.264 1
1 433 . 13 1 1 A 42 42 GLU H H 42 8.103 7.814 0.289 1
1 434 . 13 1 1 A 42 42 GLU HA H 42 4.020 4.050 -0.030 1
1 439 . 13 1 1 A 42 42 GLU C C 42 180.115 178.670 1.445 1
1 440 . 13 1 1 A 42 42 GLU CA C 42 59.847 59.505 0.342 1
1 441 . 13 1 1 A 42 42 GLU CB C 42 30.218 29.327 0.891 1
1 443 . 13 1 1 A 42 42 GLU N N 42 119.578 119.353 0.225 1
1 444 . 13 1 1 A 43 43 CYS H H 43 8.955 8.120 0.835 1
1 445 . 13 1 1 A 43 43 CYS HA H 43 4.153 4.245 -0.092 1
1 448 . 13 1 1 A 43 43 CYS C C 43 176.498 177.631 -1.133 1
1 449 . 13 1 1 A 43 43 CYS CA C 43 64.856 62.488 2.368 1
1 450 . 13 1 1 A 43 43 CYS CB C 43 27.390 27.623 -0.233 1
1 451 . 13 1 1 A 43 43 CYS N N 43 118.199 118.730 -0.531 1
1 452 . 13 1 1 A 44 44 ASN H H 44 8.543 7.934 0.609 1
1 453 . 13 1 1 A 44 44 ASN HA H 44 4.635 4.449 0.186 1
1 458 . 13 1 1 A 44 44 ASN C C 44 178.633 177.759 0.874 1
1 459 . 13 1 1 A 44 44 ASN CA C 44 56.603 56.358 0.245 1
1 460 . 13 1 1 A 44 44 ASN CB C 44 37.187 38.322 -1.135 1
1 461 . 13 1 1 A 44 44 ASN N N 44 117.002 119.642 -2.640 1
1 463 . 13 1 1 A 45 45 ARG H H 45 8.296 8.046 0.250 1
1 464 . 13 1 1 A 45 45 ARG HA H 45 3.977 4.089 -0.112 1
1 471 . 13 1 1 A 45 45 ARG C C 45 178.149 178.559 -0.410 1
1 472 . 13 1 1 A 45 45 ARG CA C 45 60.589 59.568 1.021 1
1 473 . 13 1 1 A 45 45 ARG CB C 45 30.099 30.186 -0.087 1
1 476 . 13 1 1 A 45 45 ARG N N 45 121.021 120.819 0.202 1
1 477 . 13 1 1 A 46 46 ALA H H 46 7.914 8.201 -0.287 1
1 478 . 13 1 1 A 46 46 ALA HA H 46 4.128 4.125 0.003 1
1 482 . 13 1 1 A 46 46 ALA C C 46 181.208 180.174 1.034 1
1 483 . 13 1 1 A 46 46 ALA CA C 46 55.264 55.011 0.253 1
1 484 . 13 1 1 A 46 46 ALA CB C 46 18.759 18.297 0.462 1
1 485 . 13 1 1 A 46 46 ALA N N 46 121.570 120.794 0.776 1
1 486 . 13 1 1 A 47 47 GLU H H 47 8.730 8.517 0.213 1
1 487 . 13 1 1 A 47 47 GLU HA H 47 4.194 4.028 0.166 1
1 492 . 13 1 1 A 47 47 GLU C C 47 180.115 179.214 0.901 1
1 493 . 13 1 1 A 47 47 GLU CA C 47 58.401 59.666 -1.265 1
1 494 . 13 1 1 A 47 47 GLU CB C 47 29.523 29.267 0.256 1
1 496 . 13 1 1 A 47 47 GLU N N 47 117.532 118.051 -0.519 1
1 497 . 13 1 1 A 48 48 CYS H H 48 8.283 7.884 0.399 1
1 498 . 13 1 1 A 48 48 CYS HA H 48 4.002 4.153 -0.151 1
1 501 . 13 1 1 A 48 48 CYS C C 48 177.031 177.288 -0.257 1
1 502 . 13 1 1 A 48 48 CYS CA C 48 64.749 63.897 0.852 1
1 503 . 13 1 1 A 48 48 CYS CB C 48 25.907 27.407 -1.500 1
1 504 . 13 1 1 A 48 48 CYS N N 48 118.282 119.216 -0.934 1
1 505 . 13 1 1 A 49 49 LEU H H 49 8.181 8.115 0.066 1
1 506 . 13 1 1 A 49 49 LEU HA H 49 4.175 3.940 0.235 1
1 516 . 13 1 1 A 49 49 LEU C C 49 180.430 178.772 1.658 1
1 517 . 13 1 1 A 49 49 LEU CA C 49 57.873 58.133 -0.260 1
1 518 . 13 1 1 A 49 49 LEU CB C 49 41.539 41.736 -0.197 1
1 522 . 13 1 1 A 49 49 LEU N N 49 120.371 120.589 -0.218 1
1 523 . 13 1 1 A 50 50 GLN H H 50 7.934 8.555 -0.621 1
1 524 . 13 1 1 A 50 50 GLN HA H 50 4.102 4.101 0.001 1
1 531 . 13 1 1 A 50 50 GLN C C 50 177.322 177.361 -0.039 1
1 532 . 13 1 1 A 50 50 GLN CA C 50 58.156 58.666 -0.510 1
1 533 . 13 1 1 A 50 50 GLN CB C 50 28.616 28.495 0.121 1
1 535 . 13 1 1 A 50 50 GLN N N 50 118.175 117.389 0.786 1
1 537 . 13 1 1 A 51 51 ARG H H 51 7.632 7.767 -0.135 1
1 538 . 13 1 1 A 51 51 ARG HA H 51 4.347 4.363 -0.016 1
1 545 . 13 1 1 A 51 51 ARG C C 51 176.546 176.448 0.098 1
1 546 . 13 1 1 A 51 51 ARG CA C 51 56.286 55.993 0.293 1
1 547 . 13 1 1 A 51 51 ARG CB C 51 31.314 30.290 1.024 1
1 550 . 13 1 1 A 51 51 ARG N N 51 116.454 117.959 -1.505 1
1 551 . 13 1 1 A 52 52 GLY H H 52 7.949 8.473 -0.524 1
1 552 . 13 1 1 A 52 52 GLY HA2 H 52 4.033 3.978 0.055 1
1 553 . 13 1 1 A 52 52 GLY HA3 H 52 3.903 3.978 -0.075 1
1 554 . 13 1 1 A 52 52 GLY C C 52 174.385 174.225 0.160 1
1 555 . 13 1 1 A 52 52 GLY CA C 52 46.231 45.290 0.941 1
1 556 . 13 1 1 A 52 52 GLY N N 52 108.854 107.589 1.265 1
1 557 . 13 1 1 A 53 53 VAL H H 53 7.944 7.499 0.445 1
1 558 . 13 1 1 A 53 53 VAL HA H 53 4.250 4.063 0.187 1
1 566 . 13 1 1 A 53 53 VAL C C 53 175.525 175.268 0.257 1
1 567 . 13 1 1 A 53 53 VAL CA C 53 60.377 62.524 -2.147 1
1 568 . 13 1 1 A 53 53 VAL CB C 53 34.283 32.846 1.437 1
1 571 . 13 1 1 A 53 53 VAL N N 53 118.316 120.754 -2.438 1
1 572 . 13 1 1 A 54 54 SER H H 54 8.502 8.546 -0.044 1
1 573 . 13 1 1 A 54 54 SER HA H 54 4.625 4.872 -0.247 1
1 576 . 13 1 1 A 54 54 SER C C 54 174.603 174.190 0.413 1
1 577 . 13 1 1 A 54 54 SER CA C 54 56.092 54.441 1.651 1
1 578 . 13 1 1 A 54 54 SER CB C 54 63.697 63.801 -0.104 1
1 579 . 13 1 1 A 54 54 SER N N 54 120.337 118.419 1.918 1
1 580 . 13 1 1 A 55 55 PRO HA H 55 4.624 4.550 0.074 1
1 587 . 13 1 1 A 55 55 PRO C C 55 177.322 177.547 -0.225 1
1 588 . 13 1 1 A 55 55 PRO CA C 55 64.431 64.293 0.138 1
1 589 . 13 1 1 A 55 55 PRO CB C 55 31.913 31.746 0.167 1
1 592 . 13 1 1 A 56 56 SER H H 56 7.931 8.416 -0.485 1
1 593 . 13 1 1 A 56 56 SER HA H 56 4.428 4.493 -0.065 1
1 596 . 13 1 1 A 56 56 SER C C 56 174.749 174.792 -0.043 1
1 597 . 13 1 1 A 56 56 SER CA C 56 59.130 59.396 -0.266 1
1 598 . 13 1 1 A 56 56 SER CB C 56 63.056 63.964 -0.908 1
1 599 . 13 1 1 A 56 56 SER N N 56 112.637 112.562 0.075 1
1 600 . 13 1 1 A 57 57 LYS H H 57 8.121 7.494 0.627 1
1 601 . 13 1 1 A 57 57 LYS HA H 57 4.467 4.653 -0.186 1
1 609 . 13 1 1 A 57 57 LYS C C 57 176.570 176.866 -0.296 1
1 610 . 13 1 1 A 57 57 LYS CA C 57 55.264 54.978 0.286 1
1 611 . 13 1 1 A 57 57 LYS CB C 57 32.160 31.378 0.782 1
1 615 . 13 1 1 A 57 57 LYS N N 57 123.185 118.612 4.573 1
1 616 . 13 1 1 A 58 58 ALA H H 58 7.886 8.151 -0.265 1
1 617 . 13 1 1 A 58 58 ALA HA H 58 3.923 4.192 -0.269 1
1 621 . 13 1 1 A 58 58 ALA C C 58 177.469 179.973 -2.504 1
1 622 . 13 1 1 A 58 58 ALA CA C 58 54.276 54.923 -0.647 1
1 623 . 13 1 1 A 58 58 ALA CB C 58 18.271 18.445 -0.174 1
1 624 . 13 1 1 A 58 58 ALA N N 58 123.941 123.390 0.551 1
1 625 . 13 1 1 A 59 59 HIS H H 59 8.077 8.249 -0.172 1
1 626 . 13 1 1 A 59 59 HIS HA H 59 4.420 4.427 -0.007 1
1 631 . 13 1 1 A 59 59 HIS C C 59 177.542 177.404 0.138 1
1 632 . 13 1 1 A 59 59 HIS CA C 59 57.767 58.474 -0.707 1
1 633 . 13 1 1 A 59 59 HIS CB C 59 29.852 28.794 1.058 1
1 636 . 13 1 1 A 59 59 HIS N N 59 115.566 115.648 -0.082 1
1 637 . 13 1 1 A 60 60 GLY H H 60 8.110 8.371 -0.261 1
1 638 . 13 1 1 A 60 60 GLY HA2 H 60 3.873 3.469 0.404 1
1 639 . 13 1 1 A 60 60 GLY HA3 H 60 4.025 3.533 0.492 1
1 640 . 13 1 1 A 60 60 GLY C C 60 174.918 175.471 -0.553 1
1 641 . 13 1 1 A 60 60 GLY CA C 60 45.559 47.092 -1.533 1
1 642 . 13 1 1 A 60 60 GLY N N 60 109.216 110.101 -0.885 1
1 643 . 13 1 1 A 61 61 LEU H H 61 8.280 8.381 -0.101 1
1 644 . 13 1 1 A 61 61 LEU HA H 61 4.198 3.961 0.237 1
1 654 . 13 1 1 A 61 61 LEU C C 61 178.900 177.550 1.350 1
1 655 . 13 1 1 A 61 61 LEU CA C 61 55.758 58.052 -2.294 1
1 656 . 13 1 1 A 61 61 LEU CB C 61 42.544 41.857 0.687 1
1 660 . 13 1 1 A 61 61 LEU N N 61 120.521 123.115 -2.594 1
1 661 . 13 1 1 A 62 62 GLY H H 62 8.184 8.061 0.123 1
1 662 . 13 1 1 A 62 62 GLY HA2 H 62 3.978 3.855 0.123 1
1 663 . 13 1 1 A 62 62 GLY HA3 H 62 3.817 3.857 -0.040 1
1 664 . 13 1 1 A 62 62 GLY C C 62 176.012 175.300 0.712 1
1 665 . 13 1 1 A 62 62 GLY CA C 62 46.767 47.342 -0.575 1
1 666 . 13 1 1 A 62 62 GLY N N 62 108.987 108.164 0.823 1
1 667 . 13 1 1 A 63 63 SER HA H 63 4.322 4.254 0.068 1
1 670 . 13 1 1 A 63 63 SER C C 63 174.167 175.137 -0.970 1
1 671 . 13 1 1 A 63 63 SER CA C 63 59.919 62.194 -2.275 1
1 672 . 13 1 1 A 63 63 SER CB C 63 63.312 62.969 0.343 1
1 673 . 13 1 1 A 64 64 ASN H H 64 8.087 7.892 0.195 1
1 674 . 13 1 1 A 64 64 ASN HA H 64 4.850 4.875 -0.025 1
1 679 . 13 1 1 A 64 64 ASN C C 64 173.899 175.100 -1.201 1
1 680 . 13 1 1 A 64 64 ASN CA C 64 53.218 53.216 0.002 1
1 681 . 13 1 1 A 64 64 ASN CB C 64 39.164 38.804 0.360 1
1 682 . 13 1 1 A 64 64 ASN N N 64 118.041 116.433 1.608 1
1 684 . 13 1 1 A 65 65 LEU H H 65 7.293 7.407 -0.114 1
1 685 . 13 1 1 A 65 65 LEU HA H 65 3.995 4.546 -0.551 1
1 695 . 13 1 1 A 65 65 LEU C C 65 175.696 175.128 0.568 1
1 696 . 13 1 1 A 65 65 LEU CA C 65 56.005 54.880 1.125 1
1 697 . 13 1 1 A 65 65 LEU CB C 65 43.120 43.612 -0.492 1
1 701 . 13 1 1 A 65 65 LEU N N 65 120.953 122.929 -1.976 1
1 702 . 13 1 1 A 66 66 VAL H H 66 9.517 8.953 0.564 1
1 703 . 13 1 1 A 66 66 VAL HA H 66 3.481 4.544 -1.063 1
1 711 . 13 1 1 A 66 66 VAL C C 66 175.429 175.043 0.386 1
1 712 . 13 1 1 A 66 66 VAL CA C 66 65.243 61.486 3.757 1
1 713 . 13 1 1 A 66 66 VAL CB C 66 31.335 33.402 -2.067 1
1 716 . 13 1 1 A 66 66 VAL N N 66 127.924 126.386 1.538 1
1 717 . 13 1 1 A 67 67 THR H H 67 6.253 8.296 -2.043 1
1 718 . 13 1 1 A 67 67 THR HA H 67 4.779 4.735 0.044 1
1 723 . 13 1 1 A 67 67 THR C C 67 174.894 174.818 0.076 1
1 724 . 13 1 1 A 67 67 THR CA C 67 58.719 59.599 -0.880 1
1 725 . 13 1 1 A 67 67 THR CB C 67 72.153 71.816 0.337 1
1 727 . 13 1 1 A 67 67 THR N N 67 113.376 115.932 -2.556 1
1 728 . 13 1 1 A 68 68 GLU H H 68 9.348 8.863 0.485 1
1 729 . 13 1 1 A 68 68 GLU HA H 68 3.634 4.010 -0.376 1
1 734 . 13 1 1 A 68 68 GLU C C 68 177.809 178.317 -0.508 1
1 735 . 13 1 1 A 68 68 GLU CA C 68 61.505 59.999 1.506 1
1 736 . 13 1 1 A 68 68 GLU CB C 68 28.285 29.557 -1.272 1
1 738 . 13 1 1 A 68 68 GLU N N 68 124.534 122.150 2.384 1
1 739 . 13 1 1 A 69 69 VAL H H 69 8.126 7.914 0.212 1
1 740 . 13 1 1 A 69 69 VAL HA H 69 3.862 3.535 0.327 1
1 748 . 13 1 1 A 69 69 VAL C C 69 177.712 178.053 -0.341 1
1 749 . 13 1 1 A 69 69 VAL CA C 69 65.701 66.784 -1.083 1
1 750 . 13 1 1 A 69 69 VAL CB C 69 31.829 31.582 0.247 1
1 753 . 13 1 1 A 69 69 VAL N N 69 119.139 119.829 -0.690 1
1 754 . 13 1 1 A 70 70 ARG H H 70 7.235 8.105 -0.870 1
1 755 . 13 1 1 A 70 70 ARG HA H 70 4.265 3.895 0.370 1
1 762 . 13 1 1 A 70 70 ARG C C 70 180.430 179.432 0.998 1
1 763 . 13 1 1 A 70 70 ARG CA C 70 59.742 60.134 -0.392 1
1 764 . 13 1 1 A 70 70 ARG CB C 70 29.439 29.826 -0.387 1
1 767 . 13 1 1 A 70 70 ARG N N 70 119.541 119.122 0.419 1
1 768 . 13 1 1 A 71 71 VAL H H 71 8.144 8.043 0.101 1
1 769 . 13 1 1 A 71 71 VAL HA H 71 4.018 3.950 0.068 1
1 777 . 13 1 1 A 71 71 VAL C C 71 177.493 178.405 -0.912 1
1 778 . 13 1 1 A 71 71 VAL CA C 71 67.924 66.708 1.216 1
1 779 . 13 1 1 A 71 71 VAL CB C 71 32.289 31.782 0.507 1
1 782 . 13 1 1 A 71 71 VAL N N 71 120.755 120.409 0.346 1
1 783 . 13 1 1 A 72 72 TYR H H 72 9.411 8.396 1.015 1
1 784 . 13 1 1 A 72 72 TYR HA H 72 3.908 4.164 -0.256 1
1 791 . 13 1 1 A 72 72 TYR C C 72 178.464 177.170 1.294 1
1 792 . 13 1 1 A 72 72 TYR CA C 72 63.444 62.342 1.102 1
1 793 . 13 1 1 A 72 72 TYR CB C 72 38.211 38.459 -0.248 1
1 798 . 13 1 1 A 72 72 TYR N N 72 121.175 121.129 0.046 1
1 799 . 13 1 1 A 73 73 ASN H H 73 8.816 8.819 -0.003 1
1 800 . 13 1 1 A 73 73 ASN HA H 73 4.538 4.542 -0.004 1
1 805 . 13 1 1 A 73 73 ASN C C 73 176.958 178.126 -1.168 1
1 806 . 13 1 1 A 73 73 ASN CA C 73 56.109 56.733 -0.624 1
1 807 . 13 1 1 A 73 73 ASN CB C 73 38.422 38.666 -0.244 1
1 808 . 13 1 1 A 73 73 ASN N N 73 118.122 116.998 1.124 1
1 810 . 13 1 1 A 74 74 TRP H H 74 8.657 8.313 0.344 1
1 811 . 13 1 1 A 74 74 TRP HA H 74 4.111 4.491 -0.380 1
1 820 . 13 1 1 A 74 74 TRP C C 74 179.654 178.416 1.238 1
1 821 . 13 1 1 A 74 74 TRP CA C 74 62.950 61.193 1.757 1
1 822 . 13 1 1 A 74 74 TRP CB C 74 29.555 29.508 0.047 1
1 828 . 13 1 1 A 74 74 TRP N N 74 123.988 123.335 0.653 1
1 830 . 13 1 1 A 75 75 PHE H H 75 8.562 8.504 0.058 1
1 831 . 13 1 1 A 75 75 PHE HA H 75 3.821 4.371 -0.550 1
1 839 . 13 1 1 A 75 75 PHE C C 75 177.614 178.249 -0.635 1
1 840 . 13 1 1 A 75 75 PHE CA C 75 63.374 61.989 1.385 1
1 841 . 13 1 1 A 75 75 PHE CB C 75 39.648 38.403 1.245 1
1 847 . 13 1 1 A 75 75 PHE N N 75 118.325 117.572 0.753 1
1 848 . 13 1 1 A 76 76 ALA H H 76 8.305 8.361 -0.056 1
1 849 . 13 1 1 A 76 76 ALA HA H 76 3.909 3.962 -0.053 1
1 853 . 13 1 1 A 76 76 ALA C C 76 180.868 179.740 1.128 1
1 854 . 13 1 1 A 76 76 ALA CA C 76 55.566 55.155 0.411 1
1 855 . 13 1 1 A 76 76 ALA CB C 76 17.820 18.076 -0.256 1
1 856 . 13 1 1 A 76 76 ALA N N 76 121.119 122.128 -1.009 1
1 857 . 13 1 1 A 77 77 ASN H H 77 8.335 8.085 0.250 1
1 858 . 13 1 1 A 77 77 ASN HA H 77 4.355 4.364 -0.009 1
1 863 . 13 1 1 A 77 77 ASN C C 77 177.105 177.503 -0.398 1
1 864 . 13 1 1 A 77 77 ASN CA C 77 56.145 56.281 -0.136 1
1 865 . 13 1 1 A 77 77 ASN CB C 77 38.063 38.744 -0.681 1
1 866 . 13 1 1 A 77 77 ASN N N 77 117.433 116.501 0.932 1
1 868 . 13 1 1 A 78 78 ARG H H 78 7.664 7.300 0.364 1
1 869 . 13 1 1 A 78 78 ARG HA H 78 3.629 4.117 -0.488 1
1 876 . 13 1 1 A 78 78 ARG C C 78 179.216 177.802 1.414 1
1 877 . 13 1 1 A 78 78 ARG CA C 78 58.773 58.856 -0.083 1
1 878 . 13 1 1 A 78 78 ARG CB C 78 29.605 29.326 0.279 1
1 881 . 13 1 1 A 78 78 ARG N N 78 121.999 118.309 3.690 1
1 882 . 13 1 1 A 79 79 ARG H H 79 8.320 7.610 0.710 1
1 883 . 13 1 1 A 79 79 ARG HA H 79 4.307 4.380 -0.073 1
1 890 . 13 1 1 A 79 79 ARG C C 79 180.406 178.780 1.626 1
1 891 . 13 1 1 A 79 79 ARG CA C 79 60.270 57.045 3.225 1
1 892 . 13 1 1 A 79 79 ARG CB C 79 31.335 30.654 0.681 1
1 895 . 13 1 1 A 79 79 ARG N N 79 118.139 117.753 0.386 1
1 896 . 13 1 1 A 80 80 LYS H H 80 7.759 8.199 -0.440 1
1 897 . 13 1 1 A 80 80 LYS HA H 80 4.052 4.120 -0.068 1
1 905 . 13 1 1 A 80 80 LYS C C 80 178.999 178.681 0.318 1
1 906 . 13 1 1 A 80 80 LYS CA C 80 59.531 59.126 0.405 1
1 907 . 13 1 1 A 80 80 LYS CB C 80 32.374 32.000 0.374 1
1 911 . 13 1 1 A 80 80 LYS N N 80 120.899 118.669 2.230 1
1 912 . 13 1 1 A 81 81 GLU H H 81 8.041 8.333 -0.292 1
1 913 . 13 1 1 A 81 81 GLU HA H 81 4.044 4.170 -0.126 1
1 918 . 13 1 1 A 81 81 GLU C C 81 179.168 178.631 0.537 1
1 919 . 13 1 1 A 81 81 GLU CA C 81 59.036 59.520 -0.484 1
1 920 . 13 1 1 A 81 81 GLU CB C 81 29.561 29.159 0.402 1
1 922 . 13 1 1 A 81 81 GLU N N 81 120.193 120.259 -0.066 1
1 923 . 13 1 1 A 82 82 GLU H H 82 8.131 8.477 -0.346 1
1 924 . 13 1 1 A 82 82 GLU HA H 82 4.017 4.070 -0.053 1
1 929 . 13 1 1 A 82 82 GLU C C 82 178.343 178.489 -0.146 1
1 930 . 13 1 1 A 82 82 GLU CA C 82 59.319 59.358 -0.039 1
1 931 . 13 1 1 A 82 82 GLU CB C 82 29.770 29.389 0.381 1
1 933 . 13 1 1 A 82 82 GLU N N 82 119.626 118.658 0.968 1
1 934 . 13 1 1 A 83 83 ALA H H 83 7.935 7.711 0.224 1
1 935 . 13 1 1 A 83 83 ALA HA H 83 4.180 4.171 0.009 1
1 939 . 13 1 1 A 83 83 ALA C C 83 179.994 179.600 0.394 1
1 940 . 13 1 1 A 83 83 ALA CA C 83 54.629 54.443 0.186 1
1 941 . 13 1 1 A 83 83 ALA CB C 83 18.090 18.792 -0.702 1
1 942 . 13 1 1 A 83 83 ALA N N 83 121.476 122.367 -0.891 1
1 943 . 13 1 1 A 84 84 PHE H H 84 8.043 8.206 -0.163 1
1 944 . 13 1 1 A 84 84 PHE HA H 84 4.420 4.050 0.370 1
1 952 . 13 1 1 A 84 84 PHE C C 84 177.250 177.060 0.190 1
1 953 . 13 1 1 A 84 84 PHE CA C 84 60.059 62.265 -2.206 1
1 954 . 13 1 1 A 84 84 PHE CB C 84 38.952 39.309 -0.357 1
1 960 . 13 1 1 A 84 84 PHE N N 84 119.074 120.158 -1.084 1
1 961 . 13 1 1 A 85 85 ARG H H 85 8.031 8.388 -0.357 1
1 962 . 13 1 1 A 85 85 ARG HA H 85 3.992 4.138 -0.146 1
1 968 . 13 1 1 A 85 85 ARG C C 85 178.319 178.544 -0.225 1
1 969 . 13 1 1 A 85 85 ARG CA C 85 58.523 59.671 -1.148 1
1 970 . 13 1 1 A 85 85 ARG CB C 85 30.346 30.087 0.259 1
1 973 . 13 1 1 A 85 85 ARG N N 85 119.291 117.457 1.834 1
1 974 . 13 1 1 A 86 86 GLN H H 86 8.091 8.338 -0.247 1
1 975 . 13 1 1 A 86 86 GLN HA H 86 4.148 4.235 -0.087 1
1 982 . 13 1 1 A 86 86 GLN C C 86 177.105 178.314 -1.209 1
1 983 . 13 1 1 A 86 86 GLN CA C 86 57.556 57.849 -0.293 1
1 984 . 13 1 1 A 86 86 GLN CB C 86 28.855 29.311 -0.456 1
1 986 . 13 1 1 A 86 86 GLN N N 86 119.097 117.699 1.398 1
1 988 . 13 1 1 A 87 87 LYS H H 87 7.898 8.325 -0.427 1
1 989 . 13 1 1 A 87 87 LYS HA H 87 4.116 4.046 0.070 1
1 997 . 13 1 1 A 87 87 LYS C C 87 177.542 179.073 -1.531 1
1 998 . 13 1 1 A 87 87 LYS CA C 87 57.944 58.979 -1.035 1
1 999 . 13 1 1 A 87 87 LYS CB C 87 32.242 32.002 0.240 1
1 1003 . 13 1 1 A 87 87 LYS N N 87 120.968 122.172 -1.204 1
1 1004 . 13 1 1 A 88 88 LEU H H 88 7.903 8.145 -0.242 1
1 1005 . 13 1 1 A 88 88 LEU HA H 88 4.144 4.214 -0.070 1
1 1015 . 13 1 1 A 88 88 LEU C C 88 178.221 178.002 0.219 1
1 1016 . 13 1 1 A 88 88 LEU CA C 88 56.145 56.823 -0.678 1
1 1017 . 13 1 1 A 88 88 LEU CB C 88 42.215 41.303 0.912 1
1 1021 . 13 1 1 A 88 88 LEU N N 88 120.558 117.647 2.911 1
1 1022 . 13 1 1 A 89 89 ALA H H 89 7.894 7.525 0.369 1
1 1023 . 13 1 1 A 89 89 ALA HA H 89 4.224 4.418 -0.194 1
1 1027 . 13 1 1 A 89 89 ALA C C 89 178.609 179.449 -0.840 1
1 1028 . 13 1 1 A 89 89 ALA CA C 89 53.392 53.926 -0.534 1
1 1029 . 13 1 1 A 89 89 ALA CB C 89 18.695 19.749 -1.054 1
1 1030 . 13 1 1 A 89 89 ALA N N 89 122.387 122.220 0.167 1
1 1031 . 13 1 1 A 90 90 MET H H 90 8.084 8.181 -0.097 1
1 1032 . 13 1 1 A 90 90 MET HA H 90 4.356 4.187 0.169 1
1 1040 . 13 1 1 A 90 90 MET C C 90 176.982 176.626 0.356 1
1 1041 . 13 1 1 A 90 90 MET CA C 90 56.551 58.223 -1.672 1
1 1042 . 13 1 1 A 90 90 MET CB C 90 32.719 32.201 0.518 1
1 1045 . 13 1 1 A 90 90 MET N N 90 118.509 116.824 1.685 1
1 1046 . 13 1 1 A 91 91 ASP H H 91 8.261 7.634 0.627 1
1 1047 . 13 1 1 A 91 91 ASP HA H 91 4.524 4.627 -0.103 1
1 1050 . 13 1 1 A 91 91 ASP C C 91 176.643 176.072 0.571 1
1 1051 . 13 1 1 A 91 91 ASP CA C 91 54.981 54.293 0.688 1
1 1052 . 13 1 1 A 91 91 ASP CB C 91 40.870 41.782 -0.912 1
1 1053 . 13 1 1 A 91 91 ASP N N 91 120.771 121.047 -0.276 1
1 1054 . 13 1 1 A 92 92 ALA H H 92 7.971 8.490 -0.519 1
1 1055 . 13 1 1 A 92 92 ALA HA H 92 4.200 4.238 -0.038 1
1 1059 . 13 1 1 A 92 92 ALA C C 92 177.929 177.520 0.409 1
1 1060 . 13 1 1 A 92 92 ALA CA C 92 53.184 52.651 0.533 1
1 1061 . 13 1 1 A 92 92 ALA CB C 92 18.890 19.823 -0.933 1
1 1062 . 13 1 1 A 92 92 ALA N N 92 123.057 123.438 -0.381 1
1 1063 . 13 1 1 A 93 93 TYR H H 93 8.019 8.821 -0.802 1
1 1064 . 13 1 1 A 93 93 TYR HA H 93 4.523 4.021 0.502 1
1 1071 . 13 1 1 A 93 93 TYR C C 93 176.279 174.579 1.700 1
1 1072 . 13 1 1 A 93 93 TYR CA C 93 58.401 58.579 -0.178 1
1 1073 . 13 1 1 A 93 93 TYR CB C 93 38.669 35.818 2.851 1
1 1078 . 13 1 1 A 93 93 TYR N N 93 118.337 115.488 2.849 1
1 1079 . 13 1 1 A 94 94 SER H H 94 8.037 7.801 0.236 1
1 1080 . 13 1 1 A 94 94 SER HA H 94 4.484 4.721 -0.237 1
1 1082 . 13 1 1 A 94 94 SER C C 94 174.554 175.315 -0.761 1
1 1083 . 13 1 1 A 94 94 SER CA C 94 58.401 58.546 -0.145 1
1 1084 . 13 1 1 A 94 94 SER CB C 94 63.806 64.360 -0.554 1
1 1085 . 13 1 1 A 94 94 SER N N 94 116.640 114.542 2.098 1
1 1086 . 13 1 1 A 96 96 ASN HA H 96 4.770 4.925 -0.155 1
1 1091 . 13 1 1 A 96 96 ASN C C 96 175.161 174.953 0.208 1
1 1092 . 13 1 1 A 96 96 ASN CA C 96 53.395 53.468 -0.073 1
1 1093 . 13 1 1 A 96 96 ASN CB C 96 38.999 39.514 -0.515 1
1 1095 . 13 1 1 A 97 97 SER H H 97 8.230 8.731 -0.501 1
1 1096 . 13 1 1 A 97 97 SER HA H 97 4.481 4.720 -0.239 1
1 1099 . 13 1 1 A 97 97 SER C C 97 174.482 173.570 0.912 1
1 1100 . 13 1 1 A 97 97 SER CA C 97 58.300 56.579 1.721 1
1 1101 . 13 1 1 A 97 97 SER CB C 97 63.697 65.533 -1.836 1
1 1102 . 13 1 1 A 97 97 SER N N 97 115.866 118.223 -2.357 1
1 1103 . 13 1 1 A 98 98 GLY H H 98 8.228 8.537 -0.309 1
1 1104 . 13 1 1 A 98 98 GLY HA2 H 98 4.098 4.085 0.013 1
1 1105 . 13 1 1 A 98 98 GLY HA3 H 98 4.098 4.088 0.010 1
1 1106 . 13 1 1 A 98 98 GLY C C 98 171.788 174.760 -2.972 1
1 1107 . 13 1 1 A 98 98 GLY CA C 98 44.803 43.951 0.852 1
1 1108 . 13 1 1 A 98 98 GLY N N 98 110.658 111.738 -1.080 1
1 1109 . 13 1 1 A 99 99 PRO HA H 99 4.463 4.448 0.015 1
1 1116 . 13 1 1 A 99 99 PRO CA C 99 63.230 64.281 -1.051 1
1 1117 . 13 1 1 A 99 99 PRO CB C 99 32.044 31.897 0.147 1
1 1120 . 13 1 1 A 100 100 SER H H 100 8.514 7.638 0.876 1
1 1121 . 13 1 1 A 100 100 SER CA C 100 58.450 57.032 1.418 1
1 1122 . 13 1 1 A 100 100 SER CB C 100 63.889 65.125 -1.236 1
1 1 . 14 1 1 A 9 9 ASN H H 9 8.856 8.876 -0.020 1
1 2 . 14 1 1 A 9 9 ASN HA H 9 4.694 4.778 -0.084 1
1 7 . 14 1 1 A 9 9 ASN CA C 9 53.401 52.777 0.624 1
1 8 . 14 1 1 A 9 9 ASN CB C 9 38.757 38.043 0.714 1
1 10 . 14 1 1 A 10 10 ARG HA H 10 4.346 4.789 -0.443 1
1 17 . 14 1 1 A 10 10 ARG C C 10 175.405 173.761 1.644 1
1 18 . 14 1 1 A 10 10 ARG CA C 10 56.181 55.007 1.174 1
1 19 . 14 1 1 A 10 10 ARG CB C 10 31.171 34.005 -2.834 1
1 22 . 14 1 1 A 11 11 PHE H H 11 8.310 8.644 -0.334 1
1 23 . 14 1 1 A 11 11 PHE HA H 11 4.291 4.363 -0.072 1
1 31 . 14 1 1 A 11 11 PHE C C 11 174.458 174.580 -0.122 1
1 32 . 14 1 1 A 11 11 PHE CA C 11 58.967 59.573 -0.606 1
1 33 . 14 1 1 A 11 11 PHE CB C 11 40.138 39.636 0.502 1
1 39 . 14 1 1 A 11 11 PHE N N 11 123.604 124.106 -0.502 1
1 40 . 14 1 1 A 12 12 LYS H H 12 7.307 7.727 -0.420 1
1 41 . 14 1 1 A 12 12 LYS HA H 12 4.165 4.603 -0.438 1
1 50 . 14 1 1 A 12 12 LYS C C 12 174.385 174.913 -0.528 1
1 51 . 14 1 1 A 12 12 LYS CA C 12 54.593 54.169 0.424 1
1 52 . 14 1 1 A 12 12 LYS CB C 12 34.712 36.126 -1.414 1
1 56 . 14 1 1 A 12 12 LYS N N 12 127.282 125.457 1.825 1
1 57 . 14 1 1 A 13 13 TRP H H 13 8.039 8.405 -0.366 1
1 58 . 14 1 1 A 13 13 TRP HA H 13 4.370 4.745 -0.375 1
1 67 . 14 1 1 A 13 13 TRP C C 13 177.857 176.175 1.682 1
1 68 . 14 1 1 A 13 13 TRP CA C 13 56.675 57.133 -0.458 1
1 69 . 14 1 1 A 13 13 TRP CB C 13 30.317 30.305 0.012 1
1 75 . 14 1 1 A 13 13 TRP N N 13 124.264 126.124 -1.860 1
1 77 . 14 1 1 A 14 14 GLY H H 14 9.815 8.742 1.073 1
1 78 . 14 1 1 A 14 14 GLY HA2 H 14 4.370 4.276 0.094 1
1 79 . 14 1 1 A 14 14 GLY HA3 H 14 4.335 4.293 0.042 1
1 80 . 14 1 1 A 14 14 GLY C C 14 172.904 174.791 -1.887 1
1 81 . 14 1 1 A 14 14 GLY CA C 14 44.157 43.918 0.239 1
1 82 . 14 1 1 A 14 14 GLY N N 14 115.294 108.732 6.562 1
1 83 . 14 1 1 A 15 15 PRO HA H 15 4.327 4.366 -0.039 1
1 90 . 14 1 1 A 15 15 PRO C C 15 179.726 178.864 0.862 1
1 91 . 14 1 1 A 15 15 PRO CA C 15 65.171 65.287 -0.116 1
1 92 . 14 1 1 A 15 15 PRO CB C 15 31.829 31.921 -0.092 1
1 95 . 14 1 1 A 16 16 ALA H H 16 9.214 8.140 1.074 1
1 96 . 14 1 1 A 16 16 ALA HA H 16 4.166 4.101 0.065 1
1 100 . 14 1 1 A 16 16 ALA C C 16 181.184 179.877 1.307 1
1 101 . 14 1 1 A 16 16 ALA CA C 16 55.370 55.183 0.187 1
1 102 . 14 1 1 A 16 16 ALA CB C 16 18.058 18.542 -0.484 1
1 103 . 14 1 1 A 16 16 ALA N N 16 122.414 119.788 2.626 1
1 104 . 14 1 1 A 17 17 SER H H 17 7.985 8.211 -0.226 1
1 105 . 14 1 1 A 17 17 SER HA H 17 4.317 4.151 0.166 1
1 107 . 14 1 1 A 17 17 SER C C 17 175.381 176.904 -1.523 1
1 108 . 14 1 1 A 17 17 SER CA C 17 63.163 62.241 0.922 1
1 109 . 14 1 1 A 17 17 SER CB C 17 64.055 62.916 1.139 1
1 110 . 14 1 1 A 17 17 SER N N 17 116.568 114.163 2.405 1
1 111 . 14 1 1 A 18 18 GLN H H 18 8.316 7.932 0.384 1
1 112 . 14 1 1 A 18 18 GLN HA H 18 3.323 3.470 -0.147 1
1 119 . 14 1 1 A 18 18 GLN C C 18 176.812 178.618 -1.806 1
1 120 . 14 1 1 A 18 18 GLN CA C 18 60.025 59.180 0.845 1
1 121 . 14 1 1 A 18 18 GLN CB C 18 28.686 28.459 0.227 1
1 123 . 14 1 1 A 18 18 GLN N N 18 119.002 121.049 -2.047 1
1 125 . 14 1 1 A 19 19 GLN H H 19 7.582 8.209 -0.627 1
1 126 . 14 1 1 A 19 19 GLN HA H 19 4.062 4.085 -0.023 1
1 133 . 14 1 1 A 19 19 GLN C C 19 178.488 178.449 0.039 1
1 134 . 14 1 1 A 19 19 GLN CA C 19 59.248 59.297 -0.049 1
1 135 . 14 1 1 A 19 19 GLN CB C 19 28.203 28.204 -0.001 1
1 137 . 14 1 1 A 19 19 GLN N N 19 116.221 118.688 -2.467 1
1 139 . 14 1 1 A 20 20 ILE H H 20 7.246 8.021 -0.775 1
1 140 . 14 1 1 A 20 20 ILE HA H 20 3.570 3.624 -0.054 1
1 150 . 14 1 1 A 20 20 ILE C C 20 178.999 178.527 0.472 1
1 151 . 14 1 1 A 20 20 ILE CA C 20 64.996 65.665 -0.669 1
1 152 . 14 1 1 A 20 20 ILE CB C 20 38.139 37.843 0.296 1
1 156 . 14 1 1 A 20 20 ILE N N 20 120.521 120.860 -0.339 1
1 157 . 14 1 1 A 21 21 LEU H H 21 8.034 7.852 0.182 1
1 158 . 14 1 1 A 21 21 LEU HA H 21 3.491 3.594 -0.103 1
1 168 . 14 1 1 A 21 21 LEU C C 21 178.196 178.689 -0.493 1
1 169 . 14 1 1 A 21 21 LEU CA C 21 57.944 57.529 0.415 1
1 170 . 14 1 1 A 21 21 LEU CB C 21 37.864 40.384 -2.520 1
1 174 . 14 1 1 A 21 21 LEU N N 21 121.259 118.932 2.327 1
1 175 . 14 1 1 A 22 22 TYR H H 22 8.479 7.630 0.849 1
1 176 . 14 1 1 A 22 22 TYR HA H 22 4.224 4.289 -0.065 1
1 183 . 14 1 1 A 22 22 TYR C C 22 179.630 178.549 1.081 1
1 184 . 14 1 1 A 22 22 TYR CA C 22 62.422 60.798 1.624 1
1 185 . 14 1 1 A 22 22 TYR CB C 22 37.434 37.778 -0.344 1
1 190 . 14 1 1 A 22 22 TYR N N 22 117.805 118.547 -0.742 1
1 191 . 14 1 1 A 23 23 GLN H H 23 7.707 8.323 -0.616 1
1 192 . 14 1 1 A 23 23 GLN HA H 23 4.166 4.036 0.130 1
1 199 . 14 1 1 A 23 23 GLN C C 23 178.633 178.492 0.141 1
1 200 . 14 1 1 A 23 23 GLN CA C 23 58.789 59.203 -0.414 1
1 201 . 14 1 1 A 23 23 GLN CB C 23 28.534 28.097 0.437 1
1 203 . 14 1 1 A 23 23 GLN N N 23 117.580 118.336 -0.756 1
1 205 . 14 1 1 A 24 24 ALA H H 24 8.155 7.797 0.358 1
1 206 . 14 1 1 A 24 24 ALA HA H 24 4.187 4.195 -0.008 1
1 210 . 14 1 1 A 24 24 ALA C C 24 180.018 178.996 1.022 1
1 211 . 14 1 1 A 24 24 ALA CA C 24 55.228 55.208 0.020 1
1 212 . 14 1 1 A 24 24 ALA CB C 24 19.468 18.774 0.694 1
1 213 . 14 1 1 A 24 24 ALA N N 24 122.813 122.464 0.349 1
1 214 . 14 1 1 A 25 25 TYR H H 25 8.995 8.708 0.287 1
1 215 . 14 1 1 A 25 25 TYR HA H 25 4.348 4.677 -0.329 1
1 222 . 14 1 1 A 25 25 TYR C C 25 175.792 177.719 -1.927 1
1 223 . 14 1 1 A 25 25 TYR CA C 25 61.681 62.035 -0.354 1
1 224 . 14 1 1 A 25 25 TYR CB C 25 38.175 38.631 -0.456 1
1 229 . 14 1 1 A 25 25 TYR N N 25 121.343 120.326 1.017 1
1 230 . 14 1 1 A 26 26 ASP H H 26 7.260 8.805 -1.545 1
1 231 . 14 1 1 A 26 26 ASP HA H 26 4.373 4.476 -0.103 1
1 234 . 14 1 1 A 26 26 ASP C C 26 177.322 178.165 -0.843 1
1 235 . 14 1 1 A 26 26 ASP CA C 26 56.603 57.422 -0.819 1
1 236 . 14 1 1 A 26 26 ASP CB C 26 41.060 41.435 -0.375 1
1 237 . 14 1 1 A 26 26 ASP N N 26 114.020 119.053 -5.033 1
1 238 . 14 1 1 A 27 27 ARG H H 27 7.343 7.709 -0.366 1
1 239 . 14 1 1 A 27 27 ARG HA H 27 4.302 4.355 -0.053 1
1 246 . 14 1 1 A 27 27 ARG C C 27 176.546 176.338 0.208 1
1 247 . 14 1 1 A 27 27 ARG CA C 27 57.563 57.764 -0.201 1
1 248 . 14 1 1 A 27 27 ARG CB C 27 31.500 31.351 0.149 1
1 251 . 14 1 1 A 27 27 ARG N N 27 116.729 117.035 -0.306 1
1 252 . 14 1 1 A 28 28 GLN H H 28 8.306 7.952 0.354 1
1 253 . 14 1 1 A 28 28 GLN HA H 28 4.396 4.702 -0.306 1
1 260 . 14 1 1 A 28 28 GLN C C 28 172.831 175.184 -2.353 1
1 261 . 14 1 1 A 28 28 GLN CA C 28 55.355 54.703 0.652 1
1 262 . 14 1 1 A 28 28 GLN CB C 28 31.062 31.436 -0.374 1
1 264 . 14 1 1 A 28 28 GLN N N 28 121.612 118.151 3.461 1
1 266 . 14 1 1 A 29 29 LYS H H 29 8.354 8.485 -0.131 1
1 267 . 14 1 1 A 29 29 LYS HA H 29 4.099 3.559 0.540 1
1 276 . 14 1 1 A 29 29 LYS C C 29 176.084 176.471 -0.387 1
1 277 . 14 1 1 A 29 29 LYS CA C 29 57.873 57.823 0.050 1
1 278 . 14 1 1 A 29 29 LYS CB C 29 33.313 32.652 0.661 1
1 282 . 14 1 1 A 29 29 LYS N N 29 125.038 124.020 1.018 1
1 283 . 14 1 1 A 30 30 ASN H H 30 8.856 7.920 0.936 1
1 284 . 14 1 1 A 30 30 ASN HA H 30 4.958 5.047 -0.089 1
1 289 . 14 1 1 A 30 30 ASN C C 30 171.179 172.693 -1.514 1
1 290 . 14 1 1 A 30 30 ASN CA C 30 50.891 50.322 0.569 1
1 291 . 14 1 1 A 30 30 ASN CB C 30 39.907 39.115 0.792 1
1 292 . 14 1 1 A 30 30 ASN N N 30 115.764 117.624 -1.860 1
1 294 . 14 1 1 A 31 31 PRO HA H 31 4.299 4.408 -0.109 1
1 301 . 14 1 1 A 31 31 PRO C C 31 177.493 176.302 1.191 1
1 302 . 14 1 1 A 31 31 PRO CA C 31 62.489 62.603 -0.114 1
1 303 . 14 1 1 A 31 31 PRO CB C 31 31.216 31.986 -0.770 1
1 306 . 14 1 1 A 32 32 SER H H 32 9.368 8.561 0.807 1
1 307 . 14 1 1 A 32 32 SER HA H 32 4.372 4.647 -0.275 1
1 310 . 14 1 1 A 32 32 SER C C 32 174.821 175.039 -0.218 1
1 311 . 14 1 1 A 32 32 SER CA C 32 57.203 57.039 0.164 1
1 312 . 14 1 1 A 32 32 SER CB C 32 65.594 64.981 0.613 1
1 313 . 14 1 1 A 32 32 SER N N 32 120.847 117.742 3.105 1
1 314 . 14 1 1 A 33 33 LYS H H 33 9.152 8.965 0.187 1
1 315 . 14 1 1 A 33 33 LYS HA H 33 3.719 3.890 -0.171 1
1 324 . 14 1 1 A 33 33 LYS C C 33 177.833 178.253 -0.420 1
1 325 . 14 1 1 A 33 33 LYS CA C 33 61.188 60.387 0.801 1
1 326 . 14 1 1 A 33 33 LYS CB C 33 32.572 32.390 0.182 1
1 330 . 14 1 1 A 33 33 LYS N N 33 122.966 126.869 -3.903 1
1 331 . 14 1 1 A 34 34 GLU H H 34 8.902 8.426 0.476 1
1 332 . 14 1 1 A 34 34 GLU HA H 34 4.089 4.102 -0.013 1
1 337 . 14 1 1 A 34 34 GLU C C 34 180.286 178.994 1.292 1
1 338 . 14 1 1 A 34 34 GLU CA C 34 60.483 59.322 1.161 1
1 339 . 14 1 1 A 34 34 GLU CB C 34 28.835 29.347 -0.512 1
1 341 . 14 1 1 A 34 34 GLU N N 34 117.645 118.366 -0.721 1
1 342 . 14 1 1 A 35 35 GLU H H 35 7.673 8.189 -0.516 1
1 343 . 14 1 1 A 35 35 GLU HA H 35 4.023 4.006 0.017 1
1 348 . 14 1 1 A 35 35 GLU C C 35 180.237 179.179 1.058 1
1 349 . 14 1 1 A 35 35 GLU CA C 35 59.214 59.257 -0.043 1
1 350 . 14 1 1 A 35 35 GLU CB C 35 30.099 29.290 0.809 1
1 352 . 14 1 1 A 35 35 GLU N N 35 121.077 120.542 0.535 1
1 353 . 14 1 1 A 36 36 ARG H H 36 8.932 8.412 0.520 1
1 354 . 14 1 1 A 36 36 ARG HA H 36 3.928 3.865 0.063 1
1 362 . 14 1 1 A 36 36 ARG C C 36 178.464 179.210 -0.746 1
1 363 . 14 1 1 A 36 36 ARG CA C 36 60.974 59.973 1.001 1
1 364 . 14 1 1 A 36 36 ARG CB C 36 31.171 30.060 1.111 1
1 367 . 14 1 1 A 36 36 ARG N N 36 119.441 120.194 -0.753 1
1 369 . 14 1 1 A 37 37 GLU H H 37 8.756 8.419 0.337 1
1 370 . 14 1 1 A 37 37 GLU HA H 37 3.948 4.092 -0.144 1
1 375 . 14 1 1 A 37 37 GLU C C 37 179.606 178.974 0.632 1
1 376 . 14 1 1 A 37 37 GLU CA C 37 60.094 59.043 1.051 1
1 377 . 14 1 1 A 37 37 GLU CB C 37 29.110 29.206 -0.096 1
1 379 . 14 1 1 A 37 37 GLU N N 37 119.017 119.593 -0.576 1
1 380 . 14 1 1 A 38 38 ALA H H 38 7.733 7.979 -0.246 1
1 381 . 14 1 1 A 38 38 ALA HA H 38 4.325 4.202 0.123 1
1 385 . 14 1 1 A 38 38 ALA C C 38 180.820 178.363 2.457 1
1 386 . 14 1 1 A 38 38 ALA CA C 38 55.194 54.323 0.871 1
1 387 . 14 1 1 A 38 38 ALA CB C 38 17.654 18.499 -0.845 1
1 388 . 14 1 1 A 38 38 ALA N N 38 122.889 121.674 1.215 1
1 389 . 14 1 1 A 39 39 LEU H H 39 7.740 7.897 -0.157 1
1 390 . 14 1 1 A 39 39 LEU HA H 39 4.176 4.268 -0.092 1
1 400 . 14 1 1 A 39 39 LEU C C 39 179.266 178.845 0.421 1
1 401 . 14 1 1 A 39 39 LEU CA C 39 57.944 56.394 1.550 1
1 402 . 14 1 1 A 39 39 LEU CB C 39 42.105 42.242 -0.137 1
1 406 . 14 1 1 A 39 39 LEU N N 39 119.783 116.325 3.458 1
1 407 . 14 1 1 A 40 40 VAL H H 40 8.451 8.154 0.297 1
1 408 . 14 1 1 A 40 40 VAL HA H 40 3.259 3.611 -0.352 1
1 416 . 14 1 1 A 40 40 VAL C C 40 177.153 177.694 -0.541 1
1 417 . 14 1 1 A 40 40 VAL CA C 40 67.254 67.088 0.166 1
1 418 . 14 1 1 A 40 40 VAL CB C 40 31.747 31.515 0.232 1
1 421 . 14 1 1 A 40 40 VAL N N 40 121.481 120.179 1.302 1
1 422 . 14 1 1 A 41 41 GLU H H 41 7.254 8.025 -0.771 1
1 423 . 14 1 1 A 41 41 GLU HA H 41 4.159 4.133 0.026 1
1 428 . 14 1 1 A 41 41 GLU C C 41 179.483 178.740 0.743 1
1 429 . 14 1 1 A 41 41 GLU CA C 41 59.248 59.348 -0.100 1
1 430 . 14 1 1 A 41 41 GLU CB C 41 29.358 29.513 -0.155 1
1 432 . 14 1 1 A 41 41 GLU N N 41 116.549 119.822 -3.273 1
1 433 . 14 1 1 A 42 42 GLU H H 42 8.103 8.236 -0.133 1
1 434 . 14 1 1 A 42 42 GLU HA H 42 4.020 4.049 -0.029 1
1 439 . 14 1 1 A 42 42 GLU C C 42 180.115 178.798 1.317 1
1 440 . 14 1 1 A 42 42 GLU CA C 42 59.847 59.508 0.339 1
1 441 . 14 1 1 A 42 42 GLU CB C 42 30.218 29.331 0.887 1
1 443 . 14 1 1 A 42 42 GLU N N 42 119.578 119.364 0.214 1
1 444 . 14 1 1 A 43 43 CYS H H 43 8.955 8.194 0.761 1
1 445 . 14 1 1 A 43 43 CYS HA H 43 4.153 4.241 -0.088 1
1 448 . 14 1 1 A 43 43 CYS C C 43 176.498 177.589 -1.091 1
1 449 . 14 1 1 A 43 43 CYS CA C 43 64.856 62.385 2.471 1
1 450 . 14 1 1 A 43 43 CYS CB C 43 27.390 27.820 -0.430 1
1 451 . 14 1 1 A 43 43 CYS N N 43 118.199 118.802 -0.603 1
1 452 . 14 1 1 A 44 44 ASN H H 44 8.543 7.939 0.604 1
1 453 . 14 1 1 A 44 44 ASN HA H 44 4.635 4.424 0.211 1
1 458 . 14 1 1 A 44 44 ASN C C 44 178.633 177.646 0.987 1
1 459 . 14 1 1 A 44 44 ASN CA C 44 56.603 56.390 0.213 1
1 460 . 14 1 1 A 44 44 ASN CB C 44 37.187 38.116 -0.929 1
1 461 . 14 1 1 A 44 44 ASN N N 44 117.002 119.533 -2.531 1
1 463 . 14 1 1 A 45 45 ARG H H 45 8.296 8.117 0.179 1
1 464 . 14 1 1 A 45 45 ARG HA H 45 3.977 4.060 -0.083 1
1 471 . 14 1 1 A 45 45 ARG C C 45 178.149 178.230 -0.081 1
1 472 . 14 1 1 A 45 45 ARG CA C 45 60.589 59.658 0.931 1
1 473 . 14 1 1 A 45 45 ARG CB C 45 30.099 30.155 -0.056 1
1 476 . 14 1 1 A 45 45 ARG N N 45 121.021 121.033 -0.012 1
1 477 . 14 1 1 A 46 46 ALA H H 46 7.914 8.209 -0.295 1
1 478 . 14 1 1 A 46 46 ALA HA H 46 4.128 4.114 0.014 1
1 482 . 14 1 1 A 46 46 ALA C C 46 181.208 180.218 0.990 1
1 483 . 14 1 1 A 46 46 ALA CA C 46 55.264 55.033 0.231 1
1 484 . 14 1 1 A 46 46 ALA CB C 46 18.759 18.174 0.585 1
1 485 . 14 1 1 A 46 46 ALA N N 46 121.570 120.743 0.827 1
1 486 . 14 1 1 A 47 47 GLU H H 47 8.730 8.637 0.093 1
1 487 . 14 1 1 A 47 47 GLU HA H 47 4.194 4.018 0.176 1
1 492 . 14 1 1 A 47 47 GLU C C 47 180.115 179.200 0.915 1
1 493 . 14 1 1 A 47 47 GLU CA C 47 58.401 59.702 -1.301 1
1 494 . 14 1 1 A 47 47 GLU CB C 47 29.523 29.302 0.221 1
1 496 . 14 1 1 A 47 47 GLU N N 47 117.532 118.143 -0.611 1
1 497 . 14 1 1 A 48 48 CYS H H 48 8.283 7.867 0.416 1
1 498 . 14 1 1 A 48 48 CYS HA H 48 4.002 4.137 -0.135 1
1 501 . 14 1 1 A 48 48 CYS C C 48 177.031 177.272 -0.241 1
1 502 . 14 1 1 A 48 48 CYS CA C 48 64.749 63.885 0.864 1
1 503 . 14 1 1 A 48 48 CYS CB C 48 25.907 27.170 -1.263 1
1 504 . 14 1 1 A 48 48 CYS N N 48 118.282 119.141 -0.859 1
1 505 . 14 1 1 A 49 49 LEU H H 49 8.181 8.148 0.033 1
1 506 . 14 1 1 A 49 49 LEU HA H 49 4.175 3.892 0.283 1
1 516 . 14 1 1 A 49 49 LEU C C 49 180.430 178.908 1.522 1
1 517 . 14 1 1 A 49 49 LEU CA C 49 57.873 58.213 -0.340 1
1 518 . 14 1 1 A 49 49 LEU CB C 49 41.539 41.438 0.101 1
1 522 . 14 1 1 A 49 49 LEU N N 49 120.371 120.686 -0.315 1
1 523 . 14 1 1 A 50 50 GLN H H 50 7.934 8.800 -0.866 1
1 524 . 14 1 1 A 50 50 GLN HA H 50 4.102 4.016 0.086 1
1 531 . 14 1 1 A 50 50 GLN C C 50 177.322 177.226 0.096 1
1 532 . 14 1 1 A 50 50 GLN CA C 50 58.156 58.637 -0.481 1
1 533 . 14 1 1 A 50 50 GLN CB C 50 28.616 28.217 0.399 1
1 535 . 14 1 1 A 50 50 GLN N N 50 118.175 117.419 0.756 1
1 537 . 14 1 1 A 51 51 ARG H H 51 7.632 7.833 -0.201 1
1 538 . 14 1 1 A 51 51 ARG HA H 51 4.347 4.350 -0.003 1
1 545 . 14 1 1 A 51 51 ARG C C 51 176.546 176.477 0.069 1
1 546 . 14 1 1 A 51 51 ARG CA C 51 56.286 55.839 0.447 1
1 547 . 14 1 1 A 51 51 ARG CB C 51 31.314 30.109 1.205 1
1 550 . 14 1 1 A 51 51 ARG N N 51 116.454 117.833 -1.379 1
1 551 . 14 1 1 A 52 52 GLY H H 52 7.949 7.943 0.006 1
1 552 . 14 1 1 A 52 52 GLY HA2 H 52 4.033 3.977 0.056 1
1 553 . 14 1 1 A 52 52 GLY HA3 H 52 3.903 3.978 -0.075 1
1 554 . 14 1 1 A 52 52 GLY C C 52 174.385 173.990 0.395 1
1 555 . 14 1 1 A 52 52 GLY CA C 52 46.231 45.388 0.843 1
1 556 . 14 1 1 A 52 52 GLY N N 52 108.854 107.609 1.245 1
1 557 . 14 1 1 A 53 53 VAL H H 53 7.944 7.477 0.467 1
1 558 . 14 1 1 A 53 53 VAL HA H 53 4.250 4.092 0.158 1
1 566 . 14 1 1 A 53 53 VAL C C 53 175.525 175.219 0.306 1
1 567 . 14 1 1 A 53 53 VAL CA C 53 60.377 62.379 -2.002 1
1 568 . 14 1 1 A 53 53 VAL CB C 53 34.283 32.887 1.396 1
1 571 . 14 1 1 A 53 53 VAL N N 53 118.316 120.721 -2.405 1
1 572 . 14 1 1 A 54 54 SER H H 54 8.502 8.481 0.021 1
1 573 . 14 1 1 A 54 54 SER HA H 54 4.625 4.898 -0.273 1
1 576 . 14 1 1 A 54 54 SER C C 54 174.603 174.079 0.524 1
1 577 . 14 1 1 A 54 54 SER CA C 54 56.092 54.177 1.915 1
1 578 . 14 1 1 A 54 54 SER CB C 54 63.697 63.775 -0.078 1
1 579 . 14 1 1 A 54 54 SER N N 54 120.337 118.252 2.085 1
1 580 . 14 1 1 A 55 55 PRO HA H 55 4.624 4.530 0.094 1
1 587 . 14 1 1 A 55 55 PRO C C 55 177.322 177.499 -0.177 1
1 588 . 14 1 1 A 55 55 PRO CA C 55 64.431 64.233 0.198 1
1 589 . 14 1 1 A 55 55 PRO CB C 55 31.913 31.717 0.196 1
1 592 . 14 1 1 A 56 56 SER H H 56 7.931 8.299 -0.368 1
1 593 . 14 1 1 A 56 56 SER HA H 56 4.428 4.599 -0.171 1
1 596 . 14 1 1 A 56 56 SER C C 56 174.749 174.967 -0.218 1
1 597 . 14 1 1 A 56 56 SER CA C 56 59.130 59.334 -0.204 1
1 598 . 14 1 1 A 56 56 SER CB C 56 63.056 64.025 -0.969 1
1 599 . 14 1 1 A 56 56 SER N N 56 112.637 113.005 -0.368 1
1 600 . 14 1 1 A 57 57 LYS H H 57 8.121 7.626 0.495 1
1 601 . 14 1 1 A 57 57 LYS HA H 57 4.467 4.786 -0.319 1
1 609 . 14 1 1 A 57 57 LYS C C 57 176.570 176.131 0.439 1
1 610 . 14 1 1 A 57 57 LYS CA C 57 55.264 54.930 0.334 1
1 611 . 14 1 1 A 57 57 LYS CB C 57 32.160 32.617 -0.457 1
1 615 . 14 1 1 A 57 57 LYS N N 57 123.185 117.653 5.532 1
1 616 . 14 1 1 A 58 58 ALA H H 58 7.886 7.917 -0.031 1
1 617 . 14 1 1 A 58 58 ALA HA H 58 3.923 3.884 0.039 1
1 621 . 14 1 1 A 58 58 ALA C C 58 177.469 179.747 -2.278 1
1 622 . 14 1 1 A 58 58 ALA CA C 58 54.276 54.847 -0.571 1
1 623 . 14 1 1 A 58 58 ALA CB C 58 18.271 18.314 -0.043 1
1 624 . 14 1 1 A 58 58 ALA N N 58 123.941 122.955 0.986 1
1 625 . 14 1 1 A 59 59 HIS H H 59 8.077 8.059 0.018 1
1 626 . 14 1 1 A 59 59 HIS HA H 59 4.420 4.418 0.002 1
1 631 . 14 1 1 A 59 59 HIS C C 59 177.542 177.118 0.424 1
1 632 . 14 1 1 A 59 59 HIS CA C 59 57.767 58.481 -0.714 1
1 633 . 14 1 1 A 59 59 HIS CB C 59 29.852 28.791 1.061 1
1 636 . 14 1 1 A 59 59 HIS N N 59 115.566 115.622 -0.056 1
1 637 . 14 1 1 A 60 60 GLY H H 60 8.110 7.912 0.198 1
1 638 . 14 1 1 A 60 60 GLY HA2 H 60 3.873 3.504 0.369 1
1 639 . 14 1 1 A 60 60 GLY HA3 H 60 4.025 3.616 0.409 1
1 640 . 14 1 1 A 60 60 GLY C C 60 174.918 175.721 -0.803 1
1 641 . 14 1 1 A 60 60 GLY CA C 60 45.559 47.021 -1.462 1
1 642 . 14 1 1 A 60 60 GLY N N 60 109.216 109.744 -0.528 1
1 643 . 14 1 1 A 61 61 LEU H H 61 8.280 8.515 -0.235 1
1 644 . 14 1 1 A 61 61 LEU HA H 61 4.198 3.948 0.250 1
1 654 . 14 1 1 A 61 61 LEU C C 61 178.900 177.562 1.338 1
1 655 . 14 1 1 A 61 61 LEU CA C 61 55.758 57.872 -2.114 1
1 656 . 14 1 1 A 61 61 LEU CB C 61 42.544 41.801 0.743 1
1 660 . 14 1 1 A 61 61 LEU N N 61 120.521 123.061 -2.540 1
1 661 . 14 1 1 A 62 62 GLY H H 62 8.184 8.101 0.083 1
1 662 . 14 1 1 A 62 62 GLY HA2 H 62 3.978 3.862 0.116 1
1 663 . 14 1 1 A 62 62 GLY HA3 H 62 3.817 3.867 -0.050 1
1 664 . 14 1 1 A 62 62 GLY C C 62 176.012 175.413 0.599 1
1 665 . 14 1 1 A 62 62 GLY CA C 62 46.767 47.311 -0.544 1
1 666 . 14 1 1 A 62 62 GLY N N 62 108.987 108.420 0.567 1
1 667 . 14 1 1 A 63 63 SER HA H 63 4.322 4.362 -0.040 1
1 670 . 14 1 1 A 63 63 SER C C 63 174.167 175.421 -1.254 1
1 671 . 14 1 1 A 63 63 SER CA C 63 59.919 60.799 -0.880 1
1 672 . 14 1 1 A 63 63 SER CB C 63 63.312 63.175 0.137 1
1 673 . 14 1 1 A 64 64 ASN H H 64 8.087 8.156 -0.069 1
1 674 . 14 1 1 A 64 64 ASN HA H 64 4.850 4.719 0.131 1
1 679 . 14 1 1 A 64 64 ASN C C 64 173.899 175.189 -1.290 1
1 680 . 14 1 1 A 64 64 ASN CA C 64 53.218 53.107 0.111 1
1 681 . 14 1 1 A 64 64 ASN CB C 64 39.164 39.210 -0.046 1
1 682 . 14 1 1 A 64 64 ASN N N 64 118.041 117.992 0.049 1
1 684 . 14 1 1 A 65 65 LEU H H 65 7.293 7.643 -0.350 1
1 685 . 14 1 1 A 65 65 LEU HA H 65 3.995 4.522 -0.527 1
1 695 . 14 1 1 A 65 65 LEU C C 65 175.696 175.367 0.329 1
1 696 . 14 1 1 A 65 65 LEU CA C 65 56.005 55.221 0.784 1
1 697 . 14 1 1 A 65 65 LEU CB C 65 43.120 43.263 -0.143 1
1 701 . 14 1 1 A 65 65 LEU N N 65 120.953 123.109 -2.156 1
1 702 . 14 1 1 A 66 66 VAL H H 66 9.517 8.984 0.533 1
1 703 . 14 1 1 A 66 66 VAL HA H 66 3.481 4.400 -0.919 1
1 711 . 14 1 1 A 66 66 VAL C C 66 175.429 175.164 0.265 1
1 712 . 14 1 1 A 66 66 VAL CA C 66 65.243 61.342 3.901 1
1 713 . 14 1 1 A 66 66 VAL CB C 66 31.335 33.270 -1.935 1
1 716 . 14 1 1 A 66 66 VAL N N 66 127.924 126.296 1.628 1
1 717 . 14 1 1 A 67 67 THR H H 67 6.253 8.274 -2.021 1
1 718 . 14 1 1 A 67 67 THR HA H 67 4.779 4.828 -0.049 1
1 723 . 14 1 1 A 67 67 THR C C 67 174.894 174.918 -0.024 1
1 724 . 14 1 1 A 67 67 THR CA C 67 58.719 59.437 -0.718 1
1 725 . 14 1 1 A 67 67 THR CB C 67 72.153 71.987 0.166 1
1 727 . 14 1 1 A 67 67 THR N N 67 113.376 116.757 -3.381 1
1 728 . 14 1 1 A 68 68 GLU H H 68 9.348 8.870 0.478 1
1 729 . 14 1 1 A 68 68 GLU HA H 68 3.634 4.007 -0.373 1
1 734 . 14 1 1 A 68 68 GLU C C 68 177.809 178.319 -0.510 1
1 735 . 14 1 1 A 68 68 GLU CA C 68 61.505 60.044 1.461 1
1 736 . 14 1 1 A 68 68 GLU CB C 68 28.285 29.615 -1.330 1
1 738 . 14 1 1 A 68 68 GLU N N 68 124.534 122.143 2.391 1
1 739 . 14 1 1 A 69 69 VAL H H 69 8.126 7.910 0.216 1
1 740 . 14 1 1 A 69 69 VAL HA H 69 3.862 3.507 0.355 1
1 748 . 14 1 1 A 69 69 VAL C C 69 177.712 177.992 -0.280 1
1 749 . 14 1 1 A 69 69 VAL CA C 69 65.701 66.788 -1.087 1
1 750 . 14 1 1 A 69 69 VAL CB C 69 31.829 31.510 0.319 1
1 753 . 14 1 1 A 69 69 VAL N N 69 119.139 119.954 -0.815 1
1 754 . 14 1 1 A 70 70 ARG H H 70 7.235 8.165 -0.930 1
1 755 . 14 1 1 A 70 70 ARG HA H 70 4.265 3.848 0.417 1
1 762 . 14 1 1 A 70 70 ARG C C 70 180.430 179.396 1.034 1
1 763 . 14 1 1 A 70 70 ARG CA C 70 59.742 60.039 -0.297 1
1 764 . 14 1 1 A 70 70 ARG CB C 70 29.439 29.748 -0.309 1
1 767 . 14 1 1 A 70 70 ARG N N 70 119.541 119.101 0.440 1
1 768 . 14 1 1 A 71 71 VAL H H 71 8.144 7.959 0.185 1
1 769 . 14 1 1 A 71 71 VAL HA H 71 4.018 3.918 0.100 1
1 777 . 14 1 1 A 71 71 VAL C C 71 177.493 178.293 -0.800 1
1 778 . 14 1 1 A 71 71 VAL CA C 71 67.924 66.674 1.250 1
1 779 . 14 1 1 A 71 71 VAL CB C 71 32.289 31.830 0.459 1
1 782 . 14 1 1 A 71 71 VAL N N 71 120.755 120.289 0.466 1
1 783 . 14 1 1 A 72 72 TYR H H 72 9.411 8.512 0.899 1
1 784 . 14 1 1 A 72 72 TYR HA H 72 3.908 4.181 -0.273 1
1 791 . 14 1 1 A 72 72 TYR C C 72 178.464 177.767 0.697 1
1 792 . 14 1 1 A 72 72 TYR CA C 72 63.444 62.152 1.292 1
1 793 . 14 1 1 A 72 72 TYR CB C 72 38.211 38.768 -0.557 1
1 798 . 14 1 1 A 72 72 TYR N N 72 121.175 121.065 0.110 1
1 799 . 14 1 1 A 73 73 ASN H H 73 8.816 8.777 0.039 1
1 800 . 14 1 1 A 73 73 ASN HA H 73 4.538 4.568 -0.030 1
1 805 . 14 1 1 A 73 73 ASN C C 73 176.958 178.114 -1.156 1
1 806 . 14 1 1 A 73 73 ASN CA C 73 56.109 56.642 -0.533 1
1 807 . 14 1 1 A 73 73 ASN CB C 73 38.422 38.776 -0.354 1
1 808 . 14 1 1 A 73 73 ASN N N 73 118.122 118.004 0.118 1
1 810 . 14 1 1 A 74 74 TRP H H 74 8.657 8.399 0.258 1
1 811 . 14 1 1 A 74 74 TRP HA H 74 4.111 4.331 -0.220 1
1 820 . 14 1 1 A 74 74 TRP C C 74 179.654 178.464 1.190 1
1 821 . 14 1 1 A 74 74 TRP CA C 74 62.950 61.283 1.667 1
1 822 . 14 1 1 A 74 74 TRP CB C 74 29.555 29.576 -0.021 1
1 828 . 14 1 1 A 74 74 TRP N N 74 123.988 122.975 1.013 1
1 830 . 14 1 1 A 75 75 PHE H H 75 8.562 8.380 0.182 1
1 831 . 14 1 1 A 75 75 PHE HA H 75 3.821 4.447 -0.626 1
1 839 . 14 1 1 A 75 75 PHE C C 75 177.614 178.133 -0.519 1
1 840 . 14 1 1 A 75 75 PHE CA C 75 63.374 61.818 1.556 1
1 841 . 14 1 1 A 75 75 PHE CB C 75 39.648 38.304 1.344 1
1 847 . 14 1 1 A 75 75 PHE N N 75 118.325 117.136 1.189 1
1 848 . 14 1 1 A 76 76 ALA H H 76 8.305 8.276 0.029 1
1 849 . 14 1 1 A 76 76 ALA HA H 76 3.909 3.965 -0.056 1
1 853 . 14 1 1 A 76 76 ALA C C 76 180.868 179.697 1.171 1
1 854 . 14 1 1 A 76 76 ALA CA C 76 55.566 55.223 0.343 1
1 855 . 14 1 1 A 76 76 ALA CB C 76 17.820 18.277 -0.457 1
1 856 . 14 1 1 A 76 76 ALA N N 76 121.119 122.697 -1.578 1
1 857 . 14 1 1 A 77 77 ASN H H 77 8.335 8.224 0.111 1
1 858 . 14 1 1 A 77 77 ASN HA H 77 4.355 4.361 -0.006 1
1 863 . 14 1 1 A 77 77 ASN C C 77 177.105 177.758 -0.653 1
1 864 . 14 1 1 A 77 77 ASN CA C 77 56.145 55.973 0.172 1
1 865 . 14 1 1 A 77 77 ASN CB C 77 38.063 38.498 -0.435 1
1 866 . 14 1 1 A 77 77 ASN N N 77 117.433 116.466 0.967 1
1 868 . 14 1 1 A 78 78 ARG H H 78 7.664 7.249 0.415 1
1 869 . 14 1 1 A 78 78 ARG HA H 78 3.629 3.766 -0.137 1
1 876 . 14 1 1 A 78 78 ARG C C 78 179.216 178.027 1.189 1
1 877 . 14 1 1 A 78 78 ARG CA C 78 58.773 58.521 0.252 1
1 878 . 14 1 1 A 78 78 ARG CB C 78 29.605 29.297 0.308 1
1 881 . 14 1 1 A 78 78 ARG N N 78 121.999 118.517 3.482 1
1 882 . 14 1 1 A 79 79 ARG H H 79 8.320 7.551 0.769 1
1 883 . 14 1 1 A 79 79 ARG HA H 79 4.307 4.281 0.026 1
1 890 . 14 1 1 A 79 79 ARG C C 79 180.406 178.822 1.584 1
1 891 . 14 1 1 A 79 79 ARG CA C 79 60.270 58.042 2.228 1
1 892 . 14 1 1 A 79 79 ARG CB C 79 31.335 30.548 0.787 1
1 895 . 14 1 1 A 79 79 ARG N N 79 118.139 118.144 -0.005 1
1 896 . 14 1 1 A 80 80 LYS H H 80 7.759 7.891 -0.132 1
1 897 . 14 1 1 A 80 80 LYS HA H 80 4.052 4.094 -0.042 1
1 905 . 14 1 1 A 80 80 LYS C C 80 178.999 178.659 0.340 1
1 906 . 14 1 1 A 80 80 LYS CA C 80 59.531 59.136 0.395 1
1 907 . 14 1 1 A 80 80 LYS CB C 80 32.374 31.970 0.404 1
1 911 . 14 1 1 A 80 80 LYS N N 80 120.899 118.609 2.290 1
1 912 . 14 1 1 A 81 81 GLU H H 81 8.041 8.111 -0.070 1
1 913 . 14 1 1 A 81 81 GLU HA H 81 4.044 4.169 -0.125 1
1 918 . 14 1 1 A 81 81 GLU C C 81 179.168 178.635 0.533 1
1 919 . 14 1 1 A 81 81 GLU CA C 81 59.036 59.588 -0.552 1
1 920 . 14 1 1 A 81 81 GLU CB C 81 29.561 29.156 0.405 1
1 922 . 14 1 1 A 81 81 GLU N N 81 120.193 120.095 0.098 1
1 923 . 14 1 1 A 82 82 GLU H H 82 8.131 8.021 0.110 1
1 924 . 14 1 1 A 82 82 GLU HA H 82 4.017 4.059 -0.042 1
1 929 . 14 1 1 A 82 82 GLU C C 82 178.343 178.187 0.156 1
1 930 . 14 1 1 A 82 82 GLU CA C 82 59.319 59.328 -0.009 1
1 931 . 14 1 1 A 82 82 GLU CB C 82 29.770 29.179 0.591 1
1 933 . 14 1 1 A 82 82 GLU N N 82 119.626 118.992 0.634 1
1 934 . 14 1 1 A 83 83 ALA H H 83 7.935 7.838 0.097 1
1 935 . 14 1 1 A 83 83 ALA HA H 83 4.180 4.191 -0.011 1
1 939 . 14 1 1 A 83 83 ALA C C 83 179.994 179.464 0.530 1
1 940 . 14 1 1 A 83 83 ALA CA C 83 54.629 53.864 0.765 1
1 941 . 14 1 1 A 83 83 ALA CB C 83 18.090 18.860 -0.770 1
1 942 . 14 1 1 A 83 83 ALA N N 83 121.476 121.957 -0.481 1
1 943 . 14 1 1 A 84 84 PHE H H 84 8.043 7.969 0.074 1
1 944 . 14 1 1 A 84 84 PHE HA H 84 4.420 4.063 0.357 1
1 952 . 14 1 1 A 84 84 PHE C C 84 177.250 177.130 0.120 1
1 953 . 14 1 1 A 84 84 PHE CA C 84 60.059 61.706 -1.647 1
1 954 . 14 1 1 A 84 84 PHE CB C 84 38.952 39.329 -0.377 1
1 960 . 14 1 1 A 84 84 PHE N N 84 119.074 120.555 -1.481 1
1 961 . 14 1 1 A 85 85 ARG H H 85 8.031 8.395 -0.364 1
1 962 . 14 1 1 A 85 85 ARG HA H 85 3.992 4.135 -0.143 1
1 968 . 14 1 1 A 85 85 ARG C C 85 178.319 178.326 -0.007 1
1 969 . 14 1 1 A 85 85 ARG CA C 85 58.523 59.637 -1.114 1
1 970 . 14 1 1 A 85 85 ARG CB C 85 30.346 30.009 0.337 1
1 973 . 14 1 1 A 85 85 ARG N N 85 119.291 117.592 1.699 1
1 974 . 14 1 1 A 86 86 GLN H H 86 8.091 7.727 0.364 1
1 975 . 14 1 1 A 86 86 GLN HA H 86 4.148 4.296 -0.148 1
1 982 . 14 1 1 A 86 86 GLN C C 86 177.105 178.440 -1.335 1
1 983 . 14 1 1 A 86 86 GLN CA C 86 57.556 57.353 0.203 1
1 984 . 14 1 1 A 86 86 GLN CB C 86 28.855 29.493 -0.638 1
1 986 . 14 1 1 A 86 86 GLN N N 86 119.097 117.545 1.552 1
1 988 . 14 1 1 A 87 87 LYS H H 87 7.898 8.325 -0.427 1
1 989 . 14 1 1 A 87 87 LYS HA H 87 4.116 4.070 0.046 1
1 997 . 14 1 1 A 87 87 LYS C C 87 177.542 178.843 -1.301 1
1 998 . 14 1 1 A 87 87 LYS CA C 87 57.944 58.856 -0.912 1
1 999 . 14 1 1 A 87 87 LYS CB C 87 32.242 31.958 0.284 1
1 1003 . 14 1 1 A 87 87 LYS N N 87 120.968 122.273 -1.305 1
1 1004 . 14 1 1 A 88 88 LEU H H 88 7.903 8.064 -0.161 1
1 1005 . 14 1 1 A 88 88 LEU HA H 88 4.144 4.228 -0.084 1
1 1015 . 14 1 1 A 88 88 LEU C C 88 178.221 177.529 0.692 1
1 1016 . 14 1 1 A 88 88 LEU CA C 88 56.145 56.482 -0.337 1
1 1017 . 14 1 1 A 88 88 LEU CB C 88 42.215 41.090 1.125 1
1 1021 . 14 1 1 A 88 88 LEU N N 88 120.558 116.358 4.200 1
1 1022 . 14 1 1 A 89 89 ALA H H 89 7.894 7.577 0.317 1
1 1023 . 14 1 1 A 89 89 ALA HA H 89 4.224 4.567 -0.343 1
1 1027 . 14 1 1 A 89 89 ALA C C 89 178.609 178.442 0.167 1
1 1028 . 14 1 1 A 89 89 ALA CA C 89 53.392 52.856 0.536 1
1 1029 . 14 1 1 A 89 89 ALA CB C 89 18.695 19.487 -0.792 1
1 1030 . 14 1 1 A 89 89 ALA N N 89 122.387 121.623 0.764 1
1 1031 . 14 1 1 A 90 90 MET H H 90 8.084 7.714 0.370 1
1 1032 . 14 1 1 A 90 90 MET HA H 90 4.356 4.474 -0.118 1
1 1040 . 14 1 1 A 90 90 MET C C 90 176.982 176.141 0.841 1
1 1041 . 14 1 1 A 90 90 MET CA C 90 56.551 55.470 1.081 1
1 1042 . 14 1 1 A 90 90 MET CB C 90 32.719 32.601 0.118 1
1 1045 . 14 1 1 A 90 90 MET N N 90 118.509 114.066 4.443 1
1 1046 . 14 1 1 A 91 91 ASP H H 91 8.261 7.614 0.647 1
1 1047 . 14 1 1 A 91 91 ASP HA H 91 4.524 4.643 -0.119 1
1 1050 . 14 1 1 A 91 91 ASP C C 91 176.643 177.032 -0.389 1
1 1051 . 14 1 1 A 91 91 ASP CA C 91 54.981 54.436 0.545 1
1 1052 . 14 1 1 A 91 91 ASP CB C 91 40.870 41.961 -1.091 1
1 1053 . 14 1 1 A 91 91 ASP N N 91 120.771 121.958 -1.187 1
1 1054 . 14 1 1 A 92 92 ALA H H 92 7.971 8.649 -0.678 1
1 1055 . 14 1 1 A 92 92 ALA HA H 92 4.200 4.021 0.179 1
1 1059 . 14 1 1 A 92 92 ALA C C 92 177.929 177.561 0.368 1
1 1060 . 14 1 1 A 92 92 ALA CA C 92 53.184 55.052 -1.868 1
1 1061 . 14 1 1 A 92 92 ALA CB C 92 18.890 18.581 0.309 1
1 1062 . 14 1 1 A 92 92 ALA N N 92 123.057 123.189 -0.132 1
1 1063 . 14 1 1 A 93 93 TYR H H 93 8.019 7.853 0.166 1
1 1064 . 14 1 1 A 93 93 TYR HA H 93 4.523 4.720 -0.197 1
1 1071 . 14 1 1 A 93 93 TYR C C 93 176.279 175.253 1.026 1
1 1072 . 14 1 1 A 93 93 TYR CA C 93 58.401 56.808 1.593 1
1 1073 . 14 1 1 A 93 93 TYR CB C 93 38.669 38.423 0.246 1
1 1078 . 14 1 1 A 93 93 TYR N N 93 118.337 120.862 -2.525 1
1 1079 . 14 1 1 A 94 94 SER H H 94 8.037 8.518 -0.481 1
1 1080 . 14 1 1 A 94 94 SER HA H 94 4.484 4.318 0.166 1
1 1082 . 14 1 1 A 94 94 SER C C 94 174.554 174.209 0.345 1
1 1083 . 14 1 1 A 94 94 SER CA C 94 58.401 60.219 -1.818 1
1 1084 . 14 1 1 A 94 94 SER CB C 94 63.806 63.385 0.421 1
1 1085 . 14 1 1 A 94 94 SER N N 94 116.640 123.355 -6.715 1
1 1086 . 14 1 1 A 96 96 ASN HA H 96 4.770 5.533 -0.763 1
1 1091 . 14 1 1 A 96 96 ASN C C 96 175.161 173.511 1.650 1
1 1092 . 14 1 1 A 96 96 ASN CA C 96 53.395 52.163 1.232 1
1 1093 . 14 1 1 A 96 96 ASN CB C 96 38.999 40.255 -1.256 1
1 1095 . 14 1 1 A 97 97 SER H H 97 8.230 8.730 -0.500 1
1 1096 . 14 1 1 A 97 97 SER HA H 97 4.481 5.008 -0.527 1
1 1099 . 14 1 1 A 97 97 SER C C 97 174.482 174.371 0.111 1
1 1100 . 14 1 1 A 97 97 SER CA C 97 58.300 56.348 1.952 1
1 1101 . 14 1 1 A 97 97 SER CB C 97 63.697 66.110 -2.413 1
1 1102 . 14 1 1 A 97 97 SER N N 97 115.866 116.514 -0.648 1
1 1103 . 14 1 1 A 98 98 GLY H H 98 8.228 8.680 -0.452 1
1 1104 . 14 1 1 A 98 98 GLY HA2 H 98 4.098 4.113 -0.015 1
1 1105 . 14 1 1 A 98 98 GLY HA3 H 98 4.098 4.115 -0.017 1
1 1106 . 14 1 1 A 98 98 GLY C C 98 171.788 174.168 -2.380 1
1 1107 . 14 1 1 A 98 98 GLY CA C 98 44.803 44.855 -0.052 1
1 1108 . 14 1 1 A 98 98 GLY N N 98 110.658 115.202 -4.544 1
1 1109 . 14 1 1 A 99 99 PRO HA H 99 4.463 4.415 0.048 1
1 1116 . 14 1 1 A 99 99 PRO CA C 99 63.230 64.875 -1.645 1
1 1117 . 14 1 1 A 99 99 PRO CB C 99 32.044 31.967 0.077 1
1 1120 . 14 1 1 A 100 100 SER H H 100 8.514 7.685 0.829 1
1 1121 . 14 1 1 A 100 100 SER CA C 100 58.450 57.261 1.189 1
1 1122 . 14 1 1 A 100 100 SER CB C 100 63.889 65.049 -1.160 1
1 1 . 15 1 1 A 9 9 ASN H H 9 8.856 7.954 0.902 1
1 2 . 15 1 1 A 9 9 ASN HA H 9 4.694 5.025 -0.331 1
1 7 . 15 1 1 A 9 9 ASN CA C 9 53.401 52.845 0.556 1
1 8 . 15 1 1 A 9 9 ASN CB C 9 38.757 41.624 -2.867 1
1 10 . 15 1 1 A 10 10 ARG HA H 10 4.346 4.198 0.148 1
1 17 . 15 1 1 A 10 10 ARG C C 10 175.405 176.135 -0.730 1
1 18 . 15 1 1 A 10 10 ARG CA C 10 56.181 56.755 -0.574 1
1 19 . 15 1 1 A 10 10 ARG CB C 10 31.171 30.330 0.841 1
1 22 . 15 1 1 A 11 11 PHE H H 11 8.310 8.797 -0.487 1
1 23 . 15 1 1 A 11 11 PHE HA H 11 4.291 4.906 -0.615 1
1 31 . 15 1 1 A 11 11 PHE C C 11 174.458 173.875 0.583 1
1 32 . 15 1 1 A 11 11 PHE CA C 11 58.967 56.737 2.230 1
1 33 . 15 1 1 A 11 11 PHE CB C 11 40.138 40.810 -0.672 1
1 39 . 15 1 1 A 11 11 PHE N N 11 123.604 125.385 -1.781 1
1 40 . 15 1 1 A 12 12 LYS H H 12 7.307 8.662 -1.355 1
1 41 . 15 1 1 A 12 12 LYS HA H 12 4.165 4.518 -0.353 1
1 50 . 15 1 1 A 12 12 LYS C C 12 174.385 175.607 -1.222 1
1 51 . 15 1 1 A 12 12 LYS CA C 12 54.593 54.014 0.579 1
1 52 . 15 1 1 A 12 12 LYS CB C 12 34.712 35.462 -0.750 1
1 56 . 15 1 1 A 12 12 LYS N N 12 127.282 127.886 -0.604 1
1 57 . 15 1 1 A 13 13 TRP H H 13 8.039 8.343 -0.304 1
1 58 . 15 1 1 A 13 13 TRP HA H 13 4.370 4.617 -0.247 1
1 67 . 15 1 1 A 13 13 TRP C C 13 177.857 176.574 1.283 1
1 68 . 15 1 1 A 13 13 TRP CA C 13 56.675 56.937 -0.262 1
1 69 . 15 1 1 A 13 13 TRP CB C 13 30.317 30.371 -0.054 1
1 75 . 15 1 1 A 13 13 TRP N N 13 124.264 127.562 -3.298 1
1 77 . 15 1 1 A 14 14 GLY H H 14 9.815 8.722 1.093 1
1 78 . 15 1 1 A 14 14 GLY HA2 H 14 4.370 4.218 0.152 1
1 79 . 15 1 1 A 14 14 GLY HA3 H 14 4.335 4.247 0.088 1
1 80 . 15 1 1 A 14 14 GLY C C 14 172.904 174.776 -1.872 1
1 81 . 15 1 1 A 14 14 GLY CA C 14 44.157 43.885 0.272 1
1 82 . 15 1 1 A 14 14 GLY N N 14 115.294 108.767 6.527 1
1 83 . 15 1 1 A 15 15 PRO HA H 15 4.327 4.395 -0.068 1
1 90 . 15 1 1 A 15 15 PRO C C 15 179.726 178.903 0.823 1
1 91 . 15 1 1 A 15 15 PRO CA C 15 65.171 65.442 -0.271 1
1 92 . 15 1 1 A 15 15 PRO CB C 15 31.829 31.808 0.021 1
1 95 . 15 1 1 A 16 16 ALA H H 16 9.214 8.145 1.069 1
1 96 . 15 1 1 A 16 16 ALA HA H 16 4.166 4.119 0.047 1
1 100 . 15 1 1 A 16 16 ALA C C 16 181.184 179.885 1.299 1
1 101 . 15 1 1 A 16 16 ALA CA C 16 55.370 55.177 0.193 1
1 102 . 15 1 1 A 16 16 ALA CB C 16 18.058 18.420 -0.362 1
1 103 . 15 1 1 A 16 16 ALA N N 16 122.414 119.637 2.777 1
1 104 . 15 1 1 A 17 17 SER H H 17 7.985 8.179 -0.194 1
1 105 . 15 1 1 A 17 17 SER HA H 17 4.317 4.182 0.135 1
1 107 . 15 1 1 A 17 17 SER C C 17 175.381 176.942 -1.561 1
1 108 . 15 1 1 A 17 17 SER CA C 17 63.163 62.235 0.928 1
1 109 . 15 1 1 A 17 17 SER CB C 17 64.055 62.950 1.105 1
1 110 . 15 1 1 A 17 17 SER N N 17 116.568 114.276 2.292 1
1 111 . 15 1 1 A 18 18 GLN H H 18 8.316 7.942 0.374 1
1 112 . 15 1 1 A 18 18 GLN HA H 18 3.323 3.504 -0.181 1
1 119 . 15 1 1 A 18 18 GLN C C 18 176.812 178.690 -1.878 1
1 120 . 15 1 1 A 18 18 GLN CA C 18 60.025 59.087 0.938 1
1 121 . 15 1 1 A 18 18 GLN CB C 18 28.686 28.446 0.240 1
1 123 . 15 1 1 A 18 18 GLN N N 18 119.002 121.087 -2.085 1
1 125 . 15 1 1 A 19 19 GLN H H 19 7.582 7.685 -0.103 1
1 126 . 15 1 1 A 19 19 GLN HA H 19 4.062 4.098 -0.036 1
1 133 . 15 1 1 A 19 19 GLN C C 19 178.488 178.448 0.040 1
1 134 . 15 1 1 A 19 19 GLN CA C 19 59.248 59.210 0.038 1
1 135 . 15 1 1 A 19 19 GLN CB C 19 28.203 28.261 -0.058 1
1 137 . 15 1 1 A 19 19 GLN N N 19 116.221 118.691 -2.470 1
1 139 . 15 1 1 A 20 20 ILE H H 20 7.246 7.920 -0.674 1
1 140 . 15 1 1 A 20 20 ILE HA H 20 3.570 3.623 -0.053 1
1 150 . 15 1 1 A 20 20 ILE C C 20 178.999 178.567 0.432 1
1 151 . 15 1 1 A 20 20 ILE CA C 20 64.996 65.661 -0.665 1
1 152 . 15 1 1 A 20 20 ILE CB C 20 38.139 37.838 0.301 1
1 156 . 15 1 1 A 20 20 ILE N N 20 120.521 120.881 -0.360 1
1 157 . 15 1 1 A 21 21 LEU H H 21 8.034 7.904 0.130 1
1 158 . 15 1 1 A 21 21 LEU HA H 21 3.491 3.564 -0.073 1
1 168 . 15 1 1 A 21 21 LEU C C 21 178.196 178.753 -0.557 1
1 169 . 15 1 1 A 21 21 LEU CA C 21 57.944 57.521 0.423 1
1 170 . 15 1 1 A 21 21 LEU CB C 21 37.864 40.196 -2.332 1
1 174 . 15 1 1 A 21 21 LEU N N 21 121.259 119.052 2.207 1
1 175 . 15 1 1 A 22 22 TYR H H 22 8.479 7.604 0.875 1
1 176 . 15 1 1 A 22 22 TYR HA H 22 4.224 4.333 -0.109 1
1 183 . 15 1 1 A 22 22 TYR C C 22 179.630 178.474 1.156 1
1 184 . 15 1 1 A 22 22 TYR CA C 22 62.422 60.836 1.586 1
1 185 . 15 1 1 A 22 22 TYR CB C 22 37.434 37.765 -0.331 1
1 190 . 15 1 1 A 22 22 TYR N N 22 117.805 118.360 -0.555 1
1 191 . 15 1 1 A 23 23 GLN H H 23 7.707 8.313 -0.606 1
1 192 . 15 1 1 A 23 23 GLN HA H 23 4.166 4.039 0.127 1
1 199 . 15 1 1 A 23 23 GLN C C 23 178.633 178.463 0.170 1
1 200 . 15 1 1 A 23 23 GLN CA C 23 58.789 59.177 -0.388 1
1 201 . 15 1 1 A 23 23 GLN CB C 23 28.534 28.081 0.453 1
1 203 . 15 1 1 A 23 23 GLN N N 23 117.580 118.334 -0.754 1
1 205 . 15 1 1 A 24 24 ALA H H 24 8.155 7.860 0.295 1
1 206 . 15 1 1 A 24 24 ALA HA H 24 4.187 4.237 -0.050 1
1 210 . 15 1 1 A 24 24 ALA C C 24 180.018 179.052 0.966 1
1 211 . 15 1 1 A 24 24 ALA CA C 24 55.228 55.111 0.117 1
1 212 . 15 1 1 A 24 24 ALA CB C 24 19.468 18.735 0.733 1
1 213 . 15 1 1 A 24 24 ALA N N 24 122.813 122.428 0.385 1
1 214 . 15 1 1 A 25 25 TYR H H 25 8.995 8.688 0.307 1
1 215 . 15 1 1 A 25 25 TYR HA H 25 4.348 4.787 -0.439 1
1 222 . 15 1 1 A 25 25 TYR C C 25 175.792 177.475 -1.683 1
1 223 . 15 1 1 A 25 25 TYR CA C 25 61.681 61.792 -0.111 1
1 224 . 15 1 1 A 25 25 TYR CB C 25 38.175 38.658 -0.483 1
1 229 . 15 1 1 A 25 25 TYR N N 25 121.343 120.350 0.993 1
1 230 . 15 1 1 A 26 26 ASP H H 26 7.260 8.744 -1.484 1
1 231 . 15 1 1 A 26 26 ASP HA H 26 4.373 4.466 -0.093 1
1 234 . 15 1 1 A 26 26 ASP C C 26 177.322 178.033 -0.711 1
1 235 . 15 1 1 A 26 26 ASP CA C 26 56.603 57.473 -0.870 1
1 236 . 15 1 1 A 26 26 ASP CB C 26 41.060 41.065 -0.005 1
1 237 . 15 1 1 A 26 26 ASP N N 26 114.020 119.308 -5.288 1
1 238 . 15 1 1 A 27 27 ARG H H 27 7.343 7.574 -0.231 1
1 239 . 15 1 1 A 27 27 ARG HA H 27 4.302 4.374 -0.072 1
1 246 . 15 1 1 A 27 27 ARG C C 27 176.546 176.210 0.336 1
1 247 . 15 1 1 A 27 27 ARG CA C 27 57.563 57.627 -0.064 1
1 248 . 15 1 1 A 27 27 ARG CB C 27 31.500 31.383 0.117 1
1 251 . 15 1 1 A 27 27 ARG N N 27 116.729 116.981 -0.252 1
1 252 . 15 1 1 A 28 28 GLN H H 28 8.306 8.080 0.226 1
1 253 . 15 1 1 A 28 28 GLN HA H 28 4.396 4.713 -0.317 1
1 260 . 15 1 1 A 28 28 GLN C C 28 172.831 175.175 -2.344 1
1 261 . 15 1 1 A 28 28 GLN CA C 28 55.355 54.546 0.809 1
1 262 . 15 1 1 A 28 28 GLN CB C 28 31.062 31.675 -0.613 1
1 264 . 15 1 1 A 28 28 GLN N N 28 121.612 118.396 3.216 1
1 266 . 15 1 1 A 29 29 LYS H H 29 8.354 8.533 -0.179 1
1 267 . 15 1 1 A 29 29 LYS HA H 29 4.099 3.641 0.458 1
1 276 . 15 1 1 A 29 29 LYS C C 29 176.084 176.415 -0.331 1
1 277 . 15 1 1 A 29 29 LYS CA C 29 57.873 57.300 0.573 1
1 278 . 15 1 1 A 29 29 LYS CB C 29 33.313 32.770 0.543 1
1 282 . 15 1 1 A 29 29 LYS N N 29 125.038 123.633 1.405 1
1 283 . 15 1 1 A 30 30 ASN H H 30 8.856 7.886 0.970 1
1 284 . 15 1 1 A 30 30 ASN HA H 30 4.958 5.114 -0.156 1
1 289 . 15 1 1 A 30 30 ASN C C 30 171.179 172.710 -1.531 1
1 290 . 15 1 1 A 30 30 ASN CA C 30 50.891 50.427 0.464 1
1 291 . 15 1 1 A 30 30 ASN CB C 30 39.907 39.219 0.688 1
1 292 . 15 1 1 A 30 30 ASN N N 30 115.764 117.346 -1.582 1
1 294 . 15 1 1 A 31 31 PRO HA H 31 4.299 4.452 -0.153 1
1 301 . 15 1 1 A 31 31 PRO C C 31 177.493 176.743 0.750 1
1 302 . 15 1 1 A 31 31 PRO CA C 31 62.489 62.600 -0.111 1
1 303 . 15 1 1 A 31 31 PRO CB C 31 31.216 31.799 -0.583 1
1 306 . 15 1 1 A 32 32 SER H H 32 9.368 8.489 0.879 1
1 307 . 15 1 1 A 32 32 SER HA H 32 4.372 4.765 -0.393 1
1 310 . 15 1 1 A 32 32 SER C C 32 174.821 175.800 -0.979 1
1 311 . 15 1 1 A 32 32 SER CA C 32 57.203 57.749 -0.546 1
1 312 . 15 1 1 A 32 32 SER CB C 32 65.594 64.502 1.092 1
1 313 . 15 1 1 A 32 32 SER N N 32 120.847 117.967 2.880 1
1 314 . 15 1 1 A 33 33 LYS H H 33 9.152 8.969 0.183 1
1 315 . 15 1 1 A 33 33 LYS HA H 33 3.719 3.969 -0.250 1
1 324 . 15 1 1 A 33 33 LYS C C 33 177.833 178.196 -0.363 1
1 325 . 15 1 1 A 33 33 LYS CA C 33 61.188 59.831 1.357 1
1 326 . 15 1 1 A 33 33 LYS CB C 33 32.572 32.122 0.450 1
1 330 . 15 1 1 A 33 33 LYS N N 33 122.966 124.592 -1.626 1
1 331 . 15 1 1 A 34 34 GLU H H 34 8.902 7.986 0.916 1
1 332 . 15 1 1 A 34 34 GLU HA H 34 4.089 4.096 -0.007 1
1 337 . 15 1 1 A 34 34 GLU C C 34 180.286 179.217 1.069 1
1 338 . 15 1 1 A 34 34 GLU CA C 34 60.483 59.330 1.153 1
1 339 . 15 1 1 A 34 34 GLU CB C 34 28.835 29.669 -0.834 1
1 341 . 15 1 1 A 34 34 GLU N N 34 117.645 119.134 -1.489 1
1 342 . 15 1 1 A 35 35 GLU H H 35 7.673 8.132 -0.459 1
1 343 . 15 1 1 A 35 35 GLU HA H 35 4.023 3.988 0.035 1
1 348 . 15 1 1 A 35 35 GLU C C 35 180.237 179.285 0.952 1
1 349 . 15 1 1 A 35 35 GLU CA C 35 59.214 59.285 -0.071 1
1 350 . 15 1 1 A 35 35 GLU CB C 35 30.099 29.243 0.856 1
1 352 . 15 1 1 A 35 35 GLU N N 35 121.077 120.069 1.008 1
1 353 . 15 1 1 A 36 36 ARG H H 36 8.932 8.175 0.757 1
1 354 . 15 1 1 A 36 36 ARG HA H 36 3.928 3.748 0.180 1
1 362 . 15 1 1 A 36 36 ARG C C 36 178.464 179.009 -0.545 1
1 363 . 15 1 1 A 36 36 ARG CA C 36 60.974 59.976 0.998 1
1 364 . 15 1 1 A 36 36 ARG CB C 36 31.171 29.996 1.175 1
1 367 . 15 1 1 A 36 36 ARG N N 36 119.441 120.021 -0.580 1
1 369 . 15 1 1 A 37 37 GLU H H 37 8.756 8.038 0.718 1
1 370 . 15 1 1 A 37 37 GLU HA H 37 3.948 4.097 -0.149 1
1 375 . 15 1 1 A 37 37 GLU C C 37 179.606 178.626 0.980 1
1 376 . 15 1 1 A 37 37 GLU CA C 37 60.094 59.080 1.014 1
1 377 . 15 1 1 A 37 37 GLU CB C 37 29.110 29.277 -0.167 1
1 379 . 15 1 1 A 37 37 GLU N N 37 119.017 119.593 -0.576 1
1 380 . 15 1 1 A 38 38 ALA H H 38 7.733 7.994 -0.261 1
1 381 . 15 1 1 A 38 38 ALA HA H 38 4.325 4.130 0.195 1
1 385 . 15 1 1 A 38 38 ALA C C 38 180.820 178.664 2.156 1
1 386 . 15 1 1 A 38 38 ALA CA C 38 55.194 54.509 0.685 1
1 387 . 15 1 1 A 38 38 ALA CB C 38 17.654 18.519 -0.865 1
1 388 . 15 1 1 A 38 38 ALA N N 38 122.889 122.073 0.816 1
1 389 . 15 1 1 A 39 39 LEU H H 39 7.740 7.979 -0.239 1
1 390 . 15 1 1 A 39 39 LEU HA H 39 4.176 4.279 -0.103 1
1 400 . 15 1 1 A 39 39 LEU C C 39 179.266 178.848 0.418 1
1 401 . 15 1 1 A 39 39 LEU CA C 39 57.944 56.080 1.864 1
1 402 . 15 1 1 A 39 39 LEU CB C 39 42.105 42.304 -0.199 1
1 406 . 15 1 1 A 39 39 LEU N N 39 119.783 116.882 2.901 1
1 407 . 15 1 1 A 40 40 VAL H H 40 8.451 8.429 0.022 1
1 408 . 15 1 1 A 40 40 VAL HA H 40 3.259 3.589 -0.330 1
1 416 . 15 1 1 A 40 40 VAL C C 40 177.153 177.709 -0.556 1
1 417 . 15 1 1 A 40 40 VAL CA C 40 67.254 66.922 0.332 1
1 418 . 15 1 1 A 40 40 VAL CB C 40 31.747 31.392 0.355 1
1 421 . 15 1 1 A 40 40 VAL N N 40 121.481 120.036 1.445 1
1 422 . 15 1 1 A 41 41 GLU H H 41 7.254 8.112 -0.858 1
1 423 . 15 1 1 A 41 41 GLU HA H 41 4.159 4.088 0.071 1
1 428 . 15 1 1 A 41 41 GLU C C 41 179.483 178.888 0.595 1
1 429 . 15 1 1 A 41 41 GLU CA C 41 59.248 59.405 -0.157 1
1 430 . 15 1 1 A 41 41 GLU CB C 41 29.358 29.252 0.106 1
1 432 . 15 1 1 A 41 41 GLU N N 41 116.549 119.795 -3.246 1
1 433 . 15 1 1 A 42 42 GLU H H 42 8.103 8.226 -0.123 1
1 434 . 15 1 1 A 42 42 GLU HA H 42 4.020 4.042 -0.022 1
1 439 . 15 1 1 A 42 42 GLU C C 42 180.115 178.737 1.378 1
1 440 . 15 1 1 A 42 42 GLU CA C 42 59.847 59.506 0.341 1
1 441 . 15 1 1 A 42 42 GLU CB C 42 30.218 29.326 0.892 1
1 443 . 15 1 1 A 42 42 GLU N N 42 119.578 119.346 0.232 1
1 444 . 15 1 1 A 43 43 CYS H H 43 8.955 8.105 0.850 1
1 445 . 15 1 1 A 43 43 CYS HA H 43 4.153 4.234 -0.081 1
1 448 . 15 1 1 A 43 43 CYS C C 43 176.498 177.746 -1.248 1
1 449 . 15 1 1 A 43 43 CYS CA C 43 64.856 62.488 2.368 1
1 450 . 15 1 1 A 43 43 CYS CB C 43 27.390 27.748 -0.358 1
1 451 . 15 1 1 A 43 43 CYS N N 43 118.199 118.925 -0.726 1
1 452 . 15 1 1 A 44 44 ASN H H 44 8.543 7.932 0.611 1
1 453 . 15 1 1 A 44 44 ASN HA H 44 4.635 4.421 0.214 1
1 458 . 15 1 1 A 44 44 ASN C C 44 178.633 177.509 1.124 1
1 459 . 15 1 1 A 44 44 ASN CA C 44 56.603 56.323 0.280 1
1 460 . 15 1 1 A 44 44 ASN CB C 44 37.187 38.049 -0.862 1
1 461 . 15 1 1 A 44 44 ASN N N 44 117.002 119.426 -2.424 1
1 463 . 15 1 1 A 45 45 ARG H H 45 8.296 8.138 0.158 1
1 464 . 15 1 1 A 45 45 ARG HA H 45 3.977 4.052 -0.075 1
1 471 . 15 1 1 A 45 45 ARG C C 45 178.149 178.230 -0.081 1
1 472 . 15 1 1 A 45 45 ARG CA C 45 60.589 59.578 1.011 1
1 473 . 15 1 1 A 45 45 ARG CB C 45 30.099 30.238 -0.139 1
1 476 . 15 1 1 A 45 45 ARG N N 45 121.021 120.775 0.246 1
1 477 . 15 1 1 A 46 46 ALA H H 46 7.914 8.416 -0.502 1
1 478 . 15 1 1 A 46 46 ALA HA H 46 4.128 4.120 0.008 1
1 482 . 15 1 1 A 46 46 ALA C C 46 181.208 180.348 0.860 1
1 483 . 15 1 1 A 46 46 ALA CA C 46 55.264 55.092 0.172 1
1 484 . 15 1 1 A 46 46 ALA CB C 46 18.759 18.191 0.568 1
1 485 . 15 1 1 A 46 46 ALA N N 46 121.570 120.764 0.806 1
1 486 . 15 1 1 A 47 47 GLU H H 47 8.730 8.608 0.122 1
1 487 . 15 1 1 A 47 47 GLU HA H 47 4.194 4.048 0.146 1
1 492 . 15 1 1 A 47 47 GLU C C 47 180.115 179.285 0.830 1
1 493 . 15 1 1 A 47 47 GLU CA C 47 58.401 59.688 -1.287 1
1 494 . 15 1 1 A 47 47 GLU CB C 47 29.523 29.241 0.282 1
1 496 . 15 1 1 A 47 47 GLU N N 47 117.532 118.261 -0.729 1
1 497 . 15 1 1 A 48 48 CYS H H 48 8.283 7.915 0.368 1
1 498 . 15 1 1 A 48 48 CYS HA H 48 4.002 4.141 -0.139 1
1 501 . 15 1 1 A 48 48 CYS C C 48 177.031 177.407 -0.376 1
1 502 . 15 1 1 A 48 48 CYS CA C 48 64.749 63.994 0.755 1
1 503 . 15 1 1 A 48 48 CYS CB C 48 25.907 27.591 -1.684 1
1 504 . 15 1 1 A 48 48 CYS N N 48 118.282 119.137 -0.855 1
1 505 . 15 1 1 A 49 49 LEU H H 49 8.181 8.132 0.049 1
1 506 . 15 1 1 A 49 49 LEU HA H 49 4.175 3.901 0.274 1
1 516 . 15 1 1 A 49 49 LEU C C 49 180.430 178.821 1.609 1
1 517 . 15 1 1 A 49 49 LEU CA C 49 57.873 58.181 -0.308 1
1 518 . 15 1 1 A 49 49 LEU CB C 49 41.539 41.829 -0.290 1
1 522 . 15 1 1 A 49 49 LEU N N 49 120.371 120.577 -0.206 1
1 523 . 15 1 1 A 50 50 GLN H H 50 7.934 8.757 -0.823 1
1 524 . 15 1 1 A 50 50 GLN HA H 50 4.102 4.076 0.026 1
1 531 . 15 1 1 A 50 50 GLN C C 50 177.322 177.127 0.195 1
1 532 . 15 1 1 A 50 50 GLN CA C 50 58.156 58.663 -0.507 1
1 533 . 15 1 1 A 50 50 GLN CB C 50 28.616 28.604 0.012 1
1 535 . 15 1 1 A 50 50 GLN N N 50 118.175 117.358 0.817 1
1 537 . 15 1 1 A 51 51 ARG H H 51 7.632 7.662 -0.030 1
1 538 . 15 1 1 A 51 51 ARG HA H 51 4.347 4.384 -0.037 1
1 545 . 15 1 1 A 51 51 ARG C C 51 176.546 176.478 0.068 1
1 546 . 15 1 1 A 51 51 ARG CA C 51 56.286 55.886 0.400 1
1 547 . 15 1 1 A 51 51 ARG CB C 51 31.314 30.020 1.294 1
1 550 . 15 1 1 A 51 51 ARG N N 51 116.454 117.757 -1.303 1
1 551 . 15 1 1 A 52 52 GLY H H 52 7.949 8.439 -0.490 1
1 552 . 15 1 1 A 52 52 GLY HA2 H 52 4.033 3.980 0.053 1
1 553 . 15 1 1 A 52 52 GLY HA3 H 52 3.903 3.980 -0.077 1
1 554 . 15 1 1 A 52 52 GLY C C 52 174.385 174.221 0.164 1
1 555 . 15 1 1 A 52 52 GLY CA C 52 46.231 45.297 0.934 1
1 556 . 15 1 1 A 52 52 GLY N N 52 108.854 107.554 1.300 1
1 557 . 15 1 1 A 53 53 VAL H H 53 7.944 7.522 0.422 1
1 558 . 15 1 1 A 53 53 VAL HA H 53 4.250 4.079 0.171 1
1 566 . 15 1 1 A 53 53 VAL C C 53 175.525 175.258 0.267 1
1 567 . 15 1 1 A 53 53 VAL CA C 53 60.377 62.533 -2.156 1
1 568 . 15 1 1 A 53 53 VAL CB C 53 34.283 32.885 1.398 1
1 571 . 15 1 1 A 53 53 VAL N N 53 118.316 120.654 -2.338 1
1 572 . 15 1 1 A 54 54 SER H H 54 8.502 8.521 -0.019 1
1 573 . 15 1 1 A 54 54 SER HA H 54 4.625 4.862 -0.237 1
1 576 . 15 1 1 A 54 54 SER C C 54 174.603 174.161 0.442 1
1 577 . 15 1 1 A 54 54 SER CA C 54 56.092 54.410 1.682 1
1 578 . 15 1 1 A 54 54 SER CB C 54 63.697 63.793 -0.096 1
1 579 . 15 1 1 A 54 54 SER N N 54 120.337 118.431 1.906 1
1 580 . 15 1 1 A 55 55 PRO HA H 55 4.624 4.526 0.098 1
1 587 . 15 1 1 A 55 55 PRO C C 55 177.322 176.929 0.393 1
1 588 . 15 1 1 A 55 55 PRO CA C 55 64.431 64.266 0.165 1
1 589 . 15 1 1 A 55 55 PRO CB C 55 31.913 31.736 0.177 1
1 592 . 15 1 1 A 56 56 SER H H 56 7.931 8.156 -0.225 1
1 593 . 15 1 1 A 56 56 SER HA H 56 4.428 4.371 0.057 1
1 596 . 15 1 1 A 56 56 SER C C 56 174.749 175.226 -0.477 1
1 597 . 15 1 1 A 56 56 SER CA C 56 59.130 58.889 0.241 1
1 598 . 15 1 1 A 56 56 SER CB C 56 63.056 63.836 -0.780 1
1 599 . 15 1 1 A 56 56 SER N N 56 112.637 111.079 1.558 1
1 600 . 15 1 1 A 57 57 LYS H H 57 8.121 7.614 0.507 1
1 601 . 15 1 1 A 57 57 LYS HA H 57 4.467 4.650 -0.183 1
1 609 . 15 1 1 A 57 57 LYS C C 57 176.570 176.627 -0.057 1
1 610 . 15 1 1 A 57 57 LYS CA C 57 55.264 54.960 0.304 1
1 611 . 15 1 1 A 57 57 LYS CB C 57 32.160 32.606 -0.446 1
1 615 . 15 1 1 A 57 57 LYS N N 57 123.185 119.509 3.676 1
1 616 . 15 1 1 A 58 58 ALA H H 58 7.886 8.005 -0.119 1
1 617 . 15 1 1 A 58 58 ALA HA H 58 3.923 4.225 -0.302 1
1 621 . 15 1 1 A 58 58 ALA C C 58 177.469 179.166 -1.697 1
1 622 . 15 1 1 A 58 58 ALA CA C 58 54.276 54.008 0.268 1
1 623 . 15 1 1 A 58 58 ALA CB C 58 18.271 18.447 -0.176 1
1 624 . 15 1 1 A 58 58 ALA N N 58 123.941 122.114 1.827 1
1 625 . 15 1 1 A 59 59 HIS H H 59 8.077 8.009 0.068 1
1 626 . 15 1 1 A 59 59 HIS HA H 59 4.420 4.433 -0.013 1
1 631 . 15 1 1 A 59 59 HIS C C 59 177.542 176.522 1.020 1
1 632 . 15 1 1 A 59 59 HIS CA C 59 57.767 57.495 0.272 1
1 633 . 15 1 1 A 59 59 HIS CB C 59 29.852 28.402 1.450 1
1 636 . 15 1 1 A 59 59 HIS N N 59 115.566 116.366 -0.800 1
1 637 . 15 1 1 A 60 60 GLY H H 60 8.110 7.865 0.245 1
1 638 . 15 1 1 A 60 60 GLY HA2 H 60 3.873 3.748 0.125 1
1 639 . 15 1 1 A 60 60 GLY HA3 H 60 4.025 3.796 0.229 1
1 640 . 15 1 1 A 60 60 GLY C C 60 174.918 175.699 -0.781 1
1 641 . 15 1 1 A 60 60 GLY CA C 60 45.559 46.509 -0.950 1
1 642 . 15 1 1 A 60 60 GLY N N 60 109.216 109.762 -0.546 1
1 643 . 15 1 1 A 61 61 LEU H H 61 8.280 7.639 0.641 1
1 644 . 15 1 1 A 61 61 LEU HA H 61 4.198 4.314 -0.116 1
1 654 . 15 1 1 A 61 61 LEU C C 61 178.900 177.513 1.387 1
1 655 . 15 1 1 A 61 61 LEU CA C 61 55.758 57.927 -2.169 1
1 656 . 15 1 1 A 61 61 LEU CB C 61 42.544 42.131 0.413 1
1 660 . 15 1 1 A 61 61 LEU N N 61 120.521 122.853 -2.332 1
1 661 . 15 1 1 A 62 62 GLY H H 62 8.184 7.931 0.253 1
1 662 . 15 1 1 A 62 62 GLY HA2 H 62 3.978 3.911 0.067 1
1 663 . 15 1 1 A 62 62 GLY HA3 H 62 3.817 3.921 -0.104 1
1 664 . 15 1 1 A 62 62 GLY C C 62 176.012 175.250 0.762 1
1 665 . 15 1 1 A 62 62 GLY CA C 62 46.767 47.253 -0.486 1
1 666 . 15 1 1 A 62 62 GLY N N 62 108.987 107.418 1.569 1
1 667 . 15 1 1 A 63 63 SER HA H 63 4.322 4.277 0.045 1
1 670 . 15 1 1 A 63 63 SER C C 63 174.167 175.640 -1.473 1
1 671 . 15 1 1 A 63 63 SER CA C 63 59.919 60.605 -0.686 1
1 672 . 15 1 1 A 63 63 SER CB C 63 63.312 63.090 0.222 1
1 673 . 15 1 1 A 64 64 ASN H H 64 8.087 7.924 0.163 1
1 674 . 15 1 1 A 64 64 ASN HA H 64 4.850 5.066 -0.216 1
1 679 . 15 1 1 A 64 64 ASN C C 64 173.899 175.150 -1.251 1
1 680 . 15 1 1 A 64 64 ASN CA C 64 53.218 52.316 0.902 1
1 681 . 15 1 1 A 64 64 ASN CB C 64 39.164 37.791 1.373 1
1 682 . 15 1 1 A 64 64 ASN N N 64 118.041 114.483 3.558 1
1 684 . 15 1 1 A 65 65 LEU H H 65 7.293 7.260 0.033 1
1 685 . 15 1 1 A 65 65 LEU HA H 65 3.995 4.339 -0.344 1
1 695 . 15 1 1 A 65 65 LEU C C 65 175.696 175.033 0.663 1
1 696 . 15 1 1 A 65 65 LEU CA C 65 56.005 55.325 0.680 1
1 697 . 15 1 1 A 65 65 LEU CB C 65 43.120 42.817 0.303 1
1 701 . 15 1 1 A 65 65 LEU N N 65 120.953 123.014 -2.061 1
1 702 . 15 1 1 A 66 66 VAL H H 66 9.517 8.608 0.909 1
1 703 . 15 1 1 A 66 66 VAL HA H 66 3.481 4.317 -0.836 1
1 711 . 15 1 1 A 66 66 VAL C C 66 175.429 174.777 0.652 1
1 712 . 15 1 1 A 66 66 VAL CA C 66 65.243 61.065 4.178 1
1 713 . 15 1 1 A 66 66 VAL CB C 66 31.335 33.394 -2.059 1
1 716 . 15 1 1 A 66 66 VAL N N 66 127.924 126.354 1.570 1
1 717 . 15 1 1 A 67 67 THR H H 67 6.253 8.348 -2.095 1
1 718 . 15 1 1 A 67 67 THR HA H 67 4.779 4.741 0.038 1
1 723 . 15 1 1 A 67 67 THR C C 67 174.894 174.711 0.183 1
1 724 . 15 1 1 A 67 67 THR CA C 67 58.719 59.679 -0.960 1
1 725 . 15 1 1 A 67 67 THR CB C 67 72.153 71.542 0.611 1
1 727 . 15 1 1 A 67 67 THR N N 67 113.376 116.002 -2.626 1
1 728 . 15 1 1 A 68 68 GLU H H 68 9.348 8.867 0.481 1
1 729 . 15 1 1 A 68 68 GLU HA H 68 3.634 3.998 -0.364 1
1 734 . 15 1 1 A 68 68 GLU C C 68 177.809 178.335 -0.526 1
1 735 . 15 1 1 A 68 68 GLU CA C 68 61.505 60.072 1.433 1
1 736 . 15 1 1 A 68 68 GLU CB C 68 28.285 29.565 -1.280 1
1 738 . 15 1 1 A 68 68 GLU N N 68 124.534 122.181 2.353 1
1 739 . 15 1 1 A 69 69 VAL H H 69 8.126 7.920 0.206 1
1 740 . 15 1 1 A 69 69 VAL HA H 69 3.862 3.549 0.313 1
1 748 . 15 1 1 A 69 69 VAL C C 69 177.712 178.140 -0.428 1
1 749 . 15 1 1 A 69 69 VAL CA C 69 65.701 66.820 -1.119 1
1 750 . 15 1 1 A 69 69 VAL CB C 69 31.829 31.620 0.209 1
1 753 . 15 1 1 A 69 69 VAL N N 69 119.139 119.838 -0.699 1
1 754 . 15 1 1 A 70 70 ARG H H 70 7.235 8.265 -1.030 1
1 755 . 15 1 1 A 70 70 ARG HA H 70 4.265 4.125 0.140 1
1 762 . 15 1 1 A 70 70 ARG C C 70 180.430 179.355 1.075 1
1 763 . 15 1 1 A 70 70 ARG CA C 70 59.742 60.289 -0.547 1
1 764 . 15 1 1 A 70 70 ARG CB C 70 29.439 30.057 -0.618 1
1 767 . 15 1 1 A 70 70 ARG N N 70 119.541 119.224 0.317 1
1 768 . 15 1 1 A 71 71 VAL H H 71 8.144 7.989 0.155 1
1 769 . 15 1 1 A 71 71 VAL HA H 71 4.018 3.993 0.025 1
1 777 . 15 1 1 A 71 71 VAL C C 71 177.493 177.917 -0.424 1
1 778 . 15 1 1 A 71 71 VAL CA C 71 67.924 66.473 1.451 1
1 779 . 15 1 1 A 71 71 VAL CB C 71 32.289 31.758 0.531 1
1 782 . 15 1 1 A 71 71 VAL N N 71 120.755 120.135 0.620 1
1 783 . 15 1 1 A 72 72 TYR H H 72 9.411 8.437 0.974 1
1 784 . 15 1 1 A 72 72 TYR HA H 72 3.908 4.279 -0.371 1
1 791 . 15 1 1 A 72 72 TYR C C 72 178.464 178.093 0.371 1
1 792 . 15 1 1 A 72 72 TYR CA C 72 63.444 61.780 1.664 1
1 793 . 15 1 1 A 72 72 TYR CB C 72 38.211 38.679 -0.468 1
1 798 . 15 1 1 A 72 72 TYR N N 72 121.175 121.499 -0.324 1
1 799 . 15 1 1 A 73 73 ASN H H 73 8.816 8.689 0.127 1
1 800 . 15 1 1 A 73 73 ASN HA H 73 4.538 4.645 -0.107 1
1 805 . 15 1 1 A 73 73 ASN C C 73 176.958 178.074 -1.116 1
1 806 . 15 1 1 A 73 73 ASN CA C 73 56.109 56.655 -0.546 1
1 807 . 15 1 1 A 73 73 ASN CB C 73 38.422 39.075 -0.653 1
1 808 . 15 1 1 A 73 73 ASN N N 73 118.122 118.062 0.060 1
1 810 . 15 1 1 A 74 74 TRP H H 74 8.657 8.297 0.360 1
1 811 . 15 1 1 A 74 74 TRP HA H 74 4.111 4.491 -0.380 1
1 820 . 15 1 1 A 74 74 TRP C C 74 179.654 178.523 1.131 1
1 821 . 15 1 1 A 74 74 TRP CA C 74 62.950 61.262 1.688 1
1 822 . 15 1 1 A 74 74 TRP CB C 74 29.555 29.511 0.044 1
1 828 . 15 1 1 A 74 74 TRP N N 74 123.988 123.537 0.451 1
1 830 . 15 1 1 A 75 75 PHE H H 75 8.562 8.386 0.176 1
1 831 . 15 1 1 A 75 75 PHE HA H 75 3.821 4.404 -0.583 1
1 839 . 15 1 1 A 75 75 PHE C C 75 177.614 178.083 -0.469 1
1 840 . 15 1 1 A 75 75 PHE CA C 75 63.374 62.020 1.354 1
1 841 . 15 1 1 A 75 75 PHE CB C 75 39.648 38.456 1.192 1
1 847 . 15 1 1 A 75 75 PHE N N 75 118.325 117.096 1.229 1
1 848 . 15 1 1 A 76 76 ALA H H 76 8.305 8.352 -0.047 1
1 849 . 15 1 1 A 76 76 ALA HA H 76 3.909 3.916 -0.007 1
1 853 . 15 1 1 A 76 76 ALA C C 76 180.868 179.481 1.387 1
1 854 . 15 1 1 A 76 76 ALA CA C 76 55.566 55.222 0.344 1
1 855 . 15 1 1 A 76 76 ALA CB C 76 17.820 18.073 -0.253 1
1 856 . 15 1 1 A 76 76 ALA N N 76 121.119 122.442 -1.323 1
1 857 . 15 1 1 A 77 77 ASN H H 77 8.335 8.254 0.081 1
1 858 . 15 1 1 A 77 77 ASN HA H 77 4.355 4.380 -0.025 1
1 863 . 15 1 1 A 77 77 ASN C C 77 177.105 177.728 -0.623 1
1 864 . 15 1 1 A 77 77 ASN CA C 77 56.145 56.173 -0.028 1
1 865 . 15 1 1 A 77 77 ASN CB C 77 38.063 38.650 -0.587 1
1 866 . 15 1 1 A 77 77 ASN N N 77 117.433 116.338 1.095 1
1 868 . 15 1 1 A 78 78 ARG H H 78 7.664 7.201 0.463 1
1 869 . 15 1 1 A 78 78 ARG HA H 78 3.629 3.752 -0.123 1
1 876 . 15 1 1 A 78 78 ARG C C 78 179.216 177.592 1.624 1
1 877 . 15 1 1 A 78 78 ARG CA C 78 58.773 58.509 0.264 1
1 878 . 15 1 1 A 78 78 ARG CB C 78 29.605 29.143 0.462 1
1 881 . 15 1 1 A 78 78 ARG N N 78 121.999 118.473 3.526 1
1 882 . 15 1 1 A 79 79 ARG H H 79 8.320 7.624 0.696 1
1 883 . 15 1 1 A 79 79 ARG HA H 79 4.307 4.505 -0.198 1
1 890 . 15 1 1 A 79 79 ARG C C 79 180.406 178.314 2.092 1
1 891 . 15 1 1 A 79 79 ARG CA C 79 60.270 57.235 3.035 1
1 892 . 15 1 1 A 79 79 ARG CB C 79 31.335 30.566 0.769 1
1 895 . 15 1 1 A 79 79 ARG N N 79 118.139 117.807 0.332 1
1 896 . 15 1 1 A 80 80 LYS H H 80 7.759 8.264 -0.505 1
1 897 . 15 1 1 A 80 80 LYS HA H 80 4.052 4.175 -0.123 1
1 905 . 15 1 1 A 80 80 LYS C C 80 178.999 179.421 -0.422 1
1 906 . 15 1 1 A 80 80 LYS CA C 80 59.531 59.340 0.191 1
1 907 . 15 1 1 A 80 80 LYS CB C 80 32.374 32.459 -0.085 1
1 911 . 15 1 1 A 80 80 LYS N N 80 120.899 119.355 1.544 1
1 912 . 15 1 1 A 81 81 GLU H H 81 8.041 8.202 -0.161 1
1 913 . 15 1 1 A 81 81 GLU HA H 81 4.044 4.159 -0.115 1
1 918 . 15 1 1 A 81 81 GLU C C 81 179.168 178.408 0.760 1
1 919 . 15 1 1 A 81 81 GLU CA C 81 59.036 59.567 -0.531 1
1 920 . 15 1 1 A 81 81 GLU CB C 81 29.561 29.165 0.396 1
1 922 . 15 1 1 A 81 81 GLU N N 81 120.193 118.760 1.433 1
1 923 . 15 1 1 A 82 82 GLU H H 82 8.131 8.539 -0.408 1
1 924 . 15 1 1 A 82 82 GLU HA H 82 4.017 4.069 -0.052 1
1 929 . 15 1 1 A 82 82 GLU C C 82 178.343 178.230 0.113 1
1 930 . 15 1 1 A 82 82 GLU CA C 82 59.319 59.331 -0.012 1
1 931 . 15 1 1 A 82 82 GLU CB C 82 29.770 29.267 0.503 1
1 933 . 15 1 1 A 82 82 GLU N N 82 119.626 118.882 0.744 1
1 934 . 15 1 1 A 83 83 ALA H H 83 7.935 7.784 0.151 1
1 935 . 15 1 1 A 83 83 ALA HA H 83 4.180 4.161 0.019 1
1 939 . 15 1 1 A 83 83 ALA C C 83 179.994 179.536 0.458 1
1 940 . 15 1 1 A 83 83 ALA CA C 83 54.629 54.092 0.537 1
1 941 . 15 1 1 A 83 83 ALA CB C 83 18.090 18.786 -0.696 1
1 942 . 15 1 1 A 83 83 ALA N N 83 121.476 122.141 -0.665 1
1 943 . 15 1 1 A 84 84 PHE H H 84 8.043 8.038 0.005 1
1 944 . 15 1 1 A 84 84 PHE HA H 84 4.420 4.015 0.405 1
1 952 . 15 1 1 A 84 84 PHE C C 84 177.250 177.103 0.147 1
1 953 . 15 1 1 A 84 84 PHE CA C 84 60.059 61.459 -1.400 1
1 954 . 15 1 1 A 84 84 PHE CB C 84 38.952 39.389 -0.437 1
1 960 . 15 1 1 A 84 84 PHE N N 84 119.074 120.378 -1.304 1
1 961 . 15 1 1 A 85 85 ARG H H 85 8.031 7.863 0.168 1
1 962 . 15 1 1 A 85 85 ARG HA H 85 3.992 4.111 -0.119 1
1 968 . 15 1 1 A 85 85 ARG C C 85 178.319 178.196 0.123 1
1 969 . 15 1 1 A 85 85 ARG CA C 85 58.523 59.635 -1.112 1
1 970 . 15 1 1 A 85 85 ARG CB C 85 30.346 29.872 0.474 1
1 973 . 15 1 1 A 85 85 ARG N N 85 119.291 117.653 1.638 1
1 974 . 15 1 1 A 86 86 GLN H H 86 8.091 7.972 0.119 1
1 975 . 15 1 1 A 86 86 GLN HA H 86 4.148 4.308 -0.160 1
1 982 . 15 1 1 A 86 86 GLN C C 86 177.105 178.336 -1.231 1
1 983 . 15 1 1 A 86 86 GLN CA C 86 57.556 57.300 0.256 1
1 984 . 15 1 1 A 86 86 GLN CB C 86 28.855 29.555 -0.700 1
1 986 . 15 1 1 A 86 86 GLN N N 86 119.097 117.557 1.540 1
1 988 . 15 1 1 A 87 87 LYS H H 87 7.898 8.409 -0.511 1
1 989 . 15 1 1 A 87 87 LYS HA H 87 4.116 4.063 0.053 1
1 997 . 15 1 1 A 87 87 LYS C C 87 177.542 178.889 -1.347 1
1 998 . 15 1 1 A 87 87 LYS CA C 87 57.944 58.936 -0.992 1
1 999 . 15 1 1 A 87 87 LYS CB C 87 32.242 32.111 0.131 1
1 1003 . 15 1 1 A 87 87 LYS N N 87 120.968 122.189 -1.221 1
1 1004 . 15 1 1 A 88 88 LEU H H 88 7.903 8.135 -0.232 1
1 1005 . 15 1 1 A 88 88 LEU HA H 88 4.144 4.246 -0.102 1
1 1015 . 15 1 1 A 88 88 LEU C C 88 178.221 177.169 1.052 1
1 1016 . 15 1 1 A 88 88 LEU CA C 88 56.145 56.460 -0.315 1
1 1017 . 15 1 1 A 88 88 LEU CB C 88 42.215 41.084 1.131 1
1 1021 . 15 1 1 A 88 88 LEU N N 88 120.558 117.000 3.558 1
1 1022 . 15 1 1 A 89 89 ALA H H 89 7.894 7.530 0.364 1
1 1023 . 15 1 1 A 89 89 ALA HA H 89 4.224 4.395 -0.171 1
1 1027 . 15 1 1 A 89 89 ALA C C 89 178.609 179.169 -0.560 1
1 1028 . 15 1 1 A 89 89 ALA CA C 89 53.392 53.225 0.167 1
1 1029 . 15 1 1 A 89 89 ALA CB C 89 18.695 19.788 -1.093 1
1 1030 . 15 1 1 A 89 89 ALA N N 89 122.387 121.449 0.938 1
1 1031 . 15 1 1 A 90 90 MET H H 90 8.084 7.865 0.219 1
1 1032 . 15 1 1 A 90 90 MET HA H 90 4.356 4.192 0.164 1
1 1040 . 15 1 1 A 90 90 MET C C 90 176.982 176.677 0.305 1
1 1041 . 15 1 1 A 90 90 MET CA C 90 56.551 58.481 -1.930 1
1 1042 . 15 1 1 A 90 90 MET CB C 90 32.719 32.840 -0.121 1
1 1045 . 15 1 1 A 90 90 MET N N 90 118.509 116.236 2.273 1
1 1046 . 15 1 1 A 91 91 ASP H H 91 8.261 7.444 0.817 1
1 1047 . 15 1 1 A 91 91 ASP HA H 91 4.524 4.426 0.098 1
1 1050 . 15 1 1 A 91 91 ASP C C 91 176.643 176.245 0.398 1
1 1051 . 15 1 1 A 91 91 ASP CA C 91 54.981 54.826 0.155 1
1 1052 . 15 1 1 A 91 91 ASP CB C 91 40.870 40.936 -0.066 1
1 1053 . 15 1 1 A 91 91 ASP N N 91 120.771 119.843 0.928 1
1 1054 . 15 1 1 A 92 92 ALA H H 92 7.971 8.224 -0.253 1
1 1055 . 15 1 1 A 92 92 ALA HA H 92 4.200 4.088 0.112 1
1 1059 . 15 1 1 A 92 92 ALA C C 92 177.929 177.223 0.706 1
1 1060 . 15 1 1 A 92 92 ALA CA C 92 53.184 52.020 1.164 1
1 1061 . 15 1 1 A 92 92 ALA CB C 92 18.890 19.326 -0.436 1
1 1062 . 15 1 1 A 92 92 ALA N N 92 123.057 123.783 -0.726 1
1 1063 . 15 1 1 A 93 93 TYR H H 93 8.019 8.815 -0.796 1
1 1064 . 15 1 1 A 93 93 TYR HA H 93 4.523 4.225 0.298 1
1 1071 . 15 1 1 A 93 93 TYR C C 93 176.279 175.301 0.978 1
1 1072 . 15 1 1 A 93 93 TYR CA C 93 58.401 58.795 -0.394 1
1 1073 . 15 1 1 A 93 93 TYR CB C 93 38.669 36.138 2.531 1
1 1078 . 15 1 1 A 93 93 TYR N N 93 118.337 122.309 -3.972 1
1 1079 . 15 1 1 A 94 94 SER H H 94 8.037 7.884 0.153 1
1 1080 . 15 1 1 A 94 94 SER HA H 94 4.484 4.872 -0.388 1
1 1082 . 15 1 1 A 94 94 SER C C 94 174.554 173.754 0.800 1
1 1083 . 15 1 1 A 94 94 SER CA C 94 58.401 56.331 2.070 1
1 1084 . 15 1 1 A 94 94 SER CB C 94 63.806 63.799 0.007 1
1 1085 . 15 1 1 A 94 94 SER N N 94 116.640 116.498 0.142 1
1 1086 . 15 1 1 A 96 96 ASN HA H 96 4.770 4.792 -0.022 1
1 1091 . 15 1 1 A 96 96 ASN C C 96 175.161 174.518 0.643 1
1 1092 . 15 1 1 A 96 96 ASN CA C 96 53.395 52.889 0.506 1
1 1093 . 15 1 1 A 96 96 ASN CB C 96 38.999 39.351 -0.352 1
1 1095 . 15 1 1 A 97 97 SER H H 97 8.230 8.619 -0.389 1
1 1096 . 15 1 1 A 97 97 SER HA H 97 4.481 5.219 -0.738 1
1 1099 . 15 1 1 A 97 97 SER C C 97 174.482 174.242 0.240 1
1 1100 . 15 1 1 A 97 97 SER CA C 97 58.300 56.549 1.751 1
1 1101 . 15 1 1 A 97 97 SER CB C 97 63.697 65.709 -2.012 1
1 1102 . 15 1 1 A 97 97 SER N N 97 115.866 115.809 0.057 1
1 1103 . 15 1 1 A 98 98 GLY H H 98 8.228 8.617 -0.389 1
1 1104 . 15 1 1 A 98 98 GLY HA2 H 98 4.098 4.014 0.084 1
1 1105 . 15 1 1 A 98 98 GLY HA3 H 98 4.098 4.016 0.082 1
1 1106 . 15 1 1 A 98 98 GLY C C 98 171.788 173.229 -1.441 1
1 1107 . 15 1 1 A 98 98 GLY CA C 98 44.803 45.308 -0.505 1
1 1108 . 15 1 1 A 98 98 GLY N N 98 110.658 114.559 -3.901 1
1 1109 . 15 1 1 A 99 99 PRO HA H 99 4.463 4.569 -0.106 1
1 1116 . 15 1 1 A 99 99 PRO CA C 99 63.230 62.864 0.366 1
1 1117 . 15 1 1 A 99 99 PRO CB C 99 32.044 32.636 -0.592 1
1 1120 . 15 1 1 A 100 100 SER H H 100 8.514 8.614 -0.100 1
1 1121 . 15 1 1 A 100 100 SER CA C 100 58.450 56.963 1.487 1
1 1122 . 15 1 1 A 100 100 SER CB C 100 63.889 63.500 0.389 1
1 1 . 16 1 1 A 9 9 ASN H H 9 8.856 8.973 -0.117 1
1 2 . 16 1 1 A 9 9 ASN HA H 9 4.694 4.377 0.317 1
1 7 . 16 1 1 A 9 9 ASN CA C 9 53.401 56.885 -3.484 1
1 8 . 16 1 1 A 9 9 ASN CB C 9 38.757 38.649 0.108 1
1 10 . 16 1 1 A 10 10 ARG HA H 10 4.346 4.963 -0.617 1
1 17 . 16 1 1 A 10 10 ARG C C 10 175.405 175.280 0.125 1
1 18 . 16 1 1 A 10 10 ARG CA C 10 56.181 55.210 0.971 1
1 19 . 16 1 1 A 10 10 ARG CB C 10 31.171 32.649 -1.478 1
1 22 . 16 1 1 A 11 11 PHE H H 11 8.310 8.896 -0.586 1
1 23 . 16 1 1 A 11 11 PHE HA H 11 4.291 4.658 -0.367 1
1 31 . 16 1 1 A 11 11 PHE C C 11 174.458 173.197 1.261 1
1 32 . 16 1 1 A 11 11 PHE CA C 11 58.967 58.308 0.659 1
1 33 . 16 1 1 A 11 11 PHE CB C 11 40.138 41.526 -1.388 1
1 39 . 16 1 1 A 11 11 PHE N N 11 123.604 121.165 2.439 1
1 40 . 16 1 1 A 12 12 LYS H H 12 7.307 8.320 -1.013 1
1 41 . 16 1 1 A 12 12 LYS HA H 12 4.165 4.374 -0.209 1
1 50 . 16 1 1 A 12 12 LYS C C 12 174.385 176.298 -1.913 1
1 51 . 16 1 1 A 12 12 LYS CA C 12 54.593 54.766 -0.173 1
1 52 . 16 1 1 A 12 12 LYS CB C 12 34.712 33.858 0.854 1
1 56 . 16 1 1 A 12 12 LYS N N 12 127.282 128.263 -0.981 1
1 57 . 16 1 1 A 13 13 TRP H H 13 8.039 8.281 -0.242 1
1 58 . 16 1 1 A 13 13 TRP HA H 13 4.370 4.388 -0.018 1
1 67 . 16 1 1 A 13 13 TRP C C 13 177.857 176.415 1.442 1
1 68 . 16 1 1 A 13 13 TRP CA C 13 56.675 57.114 -0.439 1
1 69 . 16 1 1 A 13 13 TRP CB C 13 30.317 30.314 0.003 1
1 75 . 16 1 1 A 13 13 TRP N N 13 124.264 127.057 -2.793 1
1 77 . 16 1 1 A 14 14 GLY H H 14 9.815 9.141 0.674 1
1 78 . 16 1 1 A 14 14 GLY HA2 H 14 4.370 4.255 0.115 1
1 79 . 16 1 1 A 14 14 GLY HA3 H 14 4.335 4.283 0.052 1
1 80 . 16 1 1 A 14 14 GLY C C 14 172.904 174.767 -1.863 1
1 81 . 16 1 1 A 14 14 GLY CA C 14 44.157 43.877 0.280 1
1 82 . 16 1 1 A 14 14 GLY N N 14 115.294 108.518 6.776 1
1 83 . 16 1 1 A 15 15 PRO HA H 15 4.327 4.375 -0.048 1
1 90 . 16 1 1 A 15 15 PRO C C 15 179.726 178.805 0.921 1
1 91 . 16 1 1 A 15 15 PRO CA C 15 65.171 65.278 -0.107 1
1 92 . 16 1 1 A 15 15 PRO CB C 15 31.829 31.841 -0.012 1
1 95 . 16 1 1 A 16 16 ALA H H 16 9.214 8.142 1.072 1
1 96 . 16 1 1 A 16 16 ALA HA H 16 4.166 4.104 0.062 1
1 100 . 16 1 1 A 16 16 ALA C C 16 181.184 179.372 1.812 1
1 101 . 16 1 1 A 16 16 ALA CA C 16 55.370 55.175 0.195 1
1 102 . 16 1 1 A 16 16 ALA CB C 16 18.058 18.573 -0.515 1
1 103 . 16 1 1 A 16 16 ALA N N 16 122.414 119.733 2.681 1
1 104 . 16 1 1 A 17 17 SER H H 17 7.985 8.276 -0.291 1
1 105 . 16 1 1 A 17 17 SER HA H 17 4.317 4.202 0.115 1
1 107 . 16 1 1 A 17 17 SER C C 17 175.381 176.721 -1.340 1
1 108 . 16 1 1 A 17 17 SER CA C 17 63.163 61.553 1.610 1
1 109 . 16 1 1 A 17 17 SER CB C 17 64.055 62.746 1.309 1
1 110 . 16 1 1 A 17 17 SER N N 17 116.568 112.824 3.744 1
1 111 . 16 1 1 A 18 18 GLN H H 18 8.316 7.917 0.399 1
1 112 . 16 1 1 A 18 18 GLN HA H 18 3.323 3.415 -0.092 1
1 119 . 16 1 1 A 18 18 GLN C C 18 176.812 178.612 -1.800 1
1 120 . 16 1 1 A 18 18 GLN CA C 18 60.025 59.203 0.822 1
1 121 . 16 1 1 A 18 18 GLN CB C 18 28.686 28.541 0.145 1
1 123 . 16 1 1 A 18 18 GLN N N 18 119.002 119.981 -0.979 1
1 125 . 16 1 1 A 19 19 GLN H H 19 7.582 8.247 -0.665 1
1 126 . 16 1 1 A 19 19 GLN HA H 19 4.062 4.075 -0.013 1
1 133 . 16 1 1 A 19 19 GLN C C 19 178.488 178.453 0.035 1
1 134 . 16 1 1 A 19 19 GLN CA C 19 59.248 59.197 0.051 1
1 135 . 16 1 1 A 19 19 GLN CB C 19 28.203 28.254 -0.051 1
1 137 . 16 1 1 A 19 19 GLN N N 19 116.221 118.824 -2.603 1
1 139 . 16 1 1 A 20 20 ILE H H 20 7.246 7.982 -0.736 1
1 140 . 16 1 1 A 20 20 ILE HA H 20 3.570 3.608 -0.038 1
1 150 . 16 1 1 A 20 20 ILE C C 20 178.999 178.540 0.459 1
1 151 . 16 1 1 A 20 20 ILE CA C 20 64.996 65.645 -0.649 1
1 152 . 16 1 1 A 20 20 ILE CB C 20 38.139 37.913 0.226 1
1 156 . 16 1 1 A 20 20 ILE N N 20 120.521 120.923 -0.402 1
1 157 . 16 1 1 A 21 21 LEU H H 21 8.034 7.881 0.153 1
1 158 . 16 1 1 A 21 21 LEU HA H 21 3.491 3.561 -0.070 1
1 168 . 16 1 1 A 21 21 LEU C C 21 178.196 178.663 -0.467 1
1 169 . 16 1 1 A 21 21 LEU CA C 21 57.944 57.496 0.448 1
1 170 . 16 1 1 A 21 21 LEU CB C 21 37.864 40.238 -2.374 1
1 174 . 16 1 1 A 21 21 LEU N N 21 121.259 118.874 2.385 1
1 175 . 16 1 1 A 22 22 TYR H H 22 8.479 7.698 0.781 1
1 176 . 16 1 1 A 22 22 TYR HA H 22 4.224 4.345 -0.121 1
1 183 . 16 1 1 A 22 22 TYR C C 22 179.630 178.540 1.090 1
1 184 . 16 1 1 A 22 22 TYR CA C 22 62.422 60.843 1.579 1
1 185 . 16 1 1 A 22 22 TYR CB C 22 37.434 37.729 -0.295 1
1 190 . 16 1 1 A 22 22 TYR N N 22 117.805 118.616 -0.811 1
1 191 . 16 1 1 A 23 23 GLN H H 23 7.707 8.302 -0.595 1
1 192 . 16 1 1 A 23 23 GLN HA H 23 4.166 4.036 0.130 1
1 199 . 16 1 1 A 23 23 GLN C C 23 178.633 178.386 0.247 1
1 200 . 16 1 1 A 23 23 GLN CA C 23 58.789 59.172 -0.383 1
1 201 . 16 1 1 A 23 23 GLN CB C 23 28.534 28.080 0.454 1
1 203 . 16 1 1 A 23 23 GLN N N 23 117.580 118.335 -0.755 1
1 205 . 16 1 1 A 24 24 ALA H H 24 8.155 7.826 0.329 1
1 206 . 16 1 1 A 24 24 ALA HA H 24 4.187 4.180 0.007 1
1 210 . 16 1 1 A 24 24 ALA C C 24 180.018 178.918 1.100 1
1 211 . 16 1 1 A 24 24 ALA CA C 24 55.228 55.213 0.015 1
1 212 . 16 1 1 A 24 24 ALA CB C 24 19.468 19.164 0.304 1
1 213 . 16 1 1 A 24 24 ALA N N 24 122.813 122.526 0.287 1
1 214 . 16 1 1 A 25 25 TYR H H 25 8.995 8.842 0.153 1
1 215 . 16 1 1 A 25 25 TYR HA H 25 4.348 4.685 -0.337 1
1 222 . 16 1 1 A 25 25 TYR C C 25 175.792 177.746 -1.954 1
1 223 . 16 1 1 A 25 25 TYR CA C 25 61.681 62.351 -0.670 1
1 224 . 16 1 1 A 25 25 TYR CB C 25 38.175 38.754 -0.579 1
1 229 . 16 1 1 A 25 25 TYR N N 25 121.343 119.727 1.616 1
1 230 . 16 1 1 A 26 26 ASP H H 26 7.260 8.707 -1.447 1
1 231 . 16 1 1 A 26 26 ASP HA H 26 4.373 4.493 -0.120 1
1 234 . 16 1 1 A 26 26 ASP C C 26 177.322 178.346 -1.024 1
1 235 . 16 1 1 A 26 26 ASP CA C 26 56.603 57.527 -0.924 1
1 236 . 16 1 1 A 26 26 ASP CB C 26 41.060 41.895 -0.835 1
1 237 . 16 1 1 A 26 26 ASP N N 26 114.020 119.231 -5.211 1
1 238 . 16 1 1 A 27 27 ARG H H 27 7.343 7.839 -0.496 1
1 239 . 16 1 1 A 27 27 ARG HA H 27 4.302 4.362 -0.060 1
1 246 . 16 1 1 A 27 27 ARG C C 27 176.546 176.216 0.330 1
1 247 . 16 1 1 A 27 27 ARG CA C 27 57.563 57.847 -0.284 1
1 248 . 16 1 1 A 27 27 ARG CB C 27 31.500 31.338 0.162 1
1 251 . 16 1 1 A 27 27 ARG N N 27 116.729 116.798 -0.069 1
1 252 . 16 1 1 A 28 28 GLN H H 28 8.306 7.888 0.418 1
1 253 . 16 1 1 A 28 28 GLN HA H 28 4.396 4.725 -0.329 1
1 260 . 16 1 1 A 28 28 GLN C C 28 172.831 175.154 -2.323 1
1 261 . 16 1 1 A 28 28 GLN CA C 28 55.355 54.651 0.704 1
1 262 . 16 1 1 A 28 28 GLN CB C 28 31.062 31.700 -0.638 1
1 264 . 16 1 1 A 28 28 GLN N N 28 121.612 117.922 3.690 1
1 266 . 16 1 1 A 29 29 LYS H H 29 8.354 8.517 -0.163 1
1 267 . 16 1 1 A 29 29 LYS HA H 29 4.099 3.485 0.614 1
1 276 . 16 1 1 A 29 29 LYS C C 29 176.084 176.655 -0.571 1
1 277 . 16 1 1 A 29 29 LYS CA C 29 57.873 57.609 0.264 1
1 278 . 16 1 1 A 29 29 LYS CB C 29 33.313 32.631 0.682 1
1 282 . 16 1 1 A 29 29 LYS N N 29 125.038 123.663 1.375 1
1 283 . 16 1 1 A 30 30 ASN H H 30 8.856 8.106 0.750 1
1 284 . 16 1 1 A 30 30 ASN HA H 30 4.958 4.952 0.006 1
1 289 . 16 1 1 A 30 30 ASN C C 30 171.179 173.543 -2.364 1
1 290 . 16 1 1 A 30 30 ASN CA C 30 50.891 50.605 0.286 1
1 291 . 16 1 1 A 30 30 ASN CB C 30 39.907 38.883 1.024 1
1 292 . 16 1 1 A 30 30 ASN N N 30 115.764 114.454 1.310 1
1 294 . 16 1 1 A 31 31 PRO HA H 31 4.299 4.736 -0.437 1
1 301 . 16 1 1 A 31 31 PRO C C 31 177.493 177.049 0.444 1
1 302 . 16 1 1 A 31 31 PRO CA C 31 62.489 62.606 -0.117 1
1 303 . 16 1 1 A 31 31 PRO CB C 31 31.216 32.081 -0.865 1
1 306 . 16 1 1 A 32 32 SER H H 32 9.368 8.451 0.917 1
1 307 . 16 1 1 A 32 32 SER HA H 32 4.372 4.676 -0.304 1
1 310 . 16 1 1 A 32 32 SER C C 32 174.821 175.688 -0.867 1
1 311 . 16 1 1 A 32 32 SER CA C 32 57.203 58.228 -1.025 1
1 312 . 16 1 1 A 32 32 SER CB C 32 65.594 64.135 1.459 1
1 313 . 16 1 1 A 32 32 SER N N 32 120.847 117.926 2.921 1
1 314 . 16 1 1 A 33 33 LYS H H 33 9.152 8.967 0.185 1
1 315 . 16 1 1 A 33 33 LYS HA H 33 3.719 3.903 -0.184 1
1 324 . 16 1 1 A 33 33 LYS C C 33 177.833 178.227 -0.394 1
1 325 . 16 1 1 A 33 33 LYS CA C 33 61.188 60.321 0.867 1
1 326 . 16 1 1 A 33 33 LYS CB C 33 32.572 32.296 0.276 1
1 330 . 16 1 1 A 33 33 LYS N N 33 122.966 124.754 -1.788 1
1 331 . 16 1 1 A 34 34 GLU H H 34 8.902 8.379 0.523 1
1 332 . 16 1 1 A 34 34 GLU HA H 34 4.089 4.062 0.027 1
1 337 . 16 1 1 A 34 34 GLU C C 34 180.286 179.277 1.009 1
1 338 . 16 1 1 A 34 34 GLU CA C 34 60.483 59.255 1.228 1
1 339 . 16 1 1 A 34 34 GLU CB C 34 28.835 29.288 -0.453 1
1 341 . 16 1 1 A 34 34 GLU N N 34 117.645 118.572 -0.927 1
1 342 . 16 1 1 A 35 35 GLU H H 35 7.673 8.200 -0.527 1
1 343 . 16 1 1 A 35 35 GLU HA H 35 4.023 3.964 0.059 1
1 348 . 16 1 1 A 35 35 GLU C C 35 180.237 179.184 1.053 1
1 349 . 16 1 1 A 35 35 GLU CA C 35 59.214 59.415 -0.201 1
1 350 . 16 1 1 A 35 35 GLU CB C 35 30.099 29.340 0.759 1
1 352 . 16 1 1 A 35 35 GLU N N 35 121.077 120.066 1.011 1
1 353 . 16 1 1 A 36 36 ARG H H 36 8.932 8.220 0.712 1
1 354 . 16 1 1 A 36 36 ARG HA H 36 3.928 3.777 0.151 1
1 362 . 16 1 1 A 36 36 ARG C C 36 178.464 179.040 -0.576 1
1 363 . 16 1 1 A 36 36 ARG CA C 36 60.974 60.114 0.860 1
1 364 . 16 1 1 A 36 36 ARG CB C 36 31.171 29.935 1.236 1
1 367 . 16 1 1 A 36 36 ARG N N 36 119.441 120.119 -0.678 1
1 369 . 16 1 1 A 37 37 GLU H H 37 8.756 8.480 0.276 1
1 370 . 16 1 1 A 37 37 GLU HA H 37 3.948 4.099 -0.151 1
1 375 . 16 1 1 A 37 37 GLU C C 37 179.606 179.041 0.565 1
1 376 . 16 1 1 A 37 37 GLU CA C 37 60.094 59.070 1.024 1
1 377 . 16 1 1 A 37 37 GLU CB C 37 29.110 29.316 -0.206 1
1 379 . 16 1 1 A 37 37 GLU N N 37 119.017 119.706 -0.689 1
1 380 . 16 1 1 A 38 38 ALA H H 38 7.733 8.069 -0.336 1
1 381 . 16 1 1 A 38 38 ALA HA H 38 4.325 4.196 0.129 1
1 385 . 16 1 1 A 38 38 ALA C C 38 180.820 178.421 2.399 1
1 386 . 16 1 1 A 38 38 ALA CA C 38 55.194 54.355 0.839 1
1 387 . 16 1 1 A 38 38 ALA CB C 38 17.654 18.506 -0.852 1
1 388 . 16 1 1 A 38 38 ALA N N 38 122.889 121.639 1.250 1
1 389 . 16 1 1 A 39 39 LEU H H 39 7.740 7.926 -0.186 1
1 390 . 16 1 1 A 39 39 LEU HA H 39 4.176 4.255 -0.079 1
1 400 . 16 1 1 A 39 39 LEU C C 39 179.266 178.831 0.435 1
1 401 . 16 1 1 A 39 39 LEU CA C 39 57.944 56.251 1.693 1
1 402 . 16 1 1 A 39 39 LEU CB C 39 42.105 42.257 -0.152 1
1 406 . 16 1 1 A 39 39 LEU N N 39 119.783 116.317 3.466 1
1 407 . 16 1 1 A 40 40 VAL H H 40 8.451 8.149 0.302 1
1 408 . 16 1 1 A 40 40 VAL HA H 40 3.259 3.619 -0.360 1
1 416 . 16 1 1 A 40 40 VAL C C 40 177.153 177.706 -0.553 1
1 417 . 16 1 1 A 40 40 VAL CA C 40 67.254 66.928 0.326 1
1 418 . 16 1 1 A 40 40 VAL CB C 40 31.747 31.471 0.276 1
1 421 . 16 1 1 A 40 40 VAL N N 40 121.481 120.053 1.428 1
1 422 . 16 1 1 A 41 41 GLU H H 41 7.254 8.019 -0.765 1
1 423 . 16 1 1 A 41 41 GLU HA H 41 4.159 4.123 0.036 1
1 428 . 16 1 1 A 41 41 GLU C C 41 179.483 178.906 0.577 1
1 429 . 16 1 1 A 41 41 GLU CA C 41 59.248 59.415 -0.167 1
1 430 . 16 1 1 A 41 41 GLU CB C 41 29.358 29.326 0.032 1
1 432 . 16 1 1 A 41 41 GLU N N 41 116.549 119.813 -3.264 1
1 433 . 16 1 1 A 42 42 GLU H H 42 8.103 7.743 0.360 1
1 434 . 16 1 1 A 42 42 GLU HA H 42 4.020 4.054 -0.034 1
1 439 . 16 1 1 A 42 42 GLU C C 42 180.115 178.773 1.342 1
1 440 . 16 1 1 A 42 42 GLU CA C 42 59.847 59.526 0.321 1
1 441 . 16 1 1 A 42 42 GLU CB C 42 30.218 29.267 0.951 1
1 443 . 16 1 1 A 42 42 GLU N N 42 119.578 119.351 0.227 1
1 444 . 16 1 1 A 43 43 CYS H H 43 8.955 8.067 0.888 1
1 445 . 16 1 1 A 43 43 CYS HA H 43 4.153 4.223 -0.070 1
1 448 . 16 1 1 A 43 43 CYS C C 43 176.498 177.603 -1.105 1
1 449 . 16 1 1 A 43 43 CYS CA C 43 64.856 62.463 2.393 1
1 450 . 16 1 1 A 43 43 CYS CB C 43 27.390 27.730 -0.340 1
1 451 . 16 1 1 A 43 43 CYS N N 43 118.199 118.781 -0.582 1
1 452 . 16 1 1 A 44 44 ASN H H 44 8.543 7.946 0.597 1
1 453 . 16 1 1 A 44 44 ASN HA H 44 4.635 4.419 0.216 1
1 458 . 16 1 1 A 44 44 ASN C C 44 178.633 177.600 1.033 1
1 459 . 16 1 1 A 44 44 ASN CA C 44 56.603 56.325 0.278 1
1 460 . 16 1 1 A 44 44 ASN CB C 44 37.187 38.094 -0.907 1
1 461 . 16 1 1 A 44 44 ASN N N 44 117.002 119.609 -2.607 1
1 463 . 16 1 1 A 45 45 ARG H H 45 8.296 8.266 0.030 1
1 464 . 16 1 1 A 45 45 ARG HA H 45 3.977 4.030 -0.053 1
1 471 . 16 1 1 A 45 45 ARG C C 45 178.149 178.293 -0.144 1
1 472 . 16 1 1 A 45 45 ARG CA C 45 60.589 59.636 0.953 1
1 473 . 16 1 1 A 45 45 ARG CB C 45 30.099 30.149 -0.050 1
1 476 . 16 1 1 A 45 45 ARG N N 45 121.021 121.136 -0.115 1
1 477 . 16 1 1 A 46 46 ALA H H 46 7.914 8.251 -0.337 1
1 478 . 16 1 1 A 46 46 ALA HA H 46 4.128 4.121 0.007 1
1 482 . 16 1 1 A 46 46 ALA C C 46 181.208 180.202 1.006 1
1 483 . 16 1 1 A 46 46 ALA CA C 46 55.264 54.928 0.336 1
1 484 . 16 1 1 A 46 46 ALA CB C 46 18.759 18.354 0.405 1
1 485 . 16 1 1 A 46 46 ALA N N 46 121.570 120.721 0.849 1
1 486 . 16 1 1 A 47 47 GLU H H 47 8.730 8.596 0.134 1
1 487 . 16 1 1 A 47 47 GLU HA H 47 4.194 4.051 0.143 1
1 492 . 16 1 1 A 47 47 GLU C C 47 180.115 179.193 0.922 1
1 493 . 16 1 1 A 47 47 GLU CA C 47 58.401 59.662 -1.261 1
1 494 . 16 1 1 A 47 47 GLU CB C 47 29.523 29.265 0.258 1
1 496 . 16 1 1 A 47 47 GLU N N 47 117.532 118.223 -0.691 1
1 497 . 16 1 1 A 48 48 CYS H H 48 8.283 7.864 0.419 1
1 498 . 16 1 1 A 48 48 CYS HA H 48 4.002 4.143 -0.141 1
1 501 . 16 1 1 A 48 48 CYS C C 48 177.031 177.444 -0.413 1
1 502 . 16 1 1 A 48 48 CYS CA C 48 64.749 63.857 0.892 1
1 503 . 16 1 1 A 48 48 CYS CB C 48 25.907 27.212 -1.305 1
1 504 . 16 1 1 A 48 48 CYS N N 48 118.282 119.173 -0.891 1
1 505 . 16 1 1 A 49 49 LEU H H 49 8.181 8.115 0.066 1
1 506 . 16 1 1 A 49 49 LEU HA H 49 4.175 3.940 0.235 1
1 516 . 16 1 1 A 49 49 LEU C C 49 180.430 178.781 1.649 1
1 517 . 16 1 1 A 49 49 LEU CA C 49 57.873 58.176 -0.303 1
1 518 . 16 1 1 A 49 49 LEU CB C 49 41.539 41.688 -0.149 1
1 522 . 16 1 1 A 49 49 LEU N N 49 120.371 120.735 -0.364 1
1 523 . 16 1 1 A 50 50 GLN H H 50 7.934 8.591 -0.657 1
1 524 . 16 1 1 A 50 50 GLN HA H 50 4.102 4.081 0.021 1
1 531 . 16 1 1 A 50 50 GLN C C 50 177.322 177.212 0.110 1
1 532 . 16 1 1 A 50 50 GLN CA C 50 58.156 58.651 -0.495 1
1 533 . 16 1 1 A 50 50 GLN CB C 50 28.616 28.580 0.036 1
1 535 . 16 1 1 A 50 50 GLN N N 50 118.175 117.394 0.781 1
1 537 . 16 1 1 A 51 51 ARG H H 51 7.632 7.691 -0.059 1
1 538 . 16 1 1 A 51 51 ARG HA H 51 4.347 4.363 -0.016 1
1 545 . 16 1 1 A 51 51 ARG C C 51 176.546 176.434 0.112 1
1 546 . 16 1 1 A 51 51 ARG CA C 51 56.286 55.992 0.294 1
1 547 . 16 1 1 A 51 51 ARG CB C 51 31.314 30.282 1.032 1
1 550 . 16 1 1 A 51 51 ARG N N 51 116.454 117.779 -1.325 1
1 551 . 16 1 1 A 52 52 GLY H H 52 7.949 8.466 -0.517 1
1 552 . 16 1 1 A 52 52 GLY HA2 H 52 4.033 3.975 0.058 1
1 553 . 16 1 1 A 52 52 GLY HA3 H 52 3.903 3.976 -0.073 1
1 554 . 16 1 1 A 52 52 GLY C C 52 174.385 174.306 0.079 1
1 555 . 16 1 1 A 52 52 GLY CA C 52 46.231 45.265 0.966 1
1 556 . 16 1 1 A 52 52 GLY N N 52 108.854 107.608 1.246 1
1 557 . 16 1 1 A 53 53 VAL H H 53 7.944 7.509 0.435 1
1 558 . 16 1 1 A 53 53 VAL HA H 53 4.250 4.051 0.199 1
1 566 . 16 1 1 A 53 53 VAL C C 53 175.525 175.143 0.382 1
1 567 . 16 1 1 A 53 53 VAL CA C 53 60.377 62.520 -2.143 1
1 568 . 16 1 1 A 53 53 VAL CB C 53 34.283 32.846 1.437 1
1 571 . 16 1 1 A 53 53 VAL N N 53 118.316 120.707 -2.391 1
1 572 . 16 1 1 A 54 54 SER H H 54 8.502 8.502 0.000 1
1 573 . 16 1 1 A 54 54 SER HA H 54 4.625 4.897 -0.272 1
1 576 . 16 1 1 A 54 54 SER C C 54 174.603 174.059 0.544 1
1 577 . 16 1 1 A 54 54 SER CA C 54 56.092 54.224 1.868 1
1 578 . 16 1 1 A 54 54 SER CB C 54 63.697 63.824 -0.127 1
1 579 . 16 1 1 A 54 54 SER N N 54 120.337 118.474 1.863 1
1 580 . 16 1 1 A 55 55 PRO HA H 55 4.624 4.516 0.108 1
1 587 . 16 1 1 A 55 55 PRO C C 55 177.322 177.619 -0.297 1
1 588 . 16 1 1 A 55 55 PRO CA C 55 64.431 64.136 0.295 1
1 589 . 16 1 1 A 55 55 PRO CB C 55 31.913 31.634 0.279 1
1 592 . 16 1 1 A 56 56 SER H H 56 7.931 8.304 -0.373 1
1 593 . 16 1 1 A 56 56 SER HA H 56 4.428 4.587 -0.159 1
1 596 . 16 1 1 A 56 56 SER C C 56 174.749 175.520 -0.771 1
1 597 . 16 1 1 A 56 56 SER CA C 56 59.130 59.707 -0.577 1
1 598 . 16 1 1 A 56 56 SER CB C 56 63.056 64.008 -0.952 1
1 599 . 16 1 1 A 56 56 SER N N 56 112.637 113.251 -0.614 1
1 600 . 16 1 1 A 57 57 LYS H H 57 8.121 7.415 0.706 1
1 601 . 16 1 1 A 57 57 LYS HA H 57 4.467 5.044 -0.577 1
1 609 . 16 1 1 A 57 57 LYS C C 57 176.570 176.106 0.464 1
1 610 . 16 1 1 A 57 57 LYS CA C 57 55.264 55.178 0.086 1
1 611 . 16 1 1 A 57 57 LYS CB C 57 32.160 32.541 -0.381 1
1 615 . 16 1 1 A 57 57 LYS N N 57 123.185 118.673 4.512 1
1 616 . 16 1 1 A 58 58 ALA H H 58 7.886 7.989 -0.103 1
1 617 . 16 1 1 A 58 58 ALA HA H 58 3.923 3.858 0.065 1
1 621 . 16 1 1 A 58 58 ALA C C 58 177.469 179.767 -2.298 1
1 622 . 16 1 1 A 58 58 ALA CA C 58 54.276 54.866 -0.590 1
1 623 . 16 1 1 A 58 58 ALA CB C 58 18.271 18.470 -0.199 1
1 624 . 16 1 1 A 58 58 ALA N N 58 123.941 122.698 1.243 1
1 625 . 16 1 1 A 59 59 HIS H H 59 8.077 8.207 -0.130 1
1 626 . 16 1 1 A 59 59 HIS HA H 59 4.420 4.372 0.048 1
1 631 . 16 1 1 A 59 59 HIS C C 59 177.542 177.496 0.046 1
1 632 . 16 1 1 A 59 59 HIS CA C 59 57.767 58.758 -0.991 1
1 633 . 16 1 1 A 59 59 HIS CB C 59 29.852 28.514 1.338 1
1 636 . 16 1 1 A 59 59 HIS N N 59 115.566 115.478 0.088 1
1 637 . 16 1 1 A 60 60 GLY H H 60 8.110 7.712 0.398 1
1 638 . 16 1 1 A 60 60 GLY HA2 H 60 3.873 3.363 0.510 1
1 639 . 16 1 1 A 60 60 GLY HA3 H 60 4.025 3.479 0.546 1
1 640 . 16 1 1 A 60 60 GLY C C 60 174.918 176.082 -1.164 1
1 641 . 16 1 1 A 60 60 GLY CA C 60 45.559 46.972 -1.413 1
1 642 . 16 1 1 A 60 60 GLY N N 60 109.216 110.579 -1.363 1
1 643 . 16 1 1 A 61 61 LEU H H 61 8.280 8.398 -0.118 1
1 644 . 16 1 1 A 61 61 LEU HA H 61 4.198 3.922 0.276 1
1 654 . 16 1 1 A 61 61 LEU C C 61 178.900 177.560 1.340 1
1 655 . 16 1 1 A 61 61 LEU CA C 61 55.758 58.046 -2.288 1
1 656 . 16 1 1 A 61 61 LEU CB C 61 42.544 41.694 0.850 1
1 660 . 16 1 1 A 61 61 LEU N N 61 120.521 123.031 -2.510 1
1 661 . 16 1 1 A 62 62 GLY H H 62 8.184 7.674 0.510 1
1 662 . 16 1 1 A 62 62 GLY HA2 H 62 3.978 3.811 0.167 1
1 663 . 16 1 1 A 62 62 GLY HA3 H 62 3.817 3.816 0.001 1
1 664 . 16 1 1 A 62 62 GLY C C 62 176.012 175.291 0.721 1
1 665 . 16 1 1 A 62 62 GLY CA C 62 46.767 47.334 -0.567 1
1 666 . 16 1 1 A 62 62 GLY N N 62 108.987 108.341 0.646 1
1 667 . 16 1 1 A 63 63 SER HA H 63 4.322 4.219 0.103 1
1 670 . 16 1 1 A 63 63 SER C C 63 174.167 175.115 -0.948 1
1 671 . 16 1 1 A 63 63 SER CA C 63 59.919 62.056 -2.137 1
1 672 . 16 1 1 A 63 63 SER CB C 63 63.312 63.029 0.283 1
1 673 . 16 1 1 A 64 64 ASN H H 64 8.087 8.252 -0.165 1
1 674 . 16 1 1 A 64 64 ASN HA H 64 4.850 5.138 -0.288 1
1 679 . 16 1 1 A 64 64 ASN C C 64 173.899 174.929 -1.030 1
1 680 . 16 1 1 A 64 64 ASN CA C 64 53.218 53.339 -0.121 1
1 681 . 16 1 1 A 64 64 ASN CB C 64 39.164 39.023 0.141 1
1 682 . 16 1 1 A 64 64 ASN N N 64 118.041 116.411 1.630 1
1 684 . 16 1 1 A 65 65 LEU H H 65 7.293 7.362 -0.069 1
1 685 . 16 1 1 A 65 65 LEU HA H 65 3.995 4.546 -0.551 1
1 695 . 16 1 1 A 65 65 LEU C C 65 175.696 174.962 0.734 1
1 696 . 16 1 1 A 65 65 LEU CA C 65 56.005 54.492 1.513 1
1 697 . 16 1 1 A 65 65 LEU CB C 65 43.120 43.700 -0.580 1
1 701 . 16 1 1 A 65 65 LEU N N 65 120.953 122.847 -1.894 1
1 702 . 16 1 1 A 66 66 VAL H H 66 9.517 8.901 0.616 1
1 703 . 16 1 1 A 66 66 VAL HA H 66 3.481 4.331 -0.850 1
1 711 . 16 1 1 A 66 66 VAL C C 66 175.429 174.847 0.582 1
1 712 . 16 1 1 A 66 66 VAL CA C 66 65.243 61.305 3.938 1
1 713 . 16 1 1 A 66 66 VAL CB C 66 31.335 33.286 -1.951 1
1 716 . 16 1 1 A 66 66 VAL N N 66 127.924 126.497 1.427 1
1 717 . 16 1 1 A 67 67 THR H H 67 6.253 8.395 -2.142 1
1 718 . 16 1 1 A 67 67 THR HA H 67 4.779 4.694 0.085 1
1 723 . 16 1 1 A 67 67 THR C C 67 174.894 174.710 0.184 1
1 724 . 16 1 1 A 67 67 THR CA C 67 58.719 59.768 -1.049 1
1 725 . 16 1 1 A 67 67 THR CB C 67 72.153 71.222 0.931 1
1 727 . 16 1 1 A 67 67 THR N N 67 113.376 115.944 -2.568 1
1 728 . 16 1 1 A 68 68 GLU H H 68 9.348 8.863 0.485 1
1 729 . 16 1 1 A 68 68 GLU HA H 68 3.634 4.004 -0.370 1
1 734 . 16 1 1 A 68 68 GLU C C 68 177.809 178.338 -0.529 1
1 735 . 16 1 1 A 68 68 GLU CA C 68 61.505 60.133 1.372 1
1 736 . 16 1 1 A 68 68 GLU CB C 68 28.285 29.609 -1.324 1
1 738 . 16 1 1 A 68 68 GLU N N 68 124.534 121.990 2.544 1
1 739 . 16 1 1 A 69 69 VAL H H 69 8.126 8.040 0.086 1
1 740 . 16 1 1 A 69 69 VAL HA H 69 3.862 3.548 0.314 1
1 748 . 16 1 1 A 69 69 VAL C C 69 177.712 178.122 -0.410 1
1 749 . 16 1 1 A 69 69 VAL CA C 69 65.701 66.960 -1.259 1
1 750 . 16 1 1 A 69 69 VAL CB C 69 31.829 31.517 0.312 1
1 753 . 16 1 1 A 69 69 VAL N N 69 119.139 119.849 -0.710 1
1 754 . 16 1 1 A 70 70 ARG H H 70 7.235 7.863 -0.628 1
1 755 . 16 1 1 A 70 70 ARG HA H 70 4.265 4.040 0.225 1
1 762 . 16 1 1 A 70 70 ARG C C 70 180.430 179.556 0.874 1
1 763 . 16 1 1 A 70 70 ARG CA C 70 59.742 60.202 -0.460 1
1 764 . 16 1 1 A 70 70 ARG CB C 70 29.439 29.990 -0.551 1
1 767 . 16 1 1 A 70 70 ARG N N 70 119.541 119.386 0.155 1
1 768 . 16 1 1 A 71 71 VAL H H 71 8.144 8.139 0.005 1
1 769 . 16 1 1 A 71 71 VAL HA H 71 4.018 3.955 0.063 1
1 777 . 16 1 1 A 71 71 VAL C C 71 177.493 178.424 -0.931 1
1 778 . 16 1 1 A 71 71 VAL CA C 71 67.924 66.838 1.086 1
1 779 . 16 1 1 A 71 71 VAL CB C 71 32.289 31.735 0.554 1
1 782 . 16 1 1 A 71 71 VAL N N 71 120.755 120.418 0.337 1
1 783 . 16 1 1 A 72 72 TYR H H 72 9.411 8.656 0.755 1
1 784 . 16 1 1 A 72 72 TYR HA H 72 3.908 4.124 -0.216 1
1 791 . 16 1 1 A 72 72 TYR C C 72 178.464 177.186 1.278 1
1 792 . 16 1 1 A 72 72 TYR CA C 72 63.444 62.331 1.113 1
1 793 . 16 1 1 A 72 72 TYR CB C 72 38.211 38.602 -0.391 1
1 798 . 16 1 1 A 72 72 TYR N N 72 121.175 120.885 0.290 1
1 799 . 16 1 1 A 73 73 ASN H H 73 8.816 8.857 -0.041 1
1 800 . 16 1 1 A 73 73 ASN HA H 73 4.538 4.476 0.062 1
1 805 . 16 1 1 A 73 73 ASN C C 73 176.958 178.039 -1.081 1
1 806 . 16 1 1 A 73 73 ASN CA C 73 56.109 56.688 -0.579 1
1 807 . 16 1 1 A 73 73 ASN CB C 73 38.422 38.597 -0.175 1
1 808 . 16 1 1 A 73 73 ASN N N 73 118.122 117.358 0.764 1
1 810 . 16 1 1 A 74 74 TRP H H 74 8.657 8.449 0.208 1
1 811 . 16 1 1 A 74 74 TRP HA H 74 4.111 4.465 -0.354 1
1 820 . 16 1 1 A 74 74 TRP C C 74 179.654 178.591 1.063 1
1 821 . 16 1 1 A 74 74 TRP CA C 74 62.950 61.234 1.716 1
1 822 . 16 1 1 A 74 74 TRP CB C 74 29.555 29.538 0.017 1
1 828 . 16 1 1 A 74 74 TRP N N 74 123.988 123.093 0.895 1
1 830 . 16 1 1 A 75 75 PHE H H 75 8.562 8.500 0.062 1
1 831 . 16 1 1 A 75 75 PHE HA H 75 3.821 4.358 -0.537 1
1 839 . 16 1 1 A 75 75 PHE C C 75 177.614 178.155 -0.541 1
1 840 . 16 1 1 A 75 75 PHE CA C 75 63.374 61.845 1.529 1
1 841 . 16 1 1 A 75 75 PHE CB C 75 39.648 38.075 1.573 1
1 847 . 16 1 1 A 75 75 PHE N N 75 118.325 117.946 0.379 1
1 848 . 16 1 1 A 76 76 ALA H H 76 8.305 8.090 0.215 1
1 849 . 16 1 1 A 76 76 ALA HA H 76 3.909 4.018 -0.109 1
1 853 . 16 1 1 A 76 76 ALA C C 76 180.868 179.524 1.344 1
1 854 . 16 1 1 A 76 76 ALA CA C 76 55.566 55.211 0.355 1
1 855 . 16 1 1 A 76 76 ALA CB C 76 17.820 18.018 -0.198 1
1 856 . 16 1 1 A 76 76 ALA N N 76 121.119 121.740 -0.621 1
1 857 . 16 1 1 A 77 77 ASN H H 77 8.335 8.117 0.218 1
1 858 . 16 1 1 A 77 77 ASN HA H 77 4.355 4.414 -0.059 1
1 863 . 16 1 1 A 77 77 ASN C C 77 177.105 177.101 0.004 1
1 864 . 16 1 1 A 77 77 ASN CA C 77 56.145 56.227 -0.082 1
1 865 . 16 1 1 A 77 77 ASN CB C 77 38.063 39.307 -1.244 1
1 866 . 16 1 1 A 77 77 ASN N N 77 117.433 116.850 0.583 1
1 868 . 16 1 1 A 78 78 ARG H H 78 7.664 7.582 0.082 1
1 869 . 16 1 1 A 78 78 ARG HA H 78 3.629 4.008 -0.379 1
1 876 . 16 1 1 A 78 78 ARG C C 78 179.216 178.719 0.497 1
1 877 . 16 1 1 A 78 78 ARG CA C 78 58.773 59.162 -0.389 1
1 878 . 16 1 1 A 78 78 ARG CB C 78 29.605 29.264 0.341 1
1 881 . 16 1 1 A 78 78 ARG N N 78 121.999 117.918 4.081 1
1 882 . 16 1 1 A 79 79 ARG H H 79 8.320 7.625 0.695 1
1 883 . 16 1 1 A 79 79 ARG HA H 79 4.307 4.168 0.139 1
1 890 . 16 1 1 A 79 79 ARG C C 79 180.406 178.709 1.697 1
1 891 . 16 1 1 A 79 79 ARG CA C 79 60.270 58.675 1.595 1
1 892 . 16 1 1 A 79 79 ARG CB C 79 31.335 30.415 0.920 1
1 895 . 16 1 1 A 79 79 ARG N N 79 118.139 118.644 -0.505 1
1 896 . 16 1 1 A 80 80 LYS H H 80 7.759 7.758 0.001 1
1 897 . 16 1 1 A 80 80 LYS HA H 80 4.052 4.157 -0.105 1
1 905 . 16 1 1 A 80 80 LYS C C 80 178.999 179.187 -0.188 1
1 906 . 16 1 1 A 80 80 LYS CA C 80 59.531 59.594 -0.063 1
1 907 . 16 1 1 A 80 80 LYS CB C 80 32.374 32.168 0.206 1
1 911 . 16 1 1 A 80 80 LYS N N 80 120.899 119.567 1.332 1
1 912 . 16 1 1 A 81 81 GLU H H 81 8.041 8.678 -0.637 1
1 913 . 16 1 1 A 81 81 GLU HA H 81 4.044 4.138 -0.094 1
1 918 . 16 1 1 A 81 81 GLU C C 81 179.168 178.381 0.787 1
1 919 . 16 1 1 A 81 81 GLU CA C 81 59.036 59.523 -0.487 1
1 920 . 16 1 1 A 81 81 GLU CB C 81 29.561 29.204 0.357 1
1 922 . 16 1 1 A 81 81 GLU N N 81 120.193 118.555 1.638 1
1 923 . 16 1 1 A 82 82 GLU H H 82 8.131 8.061 0.070 1
1 924 . 16 1 1 A 82 82 GLU HA H 82 4.017 4.075 -0.058 1
1 929 . 16 1 1 A 82 82 GLU C C 82 178.343 178.226 0.117 1
1 930 . 16 1 1 A 82 82 GLU CA C 82 59.319 59.139 0.180 1
1 931 . 16 1 1 A 82 82 GLU CB C 82 29.770 29.118 0.652 1
1 933 . 16 1 1 A 82 82 GLU N N 82 119.626 118.454 1.172 1
1 934 . 16 1 1 A 83 83 ALA H H 83 7.935 7.744 0.191 1
1 935 . 16 1 1 A 83 83 ALA HA H 83 4.180 4.231 -0.051 1
1 939 . 16 1 1 A 83 83 ALA C C 83 179.994 179.425 0.569 1
1 940 . 16 1 1 A 83 83 ALA CA C 83 54.629 53.749 0.880 1
1 941 . 16 1 1 A 83 83 ALA CB C 83 18.090 19.002 -0.912 1
1 942 . 16 1 1 A 83 83 ALA N N 83 121.476 121.772 -0.296 1
1 943 . 16 1 1 A 84 84 PHE H H 84 8.043 8.147 -0.104 1
1 944 . 16 1 1 A 84 84 PHE HA H 84 4.420 4.014 0.406 1
1 952 . 16 1 1 A 84 84 PHE C C 84 177.250 177.064 0.186 1
1 953 . 16 1 1 A 84 84 PHE CA C 84 60.059 61.672 -1.613 1
1 954 . 16 1 1 A 84 84 PHE CB C 84 38.952 39.465 -0.513 1
1 960 . 16 1 1 A 84 84 PHE N N 84 119.074 120.430 -1.356 1
1 961 . 16 1 1 A 85 85 ARG H H 85 8.031 7.884 0.147 1
1 962 . 16 1 1 A 85 85 ARG HA H 85 3.992 4.108 -0.116 1
1 968 . 16 1 1 A 85 85 ARG C C 85 178.319 178.555 -0.236 1
1 969 . 16 1 1 A 85 85 ARG CA C 85 58.523 59.574 -1.051 1
1 970 . 16 1 1 A 85 85 ARG CB C 85 30.346 29.957 0.389 1
1 973 . 16 1 1 A 85 85 ARG N N 85 119.291 117.630 1.661 1
1 974 . 16 1 1 A 86 86 GLN H H 86 8.091 7.831 0.260 1
1 975 . 16 1 1 A 86 86 GLN HA H 86 4.148 4.239 -0.091 1
1 982 . 16 1 1 A 86 86 GLN C C 86 177.105 178.353 -1.248 1
1 983 . 16 1 1 A 86 86 GLN CA C 86 57.556 57.943 -0.387 1
1 984 . 16 1 1 A 86 86 GLN CB C 86 28.855 29.338 -0.483 1
1 986 . 16 1 1 A 86 86 GLN N N 86 119.097 117.611 1.486 1
1 988 . 16 1 1 A 87 87 LYS H H 87 7.898 8.404 -0.506 1
1 989 . 16 1 1 A 87 87 LYS HA H 87 4.116 4.059 0.057 1
1 997 . 16 1 1 A 87 87 LYS C C 87 177.542 178.866 -1.324 1
1 998 . 16 1 1 A 87 87 LYS CA C 87 57.944 58.986 -1.042 1
1 999 . 16 1 1 A 87 87 LYS CB C 87 32.242 31.924 0.318 1
1 1003 . 16 1 1 A 87 87 LYS N N 87 120.968 122.281 -1.313 1
1 1004 . 16 1 1 A 88 88 LEU H H 88 7.903 8.038 -0.135 1
1 1005 . 16 1 1 A 88 88 LEU HA H 88 4.144 4.235 -0.091 1
1 1015 . 16 1 1 A 88 88 LEU C C 88 178.221 177.571 0.650 1
1 1016 . 16 1 1 A 88 88 LEU CA C 88 56.145 56.510 -0.365 1
1 1017 . 16 1 1 A 88 88 LEU CB C 88 42.215 41.100 1.115 1
1 1021 . 16 1 1 A 88 88 LEU N N 88 120.558 117.226 3.332 1
1 1022 . 16 1 1 A 89 89 ALA H H 89 7.894 7.600 0.294 1
1 1023 . 16 1 1 A 89 89 ALA HA H 89 4.224 4.383 -0.159 1
1 1027 . 16 1 1 A 89 89 ALA C C 89 178.609 179.130 -0.521 1
1 1028 . 16 1 1 A 89 89 ALA CA C 89 53.392 53.601 -0.209 1
1 1029 . 16 1 1 A 89 89 ALA CB C 89 18.695 19.524 -0.829 1
1 1030 . 16 1 1 A 89 89 ALA N N 89 122.387 122.304 0.083 1
1 1031 . 16 1 1 A 90 90 MET H H 90 8.084 8.108 -0.024 1
1 1032 . 16 1 1 A 90 90 MET HA H 90 4.356 4.145 0.211 1
1 1040 . 16 1 1 A 90 90 MET C C 90 176.982 176.835 0.147 1
1 1041 . 16 1 1 A 90 90 MET CA C 90 56.551 58.230 -1.679 1
1 1042 . 16 1 1 A 90 90 MET CB C 90 32.719 32.010 0.709 1
1 1045 . 16 1 1 A 90 90 MET N N 90 118.509 116.393 2.116 1
1 1046 . 16 1 1 A 91 91 ASP H H 91 8.261 7.839 0.422 1
1 1047 . 16 1 1 A 91 91 ASP HA H 91 4.524 4.638 -0.114 1
1 1050 . 16 1 1 A 91 91 ASP C C 91 176.643 176.048 0.595 1
1 1051 . 16 1 1 A 91 91 ASP CA C 91 54.981 54.511 0.470 1
1 1052 . 16 1 1 A 91 91 ASP CB C 91 40.870 41.637 -0.767 1
1 1053 . 16 1 1 A 91 91 ASP N N 91 120.771 119.660 1.111 1
1 1054 . 16 1 1 A 92 92 ALA H H 92 7.971 8.247 -0.276 1
1 1055 . 16 1 1 A 92 92 ALA HA H 92 4.200 4.183 0.017 1
1 1059 . 16 1 1 A 92 92 ALA C C 92 177.929 177.007 0.922 1
1 1060 . 16 1 1 A 92 92 ALA CA C 92 53.184 52.962 0.222 1
1 1061 . 16 1 1 A 92 92 ALA CB C 92 18.890 19.214 -0.324 1
1 1062 . 16 1 1 A 92 92 ALA N N 92 123.057 123.368 -0.311 1
1 1063 . 16 1 1 A 93 93 TYR H H 93 8.019 8.699 -0.680 1
1 1064 . 16 1 1 A 93 93 TYR HA H 93 4.523 4.677 -0.154 1
1 1071 . 16 1 1 A 93 93 TYR C C 93 176.279 175.738 0.541 1
1 1072 . 16 1 1 A 93 93 TYR CA C 93 58.401 57.782 0.619 1
1 1073 . 16 1 1 A 93 93 TYR CB C 93 38.669 39.514 -0.845 1
1 1078 . 16 1 1 A 93 93 TYR N N 93 118.337 122.712 -4.375 1
1 1079 . 16 1 1 A 94 94 SER H H 94 8.037 9.118 -1.081 1
1 1080 . 16 1 1 A 94 94 SER HA H 94 4.484 4.278 0.206 1
1 1082 . 16 1 1 A 94 94 SER C C 94 174.554 174.764 -0.210 1
1 1083 . 16 1 1 A 94 94 SER CA C 94 58.401 59.050 -0.649 1
1 1084 . 16 1 1 A 94 94 SER CB C 94 63.806 62.543 1.263 1
1 1085 . 16 1 1 A 94 94 SER N N 94 116.640 116.362 0.278 1
1 1086 . 16 1 1 A 96 96 ASN HA H 96 4.770 5.168 -0.398 1
1 1091 . 16 1 1 A 96 96 ASN C C 96 175.161 175.892 -0.731 1
1 1092 . 16 1 1 A 96 96 ASN CA C 96 53.395 51.999 1.396 1
1 1093 . 16 1 1 A 96 96 ASN CB C 96 38.999 41.520 -2.521 1
1 1095 . 16 1 1 A 97 97 SER H H 97 8.230 8.890 -0.660 1
1 1096 . 16 1 1 A 97 97 SER HA H 97 4.481 4.142 0.339 1
1 1099 . 16 1 1 A 97 97 SER C C 97 174.482 174.646 -0.164 1
1 1100 . 16 1 1 A 97 97 SER CA C 97 58.300 60.758 -2.458 1
1 1101 . 16 1 1 A 97 97 SER CB C 97 63.697 63.763 -0.066 1
1 1102 . 16 1 1 A 97 97 SER N N 97 115.866 117.053 -1.187 1
1 1103 . 16 1 1 A 98 98 GLY H H 98 8.228 7.798 0.430 1
1 1104 . 16 1 1 A 98 98 GLY HA2 H 98 4.098 4.086 0.012 1
1 1105 . 16 1 1 A 98 98 GLY HA3 H 98 4.098 4.089 0.009 1
1 1106 . 16 1 1 A 98 98 GLY C C 98 171.788 173.116 -1.328 1
1 1107 . 16 1 1 A 98 98 GLY CA C 98 44.803 44.778 0.025 1
1 1108 . 16 1 1 A 98 98 GLY N N 98 110.658 107.562 3.096 1
1 1109 . 16 1 1 A 99 99 PRO HA H 99 4.463 4.674 -0.211 1
1 1116 . 16 1 1 A 99 99 PRO CA C 99 63.230 62.714 0.516 1
1 1117 . 16 1 1 A 99 99 PRO CB C 99 32.044 32.326 -0.282 1
1 1120 . 16 1 1 A 100 100 SER H H 100 8.514 8.504 0.010 1
1 1121 . 16 1 1 A 100 100 SER CA C 100 58.450 57.312 1.138 1
1 1122 . 16 1 1 A 100 100 SER CB C 100 63.889 66.570 -2.681 1
1 1 . 17 1 1 A 9 9 ASN H H 9 8.856 9.013 -0.157 1
1 2 . 17 1 1 A 9 9 ASN HA H 9 4.694 4.879 -0.185 1
1 7 . 17 1 1 A 9 9 ASN CA C 9 53.401 54.829 -1.428 1
1 8 . 17 1 1 A 9 9 ASN CB C 9 38.757 40.337 -1.580 1
1 10 . 17 1 1 A 10 10 ARG HA H 10 4.346 4.172 0.174 1
1 17 . 17 1 1 A 10 10 ARG C C 10 175.405 176.397 -0.992 1
1 18 . 17 1 1 A 10 10 ARG CA C 10 56.181 59.066 -2.885 1
1 19 . 17 1 1 A 10 10 ARG CB C 10 31.171 30.398 0.773 1
1 22 . 17 1 1 A 11 11 PHE H H 11 8.310 7.799 0.511 1
1 23 . 17 1 1 A 11 11 PHE HA H 11 4.291 4.796 -0.505 1
1 31 . 17 1 1 A 11 11 PHE C C 11 174.458 172.020 2.438 1
1 32 . 17 1 1 A 11 11 PHE CA C 11 58.967 56.517 2.450 1
1 33 . 17 1 1 A 11 11 PHE CB C 11 40.138 40.120 0.018 1
1 39 . 17 1 1 A 11 11 PHE N N 11 123.604 113.964 9.640 1
1 40 . 17 1 1 A 12 12 LYS H H 12 7.307 8.524 -1.217 1
1 41 . 17 1 1 A 12 12 LYS HA H 12 4.165 4.532 -0.367 1
1 50 . 17 1 1 A 12 12 LYS C C 12 174.385 175.828 -1.443 1
1 51 . 17 1 1 A 12 12 LYS CA C 12 54.593 54.081 0.512 1
1 52 . 17 1 1 A 12 12 LYS CB C 12 34.712 34.977 -0.265 1
1 56 . 17 1 1 A 12 12 LYS N N 12 127.282 119.745 7.537 1
1 57 . 17 1 1 A 13 13 TRP H H 13 8.039 8.232 -0.193 1
1 58 . 17 1 1 A 13 13 TRP HA H 13 4.370 4.440 -0.070 1
1 67 . 17 1 1 A 13 13 TRP C C 13 177.857 176.629 1.228 1
1 68 . 17 1 1 A 13 13 TRP CA C 13 56.675 57.269 -0.594 1
1 69 . 17 1 1 A 13 13 TRP CB C 13 30.317 30.445 -0.128 1
1 75 . 17 1 1 A 13 13 TRP N N 13 124.264 127.077 -2.813 1
1 77 . 17 1 1 A 14 14 GLY H H 14 9.815 8.919 0.896 1
1 78 . 17 1 1 A 14 14 GLY HA2 H 14 4.370 4.125 0.245 1
1 79 . 17 1 1 A 14 14 GLY HA3 H 14 4.335 4.146 0.189 1
1 80 . 17 1 1 A 14 14 GLY C C 14 172.904 174.645 -1.741 1
1 81 . 17 1 1 A 14 14 GLY CA C 14 44.157 44.066 0.091 1
1 82 . 17 1 1 A 14 14 GLY N N 14 115.294 108.952 6.342 1
1 83 . 17 1 1 A 15 15 PRO HA H 15 4.327 4.421 -0.094 1
1 90 . 17 1 1 A 15 15 PRO C C 15 179.726 178.367 1.359 1
1 91 . 17 1 1 A 15 15 PRO CA C 15 65.171 65.049 0.122 1
1 92 . 17 1 1 A 15 15 PRO CB C 15 31.829 31.930 -0.101 1
1 95 . 17 1 1 A 16 16 ALA H H 16 9.214 8.155 1.059 1
1 96 . 17 1 1 A 16 16 ALA HA H 16 4.166 4.168 -0.002 1
1 100 . 17 1 1 A 16 16 ALA C C 16 181.184 179.231 1.953 1
1 101 . 17 1 1 A 16 16 ALA CA C 16 55.370 55.140 0.230 1
1 102 . 17 1 1 A 16 16 ALA CB C 16 18.058 19.381 -1.323 1
1 103 . 17 1 1 A 16 16 ALA N N 16 122.414 120.177 2.237 1
1 104 . 17 1 1 A 17 17 SER H H 17 7.985 8.387 -0.402 1
1 105 . 17 1 1 A 17 17 SER HA H 17 4.317 4.219 0.098 1
1 107 . 17 1 1 A 17 17 SER C C 17 175.381 176.799 -1.418 1
1 108 . 17 1 1 A 17 17 SER CA C 17 63.163 61.567 1.596 1
1 109 . 17 1 1 A 17 17 SER CB C 17 64.055 62.857 1.198 1
1 110 . 17 1 1 A 17 17 SER N N 17 116.568 112.726 3.842 1
1 111 . 17 1 1 A 18 18 GLN H H 18 8.316 7.776 0.540 1
1 112 . 17 1 1 A 18 18 GLN HA H 18 3.323 3.505 -0.182 1
1 119 . 17 1 1 A 18 18 GLN C C 18 176.812 178.573 -1.761 1
1 120 . 17 1 1 A 18 18 GLN CA C 18 60.025 59.304 0.721 1
1 121 . 17 1 1 A 18 18 GLN CB C 18 28.686 28.527 0.159 1
1 123 . 17 1 1 A 18 18 GLN N N 18 119.002 120.206 -1.204 1
1 125 . 17 1 1 A 19 19 GLN H H 19 7.582 8.205 -0.623 1
1 126 . 17 1 1 A 19 19 GLN HA H 19 4.062 4.093 -0.031 1
1 133 . 17 1 1 A 19 19 GLN C C 19 178.488 178.508 -0.020 1
1 134 . 17 1 1 A 19 19 GLN CA C 19 59.248 59.198 0.050 1
1 135 . 17 1 1 A 19 19 GLN CB C 19 28.203 28.183 0.020 1
1 137 . 17 1 1 A 19 19 GLN N N 19 116.221 118.679 -2.458 1
1 139 . 17 1 1 A 20 20 ILE H H 20 7.246 7.920 -0.674 1
1 140 . 17 1 1 A 20 20 ILE HA H 20 3.570 3.615 -0.045 1
1 150 . 17 1 1 A 20 20 ILE C C 20 178.999 178.500 0.499 1
1 151 . 17 1 1 A 20 20 ILE CA C 20 64.996 65.615 -0.619 1
1 152 . 17 1 1 A 20 20 ILE CB C 20 38.139 37.676 0.463 1
1 156 . 17 1 1 A 20 20 ILE N N 20 120.521 120.957 -0.436 1
1 157 . 17 1 1 A 21 21 LEU H H 21 8.034 7.860 0.174 1
1 158 . 17 1 1 A 21 21 LEU HA H 21 3.491 3.539 -0.048 1
1 168 . 17 1 1 A 21 21 LEU C C 21 178.196 178.392 -0.196 1
1 169 . 17 1 1 A 21 21 LEU CA C 21 57.944 57.411 0.533 1
1 170 . 17 1 1 A 21 21 LEU CB C 21 37.864 40.440 -2.576 1
1 174 . 17 1 1 A 21 21 LEU N N 21 121.259 118.934 2.325 1
1 175 . 17 1 1 A 22 22 TYR H H 22 8.479 7.625 0.854 1
1 176 . 17 1 1 A 22 22 TYR HA H 22 4.224 4.269 -0.045 1
1 183 . 17 1 1 A 22 22 TYR C C 22 179.630 178.605 1.025 1
1 184 . 17 1 1 A 22 22 TYR CA C 22 62.422 60.892 1.530 1
1 185 . 17 1 1 A 22 22 TYR CB C 22 37.434 37.711 -0.277 1
1 190 . 17 1 1 A 22 22 TYR N N 22 117.805 119.020 -1.215 1
1 191 . 17 1 1 A 23 23 GLN H H 23 7.707 8.340 -0.633 1
1 192 . 17 1 1 A 23 23 GLN HA H 23 4.166 4.035 0.131 1
1 199 . 17 1 1 A 23 23 GLN C C 23 178.633 178.561 0.072 1
1 200 . 17 1 1 A 23 23 GLN CA C 23 58.789 59.154 -0.365 1
1 201 . 17 1 1 A 23 23 GLN CB C 23 28.534 28.190 0.344 1
1 203 . 17 1 1 A 23 23 GLN N N 23 117.580 118.213 -0.633 1
1 205 . 17 1 1 A 24 24 ALA H H 24 8.155 7.886 0.269 1
1 206 . 17 1 1 A 24 24 ALA HA H 24 4.187 4.229 -0.042 1
1 210 . 17 1 1 A 24 24 ALA C C 24 180.018 179.097 0.921 1
1 211 . 17 1 1 A 24 24 ALA CA C 24 55.228 55.136 0.092 1
1 212 . 17 1 1 A 24 24 ALA CB C 24 19.468 18.591 0.877 1
1 213 . 17 1 1 A 24 24 ALA N N 24 122.813 122.306 0.507 1
1 214 . 17 1 1 A 25 25 TYR H H 25 8.995 8.534 0.461 1
1 215 . 17 1 1 A 25 25 TYR HA H 25 4.348 4.813 -0.465 1
1 222 . 17 1 1 A 25 25 TYR C C 25 175.792 177.475 -1.683 1
1 223 . 17 1 1 A 25 25 TYR CA C 25 61.681 61.677 0.004 1
1 224 . 17 1 1 A 25 25 TYR CB C 25 38.175 38.588 -0.413 1
1 229 . 17 1 1 A 25 25 TYR N N 25 121.343 120.320 1.023 1
1 230 . 17 1 1 A 26 26 ASP H H 26 7.260 8.771 -1.511 1
1 231 . 17 1 1 A 26 26 ASP HA H 26 4.373 4.531 -0.158 1
1 234 . 17 1 1 A 26 26 ASP C C 26 177.322 177.877 -0.555 1
1 235 . 17 1 1 A 26 26 ASP CA C 26 56.603 57.375 -0.772 1
1 236 . 17 1 1 A 26 26 ASP CB C 26 41.060 41.382 -0.322 1
1 237 . 17 1 1 A 26 26 ASP N N 26 114.020 119.498 -5.478 1
1 238 . 17 1 1 A 27 27 ARG H H 27 7.343 7.839 -0.496 1
1 239 . 17 1 1 A 27 27 ARG HA H 27 4.302 4.390 -0.088 1
1 246 . 17 1 1 A 27 27 ARG C C 27 176.546 176.453 0.093 1
1 247 . 17 1 1 A 27 27 ARG CA C 27 57.563 57.523 0.040 1
1 248 . 17 1 1 A 27 27 ARG CB C 27 31.500 31.437 0.063 1
1 251 . 17 1 1 A 27 27 ARG N N 27 116.729 116.672 0.057 1
1 252 . 17 1 1 A 28 28 GLN H H 28 8.306 8.117 0.189 1
1 253 . 17 1 1 A 28 28 GLN HA H 28 4.396 4.637 -0.241 1
1 260 . 17 1 1 A 28 28 GLN C C 28 172.831 175.595 -2.764 1
1 261 . 17 1 1 A 28 28 GLN CA C 28 55.355 54.689 0.666 1
1 262 . 17 1 1 A 28 28 GLN CB C 28 31.062 31.245 -0.183 1
1 264 . 17 1 1 A 28 28 GLN N N 28 121.612 118.629 2.983 1
1 266 . 17 1 1 A 29 29 LYS H H 29 8.354 8.562 -0.208 1
1 267 . 17 1 1 A 29 29 LYS HA H 29 4.099 3.539 0.560 1
1 276 . 17 1 1 A 29 29 LYS C C 29 176.084 176.300 -0.216 1
1 277 . 17 1 1 A 29 29 LYS CA C 29 57.873 57.855 0.018 1
1 278 . 17 1 1 A 29 29 LYS CB C 29 33.313 32.636 0.677 1
1 282 . 17 1 1 A 29 29 LYS N N 29 125.038 125.490 -0.452 1
1 283 . 17 1 1 A 30 30 ASN H H 30 8.856 7.994 0.862 1
1 284 . 17 1 1 A 30 30 ASN HA H 30 4.958 5.114 -0.156 1
1 289 . 17 1 1 A 30 30 ASN C C 30 171.179 172.384 -1.205 1
1 290 . 17 1 1 A 30 30 ASN CA C 30 50.891 50.381 0.510 1
1 291 . 17 1 1 A 30 30 ASN CB C 30 39.907 39.088 0.819 1
1 292 . 17 1 1 A 30 30 ASN N N 30 115.764 117.682 -1.918 1
1 294 . 17 1 1 A 31 31 PRO HA H 31 4.299 4.474 -0.175 1
1 301 . 17 1 1 A 31 31 PRO C C 31 177.493 176.655 0.838 1
1 302 . 17 1 1 A 31 31 PRO CA C 31 62.489 62.547 -0.058 1
1 303 . 17 1 1 A 31 31 PRO CB C 31 31.216 32.089 -0.873 1
1 306 . 17 1 1 A 32 32 SER H H 32 9.368 8.491 0.877 1
1 307 . 17 1 1 A 32 32 SER HA H 32 4.372 4.778 -0.406 1
1 310 . 17 1 1 A 32 32 SER C C 32 174.821 175.864 -1.043 1
1 311 . 17 1 1 A 32 32 SER CA C 32 57.203 57.234 -0.031 1
1 312 . 17 1 1 A 32 32 SER CB C 32 65.594 64.776 0.818 1
1 313 . 17 1 1 A 32 32 SER N N 32 120.847 117.406 3.441 1
1 314 . 17 1 1 A 33 33 LYS H H 33 9.152 8.952 0.200 1
1 315 . 17 1 1 A 33 33 LYS HA H 33 3.719 3.907 -0.188 1
1 324 . 17 1 1 A 33 33 LYS C C 33 177.833 178.240 -0.407 1
1 325 . 17 1 1 A 33 33 LYS CA C 33 61.188 60.314 0.874 1
1 326 . 17 1 1 A 33 33 LYS CB C 33 32.572 32.357 0.215 1
1 330 . 17 1 1 A 33 33 LYS N N 33 122.966 124.632 -1.666 1
1 331 . 17 1 1 A 34 34 GLU H H 34 8.902 8.209 0.693 1
1 332 . 17 1 1 A 34 34 GLU HA H 34 4.089 4.084 0.005 1
1 337 . 17 1 1 A 34 34 GLU C C 34 180.286 179.235 1.051 1
1 338 . 17 1 1 A 34 34 GLU CA C 34 60.483 59.153 1.330 1
1 339 . 17 1 1 A 34 34 GLU CB C 34 28.835 29.426 -0.591 1
1 341 . 17 1 1 A 34 34 GLU N N 34 117.645 118.353 -0.708 1
1 342 . 17 1 1 A 35 35 GLU H H 35 7.673 8.275 -0.602 1
1 343 . 17 1 1 A 35 35 GLU HA H 35 4.023 3.929 0.094 1
1 348 . 17 1 1 A 35 35 GLU C C 35 180.237 179.075 1.162 1
1 349 . 17 1 1 A 35 35 GLU CA C 35 59.214 59.453 -0.239 1
1 350 . 17 1 1 A 35 35 GLU CB C 35 30.099 29.322 0.777 1
1 352 . 17 1 1 A 35 35 GLU N N 35 121.077 119.950 1.127 1
1 353 . 17 1 1 A 36 36 ARG H H 36 8.932 8.396 0.536 1
1 354 . 17 1 1 A 36 36 ARG HA H 36 3.928 3.808 0.120 1
1 362 . 17 1 1 A 36 36 ARG C C 36 178.464 179.176 -0.712 1
1 363 . 17 1 1 A 36 36 ARG CA C 36 60.974 59.882 1.092 1
1 364 . 17 1 1 A 36 36 ARG CB C 36 31.171 30.071 1.100 1
1 367 . 17 1 1 A 36 36 ARG N N 36 119.441 120.119 -0.678 1
1 369 . 17 1 1 A 37 37 GLU H H 37 8.756 8.339 0.417 1
1 370 . 17 1 1 A 37 37 GLU HA H 37 3.948 4.397 -0.449 1
1 375 . 17 1 1 A 37 37 GLU C C 37 179.606 179.040 0.566 1
1 376 . 17 1 1 A 37 37 GLU CA C 37 60.094 59.152 0.942 1
1 377 . 17 1 1 A 37 37 GLU CB C 37 29.110 29.182 -0.072 1
1 379 . 17 1 1 A 37 37 GLU N N 37 119.017 119.581 -0.564 1
1 380 . 17 1 1 A 38 38 ALA H H 38 7.733 8.172 -0.439 1
1 381 . 17 1 1 A 38 38 ALA HA H 38 4.325 4.148 0.177 1
1 385 . 17 1 1 A 38 38 ALA C C 38 180.820 178.474 2.346 1
1 386 . 17 1 1 A 38 38 ALA CA C 38 55.194 54.324 0.870 1
1 387 . 17 1 1 A 38 38 ALA CB C 38 17.654 18.508 -0.854 1
1 388 . 17 1 1 A 38 38 ALA N N 38 122.889 121.847 1.042 1
1 389 . 17 1 1 A 39 39 LEU H H 39 7.740 8.049 -0.309 1
1 390 . 17 1 1 A 39 39 LEU HA H 39 4.176 4.295 -0.119 1
1 400 . 17 1 1 A 39 39 LEU C C 39 179.266 178.724 0.542 1
1 401 . 17 1 1 A 39 39 LEU CA C 39 57.944 55.852 2.092 1
1 402 . 17 1 1 A 39 39 LEU CB C 39 42.105 42.666 -0.561 1
1 406 . 17 1 1 A 39 39 LEU N N 39 119.783 116.852 2.931 1
1 407 . 17 1 1 A 40 40 VAL H H 40 8.451 8.365 0.086 1
1 408 . 17 1 1 A 40 40 VAL HA H 40 3.259 3.767 -0.508 1
1 416 . 17 1 1 A 40 40 VAL C C 40 177.153 177.833 -0.680 1
1 417 . 17 1 1 A 40 40 VAL CA C 40 67.254 66.792 0.462 1
1 418 . 17 1 1 A 40 40 VAL CB C 40 31.747 31.755 -0.008 1
1 421 . 17 1 1 A 40 40 VAL N N 40 121.481 119.836 1.645 1
1 422 . 17 1 1 A 41 41 GLU H H 41 7.254 7.959 -0.705 1
1 423 . 17 1 1 A 41 41 GLU HA H 41 4.159 4.157 0.002 1
1 428 . 17 1 1 A 41 41 GLU C C 41 179.483 178.854 0.629 1
1 429 . 17 1 1 A 41 41 GLU CA C 41 59.248 59.384 -0.136 1
1 430 . 17 1 1 A 41 41 GLU CB C 41 29.358 29.616 -0.258 1
1 432 . 17 1 1 A 41 41 GLU N N 41 116.549 119.740 -3.191 1
1 433 . 17 1 1 A 42 42 GLU H H 42 8.103 7.864 0.239 1
1 434 . 17 1 1 A 42 42 GLU HA H 42 4.020 4.053 -0.033 1
1 439 . 17 1 1 A 42 42 GLU C C 42 180.115 178.735 1.380 1
1 440 . 17 1 1 A 42 42 GLU CA C 42 59.847 59.584 0.263 1
1 441 . 17 1 1 A 42 42 GLU CB C 42 30.218 29.331 0.887 1
1 443 . 17 1 1 A 42 42 GLU N N 42 119.578 119.178 0.400 1
1 444 . 17 1 1 A 43 43 CYS H H 43 8.955 7.884 1.071 1
1 445 . 17 1 1 A 43 43 CYS HA H 43 4.153 4.234 -0.081 1
1 448 . 17 1 1 A 43 43 CYS C C 43 176.498 177.630 -1.132 1
1 449 . 17 1 1 A 43 43 CYS CA C 43 64.856 62.464 2.392 1
1 450 . 17 1 1 A 43 43 CYS CB C 43 27.390 27.850 -0.460 1
1 451 . 17 1 1 A 43 43 CYS N N 43 118.199 118.837 -0.638 1
1 452 . 17 1 1 A 44 44 ASN H H 44 8.543 8.367 0.176 1
1 453 . 17 1 1 A 44 44 ASN HA H 44 4.635 4.457 0.178 1
1 458 . 17 1 1 A 44 44 ASN C C 44 178.633 177.711 0.922 1
1 459 . 17 1 1 A 44 44 ASN CA C 44 56.603 56.303 0.300 1
1 460 . 17 1 1 A 44 44 ASN CB C 44 37.187 38.241 -1.054 1
1 461 . 17 1 1 A 44 44 ASN N N 44 117.002 119.593 -2.591 1
1 463 . 17 1 1 A 45 45 ARG H H 45 8.296 8.184 0.112 1
1 464 . 17 1 1 A 45 45 ARG HA H 45 3.977 4.074 -0.097 1
1 471 . 17 1 1 A 45 45 ARG C C 45 178.149 178.068 0.081 1
1 472 . 17 1 1 A 45 45 ARG CA C 45 60.589 59.236 1.353 1
1 473 . 17 1 1 A 45 45 ARG CB C 45 30.099 30.271 -0.172 1
1 476 . 17 1 1 A 45 45 ARG N N 45 121.021 120.833 0.188 1
1 477 . 17 1 1 A 46 46 ALA H H 46 7.914 8.392 -0.478 1
1 478 . 17 1 1 A 46 46 ALA HA H 46 4.128 4.125 0.003 1
1 482 . 17 1 1 A 46 46 ALA C C 46 181.208 180.254 0.954 1
1 483 . 17 1 1 A 46 46 ALA CA C 46 55.264 55.049 0.215 1
1 484 . 17 1 1 A 46 46 ALA CB C 46 18.759 18.195 0.564 1
1 485 . 17 1 1 A 46 46 ALA N N 46 121.570 120.751 0.819 1
1 486 . 17 1 1 A 47 47 GLU H H 47 8.730 8.636 0.094 1
1 487 . 17 1 1 A 47 47 GLU HA H 47 4.194 4.024 0.170 1
1 492 . 17 1 1 A 47 47 GLU C C 47 180.115 179.319 0.796 1
1 493 . 17 1 1 A 47 47 GLU CA C 47 58.401 59.750 -1.349 1
1 494 . 17 1 1 A 47 47 GLU CB C 47 29.523 29.253 0.270 1
1 496 . 17 1 1 A 47 47 GLU N N 47 117.532 118.328 -0.796 1
1 497 . 17 1 1 A 48 48 CYS H H 48 8.283 7.798 0.485 1
1 498 . 17 1 1 A 48 48 CYS HA H 48 4.002 4.113 -0.111 1
1 501 . 17 1 1 A 48 48 CYS C C 48 177.031 177.406 -0.375 1
1 502 . 17 1 1 A 48 48 CYS CA C 48 64.749 64.033 0.716 1
1 503 . 17 1 1 A 48 48 CYS CB C 48 25.907 27.259 -1.352 1
1 504 . 17 1 1 A 48 48 CYS N N 48 118.282 119.166 -0.884 1
1 505 . 17 1 1 A 49 49 LEU H H 49 8.181 8.090 0.091 1
1 506 . 17 1 1 A 49 49 LEU HA H 49 4.175 3.932 0.243 1
1 516 . 17 1 1 A 49 49 LEU C C 49 180.430 178.680 1.750 1
1 517 . 17 1 1 A 49 49 LEU CA C 49 57.873 58.179 -0.306 1
1 518 . 17 1 1 A 49 49 LEU CB C 49 41.539 41.693 -0.154 1
1 522 . 17 1 1 A 49 49 LEU N N 49 120.371 120.887 -0.516 1
1 523 . 17 1 1 A 50 50 GLN H H 50 7.934 8.576 -0.642 1
1 524 . 17 1 1 A 50 50 GLN HA H 50 4.102 4.081 0.021 1
1 531 . 17 1 1 A 50 50 GLN C C 50 177.322 177.268 0.054 1
1 532 . 17 1 1 A 50 50 GLN CA C 50 58.156 58.654 -0.498 1
1 533 . 17 1 1 A 50 50 GLN CB C 50 28.616 28.492 0.124 1
1 535 . 17 1 1 A 50 50 GLN N N 50 118.175 117.399 0.776 1
1 537 . 17 1 1 A 51 51 ARG H H 51 7.632 7.685 -0.053 1
1 538 . 17 1 1 A 51 51 ARG HA H 51 4.347 4.358 -0.011 1
1 545 . 17 1 1 A 51 51 ARG C C 51 176.546 176.424 0.122 1
1 546 . 17 1 1 A 51 51 ARG CA C 51 56.286 56.018 0.268 1
1 547 . 17 1 1 A 51 51 ARG CB C 51 31.314 30.293 1.021 1
1 550 . 17 1 1 A 51 51 ARG N N 51 116.454 118.005 -1.551 1
1 551 . 17 1 1 A 52 52 GLY H H 52 7.949 8.404 -0.455 1
1 552 . 17 1 1 A 52 52 GLY HA2 H 52 4.033 3.974 0.059 1
1 553 . 17 1 1 A 52 52 GLY HA3 H 52 3.903 3.975 -0.072 1
1 554 . 17 1 1 A 52 52 GLY C C 52 174.385 174.243 0.142 1
1 555 . 17 1 1 A 52 52 GLY CA C 52 46.231 45.260 0.971 1
1 556 . 17 1 1 A 52 52 GLY N N 52 108.854 107.575 1.279 1
1 557 . 17 1 1 A 53 53 VAL H H 53 7.944 7.560 0.384 1
1 558 . 17 1 1 A 53 53 VAL HA H 53 4.250 4.025 0.225 1
1 566 . 17 1 1 A 53 53 VAL C C 53 175.525 175.094 0.431 1
1 567 . 17 1 1 A 53 53 VAL CA C 53 60.377 62.575 -2.198 1
1 568 . 17 1 1 A 53 53 VAL CB C 53 34.283 32.776 1.507 1
1 571 . 17 1 1 A 53 53 VAL N N 53 118.316 120.679 -2.363 1
1 572 . 17 1 1 A 54 54 SER H H 54 8.502 8.553 -0.051 1
1 573 . 17 1 1 A 54 54 SER HA H 54 4.625 4.873 -0.248 1
1 576 . 17 1 1 A 54 54 SER C C 54 174.603 174.061 0.542 1
1 577 . 17 1 1 A 54 54 SER CA C 54 56.092 54.271 1.821 1
1 578 . 17 1 1 A 54 54 SER CB C 54 63.697 63.796 -0.099 1
1 579 . 17 1 1 A 54 54 SER N N 54 120.337 118.563 1.774 1
1 580 . 17 1 1 A 55 55 PRO HA H 55 4.624 4.527 0.097 1
1 587 . 17 1 1 A 55 55 PRO C C 55 177.322 177.212 0.110 1
1 588 . 17 1 1 A 55 55 PRO CA C 55 64.431 64.194 0.237 1
1 589 . 17 1 1 A 55 55 PRO CB C 55 31.913 31.689 0.224 1
1 592 . 17 1 1 A 56 56 SER H H 56 7.931 8.427 -0.496 1
1 593 . 17 1 1 A 56 56 SER HA H 56 4.428 4.621 -0.193 1
1 596 . 17 1 1 A 56 56 SER C C 56 174.749 174.700 0.049 1
1 597 . 17 1 1 A 56 56 SER CA C 56 59.130 58.907 0.223 1
1 598 . 17 1 1 A 56 56 SER CB C 56 63.056 64.084 -1.028 1
1 599 . 17 1 1 A 56 56 SER N N 56 112.637 112.891 -0.254 1
1 600 . 17 1 1 A 57 57 LYS H H 57 8.121 7.623 0.498 1
1 601 . 17 1 1 A 57 57 LYS HA H 57 4.467 4.899 -0.432 1
1 609 . 17 1 1 A 57 57 LYS C C 57 176.570 176.174 0.396 1
1 610 . 17 1 1 A 57 57 LYS CA C 57 55.264 55.117 0.147 1
1 611 . 17 1 1 A 57 57 LYS CB C 57 32.160 32.704 -0.544 1
1 615 . 17 1 1 A 57 57 LYS N N 57 123.185 118.097 5.088 1
1 616 . 17 1 1 A 58 58 ALA H H 58 7.886 7.962 -0.076 1
1 617 . 17 1 1 A 58 58 ALA HA H 58 3.923 3.852 0.071 1
1 621 . 17 1 1 A 58 58 ALA C C 58 177.469 179.718 -2.249 1
1 622 . 17 1 1 A 58 58 ALA CA C 58 54.276 54.860 -0.584 1
1 623 . 17 1 1 A 58 58 ALA CB C 58 18.271 18.552 -0.281 1
1 624 . 17 1 1 A 58 58 ALA N N 58 123.941 122.698 1.243 1
1 625 . 17 1 1 A 59 59 HIS H H 59 8.077 8.110 -0.033 1
1 626 . 17 1 1 A 59 59 HIS HA H 59 4.420 4.392 0.028 1
1 631 . 17 1 1 A 59 59 HIS C C 59 177.542 177.465 0.077 1
1 632 . 17 1 1 A 59 59 HIS CA C 59 57.767 58.562 -0.795 1
1 633 . 17 1 1 A 59 59 HIS CB C 59 29.852 28.591 1.261 1
1 636 . 17 1 1 A 59 59 HIS N N 59 115.566 115.509 0.057 1
1 637 . 17 1 1 A 60 60 GLY H H 60 8.110 7.656 0.454 1
1 638 . 17 1 1 A 60 60 GLY HA2 H 60 3.873 3.417 0.456 1
1 639 . 17 1 1 A 60 60 GLY HA3 H 60 4.025 3.529 0.496 1
1 640 . 17 1 1 A 60 60 GLY C C 60 174.918 175.643 -0.725 1
1 641 . 17 1 1 A 60 60 GLY CA C 60 45.559 46.993 -1.434 1
1 642 . 17 1 1 A 60 60 GLY N N 60 109.216 110.274 -1.058 1
1 643 . 17 1 1 A 61 61 LEU H H 61 8.280 8.454 -0.174 1
1 644 . 17 1 1 A 61 61 LEU HA H 61 4.198 3.935 0.263 1
1 654 . 17 1 1 A 61 61 LEU C C 61 178.900 177.555 1.345 1
1 655 . 17 1 1 A 61 61 LEU CA C 61 55.758 57.925 -2.167 1
1 656 . 17 1 1 A 61 61 LEU CB C 61 42.544 41.751 0.793 1
1 660 . 17 1 1 A 61 61 LEU N N 61 120.521 123.046 -2.525 1
1 661 . 17 1 1 A 62 62 GLY H H 62 8.184 8.101 0.083 1
1 662 . 17 1 1 A 62 62 GLY HA2 H 62 3.978 3.809 0.169 1
1 663 . 17 1 1 A 62 62 GLY HA3 H 62 3.817 3.813 0.004 1
1 664 . 17 1 1 A 62 62 GLY C C 62 176.012 174.887 1.125 1
1 665 . 17 1 1 A 62 62 GLY CA C 62 46.767 47.331 -0.564 1
1 666 . 17 1 1 A 62 62 GLY N N 62 108.987 108.420 0.567 1
1 667 . 17 1 1 A 63 63 SER HA H 63 4.322 4.198 0.124 1
1 670 . 17 1 1 A 63 63 SER C C 63 174.167 175.946 -1.779 1
1 671 . 17 1 1 A 63 63 SER CA C 63 59.919 61.235 -1.316 1
1 672 . 17 1 1 A 63 63 SER CB C 63 63.312 62.224 1.088 1
1 673 . 17 1 1 A 64 64 ASN H H 64 8.087 7.920 0.167 1
1 674 . 17 1 1 A 64 64 ASN HA H 64 4.850 4.958 -0.108 1
1 679 . 17 1 1 A 64 64 ASN C C 64 173.899 175.126 -1.227 1
1 680 . 17 1 1 A 64 64 ASN CA C 64 53.218 53.501 -0.283 1
1 681 . 17 1 1 A 64 64 ASN CB C 64 39.164 38.994 0.170 1
1 682 . 17 1 1 A 64 64 ASN N N 64 118.041 117.326 0.715 1
1 684 . 17 1 1 A 65 65 LEU H H 65 7.293 7.342 -0.049 1
1 685 . 17 1 1 A 65 65 LEU HA H 65 3.995 4.476 -0.481 1
1 695 . 17 1 1 A 65 65 LEU C C 65 175.696 175.005 0.691 1
1 696 . 17 1 1 A 65 65 LEU CA C 65 56.005 55.242 0.763 1
1 697 . 17 1 1 A 65 65 LEU CB C 65 43.120 43.115 0.005 1
1 701 . 17 1 1 A 65 65 LEU N N 65 120.953 122.901 -1.948 1
1 702 . 17 1 1 A 66 66 VAL H H 66 9.517 8.862 0.655 1
1 703 . 17 1 1 A 66 66 VAL HA H 66 3.481 4.631 -1.150 1
1 711 . 17 1 1 A 66 66 VAL C C 66 175.429 175.068 0.361 1
1 712 . 17 1 1 A 66 66 VAL CA C 66 65.243 60.950 4.293 1
1 713 . 17 1 1 A 66 66 VAL CB C 66 31.335 33.947 -2.612 1
1 716 . 17 1 1 A 66 66 VAL N N 66 127.924 125.791 2.133 1
1 717 . 17 1 1 A 67 67 THR H H 67 6.253 8.358 -2.105 1
1 718 . 17 1 1 A 67 67 THR HA H 67 4.779 4.836 -0.057 1
1 723 . 17 1 1 A 67 67 THR C C 67 174.894 174.941 -0.047 1
1 724 . 17 1 1 A 67 67 THR CA C 67 58.719 59.456 -0.737 1
1 725 . 17 1 1 A 67 67 THR CB C 67 72.153 71.995 0.158 1
1 727 . 17 1 1 A 67 67 THR N N 67 113.376 115.960 -2.584 1
1 728 . 17 1 1 A 68 68 GLU H H 68 9.348 9.007 0.341 1
1 729 . 17 1 1 A 68 68 GLU HA H 68 3.634 4.027 -0.393 1
1 734 . 17 1 1 A 68 68 GLU C C 68 177.809 178.243 -0.434 1
1 735 . 17 1 1 A 68 68 GLU CA C 68 61.505 59.940 1.565 1
1 736 . 17 1 1 A 68 68 GLU CB C 68 28.285 29.514 -1.229 1
1 738 . 17 1 1 A 68 68 GLU N N 68 124.534 122.071 2.463 1
1 739 . 17 1 1 A 69 69 VAL H H 69 8.126 7.906 0.220 1
1 740 . 17 1 1 A 69 69 VAL HA H 69 3.862 3.558 0.304 1
1 748 . 17 1 1 A 69 69 VAL C C 69 177.712 178.071 -0.359 1
1 749 . 17 1 1 A 69 69 VAL CA C 69 65.701 66.813 -1.112 1
1 750 . 17 1 1 A 69 69 VAL CB C 69 31.829 31.654 0.175 1
1 753 . 17 1 1 A 69 69 VAL N N 69 119.139 120.222 -1.083 1
1 754 . 17 1 1 A 70 70 ARG H H 70 7.235 8.281 -1.046 1
1 755 . 17 1 1 A 70 70 ARG HA H 70 4.265 4.043 0.222 1
1 762 . 17 1 1 A 70 70 ARG C C 70 180.430 179.489 0.941 1
1 763 . 17 1 1 A 70 70 ARG CA C 70 59.742 60.255 -0.513 1
1 764 . 17 1 1 A 70 70 ARG CB C 70 29.439 30.084 -0.645 1
1 767 . 17 1 1 A 70 70 ARG N N 70 119.541 119.212 0.329 1
1 768 . 17 1 1 A 71 71 VAL H H 71 8.144 8.023 0.121 1
1 769 . 17 1 1 A 71 71 VAL HA H 71 4.018 3.948 0.070 1
1 777 . 17 1 1 A 71 71 VAL C C 71 177.493 178.233 -0.740 1
1 778 . 17 1 1 A 71 71 VAL CA C 71 67.924 66.624 1.300 1
1 779 . 17 1 1 A 71 71 VAL CB C 71 32.289 31.945 0.344 1
1 782 . 17 1 1 A 71 71 VAL N N 71 120.755 120.235 0.520 1
1 783 . 17 1 1 A 72 72 TYR H H 72 9.411 8.422 0.989 1
1 784 . 17 1 1 A 72 72 TYR HA H 72 3.908 4.135 -0.227 1
1 791 . 17 1 1 A 72 72 TYR C C 72 178.464 177.536 0.928 1
1 792 . 17 1 1 A 72 72 TYR CA C 72 63.444 62.071 1.373 1
1 793 . 17 1 1 A 72 72 TYR CB C 72 38.211 39.141 -0.930 1
1 798 . 17 1 1 A 72 72 TYR N N 72 121.175 121.092 0.083 1
1 799 . 17 1 1 A 73 73 ASN H H 73 8.816 8.772 0.044 1
1 800 . 17 1 1 A 73 73 ASN HA H 73 4.538 4.594 -0.056 1
1 805 . 17 1 1 A 73 73 ASN C C 73 176.958 178.071 -1.113 1
1 806 . 17 1 1 A 73 73 ASN CA C 73 56.109 56.417 -0.308 1
1 807 . 17 1 1 A 73 73 ASN CB C 73 38.422 38.841 -0.419 1
1 808 . 17 1 1 A 73 73 ASN N N 73 118.122 117.920 0.202 1
1 810 . 17 1 1 A 74 74 TRP H H 74 8.657 8.474 0.183 1
1 811 . 17 1 1 A 74 74 TRP HA H 74 4.111 4.282 -0.171 1
1 820 . 17 1 1 A 74 74 TRP C C 74 179.654 178.529 1.125 1
1 821 . 17 1 1 A 74 74 TRP CA C 74 62.950 61.040 1.910 1
1 822 . 17 1 1 A 74 74 TRP CB C 74 29.555 29.776 -0.221 1
1 828 . 17 1 1 A 74 74 TRP N N 74 123.988 122.237 1.751 1
1 830 . 17 1 1 A 75 75 PHE H H 75 8.562 8.315 0.247 1
1 831 . 17 1 1 A 75 75 PHE HA H 75 3.821 4.392 -0.571 1
1 839 . 17 1 1 A 75 75 PHE C C 75 177.614 178.078 -0.464 1
1 840 . 17 1 1 A 75 75 PHE CA C 75 63.374 61.899 1.475 1
1 841 . 17 1 1 A 75 75 PHE CB C 75 39.648 38.173 1.475 1
1 847 . 17 1 1 A 75 75 PHE N N 75 118.325 117.140 1.185 1
1 848 . 17 1 1 A 76 76 ALA H H 76 8.305 8.509 -0.204 1
1 849 . 17 1 1 A 76 76 ALA HA H 76 3.909 3.911 -0.002 1
1 853 . 17 1 1 A 76 76 ALA C C 76 180.868 179.517 1.351 1
1 854 . 17 1 1 A 76 76 ALA CA C 76 55.566 55.187 0.379 1
1 855 . 17 1 1 A 76 76 ALA CB C 76 17.820 17.916 -0.096 1
1 856 . 17 1 1 A 76 76 ALA N N 76 121.119 122.371 -1.252 1
1 857 . 17 1 1 A 77 77 ASN H H 77 8.335 8.139 0.196 1
1 858 . 17 1 1 A 77 77 ASN HA H 77 4.355 4.351 0.004 1
1 863 . 17 1 1 A 77 77 ASN C C 77 177.105 177.305 -0.200 1
1 864 . 17 1 1 A 77 77 ASN CA C 77 56.145 56.323 -0.178 1
1 865 . 17 1 1 A 77 77 ASN CB C 77 38.063 38.513 -0.450 1
1 866 . 17 1 1 A 77 77 ASN N N 77 117.433 116.570 0.863 1
1 868 . 17 1 1 A 78 78 ARG H H 78 7.664 7.602 0.062 1
1 869 . 17 1 1 A 78 78 ARG HA H 78 3.629 3.708 -0.079 1
1 876 . 17 1 1 A 78 78 ARG C C 78 179.216 177.751 1.465 1
1 877 . 17 1 1 A 78 78 ARG CA C 78 58.773 59.001 -0.228 1
1 878 . 17 1 1 A 78 78 ARG CB C 78 29.605 29.235 0.370 1
1 881 . 17 1 1 A 78 78 ARG N N 78 121.999 118.499 3.500 1
1 882 . 17 1 1 A 79 79 ARG H H 79 8.320 7.499 0.821 1
1 883 . 17 1 1 A 79 79 ARG HA H 79 4.307 4.362 -0.055 1
1 890 . 17 1 1 A 79 79 ARG C C 79 180.406 178.717 1.689 1
1 891 . 17 1 1 A 79 79 ARG CA C 79 60.270 57.434 2.836 1
1 892 . 17 1 1 A 79 79 ARG CB C 79 31.335 30.669 0.666 1
1 895 . 17 1 1 A 79 79 ARG N N 79 118.139 117.807 0.332 1
1 896 . 17 1 1 A 80 80 LYS H H 80 7.759 7.957 -0.198 1
1 897 . 17 1 1 A 80 80 LYS HA H 80 4.052 4.087 -0.035 1
1 905 . 17 1 1 A 80 80 LYS C C 80 178.999 178.597 0.402 1
1 906 . 17 1 1 A 80 80 LYS CA C 80 59.531 59.059 0.472 1
1 907 . 17 1 1 A 80 80 LYS CB C 80 32.374 31.928 0.446 1
1 911 . 17 1 1 A 80 80 LYS N N 80 120.899 118.793 2.106 1
1 912 . 17 1 1 A 81 81 GLU H H 81 8.041 8.532 -0.491 1
1 913 . 17 1 1 A 81 81 GLU HA H 81 4.044 4.186 -0.142 1
1 918 . 17 1 1 A 81 81 GLU C C 81 179.168 178.593 0.575 1
1 919 . 17 1 1 A 81 81 GLU CA C 81 59.036 59.570 -0.534 1
1 920 . 17 1 1 A 81 81 GLU CB C 81 29.561 29.210 0.351 1
1 922 . 17 1 1 A 81 81 GLU N N 81 120.193 119.977 0.216 1
1 923 . 17 1 1 A 82 82 GLU H H 82 8.131 8.607 -0.476 1
1 924 . 17 1 1 A 82 82 GLU HA H 82 4.017 4.089 -0.072 1
1 929 . 17 1 1 A 82 82 GLU C C 82 178.343 177.976 0.367 1
1 930 . 17 1 1 A 82 82 GLU CA C 82 59.319 59.127 0.192 1
1 931 . 17 1 1 A 82 82 GLU CB C 82 29.770 28.781 0.989 1
1 933 . 17 1 1 A 82 82 GLU N N 82 119.626 118.717 0.909 1
1 934 . 17 1 1 A 83 83 ALA H H 83 7.935 7.572 0.363 1
1 935 . 17 1 1 A 83 83 ALA HA H 83 4.180 4.281 -0.101 1
1 939 . 17 1 1 A 83 83 ALA C C 83 179.994 179.425 0.569 1
1 940 . 17 1 1 A 83 83 ALA CA C 83 54.629 53.278 1.351 1
1 941 . 17 1 1 A 83 83 ALA CB C 83 18.090 19.149 -1.059 1
1 942 . 17 1 1 A 83 83 ALA N N 83 121.476 121.928 -0.452 1
1 943 . 17 1 1 A 84 84 PHE H H 84 8.043 8.054 -0.011 1
1 944 . 17 1 1 A 84 84 PHE HA H 84 4.420 4.000 0.420 1
1 952 . 17 1 1 A 84 84 PHE C C 84 177.250 177.061 0.189 1
1 953 . 17 1 1 A 84 84 PHE CA C 84 60.059 61.485 -1.426 1
1 954 . 17 1 1 A 84 84 PHE CB C 84 38.952 39.401 -0.449 1
1 960 . 17 1 1 A 84 84 PHE N N 84 119.074 120.328 -1.254 1
1 961 . 17 1 1 A 85 85 ARG H H 85 8.031 8.375 -0.344 1
1 962 . 17 1 1 A 85 85 ARG HA H 85 3.992 4.125 -0.133 1
1 968 . 17 1 1 A 85 85 ARG C C 85 178.319 177.895 0.424 1
1 969 . 17 1 1 A 85 85 ARG CA C 85 58.523 59.456 -0.933 1
1 970 . 17 1 1 A 85 85 ARG CB C 85 30.346 29.890 0.456 1
1 973 . 17 1 1 A 85 85 ARG N N 85 119.291 117.479 1.812 1
1 974 . 17 1 1 A 86 86 GLN H H 86 8.091 7.994 0.097 1
1 975 . 17 1 1 A 86 86 GLN HA H 86 4.148 4.329 -0.181 1
1 982 . 17 1 1 A 86 86 GLN C C 86 177.105 178.133 -1.028 1
1 983 . 17 1 1 A 86 86 GLN CA C 86 57.556 57.135 0.421 1
1 984 . 17 1 1 A 86 86 GLN CB C 86 28.855 29.140 -0.285 1
1 986 . 17 1 1 A 86 86 GLN N N 86 119.097 117.379 1.718 1
1 988 . 17 1 1 A 87 87 LYS H H 87 7.898 8.017 -0.119 1
1 989 . 17 1 1 A 87 87 LYS HA H 87 4.116 4.090 0.026 1
1 997 . 17 1 1 A 87 87 LYS C C 87 177.542 178.942 -1.400 1
1 998 . 17 1 1 A 87 87 LYS CA C 87 57.944 58.948 -1.004 1
1 999 . 17 1 1 A 87 87 LYS CB C 87 32.242 31.680 0.562 1
1 1003 . 17 1 1 A 87 87 LYS N N 87 120.968 121.091 -0.123 1
1 1004 . 17 1 1 A 88 88 LEU H H 88 7.903 8.215 -0.312 1
1 1005 . 17 1 1 A 88 88 LEU HA H 88 4.144 4.160 -0.016 1
1 1015 . 17 1 1 A 88 88 LEU C C 88 178.221 177.519 0.702 1
1 1016 . 17 1 1 A 88 88 LEU CA C 88 56.145 56.917 -0.772 1
1 1017 . 17 1 1 A 88 88 LEU CB C 88 42.215 41.540 0.675 1
1 1021 . 17 1 1 A 88 88 LEU N N 88 120.558 116.864 3.694 1
1 1022 . 17 1 1 A 89 89 ALA H H 89 7.894 7.600 0.294 1
1 1023 . 17 1 1 A 89 89 ALA HA H 89 4.224 4.270 -0.046 1
1 1027 . 17 1 1 A 89 89 ALA C C 89 178.609 178.062 0.547 1
1 1028 . 17 1 1 A 89 89 ALA CA C 89 53.392 52.190 1.202 1
1 1029 . 17 1 1 A 89 89 ALA CB C 89 18.695 19.642 -0.947 1
1 1030 . 17 1 1 A 89 89 ALA N N 89 122.387 121.679 0.708 1
1 1031 . 17 1 1 A 90 90 MET H H 90 8.084 7.574 0.510 1
1 1032 . 17 1 1 A 90 90 MET HA H 90 4.356 4.490 -0.134 1
1 1040 . 17 1 1 A 90 90 MET C C 90 176.982 176.209 0.773 1
1 1041 . 17 1 1 A 90 90 MET CA C 90 56.551 55.642 0.909 1
1 1042 . 17 1 1 A 90 90 MET CB C 90 32.719 32.185 0.534 1
1 1045 . 17 1 1 A 90 90 MET N N 90 118.509 116.132 2.377 1
1 1046 . 17 1 1 A 91 91 ASP H H 91 8.261 7.803 0.458 1
1 1047 . 17 1 1 A 91 91 ASP HA H 91 4.524 4.553 -0.029 1
1 1050 . 17 1 1 A 91 91 ASP C C 91 176.643 175.556 1.087 1
1 1051 . 17 1 1 A 91 91 ASP CA C 91 54.981 53.215 1.766 1
1 1052 . 17 1 1 A 91 91 ASP CB C 91 40.870 41.094 -0.224 1
1 1053 . 17 1 1 A 91 91 ASP N N 91 120.771 118.823 1.948 1
1 1054 . 17 1 1 A 92 92 ALA H H 92 7.971 7.415 0.556 1
1 1055 . 17 1 1 A 92 92 ALA HA H 92 4.200 4.616 -0.416 1
1 1059 . 17 1 1 A 92 92 ALA C C 92 177.929 176.014 1.915 1
1 1060 . 17 1 1 A 92 92 ALA CA C 92 53.184 50.485 2.699 1
1 1061 . 17 1 1 A 92 92 ALA CB C 92 18.890 21.504 -2.614 1
1 1062 . 17 1 1 A 92 92 ALA N N 92 123.057 122.250 0.807 1
1 1063 . 17 1 1 A 93 93 TYR H H 93 8.019 8.778 -0.759 1
1 1064 . 17 1 1 A 93 93 TYR HA H 93 4.523 4.753 -0.230 1
1 1071 . 17 1 1 A 93 93 TYR C C 93 176.279 176.049 0.230 1
1 1072 . 17 1 1 A 93 93 TYR CA C 93 58.401 58.106 0.295 1
1 1073 . 17 1 1 A 93 93 TYR CB C 93 38.669 39.346 -0.677 1
1 1078 . 17 1 1 A 93 93 TYR N N 93 118.337 122.312 -3.975 1
1 1079 . 17 1 1 A 94 94 SER H H 94 8.037 8.809 -0.772 1
1 1080 . 17 1 1 A 94 94 SER HA H 94 4.484 4.772 -0.288 1
1 1082 . 17 1 1 A 94 94 SER C C 94 174.554 173.073 1.481 1
1 1083 . 17 1 1 A 94 94 SER CA C 94 58.401 58.115 0.286 1
1 1084 . 17 1 1 A 94 94 SER CB C 94 63.806 63.357 0.449 1
1 1085 . 17 1 1 A 94 94 SER N N 94 116.640 118.381 -1.741 1
1 1086 . 17 1 1 A 96 96 ASN HA H 96 4.770 4.554 0.216 1
1 1091 . 17 1 1 A 96 96 ASN C C 96 175.161 176.089 -0.928 1
1 1092 . 17 1 1 A 96 96 ASN CA C 96 53.395 54.039 -0.644 1
1 1093 . 17 1 1 A 96 96 ASN CB C 96 38.999 37.872 1.127 1
1 1095 . 17 1 1 A 97 97 SER H H 97 8.230 8.138 0.092 1
1 1096 . 17 1 1 A 97 97 SER HA H 97 4.481 4.234 0.247 1
1 1099 . 17 1 1 A 97 97 SER C C 97 174.482 176.628 -2.146 1
1 1100 . 17 1 1 A 97 97 SER CA C 97 58.300 61.145 -2.845 1
1 1101 . 17 1 1 A 97 97 SER CB C 97 63.697 62.666 1.031 1
1 1102 . 17 1 1 A 97 97 SER N N 97 115.866 113.241 2.625 1
1 1103 . 17 1 1 A 98 98 GLY H H 98 8.228 8.196 0.032 1
1 1104 . 17 1 1 A 98 98 GLY HA2 H 98 4.098 3.764 0.334 1
1 1105 . 17 1 1 A 98 98 GLY HA3 H 98 4.098 3.765 0.333 1
1 1106 . 17 1 1 A 98 98 GLY C C 98 171.788 174.754 -2.966 1
1 1107 . 17 1 1 A 98 98 GLY CA C 98 44.803 47.860 -3.057 1
1 1108 . 17 1 1 A 98 98 GLY N N 98 110.658 110.211 0.447 1
1 1109 . 17 1 1 A 99 99 PRO HA H 99 4.463 4.633 -0.170 1
1 1116 . 17 1 1 A 99 99 PRO CA C 99 63.230 62.352 0.878 1
1 1117 . 17 1 1 A 99 99 PRO CB C 99 32.044 29.556 2.488 1
1 1120 . 17 1 1 A 100 100 SER H H 100 8.514 7.976 0.538 1
1 1121 . 17 1 1 A 100 100 SER CA C 100 58.450 60.579 -2.129 1
1 1122 . 17 1 1 A 100 100 SER CB C 100 63.889 63.276 0.613 1
1 1 . 18 1 1 A 9 9 ASN H H 9 8.856 9.121 -0.265 1
1 2 . 18 1 1 A 9 9 ASN HA H 9 4.694 5.517 -0.823 1
1 7 . 18 1 1 A 9 9 ASN CA C 9 53.401 51.941 1.460 1
1 8 . 18 1 1 A 9 9 ASN CB C 9 38.757 41.516 -2.759 1
1 10 . 18 1 1 A 10 10 ARG HA H 10 4.346 4.764 -0.418 1
1 17 . 18 1 1 A 10 10 ARG C C 10 175.405 175.079 0.326 1
1 18 . 18 1 1 A 10 10 ARG CA C 10 56.181 55.061 1.120 1
1 19 . 18 1 1 A 10 10 ARG CB C 10 31.171 30.607 0.564 1
1 22 . 18 1 1 A 11 11 PHE H H 11 8.310 8.654 -0.344 1
1 23 . 18 1 1 A 11 11 PHE HA H 11 4.291 4.850 -0.559 1
1 31 . 18 1 1 A 11 11 PHE C C 11 174.458 172.617 1.841 1
1 32 . 18 1 1 A 11 11 PHE CA C 11 58.967 58.118 0.849 1
1 33 . 18 1 1 A 11 11 PHE CB C 11 40.138 42.250 -2.112 1
1 39 . 18 1 1 A 11 11 PHE N N 11 123.604 126.308 -2.704 1
1 40 . 18 1 1 A 12 12 LYS H H 12 7.307 8.271 -0.964 1
1 41 . 18 1 1 A 12 12 LYS HA H 12 4.165 4.693 -0.528 1
1 50 . 18 1 1 A 12 12 LYS C C 12 174.385 175.557 -1.172 1
1 51 . 18 1 1 A 12 12 LYS CA C 12 54.593 54.014 0.579 1
1 52 . 18 1 1 A 12 12 LYS CB C 12 34.712 35.492 -0.780 1
1 56 . 18 1 1 A 12 12 LYS N N 12 127.282 127.341 -0.059 1
1 57 . 18 1 1 A 13 13 TRP H H 13 8.039 8.430 -0.391 1
1 58 . 18 1 1 A 13 13 TRP HA H 13 4.370 4.659 -0.289 1
1 67 . 18 1 1 A 13 13 TRP C C 13 177.857 176.713 1.144 1
1 68 . 18 1 1 A 13 13 TRP CA C 13 56.675 57.142 -0.467 1
1 69 . 18 1 1 A 13 13 TRP CB C 13 30.317 30.095 0.222 1
1 75 . 18 1 1 A 13 13 TRP N N 13 124.264 127.397 -3.133 1
1 77 . 18 1 1 A 14 14 GLY H H 14 9.815 8.665 1.150 1
1 78 . 18 1 1 A 14 14 GLY HA2 H 14 4.370 4.152 0.218 1
1 79 . 18 1 1 A 14 14 GLY HA3 H 14 4.335 4.175 0.160 1
1 80 . 18 1 1 A 14 14 GLY C C 14 172.904 174.713 -1.809 1
1 81 . 18 1 1 A 14 14 GLY CA C 14 44.157 43.909 0.248 1
1 82 . 18 1 1 A 14 14 GLY N N 14 115.294 109.446 5.848 1
1 83 . 18 1 1 A 15 15 PRO HA H 15 4.327 4.389 -0.062 1
1 90 . 18 1 1 A 15 15 PRO C C 15 179.726 178.826 0.900 1
1 91 . 18 1 1 A 15 15 PRO CA C 15 65.171 65.249 -0.078 1
1 92 . 18 1 1 A 15 15 PRO CB C 15 31.829 31.933 -0.104 1
1 95 . 18 1 1 A 16 16 ALA H H 16 9.214 8.148 1.066 1
1 96 . 18 1 1 A 16 16 ALA HA H 16 4.166 4.121 0.045 1
1 100 . 18 1 1 A 16 16 ALA C C 16 181.184 179.679 1.505 1
1 101 . 18 1 1 A 16 16 ALA CA C 16 55.370 55.255 0.115 1
1 102 . 18 1 1 A 16 16 ALA CB C 16 18.058 18.825 -0.767 1
1 103 . 18 1 1 A 16 16 ALA N N 16 122.414 119.855 2.559 1
1 104 . 18 1 1 A 17 17 SER H H 17 7.985 8.231 -0.246 1
1 105 . 18 1 1 A 17 17 SER HA H 17 4.317 4.132 0.185 1
1 107 . 18 1 1 A 17 17 SER C C 17 175.381 176.743 -1.362 1
1 108 . 18 1 1 A 17 17 SER CA C 17 63.163 62.203 0.960 1
1 109 . 18 1 1 A 17 17 SER CB C 17 64.055 62.991 1.064 1
1 110 . 18 1 1 A 17 17 SER N N 17 116.568 114.358 2.210 1
1 111 . 18 1 1 A 18 18 GLN H H 18 8.316 7.940 0.376 1
1 112 . 18 1 1 A 18 18 GLN HA H 18 3.323 3.475 -0.152 1
1 119 . 18 1 1 A 18 18 GLN C C 18 176.812 178.626 -1.814 1
1 120 . 18 1 1 A 18 18 GLN CA C 18 60.025 59.225 0.800 1
1 121 . 18 1 1 A 18 18 GLN CB C 18 28.686 28.560 0.126 1
1 123 . 18 1 1 A 18 18 GLN N N 18 119.002 120.931 -1.929 1
1 125 . 18 1 1 A 19 19 GLN H H 19 7.582 8.217 -0.635 1
1 126 . 18 1 1 A 19 19 GLN HA H 19 4.062 4.086 -0.024 1
1 133 . 18 1 1 A 19 19 GLN C C 19 178.488 178.610 -0.122 1
1 134 . 18 1 1 A 19 19 GLN CA C 19 59.248 59.205 0.043 1
1 135 . 18 1 1 A 19 19 GLN CB C 19 28.203 28.283 -0.080 1
1 137 . 18 1 1 A 19 19 GLN N N 19 116.221 118.836 -2.615 1
1 139 . 18 1 1 A 20 20 ILE H H 20 7.246 8.034 -0.788 1
1 140 . 18 1 1 A 20 20 ILE HA H 20 3.570 3.618 -0.048 1
1 150 . 18 1 1 A 20 20 ILE C C 20 178.999 178.471 0.528 1
1 151 . 18 1 1 A 20 20 ILE CA C 20 64.996 65.621 -0.625 1
1 152 . 18 1 1 A 20 20 ILE CB C 20 38.139 37.759 0.380 1
1 156 . 18 1 1 A 20 20 ILE N N 20 120.521 120.838 -0.317 1
1 157 . 18 1 1 A 21 21 LEU H H 21 8.034 7.915 0.119 1
1 158 . 18 1 1 A 21 21 LEU HA H 21 3.491 3.570 -0.079 1
1 168 . 18 1 1 A 21 21 LEU C C 21 178.196 178.504 -0.308 1
1 169 . 18 1 1 A 21 21 LEU CA C 21 57.944 57.450 0.494 1
1 170 . 18 1 1 A 21 21 LEU CB C 21 37.864 40.377 -2.513 1
1 174 . 18 1 1 A 21 21 LEU N N 21 121.259 118.908 2.351 1
1 175 . 18 1 1 A 22 22 TYR H H 22 8.479 7.650 0.829 1
1 176 . 18 1 1 A 22 22 TYR HA H 22 4.224 4.300 -0.076 1
1 183 . 18 1 1 A 22 22 TYR C C 22 179.630 178.547 1.083 1
1 184 . 18 1 1 A 22 22 TYR CA C 22 62.422 60.826 1.596 1
1 185 . 18 1 1 A 22 22 TYR CB C 22 37.434 37.660 -0.226 1
1 190 . 18 1 1 A 22 22 TYR N N 22 117.805 118.914 -1.109 1
1 191 . 18 1 1 A 23 23 GLN H H 23 7.707 8.237 -0.530 1
1 192 . 18 1 1 A 23 23 GLN HA H 23 4.166 4.046 0.120 1
1 199 . 18 1 1 A 23 23 GLN C C 23 178.633 178.573 0.060 1
1 200 . 18 1 1 A 23 23 GLN CA C 23 58.789 59.222 -0.433 1
1 201 . 18 1 1 A 23 23 GLN CB C 23 28.534 28.142 0.392 1
1 203 . 18 1 1 A 23 23 GLN N N 23 117.580 118.212 -0.632 1
1 205 . 18 1 1 A 24 24 ALA H H 24 8.155 7.887 0.268 1
1 206 . 18 1 1 A 24 24 ALA HA H 24 4.187 4.234 -0.047 1
1 210 . 18 1 1 A 24 24 ALA C C 24 180.018 179.177 0.841 1
1 211 . 18 1 1 A 24 24 ALA CA C 24 55.228 55.118 0.110 1
1 212 . 18 1 1 A 24 24 ALA CB C 24 19.468 18.647 0.821 1
1 213 . 18 1 1 A 24 24 ALA N N 24 122.813 122.442 0.371 1
1 214 . 18 1 1 A 25 25 TYR H H 25 8.995 8.501 0.494 1
1 215 . 18 1 1 A 25 25 TYR HA H 25 4.348 4.826 -0.478 1
1 222 . 18 1 1 A 25 25 TYR C C 25 175.792 177.356 -1.564 1
1 223 . 18 1 1 A 25 25 TYR CA C 25 61.681 61.796 -0.115 1
1 224 . 18 1 1 A 25 25 TYR CB C 25 38.175 38.535 -0.360 1
1 229 . 18 1 1 A 25 25 TYR N N 25 121.343 120.312 1.031 1
1 230 . 18 1 1 A 26 26 ASP H H 26 7.260 8.852 -1.592 1
1 231 . 18 1 1 A 26 26 ASP HA H 26 4.373 4.437 -0.064 1
1 234 . 18 1 1 A 26 26 ASP C C 26 177.322 178.724 -1.402 1
1 235 . 18 1 1 A 26 26 ASP CA C 26 56.603 57.775 -1.172 1
1 236 . 18 1 1 A 26 26 ASP CB C 26 41.060 41.821 -0.761 1
1 237 . 18 1 1 A 26 26 ASP N N 26 114.020 119.327 -5.307 1
1 238 . 18 1 1 A 27 27 ARG H H 27 7.343 7.871 -0.528 1
1 239 . 18 1 1 A 27 27 ARG HA H 27 4.302 4.360 -0.058 1
1 246 . 18 1 1 A 27 27 ARG C C 27 176.546 176.308 0.238 1
1 247 . 18 1 1 A 27 27 ARG CA C 27 57.563 58.076 -0.513 1
1 248 . 18 1 1 A 27 27 ARG CB C 27 31.500 31.154 0.346 1
1 251 . 18 1 1 A 27 27 ARG N N 27 116.729 117.547 -0.818 1
1 252 . 18 1 1 A 28 28 GLN H H 28 8.306 7.923 0.383 1
1 253 . 18 1 1 A 28 28 GLN HA H 28 4.396 4.696 -0.300 1
1 260 . 18 1 1 A 28 28 GLN C C 28 172.831 175.149 -2.318 1
1 261 . 18 1 1 A 28 28 GLN CA C 28 55.355 54.577 0.778 1
1 262 . 18 1 1 A 28 28 GLN CB C 28 31.062 31.543 -0.481 1
1 264 . 18 1 1 A 28 28 GLN N N 28 121.612 118.130 3.482 1
1 266 . 18 1 1 A 29 29 LYS H H 29 8.354 8.551 -0.197 1
1 267 . 18 1 1 A 29 29 LYS HA H 29 4.099 3.501 0.598 1
1 276 . 18 1 1 A 29 29 LYS C C 29 176.084 176.308 -0.224 1
1 277 . 18 1 1 A 29 29 LYS CA C 29 57.873 57.544 0.329 1
1 278 . 18 1 1 A 29 29 LYS CB C 29 33.313 32.716 0.597 1
1 282 . 18 1 1 A 29 29 LYS N N 29 125.038 123.745 1.293 1
1 283 . 18 1 1 A 30 30 ASN H H 30 8.856 8.001 0.855 1
1 284 . 18 1 1 A 30 30 ASN HA H 30 4.958 5.120 -0.162 1
1 289 . 18 1 1 A 30 30 ASN C C 30 171.179 172.655 -1.476 1
1 290 . 18 1 1 A 30 30 ASN CA C 30 50.891 50.366 0.525 1
1 291 . 18 1 1 A 30 30 ASN CB C 30 39.907 39.265 0.642 1
1 292 . 18 1 1 A 30 30 ASN N N 30 115.764 117.586 -1.822 1
1 294 . 18 1 1 A 31 31 PRO HA H 31 4.299 4.423 -0.124 1
1 301 . 18 1 1 A 31 31 PRO C C 31 177.493 176.839 0.654 1
1 302 . 18 1 1 A 31 31 PRO CA C 31 62.489 62.607 -0.118 1
1 303 . 18 1 1 A 31 31 PRO CB C 31 31.216 31.984 -0.768 1
1 306 . 18 1 1 A 32 32 SER H H 32 9.368 8.513 0.855 1
1 307 . 18 1 1 A 32 32 SER HA H 32 4.372 4.734 -0.362 1
1 310 . 18 1 1 A 32 32 SER C C 32 174.821 175.694 -0.873 1
1 311 . 18 1 1 A 32 32 SER CA C 32 57.203 58.081 -0.878 1
1 312 . 18 1 1 A 32 32 SER CB C 32 65.594 64.350 1.244 1
1 313 . 18 1 1 A 32 32 SER N N 32 120.847 117.935 2.912 1
1 314 . 18 1 1 A 33 33 LYS H H 33 9.152 8.969 0.183 1
1 315 . 18 1 1 A 33 33 LYS HA H 33 3.719 3.919 -0.200 1
1 324 . 18 1 1 A 33 33 LYS C C 33 177.833 178.255 -0.422 1
1 325 . 18 1 1 A 33 33 LYS CA C 33 61.188 60.212 0.976 1
1 326 . 18 1 1 A 33 33 LYS CB C 33 32.572 32.156 0.416 1
1 330 . 18 1 1 A 33 33 LYS N N 33 122.966 124.710 -1.744 1
1 331 . 18 1 1 A 34 34 GLU H H 34 8.902 8.257 0.645 1
1 332 . 18 1 1 A 34 34 GLU HA H 34 4.089 4.075 0.014 1
1 337 . 18 1 1 A 34 34 GLU C C 34 180.286 179.329 0.957 1
1 338 . 18 1 1 A 34 34 GLU CA C 34 60.483 59.338 1.145 1
1 339 . 18 1 1 A 34 34 GLU CB C 34 28.835 29.456 -0.621 1
1 341 . 18 1 1 A 34 34 GLU N N 34 117.645 118.892 -1.247 1
1 342 . 18 1 1 A 35 35 GLU H H 35 7.673 8.183 -0.510 1
1 343 . 18 1 1 A 35 35 GLU HA H 35 4.023 3.957 0.066 1
1 348 . 18 1 1 A 35 35 GLU C C 35 180.237 179.077 1.160 1
1 349 . 18 1 1 A 35 35 GLU CA C 35 59.214 59.407 -0.193 1
1 350 . 18 1 1 A 35 35 GLU CB C 35 30.099 29.242 0.857 1
1 352 . 18 1 1 A 35 35 GLU N N 35 121.077 120.071 1.006 1
1 353 . 18 1 1 A 36 36 ARG H H 36 8.932 8.195 0.737 1
1 354 . 18 1 1 A 36 36 ARG HA H 36 3.928 3.756 0.172 1
1 362 . 18 1 1 A 36 36 ARG C C 36 178.464 179.121 -0.657 1
1 363 . 18 1 1 A 36 36 ARG CA C 36 60.974 60.098 0.876 1
1 364 . 18 1 1 A 36 36 ARG CB C 36 31.171 29.973 1.198 1
1 367 . 18 1 1 A 36 36 ARG N N 36 119.441 120.181 -0.740 1
1 369 . 18 1 1 A 37 37 GLU H H 37 8.756 8.398 0.358 1
1 370 . 18 1 1 A 37 37 GLU HA H 37 3.948 4.074 -0.126 1
1 375 . 18 1 1 A 37 37 GLU C C 37 179.606 179.207 0.399 1
1 376 . 18 1 1 A 37 37 GLU CA C 37 60.094 59.320 0.774 1
1 377 . 18 1 1 A 37 37 GLU CB C 37 29.110 29.162 -0.052 1
1 379 . 18 1 1 A 37 37 GLU N N 37 119.017 119.796 -0.779 1
1 380 . 18 1 1 A 38 38 ALA H H 38 7.733 8.040 -0.307 1
1 381 . 18 1 1 A 38 38 ALA HA H 38 4.325 4.149 0.176 1
1 385 . 18 1 1 A 38 38 ALA C C 38 180.820 178.302 2.518 1
1 386 . 18 1 1 A 38 38 ALA CA C 38 55.194 54.232 0.962 1
1 387 . 18 1 1 A 38 38 ALA CB C 38 17.654 18.518 -0.864 1
1 388 . 18 1 1 A 38 38 ALA N N 38 122.889 121.688 1.201 1
1 389 . 18 1 1 A 39 39 LEU H H 39 7.740 7.982 -0.242 1
1 390 . 18 1 1 A 39 39 LEU HA H 39 4.176 4.295 -0.119 1
1 400 . 18 1 1 A 39 39 LEU C C 39 179.266 178.727 0.539 1
1 401 . 18 1 1 A 39 39 LEU CA C 39 57.944 55.996 1.948 1
1 402 . 18 1 1 A 39 39 LEU CB C 39 42.105 42.498 -0.393 1
1 406 . 18 1 1 A 39 39 LEU N N 39 119.783 116.577 3.206 1
1 407 . 18 1 1 A 40 40 VAL H H 40 8.451 8.214 0.237 1
1 408 . 18 1 1 A 40 40 VAL HA H 40 3.259 3.646 -0.387 1
1 416 . 18 1 1 A 40 40 VAL C C 40 177.153 177.692 -0.539 1
1 417 . 18 1 1 A 40 40 VAL CA C 40 67.254 66.930 0.324 1
1 418 . 18 1 1 A 40 40 VAL CB C 40 31.747 31.481 0.266 1
1 421 . 18 1 1 A 40 40 VAL N N 40 121.481 119.865 1.616 1
1 422 . 18 1 1 A 41 41 GLU H H 41 7.254 7.969 -0.715 1
1 423 . 18 1 1 A 41 41 GLU HA H 41 4.159 4.131 0.028 1
1 428 . 18 1 1 A 41 41 GLU C C 41 179.483 178.818 0.665 1
1 429 . 18 1 1 A 41 41 GLU CA C 41 59.248 59.346 -0.098 1
1 430 . 18 1 1 A 41 41 GLU CB C 41 29.358 29.516 -0.158 1
1 432 . 18 1 1 A 41 41 GLU N N 41 116.549 119.850 -3.301 1
1 433 . 18 1 1 A 42 42 GLU H H 42 8.103 7.747 0.356 1
1 434 . 18 1 1 A 42 42 GLU HA H 42 4.020 4.052 -0.032 1
1 439 . 18 1 1 A 42 42 GLU C C 42 180.115 178.785 1.330 1
1 440 . 18 1 1 A 42 42 GLU CA C 42 59.847 59.520 0.327 1
1 441 . 18 1 1 A 42 42 GLU CB C 42 30.218 29.352 0.866 1
1 443 . 18 1 1 A 42 42 GLU N N 42 119.578 119.355 0.223 1
1 444 . 18 1 1 A 43 43 CYS H H 43 8.955 8.023 0.932 1
1 445 . 18 1 1 A 43 43 CYS HA H 43 4.153 4.238 -0.085 1
1 448 . 18 1 1 A 43 43 CYS C C 43 176.498 177.636 -1.138 1
1 449 . 18 1 1 A 43 43 CYS CA C 43 64.856 62.396 2.460 1
1 450 . 18 1 1 A 43 43 CYS CB C 43 27.390 27.822 -0.432 1
1 451 . 18 1 1 A 43 43 CYS N N 43 118.199 118.837 -0.638 1
1 452 . 18 1 1 A 44 44 ASN H H 44 8.543 7.879 0.664 1
1 453 . 18 1 1 A 44 44 ASN HA H 44 4.635 4.444 0.191 1
1 458 . 18 1 1 A 44 44 ASN C C 44 178.633 177.777 0.856 1
1 459 . 18 1 1 A 44 44 ASN CA C 44 56.603 56.314 0.289 1
1 460 . 18 1 1 A 44 44 ASN CB C 44 37.187 38.250 -1.063 1
1 461 . 18 1 1 A 44 44 ASN N N 44 117.002 119.653 -2.651 1
1 463 . 18 1 1 A 45 45 ARG H H 45 8.296 8.204 0.092 1
1 464 . 18 1 1 A 45 45 ARG HA H 45 3.977 4.100 -0.123 1
1 471 . 18 1 1 A 45 45 ARG C C 45 178.149 178.360 -0.211 1
1 472 . 18 1 1 A 45 45 ARG CA C 45 60.589 59.397 1.192 1
1 473 . 18 1 1 A 45 45 ARG CB C 45 30.099 30.309 -0.210 1
1 476 . 18 1 1 A 45 45 ARG N N 45 121.021 120.787 0.234 1
1 477 . 18 1 1 A 46 46 ALA H H 46 7.914 8.410 -0.496 1
1 478 . 18 1 1 A 46 46 ALA HA H 46 4.128 4.110 0.018 1
1 482 . 18 1 1 A 46 46 ALA C C 46 181.208 180.127 1.081 1
1 483 . 18 1 1 A 46 46 ALA CA C 46 55.264 54.975 0.289 1
1 484 . 18 1 1 A 46 46 ALA CB C 46 18.759 18.612 0.147 1
1 485 . 18 1 1 A 46 46 ALA N N 46 121.570 120.711 0.859 1
1 486 . 18 1 1 A 47 47 GLU H H 47 8.730 8.646 0.084 1
1 487 . 18 1 1 A 47 47 GLU HA H 47 4.194 4.042 0.152 1
1 492 . 18 1 1 A 47 47 GLU C C 47 180.115 178.996 1.119 1
1 493 . 18 1 1 A 47 47 GLU CA C 47 58.401 59.263 -0.862 1
1 494 . 18 1 1 A 47 47 GLU CB C 47 29.523 29.330 0.193 1
1 496 . 18 1 1 A 47 47 GLU N N 47 117.532 118.150 -0.618 1
1 497 . 18 1 1 A 48 48 CYS H H 48 8.283 7.843 0.440 1
1 498 . 18 1 1 A 48 48 CYS HA H 48 4.002 4.124 -0.122 1
1 501 . 18 1 1 A 48 48 CYS C C 48 177.031 177.386 -0.355 1
1 502 . 18 1 1 A 48 48 CYS CA C 48 64.749 63.918 0.831 1
1 503 . 18 1 1 A 48 48 CYS CB C 48 25.907 27.205 -1.298 1
1 504 . 18 1 1 A 48 48 CYS N N 48 118.282 119.177 -0.895 1
1 505 . 18 1 1 A 49 49 LEU H H 49 8.181 8.126 0.055 1
1 506 . 18 1 1 A 49 49 LEU HA H 49 4.175 3.938 0.237 1
1 516 . 18 1 1 A 49 49 LEU C C 49 180.430 178.768 1.662 1
1 517 . 18 1 1 A 49 49 LEU CA C 49 57.873 58.176 -0.303 1
1 518 . 18 1 1 A 49 49 LEU CB C 49 41.539 41.765 -0.226 1
1 522 . 18 1 1 A 49 49 LEU N N 49 120.371 120.753 -0.382 1
1 523 . 18 1 1 A 50 50 GLN H H 50 7.934 8.578 -0.644 1
1 524 . 18 1 1 A 50 50 GLN HA H 50 4.102 4.061 0.041 1
1 531 . 18 1 1 A 50 50 GLN C C 50 177.322 177.215 0.107 1
1 532 . 18 1 1 A 50 50 GLN CA C 50 58.156 58.687 -0.531 1
1 533 . 18 1 1 A 50 50 GLN CB C 50 28.616 28.625 -0.009 1
1 535 . 18 1 1 A 50 50 GLN N N 50 118.175 117.471 0.704 1
1 537 . 18 1 1 A 51 51 ARG H H 51 7.632 7.779 -0.147 1
1 538 . 18 1 1 A 51 51 ARG HA H 51 4.347 4.356 -0.009 1
1 545 . 18 1 1 A 51 51 ARG C C 51 176.546 176.478 0.068 1
1 546 . 18 1 1 A 51 51 ARG CA C 51 56.286 55.916 0.370 1
1 547 . 18 1 1 A 51 51 ARG CB C 51 31.314 30.167 1.147 1
1 550 . 18 1 1 A 51 51 ARG N N 51 116.454 117.840 -1.386 1
1 551 . 18 1 1 A 52 52 GLY H H 52 7.949 8.323 -0.374 1
1 552 . 18 1 1 A 52 52 GLY HA2 H 52 4.033 3.968 0.065 1
1 553 . 18 1 1 A 52 52 GLY HA3 H 52 3.903 3.969 -0.066 1
1 554 . 18 1 1 A 52 52 GLY C C 52 174.385 174.188 0.197 1
1 555 . 18 1 1 A 52 52 GLY CA C 52 46.231 45.286 0.945 1
1 556 . 18 1 1 A 52 52 GLY N N 52 108.854 107.675 1.179 1
1 557 . 18 1 1 A 53 53 VAL H H 53 7.944 7.524 0.420 1
1 558 . 18 1 1 A 53 53 VAL HA H 53 4.250 4.070 0.180 1
1 566 . 18 1 1 A 53 53 VAL C C 53 175.525 174.985 0.540 1
1 567 . 18 1 1 A 53 53 VAL CA C 53 60.377 62.504 -2.127 1
1 568 . 18 1 1 A 53 53 VAL CB C 53 34.283 32.846 1.437 1
1 571 . 18 1 1 A 53 53 VAL N N 53 118.316 120.738 -2.422 1
1 572 . 18 1 1 A 54 54 SER H H 54 8.502 8.499 0.003 1
1 573 . 18 1 1 A 54 54 SER HA H 54 4.625 4.927 -0.302 1
1 576 . 18 1 1 A 54 54 SER C C 54 174.603 174.044 0.559 1
1 577 . 18 1 1 A 54 54 SER CA C 54 56.092 54.190 1.902 1
1 578 . 18 1 1 A 54 54 SER CB C 54 63.697 63.721 -0.024 1
1 579 . 18 1 1 A 54 54 SER N N 54 120.337 118.273 2.064 1
1 580 . 18 1 1 A 55 55 PRO HA H 55 4.624 4.528 0.096 1
1 587 . 18 1 1 A 55 55 PRO C C 55 177.322 177.293 0.029 1
1 588 . 18 1 1 A 55 55 PRO CA C 55 64.431 64.208 0.223 1
1 589 . 18 1 1 A 55 55 PRO CB C 55 31.913 31.699 0.214 1
1 592 . 18 1 1 A 56 56 SER H H 56 7.931 8.437 -0.506 1
1 593 . 18 1 1 A 56 56 SER HA H 56 4.428 4.599 -0.171 1
1 596 . 18 1 1 A 56 56 SER C C 56 174.749 174.867 -0.118 1
1 597 . 18 1 1 A 56 56 SER CA C 56 59.130 58.926 0.204 1
1 598 . 18 1 1 A 56 56 SER CB C 56 63.056 63.846 -0.790 1
1 599 . 18 1 1 A 56 56 SER N N 56 112.637 112.901 -0.264 1
1 600 . 18 1 1 A 57 57 LYS H H 57 8.121 7.659 0.462 1
1 601 . 18 1 1 A 57 57 LYS HA H 57 4.467 4.936 -0.469 1
1 609 . 18 1 1 A 57 57 LYS C C 57 176.570 176.196 0.374 1
1 610 . 18 1 1 A 57 57 LYS CA C 57 55.264 55.004 0.260 1
1 611 . 18 1 1 A 57 57 LYS CB C 57 32.160 32.557 -0.397 1
1 615 . 18 1 1 A 57 57 LYS N N 57 123.185 118.069 5.116 1
1 616 . 18 1 1 A 58 58 ALA H H 58 7.886 7.975 -0.089 1
1 617 . 18 1 1 A 58 58 ALA HA H 58 3.923 3.900 0.023 1
1 621 . 18 1 1 A 58 58 ALA C C 58 177.469 179.661 -2.192 1
1 622 . 18 1 1 A 58 58 ALA CA C 58 54.276 54.794 -0.518 1
1 623 . 18 1 1 A 58 58 ALA CB C 58 18.271 18.684 -0.413 1
1 624 . 18 1 1 A 58 58 ALA N N 58 123.941 122.795 1.146 1
1 625 . 18 1 1 A 59 59 HIS H H 59 8.077 8.063 0.014 1
1 626 . 18 1 1 A 59 59 HIS HA H 59 4.420 4.405 0.015 1
1 631 . 18 1 1 A 59 59 HIS C C 59 177.542 177.648 -0.106 1
1 632 . 18 1 1 A 59 59 HIS CA C 59 57.767 58.460 -0.693 1
1 633 . 18 1 1 A 59 59 HIS CB C 59 29.852 28.789 1.063 1
1 636 . 18 1 1 A 59 59 HIS N N 59 115.566 115.886 -0.320 1
1 637 . 18 1 1 A 60 60 GLY H H 60 8.110 7.734 0.376 1
1 638 . 18 1 1 A 60 60 GLY HA2 H 60 3.873 3.416 0.457 1
1 639 . 18 1 1 A 60 60 GLY HA3 H 60 4.025 3.529 0.496 1
1 640 . 18 1 1 A 60 60 GLY C C 60 174.918 175.570 -0.652 1
1 641 . 18 1 1 A 60 60 GLY CA C 60 45.559 46.972 -1.413 1
1 642 . 18 1 1 A 60 60 GLY N N 60 109.216 110.047 -0.831 1
1 643 . 18 1 1 A 61 61 LEU H H 61 8.280 8.198 0.082 1
1 644 . 18 1 1 A 61 61 LEU HA H 61 4.198 3.958 0.240 1
1 654 . 18 1 1 A 61 61 LEU C C 61 178.900 177.547 1.353 1
1 655 . 18 1 1 A 61 61 LEU CA C 61 55.758 57.926 -2.168 1
1 656 . 18 1 1 A 61 61 LEU CB C 61 42.544 41.740 0.804 1
1 660 . 18 1 1 A 61 61 LEU N N 61 120.521 123.057 -2.536 1
1 661 . 18 1 1 A 62 62 GLY H H 62 8.184 8.080 0.104 1
1 662 . 18 1 1 A 62 62 GLY HA2 H 62 3.978 3.852 0.126 1
1 663 . 18 1 1 A 62 62 GLY HA3 H 62 3.817 3.853 -0.036 1
1 664 . 18 1 1 A 62 62 GLY C C 62 176.012 175.366 0.646 1
1 665 . 18 1 1 A 62 62 GLY CA C 62 46.767 47.300 -0.533 1
1 666 . 18 1 1 A 62 62 GLY N N 62 108.987 108.414 0.573 1
1 667 . 18 1 1 A 63 63 SER HA H 63 4.322 4.337 -0.015 1
1 670 . 18 1 1 A 63 63 SER C C 63 174.167 175.467 -1.300 1
1 671 . 18 1 1 A 63 63 SER CA C 63 59.919 60.791 -0.872 1
1 672 . 18 1 1 A 63 63 SER CB C 63 63.312 63.154 0.158 1
1 673 . 18 1 1 A 64 64 ASN H H 64 8.087 8.266 -0.179 1
1 674 . 18 1 1 A 64 64 ASN HA H 64 4.850 5.050 -0.200 1
1 679 . 18 1 1 A 64 64 ASN C C 64 173.899 175.033 -1.134 1
1 680 . 18 1 1 A 64 64 ASN CA C 64 53.218 53.326 -0.108 1
1 681 . 18 1 1 A 64 64 ASN CB C 64 39.164 38.787 0.377 1
1 682 . 18 1 1 A 64 64 ASN N N 64 118.041 117.456 0.585 1
1 684 . 18 1 1 A 65 65 LEU H H 65 7.293 7.446 -0.153 1
1 685 . 18 1 1 A 65 65 LEU HA H 65 3.995 4.695 -0.700 1
1 695 . 18 1 1 A 65 65 LEU C C 65 175.696 175.185 0.511 1
1 696 . 18 1 1 A 65 65 LEU CA C 65 56.005 54.302 1.703 1
1 697 . 18 1 1 A 65 65 LEU CB C 65 43.120 43.966 -0.846 1
1 701 . 18 1 1 A 65 65 LEU N N 65 120.953 122.790 -1.837 1
1 702 . 18 1 1 A 66 66 VAL H H 66 9.517 8.856 0.661 1
1 703 . 18 1 1 A 66 66 VAL HA H 66 3.481 4.329 -0.848 1
1 711 . 18 1 1 A 66 66 VAL C C 66 175.429 175.169 0.260 1
1 712 . 18 1 1 A 66 66 VAL CA C 66 65.243 61.418 3.825 1
1 713 . 18 1 1 A 66 66 VAL CB C 66 31.335 32.584 -1.249 1
1 716 . 18 1 1 A 66 66 VAL N N 66 127.924 126.864 1.060 1
1 717 . 18 1 1 A 67 67 THR H H 67 6.253 8.274 -2.021 1
1 718 . 18 1 1 A 67 67 THR HA H 67 4.779 4.770 0.009 1
1 723 . 18 1 1 A 67 67 THR C C 67 174.894 174.858 0.036 1
1 724 . 18 1 1 A 67 67 THR CA C 67 58.719 59.571 -0.852 1
1 725 . 18 1 1 A 67 67 THR CB C 67 72.153 71.806 0.347 1
1 727 . 18 1 1 A 67 67 THR N N 67 113.376 116.161 -2.785 1
1 728 . 18 1 1 A 68 68 GLU H H 68 9.348 8.867 0.481 1
1 729 . 18 1 1 A 68 68 GLU HA H 68 3.634 3.985 -0.351 1
1 734 . 18 1 1 A 68 68 GLU C C 68 177.809 178.332 -0.523 1
1 735 . 18 1 1 A 68 68 GLU CA C 68 61.505 59.979 1.526 1
1 736 . 18 1 1 A 68 68 GLU CB C 68 28.285 29.684 -1.399 1
1 738 . 18 1 1 A 68 68 GLU N N 68 124.534 122.128 2.406 1
1 739 . 18 1 1 A 69 69 VAL H H 69 8.126 8.052 0.074 1
1 740 . 18 1 1 A 69 69 VAL HA H 69 3.862 3.527 0.335 1
1 748 . 18 1 1 A 69 69 VAL C C 69 177.712 178.064 -0.352 1
1 749 . 18 1 1 A 69 69 VAL CA C 69 65.701 66.935 -1.234 1
1 750 . 18 1 1 A 69 69 VAL CB C 69 31.829 31.477 0.352 1
1 753 . 18 1 1 A 69 69 VAL N N 69 119.139 119.847 -0.708 1
1 754 . 18 1 1 A 70 70 ARG H H 70 7.235 7.798 -0.563 1
1 755 . 18 1 1 A 70 70 ARG HA H 70 4.265 3.987 0.278 1
1 762 . 18 1 1 A 70 70 ARG C C 70 180.430 179.402 1.028 1
1 763 . 18 1 1 A 70 70 ARG CA C 70 59.742 60.191 -0.449 1
1 764 . 18 1 1 A 70 70 ARG CB C 70 29.439 29.983 -0.544 1
1 767 . 18 1 1 A 70 70 ARG N N 70 119.541 119.445 0.096 1
1 768 . 18 1 1 A 71 71 VAL H H 71 8.144 8.071 0.073 1
1 769 . 18 1 1 A 71 71 VAL HA H 71 4.018 3.972 0.046 1
1 777 . 18 1 1 A 71 71 VAL C C 71 177.493 177.949 -0.456 1
1 778 . 18 1 1 A 71 71 VAL CA C 71 67.924 66.386 1.538 1
1 779 . 18 1 1 A 71 71 VAL CB C 71 32.289 31.601 0.688 1
1 782 . 18 1 1 A 71 71 VAL N N 71 120.755 120.060 0.695 1
1 783 . 18 1 1 A 72 72 TYR H H 72 9.411 8.598 0.813 1
1 784 . 18 1 1 A 72 72 TYR HA H 72 3.908 4.221 -0.313 1
1 791 . 18 1 1 A 72 72 TYR C C 72 178.464 178.127 0.337 1
1 792 . 18 1 1 A 72 72 TYR CA C 72 63.444 61.650 1.794 1
1 793 . 18 1 1 A 72 72 TYR CB C 72 38.211 38.579 -0.368 1
1 798 . 18 1 1 A 72 72 TYR N N 72 121.175 121.361 -0.186 1
1 799 . 18 1 1 A 73 73 ASN H H 73 8.816 8.683 0.133 1
1 800 . 18 1 1 A 73 73 ASN HA H 73 4.538 4.705 -0.167 1
1 805 . 18 1 1 A 73 73 ASN C C 73 176.958 178.042 -1.084 1
1 806 . 18 1 1 A 73 73 ASN CA C 73 56.109 56.733 -0.624 1
1 807 . 18 1 1 A 73 73 ASN CB C 73 38.422 38.355 0.067 1
1 808 . 18 1 1 A 73 73 ASN N N 73 118.122 117.880 0.242 1
1 810 . 18 1 1 A 74 74 TRP H H 74 8.657 8.294 0.363 1
1 811 . 18 1 1 A 74 74 TRP HA H 74 4.111 4.506 -0.395 1
1 820 . 18 1 1 A 74 74 TRP C C 74 179.654 178.560 1.094 1
1 821 . 18 1 1 A 74 74 TRP CA C 74 62.950 61.391 1.559 1
1 822 . 18 1 1 A 74 74 TRP CB C 74 29.555 29.756 -0.201 1
1 828 . 18 1 1 A 74 74 TRP N N 74 123.988 122.959 1.029 1
1 830 . 18 1 1 A 75 75 PHE H H 75 8.562 8.355 0.207 1
1 831 . 18 1 1 A 75 75 PHE HA H 75 3.821 4.449 -0.628 1
1 839 . 18 1 1 A 75 75 PHE C C 75 177.614 178.133 -0.519 1
1 840 . 18 1 1 A 75 75 PHE CA C 75 63.374 62.011 1.363 1
1 841 . 18 1 1 A 75 75 PHE CB C 75 39.648 38.041 1.607 1
1 847 . 18 1 1 A 75 75 PHE N N 75 118.325 117.434 0.891 1
1 848 . 18 1 1 A 76 76 ALA H H 76 8.305 8.160 0.145 1
1 849 . 18 1 1 A 76 76 ALA HA H 76 3.909 3.958 -0.049 1
1 853 . 18 1 1 A 76 76 ALA C C 76 180.868 179.772 1.096 1
1 854 . 18 1 1 A 76 76 ALA CA C 76 55.566 55.136 0.430 1
1 855 . 18 1 1 A 76 76 ALA CB C 76 17.820 18.105 -0.285 1
1 856 . 18 1 1 A 76 76 ALA N N 76 121.119 122.477 -1.358 1
1 857 . 18 1 1 A 77 77 ASN H H 77 8.335 7.961 0.374 1
1 858 . 18 1 1 A 77 77 ASN HA H 77 4.355 4.322 0.033 1
1 863 . 18 1 1 A 77 77 ASN C C 77 177.105 177.697 -0.592 1
1 864 . 18 1 1 A 77 77 ASN CA C 77 56.145 56.183 -0.038 1
1 865 . 18 1 1 A 77 77 ASN CB C 77 38.063 38.507 -0.444 1
1 866 . 18 1 1 A 77 77 ASN N N 77 117.433 116.652 0.781 1
1 868 . 18 1 1 A 78 78 ARG H H 78 7.664 7.443 0.221 1
1 869 . 18 1 1 A 78 78 ARG HA H 78 3.629 3.697 -0.068 1
1 876 . 18 1 1 A 78 78 ARG C C 78 179.216 177.841 1.375 1
1 877 . 18 1 1 A 78 78 ARG CA C 78 58.773 58.908 -0.135 1
1 878 . 18 1 1 A 78 78 ARG CB C 78 29.605 29.003 0.602 1
1 881 . 18 1 1 A 78 78 ARG N N 78 121.999 118.371 3.628 1
1 882 . 18 1 1 A 79 79 ARG H H 79 8.320 7.468 0.852 1
1 883 . 18 1 1 A 79 79 ARG HA H 79 4.307 4.296 0.011 1
1 890 . 18 1 1 A 79 79 ARG C C 79 180.406 178.342 2.064 1
1 891 . 18 1 1 A 79 79 ARG CA C 79 60.270 57.705 2.565 1
1 892 . 18 1 1 A 79 79 ARG CB C 79 31.335 30.569 0.766 1
1 895 . 18 1 1 A 79 79 ARG N N 79 118.139 117.834 0.305 1
1 896 . 18 1 1 A 80 80 LYS H H 80 7.759 7.835 -0.076 1
1 897 . 18 1 1 A 80 80 LYS HA H 80 4.052 4.167 -0.115 1
1 905 . 18 1 1 A 80 80 LYS C C 80 178.999 179.088 -0.089 1
1 906 . 18 1 1 A 80 80 LYS CA C 80 59.531 59.120 0.411 1
1 907 . 18 1 1 A 80 80 LYS CB C 80 32.374 32.321 0.053 1
1 911 . 18 1 1 A 80 80 LYS N N 80 120.899 119.119 1.780 1
1 912 . 18 1 1 A 81 81 GLU H H 81 8.041 8.422 -0.381 1
1 913 . 18 1 1 A 81 81 GLU HA H 81 4.044 4.159 -0.115 1
1 918 . 18 1 1 A 81 81 GLU C C 81 179.168 178.702 0.466 1
1 919 . 18 1 1 A 81 81 GLU CA C 81 59.036 59.561 -0.525 1
1 920 . 18 1 1 A 81 81 GLU CB C 81 29.561 29.197 0.364 1
1 922 . 18 1 1 A 81 81 GLU N N 81 120.193 118.247 1.946 1
1 923 . 18 1 1 A 82 82 GLU H H 82 8.131 7.981 0.150 1
1 924 . 18 1 1 A 82 82 GLU HA H 82 4.017 4.053 -0.036 1
1 929 . 18 1 1 A 82 82 GLU C C 82 178.343 178.232 0.111 1
1 930 . 18 1 1 A 82 82 GLU CA C 82 59.319 59.347 -0.028 1
1 931 . 18 1 1 A 82 82 GLU CB C 82 29.770 29.232 0.538 1
1 933 . 18 1 1 A 82 82 GLU N N 82 119.626 118.798 0.828 1
1 934 . 18 1 1 A 83 83 ALA H H 83 7.935 7.758 0.177 1
1 935 . 18 1 1 A 83 83 ALA HA H 83 4.180 4.181 -0.001 1
1 939 . 18 1 1 A 83 83 ALA C C 83 179.994 179.543 0.451 1
1 940 . 18 1 1 A 83 83 ALA CA C 83 54.629 54.101 0.528 1
1 941 . 18 1 1 A 83 83 ALA CB C 83 18.090 18.733 -0.643 1
1 942 . 18 1 1 A 83 83 ALA N N 83 121.476 122.348 -0.872 1
1 943 . 18 1 1 A 84 84 PHE H H 84 8.043 8.203 -0.160 1
1 944 . 18 1 1 A 84 84 PHE HA H 84 4.420 4.021 0.399 1
1 952 . 18 1 1 A 84 84 PHE C C 84 177.250 177.081 0.169 1
1 953 . 18 1 1 A 84 84 PHE CA C 84 60.059 61.472 -1.413 1
1 954 . 18 1 1 A 84 84 PHE CB C 84 38.952 39.378 -0.426 1
1 960 . 18 1 1 A 84 84 PHE N N 84 119.074 120.349 -1.275 1
1 961 . 18 1 1 A 85 85 ARG H H 85 8.031 7.861 0.170 1
1 962 . 18 1 1 A 85 85 ARG HA H 85 3.992 4.143 -0.151 1
1 968 . 18 1 1 A 85 85 ARG C C 85 178.319 178.186 0.133 1
1 969 . 18 1 1 A 85 85 ARG CA C 85 58.523 59.530 -1.007 1
1 970 . 18 1 1 A 85 85 ARG CB C 85 30.346 29.954 0.392 1
1 973 . 18 1 1 A 85 85 ARG N N 85 119.291 117.652 1.639 1
1 974 . 18 1 1 A 86 86 GLN H H 86 8.091 7.934 0.157 1
1 975 . 18 1 1 A 86 86 GLN HA H 86 4.148 4.316 -0.168 1
1 982 . 18 1 1 A 86 86 GLN C C 86 177.105 178.364 -1.259 1
1 983 . 18 1 1 A 86 86 GLN CA C 86 57.556 57.273 0.283 1
1 984 . 18 1 1 A 86 86 GLN CB C 86 28.855 29.498 -0.643 1
1 986 . 18 1 1 A 86 86 GLN N N 86 119.097 117.550 1.547 1
1 988 . 18 1 1 A 87 87 LYS H H 87 7.898 8.345 -0.447 1
1 989 . 18 1 1 A 87 87 LYS HA H 87 4.116 4.072 0.044 1
1 997 . 18 1 1 A 87 87 LYS C C 87 177.542 178.898 -1.356 1
1 998 . 18 1 1 A 87 87 LYS CA C 87 57.944 58.938 -0.994 1
1 999 . 18 1 1 A 87 87 LYS CB C 87 32.242 32.080 0.162 1
1 1003 . 18 1 1 A 87 87 LYS N N 87 120.968 122.308 -1.340 1
1 1004 . 18 1 1 A 88 88 LEU H H 88 7.903 8.063 -0.160 1
1 1005 . 18 1 1 A 88 88 LEU HA H 88 4.144 4.221 -0.077 1
1 1015 . 18 1 1 A 88 88 LEU C C 88 178.221 177.402 0.819 1
1 1016 . 18 1 1 A 88 88 LEU CA C 88 56.145 56.741 -0.596 1
1 1017 . 18 1 1 A 88 88 LEU CB C 88 42.215 41.121 1.094 1
1 1021 . 18 1 1 A 88 88 LEU N N 88 120.558 117.031 3.527 1
1 1022 . 18 1 1 A 89 89 ALA H H 89 7.894 7.441 0.453 1
1 1023 . 18 1 1 A 89 89 ALA HA H 89 4.224 4.386 -0.162 1
1 1027 . 18 1 1 A 89 89 ALA C C 89 178.609 179.322 -0.713 1
1 1028 . 18 1 1 A 89 89 ALA CA C 89 53.392 53.261 0.131 1
1 1029 . 18 1 1 A 89 89 ALA CB C 89 18.695 19.503 -0.808 1
1 1030 . 18 1 1 A 89 89 ALA N N 89 122.387 122.149 0.238 1
1 1031 . 18 1 1 A 90 90 MET H H 90 8.084 7.962 0.122 1
1 1032 . 18 1 1 A 90 90 MET HA H 90 4.356 4.216 0.140 1
1 1040 . 18 1 1 A 90 90 MET C C 90 176.982 176.717 0.265 1
1 1041 . 18 1 1 A 90 90 MET CA C 90 56.551 58.314 -1.763 1
1 1042 . 18 1 1 A 90 90 MET CB C 90 32.719 32.452 0.267 1
1 1045 . 18 1 1 A 90 90 MET N N 90 118.509 116.919 1.590 1
1 1046 . 18 1 1 A 91 91 ASP H H 91 8.261 7.491 0.770 1
1 1047 . 18 1 1 A 91 91 ASP HA H 91 4.524 4.651 -0.127 1
1 1050 . 18 1 1 A 91 91 ASP C C 91 176.643 175.916 0.727 1
1 1051 . 18 1 1 A 91 91 ASP CA C 91 54.981 54.544 0.437 1
1 1052 . 18 1 1 A 91 91 ASP CB C 91 40.870 41.849 -0.979 1
1 1053 . 18 1 1 A 91 91 ASP N N 91 120.771 119.708 1.063 1
1 1054 . 18 1 1 A 92 92 ALA H H 92 7.971 8.301 -0.330 1
1 1055 . 18 1 1 A 92 92 ALA HA H 92 4.200 4.227 -0.027 1
1 1059 . 18 1 1 A 92 92 ALA C C 92 177.929 176.648 1.281 1
1 1060 . 18 1 1 A 92 92 ALA CA C 92 53.184 52.556 0.628 1
1 1061 . 18 1 1 A 92 92 ALA CB C 92 18.890 19.050 -0.160 1
1 1062 . 18 1 1 A 92 92 ALA N N 92 123.057 123.539 -0.482 1
1 1063 . 18 1 1 A 93 93 TYR H H 93 8.019 8.732 -0.713 1
1 1064 . 18 1 1 A 93 93 TYR HA H 93 4.523 4.674 -0.151 1
1 1071 . 18 1 1 A 93 93 TYR C C 93 176.279 174.809 1.470 1
1 1072 . 18 1 1 A 93 93 TYR CA C 93 58.401 57.317 1.084 1
1 1073 . 18 1 1 A 93 93 TYR CB C 93 38.669 39.415 -0.746 1
1 1078 . 18 1 1 A 93 93 TYR N N 93 118.337 120.379 -2.042 1
1 1079 . 18 1 1 A 94 94 SER H H 94 8.037 8.544 -0.507 1
1 1080 . 18 1 1 A 94 94 SER HA H 94 4.484 4.632 -0.148 1
1 1082 . 18 1 1 A 94 94 SER C C 94 174.554 174.049 0.505 1
1 1083 . 18 1 1 A 94 94 SER CA C 94 58.401 56.765 1.636 1
1 1084 . 18 1 1 A 94 94 SER CB C 94 63.806 64.905 -1.099 1
1 1085 . 18 1 1 A 94 94 SER N N 94 116.640 121.960 -5.320 1
1 1086 . 18 1 1 A 96 96 ASN HA H 96 4.770 4.885 -0.115 1
1 1091 . 18 1 1 A 96 96 ASN C C 96 175.161 175.515 -0.354 1
1 1092 . 18 1 1 A 96 96 ASN CA C 96 53.395 52.996 0.399 1
1 1093 . 18 1 1 A 96 96 ASN CB C 96 38.999 39.551 -0.552 1
1 1095 . 18 1 1 A 97 97 SER H H 97 8.230 8.553 -0.323 1
1 1096 . 18 1 1 A 97 97 SER HA H 97 4.481 4.808 -0.327 1
1 1099 . 18 1 1 A 97 97 SER C C 97 174.482 173.943 0.539 1
1 1100 . 18 1 1 A 97 97 SER CA C 97 58.300 56.695 1.605 1
1 1101 . 18 1 1 A 97 97 SER CB C 97 63.697 63.496 0.201 1
1 1102 . 18 1 1 A 97 97 SER N N 97 115.866 113.294 2.572 1
1 1103 . 18 1 1 A 98 98 GLY H H 98 8.228 7.577 0.651 1
1 1104 . 18 1 1 A 98 98 GLY HA2 H 98 4.098 4.278 -0.180 1
1 1105 . 18 1 1 A 98 98 GLY HA3 H 98 4.098 4.279 -0.181 1
1 1106 . 18 1 1 A 98 98 GLY C C 98 171.788 172.559 -0.771 1
1 1107 . 18 1 1 A 98 98 GLY CA C 98 44.803 45.309 -0.506 1
1 1108 . 18 1 1 A 98 98 GLY N N 98 110.658 109.728 0.930 1
1 1109 . 18 1 1 A 99 99 PRO HA H 99 4.463 4.626 -0.163 1
1 1116 . 18 1 1 A 99 99 PRO CA C 99 63.230 62.185 1.045 1
1 1117 . 18 1 1 A 99 99 PRO CB C 99 32.044 29.713 2.331 1
1 1120 . 18 1 1 A 100 100 SER H H 100 8.514 8.256 0.258 1
1 1121 . 18 1 1 A 100 100 SER CA C 100 58.450 61.255 -2.805 1
1 1122 . 18 1 1 A 100 100 SER CB C 100 63.889 63.282 0.607 1
1 1 . 19 1 1 A 9 9 ASN H H 9 8.856 8.484 0.372 1
1 2 . 19 1 1 A 9 9 ASN HA H 9 4.694 5.117 -0.423 1
1 7 . 19 1 1 A 9 9 ASN CA C 9 53.401 51.950 1.451 1
1 8 . 19 1 1 A 9 9 ASN CB C 9 38.757 40.444 -1.687 1
1 10 . 19 1 1 A 10 10 ARG HA H 10 4.346 4.220 0.126 1
1 17 . 19 1 1 A 10 10 ARG C C 10 175.405 175.793 -0.388 1
1 18 . 19 1 1 A 10 10 ARG CA C 10 56.181 57.146 -0.965 1
1 19 . 19 1 1 A 10 10 ARG CB C 10 31.171 30.864 0.307 1
1 22 . 19 1 1 A 11 11 PHE H H 11 8.310 8.814 -0.504 1
1 23 . 19 1 1 A 11 11 PHE HA H 11 4.291 4.537 -0.246 1
1 31 . 19 1 1 A 11 11 PHE C C 11 174.458 174.183 0.275 1
1 32 . 19 1 1 A 11 11 PHE CA C 11 58.967 56.927 2.040 1
1 33 . 19 1 1 A 11 11 PHE CB C 11 40.138 38.901 1.237 1
1 39 . 19 1 1 A 11 11 PHE N N 11 123.604 128.045 -4.441 1
1 40 . 19 1 1 A 12 12 LYS H H 12 7.307 8.361 -1.054 1
1 41 . 19 1 1 A 12 12 LYS HA H 12 4.165 4.254 -0.089 1
1 50 . 19 1 1 A 12 12 LYS C C 12 174.385 176.239 -1.854 1
1 51 . 19 1 1 A 12 12 LYS CA C 12 54.593 55.409 -0.816 1
1 52 . 19 1 1 A 12 12 LYS CB C 12 34.712 33.287 1.425 1
1 56 . 19 1 1 A 12 12 LYS N N 12 127.282 128.240 -0.958 1
1 57 . 19 1 1 A 13 13 TRP H H 13 8.039 8.328 -0.289 1
1 58 . 19 1 1 A 13 13 TRP HA H 13 4.370 4.503 -0.133 1
1 67 . 19 1 1 A 13 13 TRP C C 13 177.857 176.912 0.945 1
1 68 . 19 1 1 A 13 13 TRP CA C 13 56.675 57.109 -0.434 1
1 69 . 19 1 1 A 13 13 TRP CB C 13 30.317 30.455 -0.138 1
1 75 . 19 1 1 A 13 13 TRP N N 13 124.264 127.504 -3.240 1
1 77 . 19 1 1 A 14 14 GLY H H 14 9.815 8.762 1.053 1
1 78 . 19 1 1 A 14 14 GLY HA2 H 14 4.370 4.114 0.256 1
1 79 . 19 1 1 A 14 14 GLY HA3 H 14 4.335 4.148 0.187 1
1 80 . 19 1 1 A 14 14 GLY C C 14 172.904 174.792 -1.888 1
1 81 . 19 1 1 A 14 14 GLY CA C 14 44.157 44.133 0.024 1
1 82 . 19 1 1 A 14 14 GLY N N 14 115.294 109.820 5.474 1
1 83 . 19 1 1 A 15 15 PRO HA H 15 4.327 4.387 -0.060 1
1 90 . 19 1 1 A 15 15 PRO C C 15 179.726 178.890 0.836 1
1 91 . 19 1 1 A 15 15 PRO CA C 15 65.171 65.287 -0.116 1
1 92 . 19 1 1 A 15 15 PRO CB C 15 31.829 31.832 -0.003 1
1 95 . 19 1 1 A 16 16 ALA H H 16 9.214 8.141 1.073 1
1 96 . 19 1 1 A 16 16 ALA HA H 16 4.166 4.101 0.065 1
1 100 . 19 1 1 A 16 16 ALA C C 16 181.184 179.335 1.849 1
1 101 . 19 1 1 A 16 16 ALA CA C 16 55.370 55.175 0.195 1
1 102 . 19 1 1 A 16 16 ALA CB C 16 18.058 18.505 -0.447 1
1 103 . 19 1 1 A 16 16 ALA N N 16 122.414 119.720 2.694 1
1 104 . 19 1 1 A 17 17 SER H H 17 7.985 8.245 -0.260 1
1 105 . 19 1 1 A 17 17 SER HA H 17 4.317 4.196 0.121 1
1 107 . 19 1 1 A 17 17 SER C C 17 175.381 176.737 -1.356 1
1 108 . 19 1 1 A 17 17 SER CA C 17 63.163 61.618 1.545 1
1 109 . 19 1 1 A 17 17 SER CB C 17 64.055 62.778 1.277 1
1 110 . 19 1 1 A 17 17 SER N N 17 116.568 112.758 3.810 1
1 111 . 19 1 1 A 18 18 GLN H H 18 8.316 7.831 0.485 1
1 112 . 19 1 1 A 18 18 GLN HA H 18 3.323 3.603 -0.280 1
1 119 . 19 1 1 A 18 18 GLN C C 18 176.812 178.587 -1.775 1
1 120 . 19 1 1 A 18 18 GLN CA C 18 60.025 59.057 0.968 1
1 121 . 19 1 1 A 18 18 GLN CB C 18 28.686 28.470 0.216 1
1 123 . 19 1 1 A 18 18 GLN N N 18 119.002 120.989 -1.987 1
1 125 . 19 1 1 A 19 19 GLN H H 19 7.582 8.255 -0.673 1
1 126 . 19 1 1 A 19 19 GLN HA H 19 4.062 4.073 -0.011 1
1 133 . 19 1 1 A 19 19 GLN C C 19 178.488 178.560 -0.072 1
1 134 . 19 1 1 A 19 19 GLN CA C 19 59.248 59.195 0.053 1
1 135 . 19 1 1 A 19 19 GLN CB C 19 28.203 28.231 -0.028 1
1 137 . 19 1 1 A 19 19 GLN N N 19 116.221 119.101 -2.880 1
1 139 . 19 1 1 A 20 20 ILE H H 20 7.246 7.955 -0.709 1
1 140 . 19 1 1 A 20 20 ILE HA H 20 3.570 3.615 -0.045 1
1 150 . 19 1 1 A 20 20 ILE C C 20 178.999 178.460 0.539 1
1 151 . 19 1 1 A 20 20 ILE CA C 20 64.996 65.613 -0.617 1
1 152 . 19 1 1 A 20 20 ILE CB C 20 38.139 37.692 0.447 1
1 156 . 19 1 1 A 20 20 ILE N N 20 120.521 120.860 -0.339 1
1 157 . 19 1 1 A 21 21 LEU H H 21 8.034 8.068 -0.034 1
1 158 . 19 1 1 A 21 21 LEU HA H 21 3.491 3.562 -0.071 1
1 168 . 19 1 1 A 21 21 LEU C C 21 178.196 178.477 -0.281 1
1 169 . 19 1 1 A 21 21 LEU CA C 21 57.944 57.477 0.467 1
1 170 . 19 1 1 A 21 21 LEU CB C 21 37.864 40.520 -2.656 1
1 174 . 19 1 1 A 21 21 LEU N N 21 121.259 118.986 2.273 1
1 175 . 19 1 1 A 22 22 TYR H H 22 8.479 7.651 0.828 1
1 176 . 19 1 1 A 22 22 TYR HA H 22 4.224 4.282 -0.058 1
1 183 . 19 1 1 A 22 22 TYR C C 22 179.630 178.601 1.029 1
1 184 . 19 1 1 A 22 22 TYR CA C 22 62.422 60.755 1.667 1
1 185 . 19 1 1 A 22 22 TYR CB C 22 37.434 37.745 -0.311 1
1 190 . 19 1 1 A 22 22 TYR N N 22 117.805 118.910 -1.105 1
1 191 . 19 1 1 A 23 23 GLN H H 23 7.707 8.281 -0.574 1
1 192 . 19 1 1 A 23 23 GLN HA H 23 4.166 4.040 0.126 1
1 199 . 19 1 1 A 23 23 GLN C C 23 178.633 178.590 0.043 1
1 200 . 19 1 1 A 23 23 GLN CA C 23 58.789 59.138 -0.349 1
1 201 . 19 1 1 A 23 23 GLN CB C 23 28.534 28.172 0.362 1
1 203 . 19 1 1 A 23 23 GLN N N 23 117.580 118.338 -0.758 1
1 205 . 19 1 1 A 24 24 ALA H H 24 8.155 7.679 0.476 1
1 206 . 19 1 1 A 24 24 ALA HA H 24 4.187 4.157 0.030 1
1 210 . 19 1 1 A 24 24 ALA C C 24 180.018 179.100 0.918 1
1 211 . 19 1 1 A 24 24 ALA CA C 24 55.228 55.207 0.021 1
1 212 . 19 1 1 A 24 24 ALA CB C 24 19.468 18.860 0.608 1
1 213 . 19 1 1 A 24 24 ALA N N 24 122.813 122.359 0.454 1
1 214 . 19 1 1 A 25 25 TYR H H 25 8.995 8.830 0.165 1
1 215 . 19 1 1 A 25 25 TYR HA H 25 4.348 4.754 -0.406 1
1 222 . 19 1 1 A 25 25 TYR C C 25 175.792 177.566 -1.774 1
1 223 . 19 1 1 A 25 25 TYR CA C 25 61.681 62.261 -0.580 1
1 224 . 19 1 1 A 25 25 TYR CB C 25 38.175 38.849 -0.674 1
1 229 . 19 1 1 A 25 25 TYR N N 25 121.343 120.010 1.333 1
1 230 . 19 1 1 A 26 26 ASP H H 26 7.260 8.722 -1.462 1
1 231 . 19 1 1 A 26 26 ASP HA H 26 4.373 4.448 -0.075 1
1 234 . 19 1 1 A 26 26 ASP C C 26 177.322 178.321 -0.999 1
1 235 . 19 1 1 A 26 26 ASP CA C 26 56.603 57.607 -1.004 1
1 236 . 19 1 1 A 26 26 ASP CB C 26 41.060 41.687 -0.627 1
1 237 . 19 1 1 A 26 26 ASP N N 26 114.020 119.204 -5.184 1
1 238 . 19 1 1 A 27 27 ARG H H 27 7.343 7.868 -0.525 1
1 239 . 19 1 1 A 27 27 ARG HA H 27 4.302 4.370 -0.068 1
1 246 . 19 1 1 A 27 27 ARG C C 27 176.546 176.198 0.348 1
1 247 . 19 1 1 A 27 27 ARG CA C 27 57.563 57.749 -0.186 1
1 248 . 19 1 1 A 27 27 ARG CB C 27 31.500 31.325 0.175 1
1 251 . 19 1 1 A 27 27 ARG N N 27 116.729 116.965 -0.236 1
1 252 . 19 1 1 A 28 28 GLN H H 28 8.306 8.055 0.251 1
1 253 . 19 1 1 A 28 28 GLN HA H 28 4.396 4.696 -0.300 1
1 260 . 19 1 1 A 28 28 GLN C C 28 172.831 174.861 -2.030 1
1 261 . 19 1 1 A 28 28 GLN CA C 28 55.355 54.315 1.040 1
1 262 . 19 1 1 A 28 28 GLN CB C 28 31.062 31.863 -0.801 1
1 264 . 19 1 1 A 28 28 GLN N N 28 121.612 118.539 3.073 1
1 266 . 19 1 1 A 29 29 LYS H H 29 8.354 8.591 -0.237 1
1 267 . 19 1 1 A 29 29 LYS HA H 29 4.099 3.616 0.483 1
1 276 . 19 1 1 A 29 29 LYS C C 29 176.084 176.654 -0.570 1
1 277 . 19 1 1 A 29 29 LYS CA C 29 57.873 57.349 0.524 1
1 278 . 19 1 1 A 29 29 LYS CB C 29 33.313 32.924 0.389 1
1 282 . 19 1 1 A 29 29 LYS N N 29 125.038 123.581 1.457 1
1 283 . 19 1 1 A 30 30 ASN H H 30 8.856 8.134 0.722 1
1 284 . 19 1 1 A 30 30 ASN HA H 30 4.958 4.951 0.007 1
1 289 . 19 1 1 A 30 30 ASN C C 30 171.179 173.618 -2.439 1
1 290 . 19 1 1 A 30 30 ASN CA C 30 50.891 50.626 0.265 1
1 291 . 19 1 1 A 30 30 ASN CB C 30 39.907 38.663 1.244 1
1 292 . 19 1 1 A 30 30 ASN N N 30 115.764 114.568 1.196 1
1 294 . 19 1 1 A 31 31 PRO HA H 31 4.299 4.809 -0.510 1
1 301 . 19 1 1 A 31 31 PRO C C 31 177.493 176.902 0.591 1
1 302 . 19 1 1 A 31 31 PRO CA C 31 62.489 62.603 -0.114 1
1 303 . 19 1 1 A 31 31 PRO CB C 31 31.216 31.782 -0.566 1
1 306 . 19 1 1 A 32 32 SER H H 32 9.368 8.462 0.906 1
1 307 . 19 1 1 A 32 32 SER HA H 32 4.372 4.727 -0.355 1
1 310 . 19 1 1 A 32 32 SER C C 32 174.821 175.746 -0.925 1
1 311 . 19 1 1 A 32 32 SER CA C 32 57.203 57.691 -0.488 1
1 312 . 19 1 1 A 32 32 SER CB C 32 65.594 64.420 1.174 1
1 313 . 19 1 1 A 32 32 SER N N 32 120.847 117.913 2.934 1
1 314 . 19 1 1 A 33 33 LYS H H 33 9.152 8.974 0.178 1
1 315 . 19 1 1 A 33 33 LYS HA H 33 3.719 3.841 -0.122 1
1 324 . 19 1 1 A 33 33 LYS C C 33 177.833 178.339 -0.506 1
1 325 . 19 1 1 A 33 33 LYS CA C 33 61.188 60.320 0.868 1
1 326 . 19 1 1 A 33 33 LYS CB C 33 32.572 32.274 0.298 1
1 330 . 19 1 1 A 33 33 LYS N N 33 122.966 124.765 -1.799 1
1 331 . 19 1 1 A 34 34 GLU H H 34 8.902 8.436 0.466 1
1 332 . 19 1 1 A 34 34 GLU HA H 34 4.089 4.005 0.084 1
1 337 . 19 1 1 A 34 34 GLU C C 34 180.286 179.000 1.286 1
1 338 . 19 1 1 A 34 34 GLU CA C 34 60.483 59.458 1.025 1
1 339 . 19 1 1 A 34 34 GLU CB C 34 28.835 29.390 -0.555 1
1 341 . 19 1 1 A 34 34 GLU N N 34 117.645 117.973 -0.328 1
1 342 . 19 1 1 A 35 35 GLU H H 35 7.673 8.376 -0.703 1
1 343 . 19 1 1 A 35 35 GLU HA H 35 4.023 3.923 0.100 1
1 348 . 19 1 1 A 35 35 GLU C C 35 180.237 179.091 1.146 1
1 349 . 19 1 1 A 35 35 GLU CA C 35 59.214 59.470 -0.256 1
1 350 . 19 1 1 A 35 35 GLU CB C 35 30.099 29.319 0.780 1
1 352 . 19 1 1 A 35 35 GLU N N 35 121.077 120.062 1.015 1
1 353 . 19 1 1 A 36 36 ARG H H 36 8.932 8.298 0.634 1
1 354 . 19 1 1 A 36 36 ARG HA H 36 3.928 3.791 0.137 1
1 362 . 19 1 1 A 36 36 ARG C C 36 178.464 179.161 -0.697 1
1 363 . 19 1 1 A 36 36 ARG CA C 36 60.974 59.980 0.994 1
1 364 . 19 1 1 A 36 36 ARG CB C 36 31.171 29.758 1.413 1
1 367 . 19 1 1 A 36 36 ARG N N 36 119.441 120.052 -0.611 1
1 369 . 19 1 1 A 37 37 GLU H H 37 8.756 8.718 0.038 1
1 370 . 19 1 1 A 37 37 GLU HA H 37 3.948 4.112 -0.164 1
1 375 . 19 1 1 A 37 37 GLU C C 37 179.606 179.128 0.478 1
1 376 . 19 1 1 A 37 37 GLU CA C 37 60.094 59.032 1.062 1
1 377 . 19 1 1 A 37 37 GLU CB C 37 29.110 29.288 -0.178 1
1 379 . 19 1 1 A 37 37 GLU N N 37 119.017 119.948 -0.931 1
1 380 . 19 1 1 A 38 38 ALA H H 38 7.733 8.151 -0.418 1
1 381 . 19 1 1 A 38 38 ALA HA H 38 4.325 4.125 0.200 1
1 385 . 19 1 1 A 38 38 ALA C C 38 180.820 178.473 2.347 1
1 386 . 19 1 1 A 38 38 ALA CA C 38 55.194 54.492 0.702 1
1 387 . 19 1 1 A 38 38 ALA CB C 38 17.654 18.587 -0.933 1
1 388 . 19 1 1 A 38 38 ALA N N 38 122.889 121.924 0.965 1
1 389 . 19 1 1 A 39 39 LEU H H 39 7.740 7.731 0.009 1
1 390 . 19 1 1 A 39 39 LEU HA H 39 4.176 4.269 -0.093 1
1 400 . 19 1 1 A 39 39 LEU C C 39 179.266 178.819 0.447 1
1 401 . 19 1 1 A 39 39 LEU CA C 39 57.944 56.050 1.894 1
1 402 . 19 1 1 A 39 39 LEU CB C 39 42.105 42.403 -0.298 1
1 406 . 19 1 1 A 39 39 LEU N N 39 119.783 117.031 2.752 1
1 407 . 19 1 1 A 40 40 VAL H H 40 8.451 8.312 0.139 1
1 408 . 19 1 1 A 40 40 VAL HA H 40 3.259 3.600 -0.341 1
1 416 . 19 1 1 A 40 40 VAL C C 40 177.153 177.747 -0.594 1
1 417 . 19 1 1 A 40 40 VAL CA C 40 67.254 66.928 0.326 1
1 418 . 19 1 1 A 40 40 VAL CB C 40 31.747 31.415 0.332 1
1 421 . 19 1 1 A 40 40 VAL N N 40 121.481 119.901 1.580 1
1 422 . 19 1 1 A 41 41 GLU H H 41 7.254 7.981 -0.727 1
1 423 . 19 1 1 A 41 41 GLU HA H 41 4.159 4.124 0.035 1
1 428 . 19 1 1 A 41 41 GLU C C 41 179.483 178.902 0.581 1
1 429 . 19 1 1 A 41 41 GLU CA C 41 59.248 59.378 -0.130 1
1 430 . 19 1 1 A 41 41 GLU CB C 41 29.358 29.329 0.029 1
1 432 . 19 1 1 A 41 41 GLU N N 41 116.549 119.819 -3.270 1
1 433 . 19 1 1 A 42 42 GLU H H 42 8.103 7.718 0.385 1
1 434 . 19 1 1 A 42 42 GLU HA H 42 4.020 4.051 -0.031 1
1 439 . 19 1 1 A 42 42 GLU C C 42 180.115 178.780 1.335 1
1 440 . 19 1 1 A 42 42 GLU CA C 42 59.847 59.529 0.318 1
1 441 . 19 1 1 A 42 42 GLU CB C 42 30.218 29.337 0.881 1
1 443 . 19 1 1 A 42 42 GLU N N 42 119.578 119.235 0.343 1
1 444 . 19 1 1 A 43 43 CYS H H 43 8.955 8.063 0.892 1
1 445 . 19 1 1 A 43 43 CYS HA H 43 4.153 4.250 -0.097 1
1 448 . 19 1 1 A 43 43 CYS C C 43 176.498 177.480 -0.982 1
1 449 . 19 1 1 A 43 43 CYS CA C 43 64.856 62.336 2.520 1
1 450 . 19 1 1 A 43 43 CYS CB C 43 27.390 27.732 -0.342 1
1 451 . 19 1 1 A 43 43 CYS N N 43 118.199 118.908 -0.709 1
1 452 . 19 1 1 A 44 44 ASN H H 44 8.543 7.943 0.600 1
1 453 . 19 1 1 A 44 44 ASN HA H 44 4.635 4.426 0.209 1
1 458 . 19 1 1 A 44 44 ASN C C 44 178.633 177.598 1.035 1
1 459 . 19 1 1 A 44 44 ASN CA C 44 56.603 56.440 0.163 1
1 460 . 19 1 1 A 44 44 ASN CB C 44 37.187 38.133 -0.946 1
1 461 . 19 1 1 A 44 44 ASN N N 44 117.002 119.703 -2.701 1
1 463 . 19 1 1 A 45 45 ARG H H 45 8.296 8.355 -0.059 1
1 464 . 19 1 1 A 45 45 ARG HA H 45 3.977 4.004 -0.027 1
1 471 . 19 1 1 A 45 45 ARG C C 45 178.149 178.153 -0.004 1
1 472 . 19 1 1 A 45 45 ARG CA C 45 60.589 59.536 1.053 1
1 473 . 19 1 1 A 45 45 ARG CB C 45 30.099 30.068 0.031 1
1 476 . 19 1 1 A 45 45 ARG N N 45 121.021 121.102 -0.081 1
1 477 . 19 1 1 A 46 46 ALA H H 46 7.914 8.341 -0.427 1
1 478 . 19 1 1 A 46 46 ALA HA H 46 4.128 4.110 0.018 1
1 482 . 19 1 1 A 46 46 ALA C C 46 181.208 180.102 1.106 1
1 483 . 19 1 1 A 46 46 ALA CA C 46 55.264 54.929 0.335 1
1 484 . 19 1 1 A 46 46 ALA CB C 46 18.759 18.393 0.366 1
1 485 . 19 1 1 A 46 46 ALA N N 46 121.570 120.757 0.813 1
1 486 . 19 1 1 A 47 47 GLU H H 47 8.730 8.633 0.097 1
1 487 . 19 1 1 A 47 47 GLU HA H 47 4.194 4.053 0.141 1
1 492 . 19 1 1 A 47 47 GLU C C 47 180.115 179.099 1.016 1
1 493 . 19 1 1 A 47 47 GLU CA C 47 58.401 59.219 -0.818 1
1 494 . 19 1 1 A 47 47 GLU CB C 47 29.523 29.293 0.230 1
1 496 . 19 1 1 A 47 47 GLU N N 47 117.532 118.401 -0.869 1
1 497 . 19 1 1 A 48 48 CYS H H 48 8.283 7.921 0.362 1
1 498 . 19 1 1 A 48 48 CYS HA H 48 4.002 4.143 -0.141 1
1 501 . 19 1 1 A 48 48 CYS C C 48 177.031 177.439 -0.408 1
1 502 . 19 1 1 A 48 48 CYS CA C 48 64.749 63.871 0.878 1
1 503 . 19 1 1 A 48 48 CYS CB C 48 25.907 27.229 -1.322 1
1 504 . 19 1 1 A 48 48 CYS N N 48 118.282 119.205 -0.923 1
1 505 . 19 1 1 A 49 49 LEU H H 49 8.181 8.096 0.085 1
1 506 . 19 1 1 A 49 49 LEU HA H 49 4.175 3.927 0.248 1
1 516 . 19 1 1 A 49 49 LEU C C 49 180.430 178.774 1.656 1
1 517 . 19 1 1 A 49 49 LEU CA C 49 57.873 58.029 -0.156 1
1 518 . 19 1 1 A 49 49 LEU CB C 49 41.539 41.741 -0.202 1
1 522 . 19 1 1 A 49 49 LEU N N 49 120.371 120.725 -0.354 1
1 523 . 19 1 1 A 50 50 GLN H H 50 7.934 8.357 -0.423 1
1 524 . 19 1 1 A 50 50 GLN HA H 50 4.102 4.097 0.005 1
1 531 . 19 1 1 A 50 50 GLN C C 50 177.322 177.646 -0.324 1
1 532 . 19 1 1 A 50 50 GLN CA C 50 58.156 58.712 -0.556 1
1 533 . 19 1 1 A 50 50 GLN CB C 50 28.616 28.457 0.159 1
1 535 . 19 1 1 A 50 50 GLN N N 50 118.175 117.265 0.910 1
1 537 . 19 1 1 A 51 51 ARG H H 51 7.632 7.752 -0.120 1
1 538 . 19 1 1 A 51 51 ARG HA H 51 4.347 4.335 0.012 1
1 545 . 19 1 1 A 51 51 ARG C C 51 176.546 176.415 0.131 1
1 546 . 19 1 1 A 51 51 ARG CA C 51 56.286 55.982 0.304 1
1 547 . 19 1 1 A 51 51 ARG CB C 51 31.314 30.436 0.878 1
1 550 . 19 1 1 A 51 51 ARG N N 51 116.454 118.189 -1.735 1
1 551 . 19 1 1 A 52 52 GLY H H 52 7.949 8.446 -0.497 1
1 552 . 19 1 1 A 52 52 GLY HA2 H 52 4.033 3.981 0.052 1
1 553 . 19 1 1 A 52 52 GLY HA3 H 52 3.903 3.982 -0.079 1
1 554 . 19 1 1 A 52 52 GLY C C 52 174.385 174.424 -0.039 1
1 555 . 19 1 1 A 52 52 GLY CA C 52 46.231 45.065 1.166 1
1 556 . 19 1 1 A 52 52 GLY N N 52 108.854 107.560 1.294 1
1 557 . 19 1 1 A 53 53 VAL H H 53 7.944 7.580 0.364 1
1 558 . 19 1 1 A 53 53 VAL HA H 53 4.250 4.011 0.239 1
1 566 . 19 1 1 A 53 53 VAL C C 53 175.525 175.060 0.465 1
1 567 . 19 1 1 A 53 53 VAL CA C 53 60.377 62.594 -2.217 1
1 568 . 19 1 1 A 53 53 VAL CB C 53 34.283 32.839 1.444 1
1 571 . 19 1 1 A 53 53 VAL N N 53 118.316 120.709 -2.393 1
1 572 . 19 1 1 A 54 54 SER H H 54 8.502 8.503 -0.001 1
1 573 . 19 1 1 A 54 54 SER HA H 54 4.625 4.929 -0.304 1
1 576 . 19 1 1 A 54 54 SER C C 54 174.603 174.047 0.556 1
1 577 . 19 1 1 A 54 54 SER CA C 54 56.092 54.210 1.882 1
1 578 . 19 1 1 A 54 54 SER CB C 54 63.697 63.721 -0.024 1
1 579 . 19 1 1 A 54 54 SER N N 54 120.337 118.381 1.956 1
1 580 . 19 1 1 A 55 55 PRO HA H 55 4.624 4.528 0.096 1
1 587 . 19 1 1 A 55 55 PRO C C 55 177.322 177.582 -0.260 1
1 588 . 19 1 1 A 55 55 PRO CA C 55 64.431 64.194 0.237 1
1 589 . 19 1 1 A 55 55 PRO CB C 55 31.913 31.689 0.224 1
1 592 . 19 1 1 A 56 56 SER H H 56 7.931 8.307 -0.376 1
1 593 . 19 1 1 A 56 56 SER HA H 56 4.428 4.575 -0.147 1
1 596 . 19 1 1 A 56 56 SER C C 56 174.749 175.159 -0.410 1
1 597 . 19 1 1 A 56 56 SER CA C 56 59.130 59.364 -0.234 1
1 598 . 19 1 1 A 56 56 SER CB C 56 63.056 63.896 -0.840 1
1 599 . 19 1 1 A 56 56 SER N N 56 112.637 113.492 -0.855 1
1 600 . 19 1 1 A 57 57 LYS H H 57 8.121 7.638 0.483 1
1 601 . 19 1 1 A 57 57 LYS HA H 57 4.467 4.996 -0.529 1
1 609 . 19 1 1 A 57 57 LYS C C 57 176.570 176.150 0.420 1
1 610 . 19 1 1 A 57 57 LYS CA C 57 55.264 55.066 0.198 1
1 611 . 19 1 1 A 57 57 LYS CB C 57 32.160 32.660 -0.500 1
1 615 . 19 1 1 A 57 57 LYS N N 57 123.185 117.706 5.479 1
1 616 . 19 1 1 A 58 58 ALA H H 58 7.886 7.918 -0.032 1
1 617 . 19 1 1 A 58 58 ALA HA H 58 3.923 3.861 0.062 1
1 621 . 19 1 1 A 58 58 ALA C C 58 177.469 179.688 -2.219 1
1 622 . 19 1 1 A 58 58 ALA CA C 58 54.276 54.892 -0.616 1
1 623 . 19 1 1 A 58 58 ALA CB C 58 18.271 18.206 0.065 1
1 624 . 19 1 1 A 58 58 ALA N N 58 123.941 123.178 0.763 1
1 625 . 19 1 1 A 59 59 HIS H H 59 8.077 8.209 -0.132 1
1 626 . 19 1 1 A 59 59 HIS HA H 59 4.420 4.388 0.032 1
1 631 . 19 1 1 A 59 59 HIS C C 59 177.542 177.475 0.067 1
1 632 . 19 1 1 A 59 59 HIS CA C 59 57.767 58.584 -0.817 1
1 633 . 19 1 1 A 59 59 HIS CB C 59 29.852 28.599 1.253 1
1 636 . 19 1 1 A 59 59 HIS N N 59 115.566 115.488 0.078 1
1 637 . 19 1 1 A 60 60 GLY H H 60 8.110 7.866 0.244 1
1 638 . 19 1 1 A 60 60 GLY HA2 H 60 3.873 3.356 0.517 1
1 639 . 19 1 1 A 60 60 GLY HA3 H 60 4.025 3.468 0.557 1
1 640 . 19 1 1 A 60 60 GLY C C 60 174.918 175.843 -0.925 1
1 641 . 19 1 1 A 60 60 GLY CA C 60 45.559 46.999 -1.440 1
1 642 . 19 1 1 A 60 60 GLY N N 60 109.216 110.179 -0.963 1
1 643 . 19 1 1 A 61 61 LEU H H 61 8.280 8.509 -0.229 1
1 644 . 19 1 1 A 61 61 LEU HA H 61 4.198 3.932 0.266 1
1 654 . 19 1 1 A 61 61 LEU C C 61 178.900 177.574 1.326 1
1 655 . 19 1 1 A 61 61 LEU CA C 61 55.758 58.002 -2.244 1
1 656 . 19 1 1 A 61 61 LEU CB C 61 42.544 41.703 0.841 1
1 660 . 19 1 1 A 61 61 LEU N N 61 120.521 123.033 -2.512 1
1 661 . 19 1 1 A 62 62 GLY H H 62 8.184 8.056 0.128 1
1 662 . 19 1 1 A 62 62 GLY HA2 H 62 3.978 3.818 0.160 1
1 663 . 19 1 1 A 62 62 GLY HA3 H 62 3.817 3.823 -0.006 1
1 664 . 19 1 1 A 62 62 GLY C C 62 176.012 175.277 0.735 1
1 665 . 19 1 1 A 62 62 GLY CA C 62 46.767 47.328 -0.561 1
1 666 . 19 1 1 A 62 62 GLY N N 62 108.987 108.249 0.738 1
1 667 . 19 1 1 A 63 63 SER HA H 63 4.322 4.162 0.160 1
1 670 . 19 1 1 A 63 63 SER C C 63 174.167 176.291 -2.124 1
1 671 . 19 1 1 A 63 63 SER CA C 63 59.919 61.066 -1.147 1
1 672 . 19 1 1 A 63 63 SER CB C 63 63.312 63.135 0.177 1
1 673 . 19 1 1 A 64 64 ASN H H 64 8.087 7.960 0.127 1
1 674 . 19 1 1 A 64 64 ASN HA H 64 4.850 5.137 -0.287 1
1 679 . 19 1 1 A 64 64 ASN C C 64 173.899 175.082 -1.183 1
1 680 . 19 1 1 A 64 64 ASN CA C 64 53.218 52.915 0.303 1
1 681 . 19 1 1 A 64 64 ASN CB C 64 39.164 38.771 0.393 1
1 682 . 19 1 1 A 64 64 ASN N N 64 118.041 117.979 0.062 1
1 684 . 19 1 1 A 65 65 LEU H H 65 7.293 7.305 -0.012 1
1 685 . 19 1 1 A 65 65 LEU HA H 65 3.995 4.556 -0.561 1
1 695 . 19 1 1 A 65 65 LEU C C 65 175.696 175.295 0.401 1
1 696 . 19 1 1 A 65 65 LEU CA C 65 56.005 54.813 1.192 1
1 697 . 19 1 1 A 65 65 LEU CB C 65 43.120 43.535 -0.415 1
1 701 . 19 1 1 A 65 65 LEU N N 65 120.953 121.142 -0.189 1
1 702 . 19 1 1 A 66 66 VAL H H 66 9.517 8.954 0.563 1
1 703 . 19 1 1 A 66 66 VAL HA H 66 3.481 4.280 -0.799 1
1 711 . 19 1 1 A 66 66 VAL C C 66 175.429 175.269 0.160 1
1 712 . 19 1 1 A 66 66 VAL CA C 66 65.243 61.365 3.878 1
1 713 . 19 1 1 A 66 66 VAL CB C 66 31.335 32.939 -1.604 1
1 716 . 19 1 1 A 66 66 VAL N N 66 127.924 126.626 1.298 1
1 717 . 19 1 1 A 67 67 THR H H 67 6.253 8.325 -2.072 1
1 718 . 19 1 1 A 67 67 THR HA H 67 4.779 4.998 -0.219 1
1 723 . 19 1 1 A 67 67 THR C C 67 174.894 175.147 -0.253 1
1 724 . 19 1 1 A 67 67 THR CA C 67 58.719 59.487 -0.768 1
1 725 . 19 1 1 A 67 67 THR CB C 67 72.153 72.319 -0.166 1
1 727 . 19 1 1 A 67 67 THR N N 67 113.376 116.063 -2.687 1
1 728 . 19 1 1 A 68 68 GLU H H 68 9.348 8.898 0.450 1
1 729 . 19 1 1 A 68 68 GLU HA H 68 3.634 4.017 -0.383 1
1 734 . 19 1 1 A 68 68 GLU C C 68 177.809 178.316 -0.507 1
1 735 . 19 1 1 A 68 68 GLU CA C 68 61.505 59.954 1.551 1
1 736 . 19 1 1 A 68 68 GLU CB C 68 28.285 29.510 -1.225 1
1 738 . 19 1 1 A 68 68 GLU N N 68 124.534 122.301 2.233 1
1 739 . 19 1 1 A 69 69 VAL H H 69 8.126 7.868 0.258 1
1 740 . 19 1 1 A 69 69 VAL HA H 69 3.862 3.529 0.333 1
1 748 . 19 1 1 A 69 69 VAL C C 69 177.712 178.061 -0.349 1
1 749 . 19 1 1 A 69 69 VAL CA C 69 65.701 66.726 -1.025 1
1 750 . 19 1 1 A 69 69 VAL CB C 69 31.829 31.829 0.000 1
1 753 . 19 1 1 A 69 69 VAL N N 69 119.139 120.165 -1.026 1
1 754 . 19 1 1 A 70 70 ARG H H 70 7.235 8.420 -1.185 1
1 755 . 19 1 1 A 70 70 ARG HA H 70 4.265 4.088 0.177 1
1 762 . 19 1 1 A 70 70 ARG C C 70 180.430 179.534 0.896 1
1 763 . 19 1 1 A 70 70 ARG CA C 70 59.742 60.248 -0.506 1
1 764 . 19 1 1 A 70 70 ARG CB C 70 29.439 30.088 -0.649 1
1 767 . 19 1 1 A 70 70 ARG N N 70 119.541 119.229 0.312 1
1 768 . 19 1 1 A 71 71 VAL H H 71 8.144 8.108 0.036 1
1 769 . 19 1 1 A 71 71 VAL HA H 71 4.018 3.877 0.141 1
1 777 . 19 1 1 A 71 71 VAL C C 71 177.493 178.274 -0.781 1
1 778 . 19 1 1 A 71 71 VAL CA C 71 67.924 66.649 1.275 1
1 779 . 19 1 1 A 71 71 VAL CB C 71 32.289 31.528 0.761 1
1 782 . 19 1 1 A 71 71 VAL N N 71 120.755 120.351 0.404 1
1 783 . 19 1 1 A 72 72 TYR H H 72 9.411 8.310 1.101 1
1 784 . 19 1 1 A 72 72 TYR HA H 72 3.908 4.190 -0.282 1
1 791 . 19 1 1 A 72 72 TYR C C 72 178.464 177.836 0.628 1
1 792 . 19 1 1 A 72 72 TYR CA C 72 63.444 62.082 1.362 1
1 793 . 19 1 1 A 72 72 TYR CB C 72 38.211 38.895 -0.684 1
1 798 . 19 1 1 A 72 72 TYR N N 72 121.175 121.299 -0.124 1
1 799 . 19 1 1 A 73 73 ASN H H 73 8.816 8.623 0.193 1
1 800 . 19 1 1 A 73 73 ASN HA H 73 4.538 4.593 -0.055 1
1 805 . 19 1 1 A 73 73 ASN C C 73 176.958 178.120 -1.162 1
1 806 . 19 1 1 A 73 73 ASN CA C 73 56.109 56.670 -0.561 1
1 807 . 19 1 1 A 73 73 ASN CB C 73 38.422 38.820 -0.398 1
1 808 . 19 1 1 A 73 73 ASN N N 73 118.122 118.023 0.099 1
1 810 . 19 1 1 A 74 74 TRP H H 74 8.657 8.520 0.137 1
1 811 . 19 1 1 A 74 74 TRP HA H 74 4.111 4.393 -0.282 1
1 820 . 19 1 1 A 74 74 TRP C C 74 179.654 178.606 1.048 1
1 821 . 19 1 1 A 74 74 TRP CA C 74 62.950 61.107 1.843 1
1 822 . 19 1 1 A 74 74 TRP CB C 74 29.555 29.548 0.007 1
1 828 . 19 1 1 A 74 74 TRP N N 74 123.988 122.915 1.073 1
1 830 . 19 1 1 A 75 75 PHE H H 75 8.562 8.262 0.300 1
1 831 . 19 1 1 A 75 75 PHE HA H 75 3.821 4.399 -0.578 1
1 839 . 19 1 1 A 75 75 PHE C C 75 177.614 178.053 -0.439 1
1 840 . 19 1 1 A 75 75 PHE CA C 75 63.374 61.943 1.431 1
1 841 . 19 1 1 A 75 75 PHE CB C 75 39.648 38.204 1.444 1
1 847 . 19 1 1 A 75 75 PHE N N 75 118.325 117.147 1.178 1
1 848 . 19 1 1 A 76 76 ALA H H 76 8.305 8.253 0.052 1
1 849 . 19 1 1 A 76 76 ALA HA H 76 3.909 3.897 0.012 1
1 853 . 19 1 1 A 76 76 ALA C C 76 180.868 179.616 1.252 1
1 854 . 19 1 1 A 76 76 ALA CA C 76 55.566 55.199 0.367 1
1 855 . 19 1 1 A 76 76 ALA CB C 76 17.820 17.954 -0.134 1
1 856 . 19 1 1 A 76 76 ALA N N 76 121.119 122.354 -1.235 1
1 857 . 19 1 1 A 77 77 ASN H H 77 8.335 8.134 0.201 1
1 858 . 19 1 1 A 77 77 ASN HA H 77 4.355 4.364 -0.009 1
1 863 . 19 1 1 A 77 77 ASN C C 77 177.105 177.513 -0.408 1
1 864 . 19 1 1 A 77 77 ASN CA C 77 56.145 56.291 -0.146 1
1 865 . 19 1 1 A 77 77 ASN CB C 77 38.063 38.516 -0.453 1
1 866 . 19 1 1 A 77 77 ASN N N 77 117.433 116.291 1.142 1
1 868 . 19 1 1 A 78 78 ARG H H 78 7.664 7.359 0.305 1
1 869 . 19 1 1 A 78 78 ARG HA H 78 3.629 3.723 -0.094 1
1 876 . 19 1 1 A 78 78 ARG C C 78 179.216 177.921 1.295 1
1 877 . 19 1 1 A 78 78 ARG CA C 78 58.773 59.003 -0.230 1
1 878 . 19 1 1 A 78 78 ARG CB C 78 29.605 29.060 0.545 1
1 881 . 19 1 1 A 78 78 ARG N N 78 121.999 118.279 3.720 1
1 882 . 19 1 1 A 79 79 ARG H H 79 8.320 7.495 0.825 1
1 883 . 19 1 1 A 79 79 ARG HA H 79 4.307 4.304 0.003 1
1 890 . 19 1 1 A 79 79 ARG C C 79 180.406 178.457 1.949 1
1 891 . 19 1 1 A 79 79 ARG CA C 79 60.270 58.064 2.206 1
1 892 . 19 1 1 A 79 79 ARG CB C 79 31.335 30.495 0.840 1
1 895 . 19 1 1 A 79 79 ARG N N 79 118.139 118.122 0.017 1
1 896 . 19 1 1 A 80 80 LYS H H 80 7.759 7.787 -0.028 1
1 897 . 19 1 1 A 80 80 LYS HA H 80 4.052 4.178 -0.126 1
1 905 . 19 1 1 A 80 80 LYS C C 80 178.999 179.169 -0.170 1
1 906 . 19 1 1 A 80 80 LYS CA C 80 59.531 59.290 0.241 1
1 907 . 19 1 1 A 80 80 LYS CB C 80 32.374 32.169 0.205 1
1 911 . 19 1 1 A 80 80 LYS N N 80 120.899 119.273 1.626 1
1 912 . 19 1 1 A 81 81 GLU H H 81 8.041 8.302 -0.261 1
1 913 . 19 1 1 A 81 81 GLU HA H 81 4.044 4.160 -0.116 1
1 918 . 19 1 1 A 81 81 GLU C C 81 179.168 178.695 0.473 1
1 919 . 19 1 1 A 81 81 GLU CA C 81 59.036 59.536 -0.500 1
1 920 . 19 1 1 A 81 81 GLU CB C 81 29.561 29.171 0.390 1
1 922 . 19 1 1 A 81 81 GLU N N 81 120.193 118.303 1.890 1
1 923 . 19 1 1 A 82 82 GLU H H 82 8.131 7.967 0.164 1
1 924 . 19 1 1 A 82 82 GLU HA H 82 4.017 4.079 -0.062 1
1 929 . 19 1 1 A 82 82 GLU C C 82 178.343 178.278 0.065 1
1 930 . 19 1 1 A 82 82 GLU CA C 82 59.319 59.354 -0.035 1
1 931 . 19 1 1 A 82 82 GLU CB C 82 29.770 29.399 0.371 1
1 933 . 19 1 1 A 82 82 GLU N N 82 119.626 118.513 1.113 1
1 934 . 19 1 1 A 83 83 ALA H H 83 7.935 7.748 0.187 1
1 935 . 19 1 1 A 83 83 ALA HA H 83 4.180 4.171 0.009 1
1 939 . 19 1 1 A 83 83 ALA C C 83 179.994 179.558 0.436 1
1 940 . 19 1 1 A 83 83 ALA CA C 83 54.629 54.143 0.486 1
1 941 . 19 1 1 A 83 83 ALA CB C 83 18.090 18.730 -0.640 1
1 942 . 19 1 1 A 83 83 ALA N N 83 121.476 122.372 -0.896 1
1 943 . 19 1 1 A 84 84 PHE H H 84 8.043 8.077 -0.034 1
1 944 . 19 1 1 A 84 84 PHE HA H 84 4.420 4.061 0.359 1
1 952 . 19 1 1 A 84 84 PHE C C 84 177.250 177.107 0.143 1
1 953 . 19 1 1 A 84 84 PHE CA C 84 60.059 61.765 -1.706 1
1 954 . 19 1 1 A 84 84 PHE CB C 84 38.952 39.343 -0.391 1
1 960 . 19 1 1 A 84 84 PHE N N 84 119.074 120.559 -1.485 1
1 961 . 19 1 1 A 85 85 ARG H H 85 8.031 8.383 -0.352 1
1 962 . 19 1 1 A 85 85 ARG HA H 85 3.992 4.126 -0.134 1
1 968 . 19 1 1 A 85 85 ARG C C 85 178.319 178.416 -0.097 1
1 969 . 19 1 1 A 85 85 ARG CA C 85 58.523 59.630 -1.107 1
1 970 . 19 1 1 A 85 85 ARG CB C 85 30.346 30.008 0.338 1
1 973 . 19 1 1 A 85 85 ARG N N 85 119.291 117.416 1.875 1
1 974 . 19 1 1 A 86 86 GLN H H 86 8.091 7.804 0.287 1
1 975 . 19 1 1 A 86 86 GLN HA H 86 4.148 4.257 -0.109 1
1 982 . 19 1 1 A 86 86 GLN C C 86 177.105 178.203 -1.098 1
1 983 . 19 1 1 A 86 86 GLN CA C 86 57.556 57.425 0.131 1
1 984 . 19 1 1 A 86 86 GLN CB C 86 28.855 29.447 -0.592 1
1 986 . 19 1 1 A 86 86 GLN N N 86 119.097 117.607 1.490 1
1 988 . 19 1 1 A 87 87 LYS H H 87 7.898 8.063 -0.165 1
1 989 . 19 1 1 A 87 87 LYS HA H 87 4.116 4.016 0.100 1
1 997 . 19 1 1 A 87 87 LYS C C 87 177.542 179.651 -2.109 1
1 998 . 19 1 1 A 87 87 LYS CA C 87 57.944 59.218 -1.274 1
1 999 . 19 1 1 A 87 87 LYS CB C 87 32.242 31.747 0.495 1
1 1003 . 19 1 1 A 87 87 LYS N N 87 120.968 122.064 -1.096 1
1 1004 . 19 1 1 A 88 88 LEU H H 88 7.903 8.012 -0.109 1
1 1005 . 19 1 1 A 88 88 LEU HA H 88 4.144 4.004 0.140 1
1 1015 . 19 1 1 A 88 88 LEU C C 88 178.221 178.525 -0.304 1
1 1016 . 19 1 1 A 88 88 LEU CA C 88 56.145 57.353 -1.208 1
1 1017 . 19 1 1 A 88 88 LEU CB C 88 42.215 41.510 0.705 1
1 1021 . 19 1 1 A 88 88 LEU N N 88 120.558 117.466 3.092 1
1 1022 . 19 1 1 A 89 89 ALA H H 89 7.894 7.571 0.323 1
1 1023 . 19 1 1 A 89 89 ALA HA H 89 4.224 4.301 -0.077 1
1 1027 . 19 1 1 A 89 89 ALA C C 89 178.609 179.339 -0.730 1
1 1028 . 19 1 1 A 89 89 ALA CA C 89 53.392 54.487 -1.095 1
1 1029 . 19 1 1 A 89 89 ALA CB C 89 18.695 19.043 -0.348 1
1 1030 . 19 1 1 A 89 89 ALA N N 89 122.387 122.435 -0.048 1
1 1031 . 19 1 1 A 90 90 MET H H 90 8.084 7.970 0.114 1
1 1032 . 19 1 1 A 90 90 MET HA H 90 4.356 4.117 0.239 1
1 1040 . 19 1 1 A 90 90 MET C C 90 176.982 176.991 -0.009 1
1 1041 . 19 1 1 A 90 90 MET CA C 90 56.551 58.275 -1.724 1
1 1042 . 19 1 1 A 90 90 MET CB C 90 32.719 32.550 0.169 1
1 1045 . 19 1 1 A 90 90 MET N N 90 118.509 116.459 2.050 1
1 1046 . 19 1 1 A 91 91 ASP H H 91 8.261 7.318 0.943 1
1 1047 . 19 1 1 A 91 91 ASP HA H 91 4.524 4.647 -0.123 1
1 1050 . 19 1 1 A 91 91 ASP C C 91 176.643 176.535 0.108 1
1 1051 . 19 1 1 A 91 91 ASP CA C 91 54.981 54.344 0.637 1
1 1052 . 19 1 1 A 91 91 ASP CB C 91 40.870 41.768 -0.898 1
1 1053 . 19 1 1 A 91 91 ASP N N 91 120.771 119.633 1.138 1
1 1054 . 19 1 1 A 92 92 ALA H H 92 7.971 8.888 -0.917 1
1 1055 . 19 1 1 A 92 92 ALA HA H 92 4.200 4.205 -0.005 1
1 1059 . 19 1 1 A 92 92 ALA C C 92 177.929 177.916 0.013 1
1 1060 . 19 1 1 A 92 92 ALA CA C 92 53.184 53.137 0.047 1
1 1061 . 19 1 1 A 92 92 ALA CB C 92 18.890 18.166 0.724 1
1 1062 . 19 1 1 A 92 92 ALA N N 92 123.057 120.278 2.779 1
1 1063 . 19 1 1 A 93 93 TYR H H 93 8.019 8.465 -0.446 1
1 1064 . 19 1 1 A 93 93 TYR HA H 93 4.523 4.390 0.133 1
1 1071 . 19 1 1 A 93 93 TYR C C 93 176.279 175.876 0.403 1
1 1072 . 19 1 1 A 93 93 TYR CA C 93 58.401 60.933 -2.532 1
1 1073 . 19 1 1 A 93 93 TYR CB C 93 38.669 37.435 1.234 1
1 1078 . 19 1 1 A 93 93 TYR N N 93 118.337 116.555 1.782 1
1 1079 . 19 1 1 A 94 94 SER H H 94 8.037 7.425 0.612 1
1 1080 . 19 1 1 A 94 94 SER HA H 94 4.484 4.228 0.256 1
1 1082 . 19 1 1 A 94 94 SER C C 94 174.554 173.833 0.721 1
1 1083 . 19 1 1 A 94 94 SER CA C 94 58.401 56.991 1.410 1
1 1084 . 19 1 1 A 94 94 SER CB C 94 63.806 64.202 -0.396 1
1 1085 . 19 1 1 A 94 94 SER N N 94 116.640 117.016 -0.376 1
1 1086 . 19 1 1 A 96 96 ASN HA H 96 4.770 4.932 -0.162 1
1 1091 . 19 1 1 A 96 96 ASN C C 96 175.161 175.313 -0.152 1
1 1092 . 19 1 1 A 96 96 ASN CA C 96 53.395 51.289 2.106 1
1 1093 . 19 1 1 A 96 96 ASN CB C 96 38.999 39.004 -0.005 1
1 1095 . 19 1 1 A 97 97 SER H H 97 8.230 8.611 -0.381 1
1 1096 . 19 1 1 A 97 97 SER HA H 97 4.481 4.025 0.456 1
1 1099 . 19 1 1 A 97 97 SER C C 97 174.482 175.722 -1.240 1
1 1100 . 19 1 1 A 97 97 SER CA C 97 58.300 60.552 -2.252 1
1 1101 . 19 1 1 A 97 97 SER CB C 97 63.697 62.809 0.888 1
1 1102 . 19 1 1 A 97 97 SER N N 97 115.866 116.136 -0.270 1
1 1103 . 19 1 1 A 98 98 GLY H H 98 8.228 9.017 -0.789 1
1 1104 . 19 1 1 A 98 98 GLY HA2 H 98 4.098 3.923 0.175 1
1 1105 . 19 1 1 A 98 98 GLY HA3 H 98 4.098 3.924 0.174 1
1 1106 . 19 1 1 A 98 98 GLY C C 98 171.788 175.468 -3.680 1
1 1107 . 19 1 1 A 98 98 GLY CA C 98 44.803 46.765 -1.962 1
1 1108 . 19 1 1 A 98 98 GLY N N 98 110.658 114.294 -3.636 1
1 1109 . 19 1 1 A 99 99 PRO HA H 99 4.463 4.544 -0.081 1
1 1116 . 19 1 1 A 99 99 PRO CA C 99 63.230 63.513 -0.283 1
1 1117 . 19 1 1 A 99 99 PRO CB C 99 32.044 32.059 -0.015 1
1 1120 . 19 1 1 A 100 100 SER H H 100 8.514 7.631 0.883 1
1 1121 . 19 1 1 A 100 100 SER CA C 100 58.450 60.539 -2.089 1
1 1122 . 19 1 1 A 100 100 SER CB C 100 63.889 63.645 0.244 1
1 1 . 20 1 1 A 9 9 ASN H H 9 8.856 8.032 0.824 1
1 2 . 20 1 1 A 9 9 ASN HA H 9 4.694 4.668 0.026 1
1 7 . 20 1 1 A 9 9 ASN CA C 9 53.401 53.488 -0.087 1
1 8 . 20 1 1 A 9 9 ASN CB C 9 38.757 38.816 -0.059 1
1 10 . 20 1 1 A 10 10 ARG HA H 10 4.346 4.555 -0.209 1
1 17 . 20 1 1 A 10 10 ARG C C 10 175.405 175.280 0.125 1
1 18 . 20 1 1 A 10 10 ARG CA C 10 56.181 55.339 0.842 1
1 19 . 20 1 1 A 10 10 ARG CB C 10 31.171 29.485 1.686 1
1 22 . 20 1 1 A 11 11 PHE H H 11 8.310 8.772 -0.462 1
1 23 . 20 1 1 A 11 11 PHE HA H 11 4.291 5.183 -0.892 1
1 31 . 20 1 1 A 11 11 PHE C C 11 174.458 174.258 0.200 1
1 32 . 20 1 1 A 11 11 PHE CA C 11 58.967 56.884 2.083 1
1 33 . 20 1 1 A 11 11 PHE CB C 11 40.138 42.452 -2.314 1
1 39 . 20 1 1 A 11 11 PHE N N 11 123.604 126.083 -2.479 1
1 40 . 20 1 1 A 12 12 LYS H H 12 7.307 8.137 -0.830 1
1 41 . 20 1 1 A 12 12 LYS HA H 12 4.165 4.237 -0.072 1
1 50 . 20 1 1 A 12 12 LYS C C 12 174.385 174.972 -0.587 1
1 51 . 20 1 1 A 12 12 LYS CA C 12 54.593 54.261 0.332 1
1 52 . 20 1 1 A 12 12 LYS CB C 12 34.712 36.043 -1.331 1
1 56 . 20 1 1 A 12 12 LYS N N 12 127.282 125.786 1.496 1
1 57 . 20 1 1 A 13 13 TRP H H 13 8.039 8.265 -0.226 1
1 58 . 20 1 1 A 13 13 TRP HA H 13 4.370 4.661 -0.291 1
1 67 . 20 1 1 A 13 13 TRP C C 13 177.857 176.537 1.320 1
1 68 . 20 1 1 A 13 13 TRP CA C 13 56.675 57.432 -0.757 1
1 69 . 20 1 1 A 13 13 TRP CB C 13 30.317 30.419 -0.102 1
1 75 . 20 1 1 A 13 13 TRP N N 13 124.264 126.942 -2.678 1
1 77 . 20 1 1 A 14 14 GLY H H 14 9.815 8.661 1.154 1
1 78 . 20 1 1 A 14 14 GLY HA2 H 14 4.370 4.206 0.164 1
1 79 . 20 1 1 A 14 14 GLY HA3 H 14 4.335 4.227 0.108 1
1 80 . 20 1 1 A 14 14 GLY C C 14 172.904 174.780 -1.876 1
1 81 . 20 1 1 A 14 14 GLY CA C 14 44.157 43.906 0.251 1
1 82 . 20 1 1 A 14 14 GLY N N 14 115.294 109.238 6.056 1
1 83 . 20 1 1 A 15 15 PRO HA H 15 4.327 4.392 -0.065 1
1 90 . 20 1 1 A 15 15 PRO C C 15 179.726 178.894 0.832 1
1 91 . 20 1 1 A 15 15 PRO CA C 15 65.171 65.361 -0.190 1
1 92 . 20 1 1 A 15 15 PRO CB C 15 31.829 31.822 0.007 1
1 95 . 20 1 1 A 16 16 ALA H H 16 9.214 8.141 1.073 1
1 96 . 20 1 1 A 16 16 ALA HA H 16 4.166 4.119 0.047 1
1 100 . 20 1 1 A 16 16 ALA C C 16 181.184 179.798 1.386 1
1 101 . 20 1 1 A 16 16 ALA CA C 16 55.370 55.258 0.112 1
1 102 . 20 1 1 A 16 16 ALA CB C 16 18.058 18.761 -0.703 1
1 103 . 20 1 1 A 16 16 ALA N N 16 122.414 119.627 2.787 1
1 104 . 20 1 1 A 17 17 SER H H 17 7.985 8.241 -0.256 1
1 105 . 20 1 1 A 17 17 SER HA H 17 4.317 4.161 0.156 1
1 107 . 20 1 1 A 17 17 SER C C 17 175.381 176.791 -1.410 1
1 108 . 20 1 1 A 17 17 SER CA C 17 63.163 62.145 1.018 1
1 109 . 20 1 1 A 17 17 SER CB C 17 64.055 63.121 0.934 1
1 110 . 20 1 1 A 17 17 SER N N 17 116.568 114.252 2.316 1
1 111 . 20 1 1 A 18 18 GLN H H 18 8.316 7.947 0.369 1
1 112 . 20 1 1 A 18 18 GLN HA H 18 3.323 3.497 -0.174 1
1 119 . 20 1 1 A 18 18 GLN C C 18 176.812 178.636 -1.824 1
1 120 . 20 1 1 A 18 18 GLN CA C 18 60.025 59.341 0.684 1
1 121 . 20 1 1 A 18 18 GLN CB C 18 28.686 28.566 0.120 1
1 123 . 20 1 1 A 18 18 GLN N N 18 119.002 120.990 -1.988 1
1 125 . 20 1 1 A 19 19 GLN H H 19 7.582 8.268 -0.686 1
1 126 . 20 1 1 A 19 19 GLN HA H 19 4.062 4.061 0.001 1
1 133 . 20 1 1 A 19 19 GLN C C 19 178.488 178.465 0.023 1
1 134 . 20 1 1 A 19 19 GLN CA C 19 59.248 59.211 0.037 1
1 135 . 20 1 1 A 19 19 GLN CB C 19 28.203 28.270 -0.067 1
1 137 . 20 1 1 A 19 19 GLN N N 19 116.221 118.848 -2.627 1
1 139 . 20 1 1 A 20 20 ILE H H 20 7.246 7.991 -0.745 1
1 140 . 20 1 1 A 20 20 ILE HA H 20 3.570 3.624 -0.054 1
1 150 . 20 1 1 A 20 20 ILE C C 20 178.999 178.564 0.435 1
1 151 . 20 1 1 A 20 20 ILE CA C 20 64.996 65.672 -0.676 1
1 152 . 20 1 1 A 20 20 ILE CB C 20 38.139 37.946 0.193 1
1 156 . 20 1 1 A 20 20 ILE N N 20 120.521 120.946 -0.425 1
1 157 . 20 1 1 A 21 21 LEU H H 21 8.034 7.946 0.088 1
1 158 . 20 1 1 A 21 21 LEU HA H 21 3.491 3.617 -0.126 1
1 168 . 20 1 1 A 21 21 LEU C C 21 178.196 178.782 -0.586 1
1 169 . 20 1 1 A 21 21 LEU CA C 21 57.944 57.549 0.395 1
1 170 . 20 1 1 A 21 21 LEU CB C 21 37.864 40.304 -2.440 1
1 174 . 20 1 1 A 21 21 LEU N N 21 121.259 118.908 2.351 1
1 175 . 20 1 1 A 22 22 TYR H H 22 8.479 7.670 0.809 1
1 176 . 20 1 1 A 22 22 TYR HA H 22 4.224 4.295 -0.071 1
1 183 . 20 1 1 A 22 22 TYR C C 22 179.630 178.547 1.083 1
1 184 . 20 1 1 A 22 22 TYR CA C 22 62.422 60.804 1.618 1
1 185 . 20 1 1 A 22 22 TYR CB C 22 37.434 37.692 -0.258 1
1 190 . 20 1 1 A 22 22 TYR N N 22 117.805 118.490 -0.685 1
1 191 . 20 1 1 A 23 23 GLN H H 23 7.707 8.340 -0.633 1
1 192 . 20 1 1 A 23 23 GLN HA H 23 4.166 4.026 0.140 1
1 199 . 20 1 1 A 23 23 GLN C C 23 178.633 178.533 0.100 1
1 200 . 20 1 1 A 23 23 GLN CA C 23 58.789 59.179 -0.390 1
1 201 . 20 1 1 A 23 23 GLN CB C 23 28.534 28.074 0.460 1
1 203 . 20 1 1 A 23 23 GLN N N 23 117.580 118.354 -0.774 1
1 205 . 20 1 1 A 24 24 ALA H H 24 8.155 7.861 0.294 1
1 206 . 20 1 1 A 24 24 ALA HA H 24 4.187 4.230 -0.043 1
1 210 . 20 1 1 A 24 24 ALA C C 24 180.018 179.259 0.759 1
1 211 . 20 1 1 A 24 24 ALA CA C 24 55.228 55.169 0.059 1
1 212 . 20 1 1 A 24 24 ALA CB C 24 19.468 18.648 0.820 1
1 213 . 20 1 1 A 24 24 ALA N N 24 122.813 122.374 0.439 1
1 214 . 20 1 1 A 25 25 TYR H H 25 8.995 8.567 0.428 1
1 215 . 20 1 1 A 25 25 TYR HA H 25 4.348 4.815 -0.467 1
1 222 . 20 1 1 A 25 25 TYR C C 25 175.792 177.326 -1.534 1
1 223 . 20 1 1 A 25 25 TYR CA C 25 61.681 61.948 -0.267 1
1 224 . 20 1 1 A 25 25 TYR CB C 25 38.175 38.646 -0.471 1
1 229 . 20 1 1 A 25 25 TYR N N 25 121.343 120.463 0.880 1
1 230 . 20 1 1 A 26 26 ASP H H 26 7.260 8.764 -1.504 1
1 231 . 20 1 1 A 26 26 ASP HA H 26 4.373 4.445 -0.072 1
1 234 . 20 1 1 A 26 26 ASP C C 26 177.322 178.421 -1.099 1
1 235 . 20 1 1 A 26 26 ASP CA C 26 56.603 57.541 -0.938 1
1 236 . 20 1 1 A 26 26 ASP CB C 26 41.060 41.780 -0.720 1
1 237 . 20 1 1 A 26 26 ASP N N 26 114.020 119.205 -5.185 1
1 238 . 20 1 1 A 27 27 ARG H H 27 7.343 7.658 -0.315 1
1 239 . 20 1 1 A 27 27 ARG HA H 27 4.302 4.364 -0.062 1
1 246 . 20 1 1 A 27 27 ARG C C 27 176.546 176.258 0.288 1
1 247 . 20 1 1 A 27 27 ARG CA C 27 57.563 57.789 -0.226 1
1 248 . 20 1 1 A 27 27 ARG CB C 27 31.500 31.302 0.198 1
1 251 . 20 1 1 A 27 27 ARG N N 27 116.729 116.958 -0.229 1
1 252 . 20 1 1 A 28 28 GLN H H 28 8.306 8.008 0.298 1
1 253 . 20 1 1 A 28 28 GLN HA H 28 4.396 4.717 -0.321 1
1 260 . 20 1 1 A 28 28 GLN C C 28 172.831 175.138 -2.307 1
1 261 . 20 1 1 A 28 28 GLN CA C 28 55.355 54.360 0.995 1
1 262 . 20 1 1 A 28 28 GLN CB C 28 31.062 31.814 -0.752 1
1 264 . 20 1 1 A 28 28 GLN N N 28 121.612 118.209 3.403 1
1 266 . 20 1 1 A 29 29 LYS H H 29 8.354 8.551 -0.197 1
1 267 . 20 1 1 A 29 29 LYS HA H 29 4.099 3.545 0.554 1
1 276 . 20 1 1 A 29 29 LYS C C 29 176.084 176.670 -0.586 1
1 277 . 20 1 1 A 29 29 LYS CA C 29 57.873 57.577 0.296 1
1 278 . 20 1 1 A 29 29 LYS CB C 29 33.313 32.689 0.624 1
1 282 . 20 1 1 A 29 29 LYS N N 29 125.038 123.824 1.214 1
1 283 . 20 1 1 A 30 30 ASN H H 30 8.856 8.100 0.756 1
1 284 . 20 1 1 A 30 30 ASN HA H 30 4.958 4.979 -0.021 1
1 289 . 20 1 1 A 30 30 ASN C C 30 171.179 173.718 -2.539 1
1 290 . 20 1 1 A 30 30 ASN CA C 30 50.891 50.617 0.274 1
1 291 . 20 1 1 A 30 30 ASN CB C 30 39.907 38.798 1.109 1
1 292 . 20 1 1 A 30 30 ASN N N 30 115.764 114.405 1.359 1
1 294 . 20 1 1 A 31 31 PRO HA H 31 4.299 4.471 -0.172 1
1 301 . 20 1 1 A 31 31 PRO C C 31 177.493 176.753 0.740 1
1 302 . 20 1 1 A 31 31 PRO CA C 31 62.489 62.602 -0.113 1
1 303 . 20 1 1 A 31 31 PRO CB C 31 31.216 32.123 -0.907 1
1 306 . 20 1 1 A 32 32 SER H H 32 9.368 8.453 0.915 1
1 307 . 20 1 1 A 32 32 SER HA H 32 4.372 4.779 -0.407 1
1 310 . 20 1 1 A 32 32 SER C C 32 174.821 175.695 -0.874 1
1 311 . 20 1 1 A 32 32 SER CA C 32 57.203 57.790 -0.587 1
1 312 . 20 1 1 A 32 32 SER CB C 32 65.594 64.453 1.141 1
1 313 . 20 1 1 A 32 32 SER N N 32 120.847 117.967 2.880 1
1 314 . 20 1 1 A 33 33 LYS H H 33 9.152 8.958 0.194 1
1 315 . 20 1 1 A 33 33 LYS HA H 33 3.719 3.852 -0.133 1
1 324 . 20 1 1 A 33 33 LYS C C 33 177.833 178.344 -0.511 1
1 325 . 20 1 1 A 33 33 LYS CA C 33 61.188 60.319 0.869 1
1 326 . 20 1 1 A 33 33 LYS CB C 33 32.572 32.224 0.348 1
1 330 . 20 1 1 A 33 33 LYS N N 33 122.966 124.812 -1.846 1
1 331 . 20 1 1 A 34 34 GLU H H 34 8.902 8.395 0.507 1
1 332 . 20 1 1 A 34 34 GLU HA H 34 4.089 4.004 0.085 1
1 337 . 20 1 1 A 34 34 GLU C C 34 180.286 179.263 1.023 1
1 338 . 20 1 1 A 34 34 GLU CA C 34 60.483 59.552 0.931 1
1 339 . 20 1 1 A 34 34 GLU CB C 34 28.835 29.316 -0.481 1
1 341 . 20 1 1 A 34 34 GLU N N 34 117.645 117.569 0.076 1
1 342 . 20 1 1 A 35 35 GLU H H 35 7.673 8.358 -0.685 1
1 343 . 20 1 1 A 35 35 GLU HA H 35 4.023 3.948 0.075 1
1 348 . 20 1 1 A 35 35 GLU C C 35 180.237 179.262 0.975 1
1 349 . 20 1 1 A 35 35 GLU CA C 35 59.214 59.370 -0.156 1
1 350 . 20 1 1 A 35 35 GLU CB C 35 30.099 29.267 0.832 1
1 352 . 20 1 1 A 35 35 GLU N N 35 121.077 120.006 1.071 1
1 353 . 20 1 1 A 36 36 ARG H H 36 8.932 8.481 0.451 1
1 354 . 20 1 1 A 36 36 ARG HA H 36 3.928 3.779 0.149 1
1 362 . 20 1 1 A 36 36 ARG C C 36 178.464 179.113 -0.649 1
1 363 . 20 1 1 A 36 36 ARG CA C 36 60.974 59.990 0.984 1
1 364 . 20 1 1 A 36 36 ARG CB C 36 31.171 29.881 1.290 1
1 367 . 20 1 1 A 36 36 ARG N N 36 119.441 120.113 -0.672 1
1 369 . 20 1 1 A 37 37 GLU H H 37 8.756 8.828 -0.072 1
1 370 . 20 1 1 A 37 37 GLU HA H 37 3.948 4.103 -0.155 1
1 375 . 20 1 1 A 37 37 GLU C C 37 179.606 178.694 0.912 1
1 376 . 20 1 1 A 37 37 GLU CA C 37 60.094 59.029 1.065 1
1 377 . 20 1 1 A 37 37 GLU CB C 37 29.110 29.410 -0.300 1
1 379 . 20 1 1 A 37 37 GLU N N 37 119.017 119.575 -0.558 1
1 380 . 20 1 1 A 38 38 ALA H H 38 7.733 7.988 -0.255 1
1 381 . 20 1 1 A 38 38 ALA HA H 38 4.325 4.101 0.224 1
1 385 . 20 1 1 A 38 38 ALA C C 38 180.820 178.533 2.287 1
1 386 . 20 1 1 A 38 38 ALA CA C 38 55.194 54.516 0.678 1
1 387 . 20 1 1 A 38 38 ALA CB C 38 17.654 18.547 -0.893 1
1 388 . 20 1 1 A 38 38 ALA N N 38 122.889 122.081 0.808 1
1 389 . 20 1 1 A 39 39 LEU H H 39 7.740 7.871 -0.131 1
1 390 . 20 1 1 A 39 39 LEU HA H 39 4.176 4.312 -0.136 1
1 400 . 20 1 1 A 39 39 LEU C C 39 179.266 178.803 0.463 1
1 401 . 20 1 1 A 39 39 LEU CA C 39 57.944 56.087 1.857 1
1 402 . 20 1 1 A 39 39 LEU CB C 39 42.105 42.319 -0.214 1
1 406 . 20 1 1 A 39 39 LEU N N 39 119.783 116.604 3.179 1
1 407 . 20 1 1 A 40 40 VAL H H 40 8.451 8.533 -0.082 1
1 408 . 20 1 1 A 40 40 VAL HA H 40 3.259 3.609 -0.350 1
1 416 . 20 1 1 A 40 40 VAL C C 40 177.153 177.729 -0.576 1
1 417 . 20 1 1 A 40 40 VAL CA C 40 67.254 66.899 0.355 1
1 418 . 20 1 1 A 40 40 VAL CB C 40 31.747 31.409 0.338 1
1 421 . 20 1 1 A 40 40 VAL N N 40 121.481 119.992 1.489 1
1 422 . 20 1 1 A 41 41 GLU H H 41 7.254 8.041 -0.787 1
1 423 . 20 1 1 A 41 41 GLU HA H 41 4.159 4.103 0.056 1
1 428 . 20 1 1 A 41 41 GLU C C 41 179.483 178.914 0.569 1
1 429 . 20 1 1 A 41 41 GLU CA C 41 59.248 59.370 -0.122 1
1 430 . 20 1 1 A 41 41 GLU CB C 41 29.358 29.271 0.087 1
1 432 . 20 1 1 A 41 41 GLU N N 41 116.549 119.822 -3.273 1
1 433 . 20 1 1 A 42 42 GLU H H 42 8.103 8.134 -0.031 1
1 434 . 20 1 1 A 42 42 GLU HA H 42 4.020 4.052 -0.032 1
1 439 . 20 1 1 A 42 42 GLU C C 42 180.115 178.787 1.328 1
1 440 . 20 1 1 A 42 42 GLU CA C 42 59.847 59.533 0.314 1
1 441 . 20 1 1 A 42 42 GLU CB C 42 30.218 29.282 0.936 1
1 443 . 20 1 1 A 42 42 GLU N N 42 119.578 119.144 0.434 1
1 444 . 20 1 1 A 43 43 CYS H H 43 8.955 8.117 0.838 1
1 445 . 20 1 1 A 43 43 CYS HA H 43 4.153 4.253 -0.100 1
1 448 . 20 1 1 A 43 43 CYS C C 43 176.498 177.640 -1.142 1
1 449 . 20 1 1 A 43 43 CYS CA C 43 64.856 62.341 2.515 1
1 450 . 20 1 1 A 43 43 CYS CB C 43 27.390 27.752 -0.362 1
1 451 . 20 1 1 A 43 43 CYS N N 43 118.199 118.836 -0.637 1
1 452 . 20 1 1 A 44 44 ASN H H 44 8.543 7.943 0.600 1
1 453 . 20 1 1 A 44 44 ASN HA H 44 4.635 4.412 0.223 1
1 458 . 20 1 1 A 44 44 ASN C C 44 178.633 177.642 0.991 1
1 459 . 20 1 1 A 44 44 ASN CA C 44 56.603 56.397 0.206 1
1 460 . 20 1 1 A 44 44 ASN CB C 44 37.187 38.171 -0.984 1
1 461 . 20 1 1 A 44 44 ASN N N 44 117.002 119.578 -2.576 1
1 463 . 20 1 1 A 45 45 ARG H H 45 8.296 8.292 0.004 1
1 464 . 20 1 1 A 45 45 ARG HA H 45 3.977 4.060 -0.083 1
1 471 . 20 1 1 A 45 45 ARG C C 45 178.149 178.392 -0.243 1
1 472 . 20 1 1 A 45 45 ARG CA C 45 60.589 59.493 1.096 1
1 473 . 20 1 1 A 45 45 ARG CB C 45 30.099 30.225 -0.126 1
1 476 . 20 1 1 A 45 45 ARG N N 45 121.021 121.030 -0.009 1
1 477 . 20 1 1 A 46 46 ALA H H 46 7.914 8.333 -0.419 1
1 478 . 20 1 1 A 46 46 ALA HA H 46 4.128 4.109 0.019 1
1 482 . 20 1 1 A 46 46 ALA C C 46 181.208 180.362 0.846 1
1 483 . 20 1 1 A 46 46 ALA CA C 46 55.264 54.836 0.428 1
1 484 . 20 1 1 A 46 46 ALA CB C 46 18.759 18.520 0.239 1
1 485 . 20 1 1 A 46 46 ALA N N 46 121.570 120.741 0.829 1
1 486 . 20 1 1 A 47 47 GLU H H 47 8.730 8.605 0.125 1
1 487 . 20 1 1 A 47 47 GLU HA H 47 4.194 4.026 0.168 1
1 492 . 20 1 1 A 47 47 GLU C C 47 180.115 178.934 1.181 1
1 493 . 20 1 1 A 47 47 GLU CA C 47 58.401 59.174 -0.773 1
1 494 . 20 1 1 A 47 47 GLU CB C 47 29.523 29.395 0.128 1
1 496 . 20 1 1 A 47 47 GLU N N 47 117.532 118.460 -0.928 1
1 497 . 20 1 1 A 48 48 CYS H H 48 8.283 7.926 0.357 1
1 498 . 20 1 1 A 48 48 CYS HA H 48 4.002 4.111 -0.109 1
1 501 . 20 1 1 A 48 48 CYS C C 48 177.031 177.293 -0.262 1
1 502 . 20 1 1 A 48 48 CYS CA C 48 64.749 64.077 0.672 1
1 503 . 20 1 1 A 48 48 CYS CB C 48 25.907 27.316 -1.409 1
1 504 . 20 1 1 A 48 48 CYS N N 48 118.282 119.123 -0.841 1
1 505 . 20 1 1 A 49 49 LEU H H 49 8.181 8.112 0.069 1
1 506 . 20 1 1 A 49 49 LEU HA H 49 4.175 3.887 0.288 1
1 516 . 20 1 1 A 49 49 LEU C C 49 180.430 178.819 1.611 1
1 517 . 20 1 1 A 49 49 LEU CA C 49 57.873 58.230 -0.357 1
1 518 . 20 1 1 A 49 49 LEU CB C 49 41.539 41.523 0.016 1
1 522 . 20 1 1 A 49 49 LEU N N 49 120.371 120.747 -0.376 1
1 523 . 20 1 1 A 50 50 GLN H H 50 7.934 8.774 -0.840 1
1 524 . 20 1 1 A 50 50 GLN HA H 50 4.102 4.021 0.081 1
1 531 . 20 1 1 A 50 50 GLN C C 50 177.322 177.312 0.010 1
1 532 . 20 1 1 A 50 50 GLN CA C 50 58.156 58.645 -0.489 1
1 533 . 20 1 1 A 50 50 GLN CB C 50 28.616 28.246 0.370 1
1 535 . 20 1 1 A 50 50 GLN N N 50 118.175 117.413 0.762 1
1 537 . 20 1 1 A 51 51 ARG H H 51 7.632 7.774 -0.142 1
1 538 . 20 1 1 A 51 51 ARG HA H 51 4.347 4.358 -0.011 1
1 545 . 20 1 1 A 51 51 ARG C C 51 176.546 176.428 0.118 1
1 546 . 20 1 1 A 51 51 ARG CA C 51 56.286 55.926 0.360 1
1 547 . 20 1 1 A 51 51 ARG CB C 51 31.314 30.254 1.060 1
1 550 . 20 1 1 A 51 51 ARG N N 51 116.454 117.844 -1.390 1
1 551 . 20 1 1 A 52 52 GLY H H 52 7.949 7.982 -0.033 1
1 552 . 20 1 1 A 52 52 GLY HA2 H 52 4.033 3.973 0.060 1
1 553 . 20 1 1 A 52 52 GLY HA3 H 52 3.903 3.975 -0.072 1
1 554 . 20 1 1 A 52 52 GLY C C 52 174.385 174.312 0.073 1
1 555 . 20 1 1 A 52 52 GLY CA C 52 46.231 45.263 0.968 1
1 556 . 20 1 1 A 52 52 GLY N N 52 108.854 107.511 1.343 1
1 557 . 20 1 1 A 53 53 VAL H H 53 7.944 7.557 0.387 1
1 558 . 20 1 1 A 53 53 VAL HA H 53 4.250 4.030 0.220 1
1 566 . 20 1 1 A 53 53 VAL C C 53 175.525 174.960 0.565 1
1 567 . 20 1 1 A 53 53 VAL CA C 53 60.377 62.583 -2.206 1
1 568 . 20 1 1 A 53 53 VAL CB C 53 34.283 32.878 1.405 1
1 571 . 20 1 1 A 53 53 VAL N N 53 118.316 120.765 -2.449 1
1 572 . 20 1 1 A 54 54 SER H H 54 8.502 8.499 0.003 1
1 573 . 20 1 1 A 54 54 SER HA H 54 4.625 4.928 -0.303 1
1 576 . 20 1 1 A 54 54 SER C C 54 174.603 174.088 0.515 1
1 577 . 20 1 1 A 54 54 SER CA C 54 56.092 54.199 1.893 1
1 578 . 20 1 1 A 54 54 SER CB C 54 63.697 63.716 -0.019 1
1 579 . 20 1 1 A 54 54 SER N N 54 120.337 118.387 1.950 1
1 580 . 20 1 1 A 55 55 PRO HA H 55 4.624 4.533 0.091 1
1 587 . 20 1 1 A 55 55 PRO C C 55 177.322 177.351 -0.029 1
1 588 . 20 1 1 A 55 55 PRO CA C 55 64.431 64.241 0.190 1
1 589 . 20 1 1 A 55 55 PRO CB C 55 31.913 31.716 0.197 1
1 592 . 20 1 1 A 56 56 SER H H 56 7.931 8.452 -0.521 1
1 593 . 20 1 1 A 56 56 SER HA H 56 4.428 4.617 -0.189 1
1 596 . 20 1 1 A 56 56 SER C C 56 174.749 174.971 -0.222 1
1 597 . 20 1 1 A 56 56 SER CA C 56 59.130 59.205 -0.075 1
1 598 . 20 1 1 A 56 56 SER CB C 56 63.056 63.805 -0.749 1
1 599 . 20 1 1 A 56 56 SER N N 56 112.637 113.051 -0.414 1
1 600 . 20 1 1 A 57 57 LYS H H 57 8.121 7.604 0.517 1
1 601 . 20 1 1 A 57 57 LYS HA H 57 4.467 4.848 -0.381 1
1 609 . 20 1 1 A 57 57 LYS C C 57 176.570 176.075 0.495 1
1 610 . 20 1 1 A 57 57 LYS CA C 57 55.264 54.888 0.376 1
1 611 . 20 1 1 A 57 57 LYS CB C 57 32.160 32.519 -0.359 1
1 615 . 20 1 1 A 57 57 LYS N N 57 123.185 117.927 5.258 1
1 616 . 20 1 1 A 58 58 ALA H H 58 7.886 7.910 -0.024 1
1 617 . 20 1 1 A 58 58 ALA HA H 58 3.923 3.961 -0.038 1
1 621 . 20 1 1 A 58 58 ALA C C 58 177.469 179.814 -2.345 1
1 622 . 20 1 1 A 58 58 ALA CA C 58 54.276 55.113 -0.837 1
1 623 . 20 1 1 A 58 58 ALA CB C 58 18.271 18.532 -0.261 1
1 624 . 20 1 1 A 58 58 ALA N N 58 123.941 123.405 0.536 1
1 625 . 20 1 1 A 59 59 HIS H H 59 8.077 8.234 -0.157 1
1 626 . 20 1 1 A 59 59 HIS HA H 59 4.420 4.406 0.014 1
1 631 . 20 1 1 A 59 59 HIS C C 59 177.542 176.373 1.169 1
1 632 . 20 1 1 A 59 59 HIS CA C 59 57.767 58.568 -0.801 1
1 633 . 20 1 1 A 59 59 HIS CB C 59 29.852 28.544 1.308 1
1 636 . 20 1 1 A 59 59 HIS N N 59 115.566 115.469 0.097 1
1 637 . 20 1 1 A 60 60 GLY H H 60 8.110 8.240 -0.130 1
1 638 . 20 1 1 A 60 60 GLY HA2 H 60 3.873 3.722 0.151 1
1 639 . 20 1 1 A 60 60 GLY HA3 H 60 4.025 3.846 0.179 1
1 640 . 20 1 1 A 60 60 GLY C C 60 174.918 174.756 0.162 1
1 641 . 20 1 1 A 60 60 GLY CA C 60 45.559 45.115 0.444 1
1 642 . 20 1 1 A 60 60 GLY N N 60 109.216 108.619 0.597 1
1 643 . 20 1 1 A 61 61 LEU H H 61 8.280 7.822 0.458 1
1 644 . 20 1 1 A 61 61 LEU HA H 61 4.198 4.221 -0.023 1
1 654 . 20 1 1 A 61 61 LEU C C 61 178.900 177.415 1.485 1
1 655 . 20 1 1 A 61 61 LEU CA C 61 55.758 55.616 0.142 1
1 656 . 20 1 1 A 61 61 LEU CB C 61 42.544 42.928 -0.384 1
1 660 . 20 1 1 A 61 61 LEU N N 61 120.521 120.074 0.447 1
1 661 . 20 1 1 A 62 62 GLY H H 62 8.184 8.039 0.145 1
1 662 . 20 1 1 A 62 62 GLY HA2 H 62 3.978 3.983 -0.005 1
1 663 . 20 1 1 A 62 62 GLY HA3 H 62 3.817 3.984 -0.167 1
1 664 . 20 1 1 A 62 62 GLY C C 62 176.012 175.230 0.782 1
1 665 . 20 1 1 A 62 62 GLY CA C 62 46.767 46.784 -0.017 1
1 666 . 20 1 1 A 62 62 GLY N N 62 108.987 108.073 0.914 1
1 667 . 20 1 1 A 63 63 SER HA H 63 4.322 4.344 -0.022 1
1 670 . 20 1 1 A 63 63 SER C C 63 174.167 175.981 -1.814 1
1 671 . 20 1 1 A 63 63 SER CA C 63 59.919 61.000 -1.081 1
1 672 . 20 1 1 A 63 63 SER CB C 63 63.312 63.362 -0.050 1
1 673 . 20 1 1 A 64 64 ASN H H 64 8.087 8.009 0.078 1
1 674 . 20 1 1 A 64 64 ASN HA H 64 4.850 4.971 -0.121 1
1 679 . 20 1 1 A 64 64 ASN C C 64 173.899 175.432 -1.533 1
1 680 . 20 1 1 A 64 64 ASN CA C 64 53.218 54.826 -1.608 1
1 681 . 20 1 1 A 64 64 ASN CB C 64 39.164 38.544 0.620 1
1 682 . 20 1 1 A 64 64 ASN N N 64 118.041 117.406 0.635 1
1 684 . 20 1 1 A 65 65 LEU H H 65 7.293 7.449 -0.156 1
1 685 . 20 1 1 A 65 65 LEU HA H 65 3.995 4.313 -0.318 1
1 695 . 20 1 1 A 65 65 LEU C C 65 175.696 176.055 -0.359 1
1 696 . 20 1 1 A 65 65 LEU CA C 65 56.005 55.817 0.188 1
1 697 . 20 1 1 A 65 65 LEU CB C 65 43.120 42.895 0.225 1
1 701 . 20 1 1 A 65 65 LEU N N 65 120.953 122.818 -1.865 1
1 702 . 20 1 1 A 66 66 VAL H H 66 9.517 8.744 0.773 1
1 703 . 20 1 1 A 66 66 VAL HA H 66 3.481 4.290 -0.809 1
1 711 . 20 1 1 A 66 66 VAL C C 66 175.429 175.120 0.309 1
1 712 . 20 1 1 A 66 66 VAL CA C 66 65.243 61.368 3.875 1
1 713 . 20 1 1 A 66 66 VAL CB C 66 31.335 32.928 -1.593 1
1 716 . 20 1 1 A 66 66 VAL N N 66 127.924 126.836 1.088 1
1 717 . 20 1 1 A 67 67 THR H H 67 6.253 8.215 -1.962 1
1 718 . 20 1 1 A 67 67 THR HA H 67 4.779 4.813 -0.034 1
1 723 . 20 1 1 A 67 67 THR C C 67 174.894 174.867 0.027 1
1 724 . 20 1 1 A 67 67 THR CA C 67 58.719 59.482 -0.763 1
1 725 . 20 1 1 A 67 67 THR CB C 67 72.153 72.099 0.054 1
1 727 . 20 1 1 A 67 67 THR N N 67 113.376 115.909 -2.533 1
1 728 . 20 1 1 A 68 68 GLU H H 68 9.348 8.868 0.480 1
1 729 . 20 1 1 A 68 68 GLU HA H 68 3.634 4.003 -0.369 1
1 734 . 20 1 1 A 68 68 GLU C C 68 177.809 178.284 -0.475 1
1 735 . 20 1 1 A 68 68 GLU CA C 68 61.505 59.933 1.572 1
1 736 . 20 1 1 A 68 68 GLU CB C 68 28.285 29.379 -1.094 1
1 738 . 20 1 1 A 68 68 GLU N N 68 124.534 122.292 2.242 1
1 739 . 20 1 1 A 69 69 VAL H H 69 8.126 7.312 0.814 1
1 740 . 20 1 1 A 69 69 VAL HA H 69 3.862 3.539 0.323 1
1 748 . 20 1 1 A 69 69 VAL C C 69 177.712 178.089 -0.377 1
1 749 . 20 1 1 A 69 69 VAL CA C 69 65.701 66.709 -1.008 1
1 750 . 20 1 1 A 69 69 VAL CB C 69 31.829 31.703 0.126 1
1 753 . 20 1 1 A 69 69 VAL N N 69 119.139 120.130 -0.991 1
1 754 . 20 1 1 A 70 70 ARG H H 70 7.235 8.194 -0.959 1
1 755 . 20 1 1 A 70 70 ARG HA H 70 4.265 3.931 0.334 1
1 762 . 20 1 1 A 70 70 ARG C C 70 180.430 179.267 1.163 1
1 763 . 20 1 1 A 70 70 ARG CA C 70 59.742 60.105 -0.363 1
1 764 . 20 1 1 A 70 70 ARG CB C 70 29.439 29.692 -0.253 1
1 767 . 20 1 1 A 70 70 ARG N N 70 119.541 119.103 0.438 1
1 768 . 20 1 1 A 71 71 VAL H H 71 8.144 7.907 0.237 1
1 769 . 20 1 1 A 71 71 VAL HA H 71 4.018 4.029 -0.011 1
1 777 . 20 1 1 A 71 71 VAL C C 71 177.493 177.968 -0.475 1
1 778 . 20 1 1 A 71 71 VAL CA C 71 67.924 66.549 1.375 1
1 779 . 20 1 1 A 71 71 VAL CB C 71 32.289 31.907 0.382 1
1 782 . 20 1 1 A 71 71 VAL N N 71 120.755 120.163 0.592 1
1 783 . 20 1 1 A 72 72 TYR H H 72 9.411 8.345 1.066 1
1 784 . 20 1 1 A 72 72 TYR HA H 72 3.908 4.243 -0.335 1
1 791 . 20 1 1 A 72 72 TYR C C 72 178.464 178.111 0.353 1
1 792 . 20 1 1 A 72 72 TYR CA C 72 63.444 61.883 1.561 1
1 793 . 20 1 1 A 72 72 TYR CB C 72 38.211 38.899 -0.688 1
1 798 . 20 1 1 A 72 72 TYR N N 72 121.175 121.497 -0.322 1
1 799 . 20 1 1 A 73 73 ASN H H 73 8.816 8.700 0.116 1
1 800 . 20 1 1 A 73 73 ASN HA H 73 4.538 4.609 -0.071 1
1 805 . 20 1 1 A 73 73 ASN C C 73 176.958 178.093 -1.135 1
1 806 . 20 1 1 A 73 73 ASN CA C 73 56.109 56.514 -0.405 1
1 807 . 20 1 1 A 73 73 ASN CB C 73 38.422 38.975 -0.553 1
1 808 . 20 1 1 A 73 73 ASN N N 73 118.122 117.874 0.248 1
1 810 . 20 1 1 A 74 74 TRP H H 74 8.657 8.485 0.172 1
1 811 . 20 1 1 A 74 74 TRP HA H 74 4.111 4.426 -0.315 1
1 820 . 20 1 1 A 74 74 TRP C C 74 179.654 178.591 1.063 1
1 821 . 20 1 1 A 74 74 TRP CA C 74 62.950 61.053 1.897 1
1 822 . 20 1 1 A 74 74 TRP CB C 74 29.555 29.511 0.044 1
1 828 . 20 1 1 A 74 74 TRP N N 74 123.988 122.945 1.043 1
1 830 . 20 1 1 A 75 75 PHE H H 75 8.562 8.374 0.188 1
1 831 . 20 1 1 A 75 75 PHE HA H 75 3.821 4.425 -0.604 1
1 839 . 20 1 1 A 75 75 PHE C C 75 177.614 178.267 -0.653 1
1 840 . 20 1 1 A 75 75 PHE CA C 75 63.374 62.038 1.336 1
1 841 . 20 1 1 A 75 75 PHE CB C 75 39.648 38.551 1.097 1
1 847 . 20 1 1 A 75 75 PHE N N 75 118.325 116.959 1.366 1
1 848 . 20 1 1 A 76 76 ALA H H 76 8.305 8.296 0.009 1
1 849 . 20 1 1 A 76 76 ALA HA H 76 3.909 3.936 -0.027 1
1 853 . 20 1 1 A 76 76 ALA C C 76 180.868 179.947 0.921 1
1 854 . 20 1 1 A 76 76 ALA CA C 76 55.566 55.294 0.272 1
1 855 . 20 1 1 A 76 76 ALA CB C 76 17.820 17.992 -0.172 1
1 856 . 20 1 1 A 76 76 ALA N N 76 121.119 122.706 -1.587 1
1 857 . 20 1 1 A 77 77 ASN H H 77 8.335 8.210 0.125 1
1 858 . 20 1 1 A 77 77 ASN HA H 77 4.355 4.352 0.003 1
1 863 . 20 1 1 A 77 77 ASN C C 77 177.105 177.595 -0.490 1
1 864 . 20 1 1 A 77 77 ASN CA C 77 56.145 56.097 0.048 1
1 865 . 20 1 1 A 77 77 ASN CB C 77 38.063 38.449 -0.386 1
1 866 . 20 1 1 A 77 77 ASN N N 77 117.433 116.434 0.999 1
1 868 . 20 1 1 A 78 78 ARG H H 78 7.664 7.252 0.412 1
1 869 . 20 1 1 A 78 78 ARG HA H 78 3.629 3.795 -0.166 1
1 876 . 20 1 1 A 78 78 ARG C C 78 179.216 177.491 1.725 1
1 877 . 20 1 1 A 78 78 ARG CA C 78 58.773 58.577 0.196 1
1 878 . 20 1 1 A 78 78 ARG CB C 78 29.605 29.303 0.302 1
1 881 . 20 1 1 A 78 78 ARG N N 78 121.999 118.741 3.258 1
1 882 . 20 1 1 A 79 79 ARG H H 79 8.320 7.568 0.752 1
1 883 . 20 1 1 A 79 79 ARG HA H 79 4.307 4.717 -0.410 1
1 890 . 20 1 1 A 79 79 ARG C C 79 180.406 178.802 1.604 1
1 891 . 20 1 1 A 79 79 ARG CA C 79 60.270 57.127 3.143 1
1 892 . 20 1 1 A 79 79 ARG CB C 79 31.335 30.682 0.653 1
1 895 . 20 1 1 A 79 79 ARG N N 79 118.139 117.732 0.407 1
1 896 . 20 1 1 A 80 80 LYS H H 80 7.759 8.052 -0.293 1
1 897 . 20 1 1 A 80 80 LYS HA H 80 4.052 4.111 -0.059 1
1 905 . 20 1 1 A 80 80 LYS C C 80 178.999 178.577 0.422 1
1 906 . 20 1 1 A 80 80 LYS CA C 80 59.531 58.985 0.546 1
1 907 . 20 1 1 A 80 80 LYS CB C 80 32.374 31.934 0.440 1
1 911 . 20 1 1 A 80 80 LYS N N 80 120.899 118.536 2.363 1
1 912 . 20 1 1 A 81 81 GLU H H 81 8.041 8.055 -0.014 1
1 913 . 20 1 1 A 81 81 GLU HA H 81 4.044 4.174 -0.130 1
1 918 . 20 1 1 A 81 81 GLU C C 81 179.168 178.808 0.360 1
1 919 . 20 1 1 A 81 81 GLU CA C 81 59.036 59.606 -0.570 1
1 920 . 20 1 1 A 81 81 GLU CB C 81 29.561 29.121 0.440 1
1 922 . 20 1 1 A 81 81 GLU N N 81 120.193 120.474 -0.281 1
1 923 . 20 1 1 A 82 82 GLU H H 82 8.131 8.407 -0.276 1
1 924 . 20 1 1 A 82 82 GLU HA H 82 4.017 4.075 -0.058 1
1 929 . 20 1 1 A 82 82 GLU C C 82 178.343 178.540 -0.197 1
1 930 . 20 1 1 A 82 82 GLU CA C 82 59.319 59.427 -0.108 1
1 931 . 20 1 1 A 82 82 GLU CB C 82 29.770 29.207 0.563 1
1 933 . 20 1 1 A 82 82 GLU N N 82 119.626 119.134 0.492 1
1 934 . 20 1 1 A 83 83 ALA H H 83 7.935 7.647 0.288 1
1 935 . 20 1 1 A 83 83 ALA HA H 83 4.180 4.177 0.003 1
1 939 . 20 1 1 A 83 83 ALA C C 83 179.994 179.726 0.268 1
1 940 . 20 1 1 A 83 83 ALA CA C 83 54.629 54.402 0.227 1
1 941 . 20 1 1 A 83 83 ALA CB C 83 18.090 18.719 -0.629 1
1 942 . 20 1 1 A 83 83 ALA N N 83 121.476 122.474 -0.998 1
1 943 . 20 1 1 A 84 84 PHE H H 84 8.043 8.274 -0.231 1
1 944 . 20 1 1 A 84 84 PHE HA H 84 4.420 4.061 0.359 1
1 952 . 20 1 1 A 84 84 PHE C C 84 177.250 177.089 0.161 1
1 953 . 20 1 1 A 84 84 PHE CA C 84 60.059 61.844 -1.785 1
1 954 . 20 1 1 A 84 84 PHE CB C 84 38.952 39.383 -0.431 1
1 960 . 20 1 1 A 84 84 PHE N N 84 119.074 120.163 -1.089 1
1 961 . 20 1 1 A 85 85 ARG H H 85 8.031 7.882 0.149 1
1 962 . 20 1 1 A 85 85 ARG HA H 85 3.992 4.144 -0.152 1
1 968 . 20 1 1 A 85 85 ARG C C 85 178.319 178.521 -0.202 1
1 969 . 20 1 1 A 85 85 ARG CA C 85 58.523 59.586 -1.063 1
1 970 . 20 1 1 A 85 85 ARG CB C 85 30.346 30.001 0.345 1
1 973 . 20 1 1 A 85 85 ARG N N 85 119.291 117.446 1.845 1
1 974 . 20 1 1 A 86 86 GLN H H 86 8.091 7.835 0.256 1
1 975 . 20 1 1 A 86 86 GLN HA H 86 4.148 4.262 -0.114 1
1 982 . 20 1 1 A 86 86 GLN C C 86 177.105 178.463 -1.358 1
1 983 . 20 1 1 A 86 86 GLN CA C 86 57.556 57.683 -0.127 1
1 984 . 20 1 1 A 86 86 GLN CB C 86 28.855 29.439 -0.584 1
1 986 . 20 1 1 A 86 86 GLN N N 86 119.097 117.507 1.590 1
1 988 . 20 1 1 A 87 87 LYS H H 87 7.898 8.419 -0.521 1
1 989 . 20 1 1 A 87 87 LYS HA H 87 4.116 4.096 0.020 1
1 997 . 20 1 1 A 87 87 LYS C C 87 177.542 178.894 -1.352 1
1 998 . 20 1 1 A 87 87 LYS CA C 87 57.944 58.800 -0.856 1
1 999 . 20 1 1 A 87 87 LYS CB C 87 32.242 31.956 0.286 1
1 1003 . 20 1 1 A 87 87 LYS N N 87 120.968 122.192 -1.224 1
1 1004 . 20 1 1 A 88 88 LEU H H 88 7.903 8.152 -0.249 1
1 1005 . 20 1 1 A 88 88 LEU HA H 88 4.144 4.447 -0.303 1
1 1015 . 20 1 1 A 88 88 LEU C C 88 178.221 177.431 0.790 1
1 1016 . 20 1 1 A 88 88 LEU CA C 88 56.145 56.357 -0.212 1
1 1017 . 20 1 1 A 88 88 LEU CB C 88 42.215 41.225 0.990 1
1 1021 . 20 1 1 A 88 88 LEU N N 88 120.558 116.713 3.845 1
1 1022 . 20 1 1 A 89 89 ALA H H 89 7.894 7.565 0.329 1
1 1023 . 20 1 1 A 89 89 ALA HA H 89 4.224 4.374 -0.150 1
1 1027 . 20 1 1 A 89 89 ALA C C 89 178.609 179.205 -0.596 1
1 1028 . 20 1 1 A 89 89 ALA CA C 89 53.392 53.366 0.026 1
1 1029 . 20 1 1 A 89 89 ALA CB C 89 18.695 19.631 -0.936 1
1 1030 . 20 1 1 A 89 89 ALA N N 89 122.387 121.639 0.748 1
1 1031 . 20 1 1 A 90 90 MET H H 90 8.084 8.048 0.036 1
1 1032 . 20 1 1 A 90 90 MET HA H 90 4.356 4.127 0.229 1
1 1040 . 20 1 1 A 90 90 MET C C 90 176.982 178.269 -1.287 1
1 1041 . 20 1 1 A 90 90 MET CA C 90 56.551 58.515 -1.964 1
1 1042 . 20 1 1 A 90 90 MET CB C 90 32.719 33.208 -0.489 1
1 1045 . 20 1 1 A 90 90 MET N N 90 118.509 116.914 1.595 1
1 1046 . 20 1 1 A 91 91 ASP H H 91 8.261 7.511 0.750 1
1 1047 . 20 1 1 A 91 91 ASP HA H 91 4.524 4.373 0.151 1
1 1050 . 20 1 1 A 91 91 ASP C C 91 176.643 176.162 0.481 1
1 1051 . 20 1 1 A 91 91 ASP CA C 91 54.981 57.187 -2.206 1
1 1052 . 20 1 1 A 91 91 ASP CB C 91 40.870 41.023 -0.153 1
1 1053 . 20 1 1 A 91 91 ASP N N 91 120.771 119.079 1.692 1
1 1054 . 20 1 1 A 92 92 ALA H H 92 7.971 8.078 -0.107 1
1 1055 . 20 1 1 A 92 92 ALA HA H 92 4.200 4.088 0.112 1
1 1059 . 20 1 1 A 92 92 ALA C C 92 177.929 177.135 0.794 1
1 1060 . 20 1 1 A 92 92 ALA CA C 92 53.184 53.272 -0.088 1
1 1061 . 20 1 1 A 92 92 ALA CB C 92 18.890 17.138 1.752 1
1 1062 . 20 1 1 A 92 92 ALA N N 92 123.057 120.160 2.897 1
1 1063 . 20 1 1 A 93 93 TYR H H 93 8.019 8.272 -0.253 1
1 1064 . 20 1 1 A 93 93 TYR HA H 93 4.523 4.712 -0.189 1
1 1071 . 20 1 1 A 93 93 TYR C C 93 176.279 174.905 1.374 1
1 1072 . 20 1 1 A 93 93 TYR CA C 93 58.401 58.336 0.065 1
1 1073 . 20 1 1 A 93 93 TYR CB C 93 38.669 39.946 -1.277 1
1 1078 . 20 1 1 A 93 93 TYR N N 93 118.337 114.405 3.932 1
1 1079 . 20 1 1 A 94 94 SER H H 94 8.037 6.918 1.119 1
1 1080 . 20 1 1 A 94 94 SER HA H 94 4.484 4.821 -0.337 1
1 1082 . 20 1 1 A 94 94 SER C C 94 174.554 173.319 1.235 1
1 1083 . 20 1 1 A 94 94 SER CA C 94 58.401 56.035 2.366 1
1 1084 . 20 1 1 A 94 94 SER CB C 94 63.806 65.753 -1.947 1
1 1085 . 20 1 1 A 94 94 SER N N 94 116.640 116.162 0.478 1
1 1086 . 20 1 1 A 96 96 ASN HA H 96 4.770 5.081 -0.311 1
1 1091 . 20 1 1 A 96 96 ASN C C 96 175.161 174.597 0.564 1
1 1092 . 20 1 1 A 96 96 ASN CA C 96 53.395 50.975 2.420 1
1 1093 . 20 1 1 A 96 96 ASN CB C 96 38.999 39.433 -0.434 1
1 1095 . 20 1 1 A 97 97 SER H H 97 8.230 8.525 -0.295 1
1 1096 . 20 1 1 A 97 97 SER HA H 97 4.481 4.400 0.081 1
1 1099 . 20 1 1 A 97 97 SER C C 97 174.482 174.503 -0.021 1
1 1100 . 20 1 1 A 97 97 SER CA C 97 58.300 59.421 -1.121 1
1 1101 . 20 1 1 A 97 97 SER CB C 97 63.697 63.160 0.537 1
1 1102 . 20 1 1 A 97 97 SER N N 97 115.866 114.899 0.967 1
1 1103 . 20 1 1 A 98 98 GLY H H 98 8.228 8.383 -0.155 1
1 1104 . 20 1 1 A 98 98 GLY HA2 H 98 4.098 4.181 -0.083 1
1 1105 . 20 1 1 A 98 98 GLY HA3 H 98 4.098 4.183 -0.085 1
1 1106 . 20 1 1 A 98 98 GLY C C 98 171.788 171.715 0.073 1
1 1107 . 20 1 1 A 98 98 GLY CA C 98 44.803 45.024 -0.221 1
1 1108 . 20 1 1 A 98 98 GLY N N 98 110.658 109.379 1.279 1
1 1109 . 20 1 1 A 99 99 PRO HA H 99 4.463 4.622 -0.159 1
1 1116 . 20 1 1 A 99 99 PRO CA C 99 63.230 62.694 0.536 1
1 1117 . 20 1 1 A 99 99 PRO CB C 99 32.044 33.043 -0.999 1
1 1120 . 20 1 1 A 100 100 SER H H 100 8.514 8.649 -0.135 1
1 1121 . 20 1 1 A 100 100 SER CA C 100 58.450 59.685 -1.235 1
1 1122 . 20 1 1 A 100 100 SER CB C 100 63.889 65.049 -1.160 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 88 1.059 1
2 1 1 1 "RMS(OBS, PRED)" CA 91 1.134 1
3 1 1 1 "RMS(OBS, PRED)" CB 86 1.033 1
4 1 1 1 "RMS(OBS, PRED)" H 84 0.551 1
5 1 1 1 "RMS(OBS, PRED)" HA 95 0.283 1
6 1 1 1 "RMS(OBS, PRED)" N 82 1.895 1
7 1 2 1 "RMS(OBS, PRED)" C 88 1.093 1
8 1 2 1 "RMS(OBS, PRED)" CA 91 1.134 1
9 1 2 1 "RMS(OBS, PRED)" CB 86 0.961 1
10 1 2 1 "RMS(OBS, PRED)" H 84 0.590 1
11 1 2 1 "RMS(OBS, PRED)" HA 95 0.294 1
12 1 2 1 "RMS(OBS, PRED)" N 82 2.078 1
13 1 3 1 "RMS(OBS, PRED)" C 88 1.106 1
14 1 3 1 "RMS(OBS, PRED)" CA 91 1.158 1
15 1 3 1 "RMS(OBS, PRED)" CB 86 1.044 1
16 1 3 1 "RMS(OBS, PRED)" H 84 0.563 1
17 1 3 1 "RMS(OBS, PRED)" HA 95 0.286 1
18 1 3 1 "RMS(OBS, PRED)" N 82 2.337 1
19 1 4 1 "RMS(OBS, PRED)" C 88 1.021 1
20 1 4 1 "RMS(OBS, PRED)" CA 91 1.119 1
21 1 4 1 "RMS(OBS, PRED)" CB 86 0.790 1
22 1 4 1 "RMS(OBS, PRED)" H 84 0.574 1
23 1 4 1 "RMS(OBS, PRED)" HA 95 0.260 1
24 1 4 1 "RMS(OBS, PRED)" N 82 2.062 1
25 1 5 1 "RMS(OBS, PRED)" C 88 1.101 1
26 1 5 1 "RMS(OBS, PRED)" CA 91 1.260 1
27 1 5 1 "RMS(OBS, PRED)" CB 86 0.894 1
28 1 5 1 "RMS(OBS, PRED)" H 84 0.572 1
29 1 5 1 "RMS(OBS, PRED)" HA 95 0.293 1
30 1 5 1 "RMS(OBS, PRED)" N 82 1.939 1
31 1 6 1 "RMS(OBS, PRED)" C 88 1.071 1
32 1 6 1 "RMS(OBS, PRED)" CA 91 1.151 1
33 1 6 1 "RMS(OBS, PRED)" CB 86 0.934 1
34 1 6 1 "RMS(OBS, PRED)" H 84 0.561 1
35 1 6 1 "RMS(OBS, PRED)" HA 95 0.249 1
36 1 6 1 "RMS(OBS, PRED)" N 82 2.001 1
37 1 7 1 "RMS(OBS, PRED)" C 88 1.057 1
38 1 7 1 "RMS(OBS, PRED)" CA 91 1.109 1
39 1 7 1 "RMS(OBS, PRED)" CB 86 1.022 1
40 1 7 1 "RMS(OBS, PRED)" H 84 0.569 1
41 1 7 1 "RMS(OBS, PRED)" HA 95 0.269 1
42 1 7 1 "RMS(OBS, PRED)" N 82 1.971 1
43 1 8 1 "RMS(OBS, PRED)" C 88 1.009 1
44 1 8 1 "RMS(OBS, PRED)" CA 91 1.120 1
45 1 8 1 "RMS(OBS, PRED)" CB 86 0.944 1
46 1 8 1 "RMS(OBS, PRED)" H 84 0.577 1
47 1 8 1 "RMS(OBS, PRED)" HA 95 0.266 1
48 1 8 1 "RMS(OBS, PRED)" N 82 1.983 1
49 1 9 1 "RMS(OBS, PRED)" C 88 1.051 1
50 1 9 1 "RMS(OBS, PRED)" CA 91 1.219 1
51 1 9 1 "RMS(OBS, PRED)" CB 86 0.893 1
52 1 9 1 "RMS(OBS, PRED)" H 84 0.546 1
53 1 9 1 "RMS(OBS, PRED)" HA 95 0.262 1
54 1 9 1 "RMS(OBS, PRED)" N 82 2.050 1
55 1 10 1 "RMS(OBS, PRED)" C 88 1.032 1
56 1 10 1 "RMS(OBS, PRED)" CA 91 1.125 1
57 1 10 1 "RMS(OBS, PRED)" CB 86 0.994 1
58 1 10 1 "RMS(OBS, PRED)" H 84 0.539 1
59 1 10 1 "RMS(OBS, PRED)" HA 95 0.274 1
60 1 10 1 "RMS(OBS, PRED)" N 82 2.025 1
61 1 11 1 "RMS(OBS, PRED)" C 88 1.124 1
62 1 11 1 "RMS(OBS, PRED)" CA 91 1.172 1
63 1 11 1 "RMS(OBS, PRED)" CB 86 0.916 1
64 1 11 1 "RMS(OBS, PRED)" H 84 0.577 1
65 1 11 1 "RMS(OBS, PRED)" HA 95 0.243 1
66 1 11 1 "RMS(OBS, PRED)" N 82 1.932 1
67 1 12 1 "RMS(OBS, PRED)" C 88 1.043 1
68 1 12 1 "RMS(OBS, PRED)" CA 91 1.200 1
69 1 12 1 "RMS(OBS, PRED)" CB 86 0.885 1
70 1 12 1 "RMS(OBS, PRED)" H 84 0.562 1
71 1 12 1 "RMS(OBS, PRED)" HA 95 0.264 1
72 1 12 1 "RMS(OBS, PRED)" N 82 2.230 1
73 1 13 1 "RMS(OBS, PRED)" C 88 1.028 1
74 1 13 1 "RMS(OBS, PRED)" CA 91 1.103 1
75 1 13 1 "RMS(OBS, PRED)" CB 86 0.835 1
76 1 13 1 "RMS(OBS, PRED)" H 84 0.571 1
77 1 13 1 "RMS(OBS, PRED)" HA 95 0.249 1
78 1 13 1 "RMS(OBS, PRED)" N 82 1.903 1
79 1 14 1 "RMS(OBS, PRED)" C 88 1.029 1
80 1 14 1 "RMS(OBS, PRED)" CA 91 1.075 1
81 1 14 1 "RMS(OBS, PRED)" CB 86 0.833 1
82 1 14 1 "RMS(OBS, PRED)" H 84 0.541 1
83 1 14 1 "RMS(OBS, PRED)" HA 95 0.246 1
84 1 14 1 "RMS(OBS, PRED)" N 82 2.243 1
85 1 15 1 "RMS(OBS, PRED)" C 88 0.997 1
86 1 15 1 "RMS(OBS, PRED)" CA 91 1.107 1
87 1 15 1 "RMS(OBS, PRED)" CB 86 0.870 1
88 1 15 1 "RMS(OBS, PRED)" H 84 0.591 1
89 1 15 1 "RMS(OBS, PRED)" HA 95 0.237 1
90 1 15 1 "RMS(OBS, PRED)" N 82 2.023 1
91 1 16 1 "RMS(OBS, PRED)" C 88 1.028 1
92 1 16 1 "RMS(OBS, PRED)" CA 91 1.140 1
93 1 16 1 "RMS(OBS, PRED)" CB 86 0.886 1
94 1 16 1 "RMS(OBS, PRED)" H 84 0.551 1
95 1 16 1 "RMS(OBS, PRED)" HA 95 0.251 1
96 1 16 1 "RMS(OBS, PRED)" N 82 2.051 1
97 1 17 1 "RMS(OBS, PRED)" C 88 1.141 1
98 1 17 1 "RMS(OBS, PRED)" CA 91 1.285 1
99 1 17 1 "RMS(OBS, PRED)" CB 86 0.890 1
100 1 17 1 "RMS(OBS, PRED)" H 84 0.572 1
101 1 17 1 "RMS(OBS, PRED)" HA 95 0.260 1
102 1 17 1 "RMS(OBS, PRED)" N 82 2.436 1
103 1 18 1 "RMS(OBS, PRED)" C 88 1.001 1
104 1 18 1 "RMS(OBS, PRED)" CA 91 1.121 1
105 1 18 1 "RMS(OBS, PRED)" CB 86 0.852 1
106 1 18 1 "RMS(OBS, PRED)" H 84 0.558 1
107 1 18 1 "RMS(OBS, PRED)" HA 95 0.267 1
108 1 18 1 "RMS(OBS, PRED)" N 82 2.040 1
109 1 19 1 "RMS(OBS, PRED)" C 88 1.096 1
110 1 19 1 "RMS(OBS, PRED)" CA 91 1.198 1
111 1 19 1 "RMS(OBS, PRED)" CB 86 0.772 1
112 1 19 1 "RMS(OBS, PRED)" H 84 0.577 1
113 1 19 1 "RMS(OBS, PRED)" HA 95 0.243 1
114 1 19 1 "RMS(OBS, PRED)" N 82 2.036 1
115 1 20 1 "RMS(OBS, PRED)" C 88 1.022 1
116 1 20 1 "RMS(OBS, PRED)" CA 91 1.123 1
117 1 20 1 "RMS(OBS, PRED)" CB 86 0.836 1
118 1 20 1 "RMS(OBS, PRED)" H 84 0.565 1
119 1 20 1 "RMS(OBS, PRED)" HA 95 0.239 1
120 1 20 1 "RMS(OBS, PRED)" N 82 1.971 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 9 9 ASN H H 9 8.856 8.507 0.349 2
1 2 . 1 1 A 9 9 ASN HA H 9 4.694 4.909 -0.215 2
1 7 . 1 1 A 9 9 ASN CA C 9 53.401 53.222 0.179 2
1 8 . 1 1 A 9 9 ASN CB C 9 38.757 39.677 -0.920 2
1 10 . 1 1 A 10 10 ARG HA H 10 4.346 4.694 -0.348 2
1 17 . 1 1 A 10 10 ARG C C 10 175.405 175.290 0.115 2
1 18 . 1 1 A 10 10 ARG CA C 10 56.181 55.424 0.757 2
1 19 . 1 1 A 10 10 ARG CB C 10 31.171 31.544 -0.373 2
1 22 . 1 1 A 11 11 PHE H H 11 8.310 8.735 -0.425 2
1 23 . 1 1 A 11 11 PHE HA H 11 4.291 4.775 -0.484 2
1 31 . 1 1 A 11 11 PHE C C 11 174.458 173.546 0.912 2
1 32 . 1 1 A 11 11 PHE CA C 11 58.967 57.740 1.227 2
1 33 . 1 1 A 11 11 PHE CB C 11 40.138 40.852 -0.714 2
1 39 . 1 1 A 11 11 PHE N N 11 123.604 123.952 -0.348 2
1 40 . 1 1 A 12 12 LYS H H 12 7.307 8.298 -0.991 2
1 41 . 1 1 A 12 12 LYS HA H 12 4.165 4.514 -0.349 2
1 50 . 1 1 A 12 12 LYS C C 12 174.385 175.538 -1.153 2
1 51 . 1 1 A 12 12 LYS CA C 12 54.593 54.189 0.404 2
1 52 . 1 1 A 12 12 LYS CB C 12 34.712 35.229 -0.517 2
1 56 . 1 1 A 12 12 LYS N N 12 127.282 125.941 1.341 2
1 57 . 1 1 A 13 13 TRP H H 13 8.039 8.345 -0.306 2
1 58 . 1 1 A 13 13 TRP HA H 13 4.370 4.580 -0.210 2
1 67 . 1 1 A 13 13 TRP C C 13 177.857 176.570 1.287 2
1 68 . 1 1 A 13 13 TRP CA C 13 56.675 57.164 -0.489 2
1 69 . 1 1 A 13 13 TRP CB C 13 30.317 30.346 -0.029 2
1 75 . 1 1 A 13 13 TRP N N 13 124.264 127.060 -2.796 2
1 77 . 1 1 A 14 14 GLY H H 14 9.815 8.745 1.071 2
1 78 . 1 1 A 14 14 GLY HA2 H 14 4.370 4.195 0.175 2
1 79 . 1 1 A 14 14 GLY HA3 H 14 4.335 4.220 0.115 2
1 80 . 1 1 A 14 14 GLY C C 14 172.904 174.747 -1.843 2
1 81 . 1 1 A 14 14 GLY CA C 14 44.157 43.938 0.219 2
1 82 . 1 1 A 14 14 GLY N N 14 115.294 109.050 6.244 2
1 83 . 1 1 A 15 15 PRO HA H 15 4.327 4.393 -0.066 2
1 90 . 1 1 A 15 15 PRO C C 15 179.726 178.797 0.929 2
1 91 . 1 1 A 15 15 PRO CA C 15 65.171 65.276 -0.105 2
1 92 . 1 1 A 15 15 PRO CB C 15 31.829 31.878 -0.049 2
1 95 . 1 1 A 16 16 ALA H H 16 9.214 8.136 1.078 2
1 96 . 1 1 A 16 16 ALA HA H 16 4.166 4.121 0.045 2
1 100 . 1 1 A 16 16 ALA C C 16 181.184 179.691 1.493 2
1 101 . 1 1 A 16 16 ALA CA C 16 55.370 55.209 0.161 2
1 102 . 1 1 A 16 16 ALA CB C 16 18.058 18.767 -0.709 2
1 103 . 1 1 A 16 16 ALA N N 16 122.414 119.782 2.632 2
1 104 . 1 1 A 17 17 SER H H 17 7.985 8.215 -0.230 2
1 105 . 1 1 A 17 17 SER HA H 17 4.317 4.143 0.174 2
1 107 . 1 1 A 17 17 SER C C 17 175.381 176.786 -1.405 2
1 108 . 1 1 A 17 17 SER CA C 17 63.163 62.064 1.099 2
1 109 . 1 1 A 17 17 SER CB C 17 64.055 62.948 1.107 2
1 110 . 1 1 A 17 17 SER N N 17 116.568 113.906 2.662 2
1 111 . 1 1 A 18 18 GLN H H 18 8.316 7.881 0.435 2
1 112 . 1 1 A 18 18 GLN HA H 18 3.323 3.488 -0.165 2
1 119 . 1 1 A 18 18 GLN C C 18 176.812 178.610 -1.798 2
1 120 . 1 1 A 18 18 GLN CA C 18 60.025 59.200 0.825 2
1 121 . 1 1 A 18 18 GLN CB C 18 28.686 28.485 0.201 2
1 123 . 1 1 A 18 18 GLN N N 18 119.002 120.856 -1.854 2
1 125 . 1 1 A 19 19 GLN H H 19 7.582 8.139 -0.557 2
1 126 . 1 1 A 19 19 GLN HA H 19 4.062 4.095 -0.033 2
1 133 . 1 1 A 19 19 GLN C C 19 178.488 178.514 -0.026 2
1 134 . 1 1 A 19 19 GLN CA C 19 59.248 59.221 0.027 2
1 135 . 1 1 A 19 19 GLN CB C 19 28.203 28.222 -0.019 2
1 137 . 1 1 A 19 19 GLN N N 19 116.221 118.778 -2.557 2
1 139 . 1 1 A 20 20 ILE H H 20 7.246 7.962 -0.716 2
1 140 . 1 1 A 20 20 ILE HA H 20 3.570 3.619 -0.049 2
1 150 . 1 1 A 20 20 ILE C C 20 178.999 178.530 0.469 2
1 151 . 1 1 A 20 20 ILE CA C 20 64.996 65.607 -0.611 2
1 152 . 1 1 A 20 20 ILE CB C 20 38.139 37.776 0.363 2
1 156 . 1 1 A 20 20 ILE N N 20 120.521 120.918 -0.397 2
1 157 . 1 1 A 21 21 LEU H H 21 8.034 7.892 0.142 2
1 158 . 1 1 A 21 21 LEU HA H 21 3.491 3.566 -0.075 2
1 168 . 1 1 A 21 21 LEU C C 21 178.196 178.527 -0.331 2
1 169 . 1 1 A 21 21 LEU CA C 21 57.944 57.471 0.473 2
1 170 . 1 1 A 21 21 LEU CB C 21 37.864 40.356 -2.492 2
1 174 . 1 1 A 21 21 LEU N N 21 121.259 118.947 2.312 2
1 175 . 1 1 A 22 22 TYR H H 22 8.479 7.619 0.860 2
1 176 . 1 1 A 22 22 TYR HA H 22 4.224 4.287 -0.063 2
1 183 . 1 1 A 22 22 TYR C C 22 179.630 178.590 1.040 2
1 184 . 1 1 A 22 22 TYR CA C 22 62.422 60.791 1.631 2
1 185 . 1 1 A 22 22 TYR CB C 22 37.434 37.702 -0.268 2
1 190 . 1 1 A 22 22 TYR N N 22 117.805 118.725 -0.920 2
1 191 . 1 1 A 23 23 GLN H H 23 7.707 8.328 -0.621 2
1 192 . 1 1 A 23 23 GLN HA H 23 4.166 4.032 0.134 2
1 199 . 1 1 A 23 23 GLN C C 23 178.633 178.550 0.083 2
1 200 . 1 1 A 23 23 GLN CA C 23 58.789 59.166 -0.377 2
1 201 . 1 1 A 23 23 GLN CB C 23 28.534 28.136 0.398 2
1 203 . 1 1 A 23 23 GLN N N 23 117.580 118.326 -0.746 2
1 205 . 1 1 A 24 24 ALA H H 24 8.155 7.827 0.328 2
1 206 . 1 1 A 24 24 ALA HA H 24 4.187 4.206 -0.019 2
1 210 . 1 1 A 24 24 ALA C C 24 180.018 179.166 0.852 2
1 211 . 1 1 A 24 24 ALA CA C 24 55.228 55.161 0.067 2
1 212 . 1 1 A 24 24 ALA CB C 24 19.468 18.682 0.786 2
1 213 . 1 1 A 24 24 ALA N N 24 122.813 122.356 0.457 2
1 214 . 1 1 A 25 25 TYR H H 25 8.995 8.589 0.406 2
1 215 . 1 1 A 25 25 TYR HA H 25 4.348 4.767 -0.419 2
1 222 . 1 1 A 25 25 TYR C C 25 175.792 177.509 -1.717 2
1 223 . 1 1 A 25 25 TYR CA C 25 61.681 61.963 -0.282 2
1 224 . 1 1 A 25 25 TYR CB C 25 38.175 38.642 -0.467 2
1 229 . 1 1 A 25 25 TYR N N 25 121.343 120.255 1.088 2
1 230 . 1 1 A 26 26 ASP H H 26 7.260 8.754 -1.494 2
1 231 . 1 1 A 26 26 ASP HA H 26 4.373 4.472 -0.099 2
1 234 . 1 1 A 26 26 ASP C C 26 177.322 178.290 -0.968 2
1 235 . 1 1 A 26 26 ASP CA C 26 56.603 57.534 -0.931 2
1 236 . 1 1 A 26 26 ASP CB C 26 41.060 41.593 -0.533 2
1 237 . 1 1 A 26 26 ASP N N 26 114.020 119.272 -5.252 2
1 238 . 1 1 A 27 27 ARG H H 27 7.343 7.793 -0.450 2
1 239 . 1 1 A 27 27 ARG HA H 27 4.302 4.363 -0.061 2
1 246 . 1 1 A 27 27 ARG C C 27 176.546 176.277 0.269 2
1 247 . 1 1 A 27 27 ARG CA C 27 57.563 57.770 -0.207 2
1 248 . 1 1 A 27 27 ARG CB C 27 31.500 31.332 0.168 2
1 251 . 1 1 A 27 27 ARG N N 27 116.729 117.030 -0.301 2
1 252 . 1 1 A 28 28 GLN H H 28 8.306 8.017 0.289 2
1 253 . 1 1 A 28 28 GLN HA H 28 4.396 4.693 -0.297 2
1 260 . 1 1 A 28 28 GLN C C 28 172.831 175.194 -2.363 2
1 261 . 1 1 A 28 28 GLN CA C 28 55.355 54.522 0.833 2
1 262 . 1 1 A 28 28 GLN CB C 28 31.062 31.575 -0.513 2
1 264 . 1 1 A 28 28 GLN N N 28 121.612 118.327 3.285 2
1 266 . 1 1 A 29 29 LYS H H 29 8.354 8.530 -0.176 2
1 267 . 1 1 A 29 29 LYS HA H 29 4.099 3.548 0.551 2
1 276 . 1 1 A 29 29 LYS C C 29 176.084 176.474 -0.390 2
1 277 . 1 1 A 29 29 LYS CA C 29 57.873 57.675 0.198 2
1 278 . 1 1 A 29 29 LYS CB C 29 33.313 32.743 0.570 2
1 282 . 1 1 A 29 29 LYS N N 29 125.038 124.075 0.963 2
1 283 . 1 1 A 30 30 ASN H H 30 8.856 8.003 0.853 2
1 284 . 1 1 A 30 30 ASN HA H 30 4.958 5.050 -0.092 2
1 289 . 1 1 A 30 30 ASN C C 30 171.179 172.944 -1.765 2
1 290 . 1 1 A 30 30 ASN CA C 30 50.891 50.437 0.454 2
1 291 . 1 1 A 30 30 ASN CB C 30 39.907 39.041 0.865 2
1 292 . 1 1 A 30 30 ASN N N 30 115.764 116.702 -0.938 2
1 294 . 1 1 A 31 31 PRO HA H 31 4.299 4.482 -0.183 2
1 301 . 1 1 A 31 31 PRO C C 31 177.493 176.756 0.737 2
1 302 . 1 1 A 31 31 PRO CA C 31 62.489 62.582 -0.093 2
1 303 . 1 1 A 31 31 PRO CB C 31 31.216 31.872 -0.656 2
1 306 . 1 1 A 32 32 SER H H 32 9.368 8.479 0.889 2
1 307 . 1 1 A 32 32 SER HA H 32 4.372 4.741 -0.369 2
1 310 . 1 1 A 32 32 SER C C 32 174.821 175.723 -0.902 2
1 311 . 1 1 A 32 32 SER CA C 32 57.203 57.707 -0.504 2
1 312 . 1 1 A 32 32 SER CB C 32 65.594 64.488 1.106 2
1 313 . 1 1 A 32 32 SER N N 32 120.847 117.741 3.106 2
1 314 . 1 1 A 33 33 LYS H H 33 9.152 8.971 0.181 2
1 315 . 1 1 A 33 33 LYS HA H 33 3.719 3.908 -0.189 2
1 324 . 1 1 A 33 33 LYS C C 33 177.833 178.261 -0.428 2
1 325 . 1 1 A 33 33 LYS CA C 33 61.188 60.238 0.950 2
1 326 . 1 1 A 33 33 LYS CB C 33 32.572 32.281 0.291 2
1 330 . 1 1 A 33 33 LYS N N 33 122.966 124.785 -1.819 2
1 331 . 1 1 A 34 34 GLU H H 34 8.902 8.305 0.597 2
1 332 . 1 1 A 34 34 GLU HA H 34 4.089 4.063 0.026 2
1 337 . 1 1 A 34 34 GLU C C 34 180.286 179.187 1.099 2
1 338 . 1 1 A 34 34 GLU CA C 34 60.483 59.361 1.122 2
1 339 . 1 1 A 34 34 GLU CB C 34 28.835 29.391 -0.556 2
1 341 . 1 1 A 34 34 GLU N N 34 117.645 118.444 -0.799 2
1 342 . 1 1 A 35 35 GLU H H 35 7.673 8.184 -0.511 2
1 343 . 1 1 A 35 35 GLU HA H 35 4.023 3.960 0.063 2
1 348 . 1 1 A 35 35 GLU C C 35 180.237 179.182 1.055 2
1 349 . 1 1 A 35 35 GLU CA C 35 59.214 59.343 -0.129 2
1 350 . 1 1 A 35 35 GLU CB C 35 30.099 29.280 0.819 2
1 352 . 1 1 A 35 35 GLU N N 35 121.077 120.175 0.902 2
1 353 . 1 1 A 36 36 ARG H H 36 8.932 8.282 0.650 2
1 354 . 1 1 A 36 36 ARG HA H 36 3.928 3.778 0.150 2
1 362 . 1 1 A 36 36 ARG C C 36 178.464 179.095 -0.631 2
1 363 . 1 1 A 36 36 ARG CA C 36 60.974 60.029 0.945 2
1 364 . 1 1 A 36 36 ARG CB C 36 31.171 29.918 1.253 2
1 367 . 1 1 A 36 36 ARG N N 36 119.441 120.098 -0.657 2
1 369 . 1 1 A 37 37 GLU H H 37 8.756 8.361 0.395 2
1 370 . 1 1 A 37 37 GLU HA H 37 3.948 4.114 -0.166 2
1 375 . 1 1 A 37 37 GLU C C 37 179.606 178.902 0.704 2
1 376 . 1 1 A 37 37 GLU CA C 37 60.094 59.046 1.048 2
1 377 . 1 1 A 37 37 GLU CB C 37 29.110 29.306 -0.196 2
1 379 . 1 1 A 37 37 GLU N N 37 119.017 119.729 -0.712 2
1 380 . 1 1 A 38 38 ALA H H 38 7.733 8.047 -0.314 2
1 381 . 1 1 A 38 38 ALA HA H 38 4.325 4.125 0.200 2
1 385 . 1 1 A 38 38 ALA C C 38 180.820 178.505 2.315 2
1 386 . 1 1 A 38 38 ALA CA C 38 55.194 54.454 0.740 2
1 387 . 1 1 A 38 38 ALA CB C 38 17.654 18.541 -0.887 2
1 388 . 1 1 A 38 38 ALA N N 38 122.889 121.919 0.970 2
1 389 . 1 1 A 39 39 LEU H H 39 7.740 7.851 -0.111 2
1 390 . 1 1 A 39 39 LEU HA H 39 4.176 4.277 -0.101 2
1 400 . 1 1 A 39 39 LEU C C 39 179.266 178.793 0.473 2
1 401 . 1 1 A 39 39 LEU CA C 39 57.944 56.098 1.846 2
1 402 . 1 1 A 39 39 LEU CB C 39 42.105 42.370 -0.265 2
1 406 . 1 1 A 39 39 LEU N N 39 119.783 116.802 2.981 2
1 407 . 1 1 A 40 40 VAL H H 40 8.451 8.323 0.128 2
1 408 . 1 1 A 40 40 VAL HA H 40 3.259 3.632 -0.373 2
1 416 . 1 1 A 40 40 VAL C C 40 177.153 177.714 -0.561 2
1 417 . 1 1 A 40 40 VAL CA C 40 67.254 66.945 0.309 2
1 418 . 1 1 A 40 40 VAL CB C 40 31.747 31.483 0.264 2
1 421 . 1 1 A 40 40 VAL N N 40 121.481 119.962 1.519 2
1 422 . 1 1 A 41 41 GLU H H 41 7.254 8.044 -0.790 2
1 423 . 1 1 A 41 41 GLU HA H 41 4.159 4.123 0.036 2
1 428 . 1 1 A 41 41 GLU C C 41 179.483 178.860 0.623 2
1 429 . 1 1 A 41 41 GLU CA C 41 59.248 59.386 -0.138 2
1 430 . 1 1 A 41 41 GLU CB C 41 29.358 29.393 -0.035 2
1 432 . 1 1 A 41 41 GLU N N 41 116.549 119.827 -3.278 2
1 433 . 1 1 A 42 42 GLU H H 42 8.103 7.897 0.206 2
1 434 . 1 1 A 42 42 GLU HA H 42 4.020 4.050 -0.030 2
1 439 . 1 1 A 42 42 GLU C C 42 180.115 178.778 1.337 2
1 440 . 1 1 A 42 42 GLU CA C 42 59.847 59.522 0.325 2
1 441 . 1 1 A 42 42 GLU CB C 42 30.218 29.334 0.884 2
1 443 . 1 1 A 42 42 GLU N N 42 119.578 119.304 0.274 2
1 444 . 1 1 A 43 43 CYS H H 43 8.955 8.095 0.860 2
1 445 . 1 1 A 43 43 CYS HA H 43 4.153 4.237 -0.084 2
1 448 . 1 1 A 43 43 CYS C C 43 176.498 177.609 -1.111 2
1 449 . 1 1 A 43 43 CYS CA C 43 64.856 62.435 2.421 2
1 450 . 1 1 A 43 43 CYS CB C 43 27.390 27.777 -0.387 2
1 451 . 1 1 A 43 43 CYS N N 43 118.199 118.837 -0.638 2
1 452 . 1 1 A 44 44 ASN H H 44 8.543 7.994 0.549 2
1 453 . 1 1 A 44 44 ASN HA H 44 4.635 4.427 0.208 2
1 458 . 1 1 A 44 44 ASN C C 44 178.633 177.620 1.013 2
1 459 . 1 1 A 44 44 ASN CA C 44 56.603 56.356 0.247 2
1 460 . 1 1 A 44 44 ASN CB C 44 37.187 38.162 -0.975 2
1 461 . 1 1 A 44 44 ASN N N 44 117.002 119.592 -2.590 2
1 463 . 1 1 A 45 45 ARG H H 45 8.296 8.186 0.110 2
1 464 . 1 1 A 45 45 ARG HA H 45 3.977 4.058 -0.081 2
1 471 . 1 1 A 45 45 ARG C C 45 178.149 178.298 -0.149 2
1 472 . 1 1 A 45 45 ARG CA C 45 60.589 59.498 1.091 2
1 473 . 1 1 A 45 45 ARG CB C 45 30.099 30.200 -0.101 2
1 476 . 1 1 A 45 45 ARG N N 45 121.021 120.986 0.035 2
1 477 . 1 1 A 46 46 ALA H H 46 7.914 8.311 -0.397 2
1 478 . 1 1 A 46 46 ALA HA H 46 4.128 4.113 0.015 2
1 482 . 1 1 A 46 46 ALA C C 46 181.208 180.198 1.010 2
1 483 . 1 1 A 46 46 ALA CA C 46 55.264 54.960 0.304 2
1 484 . 1 1 A 46 46 ALA CB C 46 18.759 18.408 0.351 2
1 485 . 1 1 A 46 46 ALA N N 46 121.570 120.761 0.809 2
1 486 . 1 1 A 47 47 GLU H H 47 8.730 8.607 0.123 2
1 487 . 1 1 A 47 47 GLU HA H 47 4.194 4.040 0.154 2
1 492 . 1 1 A 47 47 GLU C C 47 180.115 179.131 0.984 2
1 493 . 1 1 A 47 47 GLU CA C 47 58.401 59.438 -1.037 2
1 494 . 1 1 A 47 47 GLU CB C 47 29.523 29.329 0.194 2
1 496 . 1 1 A 47 47 GLU N N 47 117.532 118.200 -0.668 2
1 497 . 1 1 A 48 48 CYS H H 48 8.283 7.870 0.413 2
1 498 . 1 1 A 48 48 CYS HA H 48 4.002 4.128 -0.126 2
1 501 . 1 1 A 48 48 CYS C C 48 177.031 177.384 -0.353 2
1 502 . 1 1 A 48 48 CYS CA C 48 64.749 63.915 0.834 2
1 503 . 1 1 A 48 48 CYS CB C 48 25.907 27.286 -1.379 2
1 504 . 1 1 A 48 48 CYS N N 48 118.282 119.165 -0.883 2
1 505 . 1 1 A 49 49 LEU H H 49 8.181 8.086 0.095 2
1 506 . 1 1 A 49 49 LEU HA H 49 4.175 3.908 0.267 2
1 516 . 1 1 A 49 49 LEU C C 49 180.430 178.783 1.647 2
1 517 . 1 1 A 49 49 LEU CA C 49 57.873 58.174 -0.301 2
1 518 . 1 1 A 49 49 LEU CB C 49 41.539 41.712 -0.173 2
1 522 . 1 1 A 49 49 LEU N N 49 120.371 120.780 -0.409 2
1 523 . 1 1 A 50 50 GLN H H 50 7.934 8.615 -0.681 2
1 524 . 1 1 A 50 50 GLN HA H 50 4.102 4.068 0.034 2
1 531 . 1 1 A 50 50 GLN C C 50 177.322 177.245 0.076 2
1 532 . 1 1 A 50 50 GLN CA C 50 58.156 58.674 -0.518 2
1 533 . 1 1 A 50 50 GLN CB C 50 28.616 28.533 0.083 2
1 535 . 1 1 A 50 50 GLN N N 50 118.175 117.405 0.770 2
1 537 . 1 1 A 51 51 ARG H H 51 7.632 7.725 -0.093 2
1 538 . 1 1 A 51 51 ARG HA H 51 4.347 4.360 -0.013 2
1 545 . 1 1 A 51 51 ARG C C 51 176.546 176.450 0.096 2
1 546 . 1 1 A 51 51 ARG CA C 51 56.286 55.937 0.349 2
1 547 . 1 1 A 51 51 ARG CB C 51 31.314 30.213 1.101 2
1 550 . 1 1 A 51 51 ARG N N 51 116.454 117.861 -1.407 2
1 551 . 1 1 A 52 52 GLY H H 52 7.949 8.329 -0.380 2
1 552 . 1 1 A 52 52 GLY HA2 H 52 4.033 3.972 0.061 2
1 553 . 1 1 A 52 52 GLY HA3 H 52 3.903 3.973 -0.070 2
1 554 . 1 1 A 52 52 GLY C C 52 174.385 174.231 0.154 2
1 555 . 1 1 A 52 52 GLY CA C 52 46.231 45.272 0.959 2
1 556 . 1 1 A 52 52 GLY N N 52 108.854 107.612 1.242 2
1 557 . 1 1 A 53 53 VAL H H 53 7.944 7.530 0.414 2
1 558 . 1 1 A 53 53 VAL HA H 53 4.250 4.048 0.202 2
1 566 . 1 1 A 53 53 VAL C C 53 175.525 175.094 0.431 2
1 567 . 1 1 A 53 53 VAL CA C 53 60.377 62.524 -2.147 2
1 568 . 1 1 A 53 53 VAL CB C 53 34.283 32.850 1.433 2
1 571 . 1 1 A 53 53 VAL N N 53 118.316 120.744 -2.428 2
1 572 . 1 1 A 54 54 SER H H 54 8.502 8.508 -0.006 2
1 573 . 1 1 A 54 54 SER HA H 54 4.625 4.907 -0.282 2
1 576 . 1 1 A 54 54 SER C C 54 174.603 174.074 0.529 2
1 577 . 1 1 A 54 54 SER CA C 54 56.092 54.222 1.870 2
1 578 . 1 1 A 54 54 SER CB C 54 63.697 63.771 -0.074 2
1 579 . 1 1 A 54 54 SER N N 54 120.337 118.379 1.958 2
1 580 . 1 1 A 55 55 PRO HA H 55 4.624 4.528 0.096 2
1 587 . 1 1 A 55 55 PRO C C 55 177.322 177.472 -0.150 2
1 588 . 1 1 A 55 55 PRO CA C 55 64.431 64.210 0.221 2
1 589 . 1 1 A 55 55 PRO CB C 55 31.913 31.699 0.214 2
1 592 . 1 1 A 56 56 SER H H 56 7.931 8.354 -0.423 2
1 593 . 1 1 A 56 56 SER HA H 56 4.428 4.579 -0.151 2
1 596 . 1 1 A 56 56 SER C C 56 174.749 175.062 -0.313 2
1 597 . 1 1 A 56 56 SER CA C 56 59.130 59.218 -0.088 2
1 598 . 1 1 A 56 56 SER CB C 56 63.056 63.947 -0.891 2
1 599 . 1 1 A 56 56 SER N N 56 112.637 112.956 -0.319 2
1 600 . 1 1 A 57 57 LYS H H 57 8.121 7.602 0.519 2
1 601 . 1 1 A 57 57 LYS HA H 57 4.467 4.880 -0.413 2
1 609 . 1 1 A 57 57 LYS C C 57 176.570 176.230 0.340 2
1 610 . 1 1 A 57 57 LYS CA C 57 55.264 55.068 0.196 2
1 611 . 1 1 A 57 57 LYS CB C 57 32.160 32.541 -0.381 2
1 615 . 1 1 A 57 57 LYS N N 57 123.185 118.205 4.980 2
1 616 . 1 1 A 58 58 ALA H H 58 7.886 7.967 -0.081 2
1 617 . 1 1 A 58 58 ALA HA H 58 3.923 3.936 -0.013 2
1 621 . 1 1 A 58 58 ALA C C 58 177.469 179.724 -2.255 2
1 622 . 1 1 A 58 58 ALA CA C 58 54.276 54.841 -0.565 2
1 623 . 1 1 A 58 58 ALA CB C 58 18.271 18.451 -0.180 2
1 624 . 1 1 A 58 58 ALA N N 58 123.941 122.878 1.063 2
1 625 . 1 1 A 59 59 HIS H H 59 8.077 8.138 -0.061 2
1 626 . 1 1 A 59 59 HIS HA H 59 4.420 4.404 0.016 2
1 631 . 1 1 A 59 59 HIS C C 59 177.542 177.227 0.315 2
1 632 . 1 1 A 59 59 HIS CA C 59 57.767 58.499 -0.733 2
1 633 . 1 1 A 59 59 HIS CB C 59 29.852 28.624 1.228 2
1 636 . 1 1 A 59 59 HIS N N 59 115.566 115.599 -0.033 2
1 637 . 1 1 A 60 60 GLY H H 60 8.110 7.828 0.282 2
1 638 . 1 1 A 60 60 GLY HA2 H 60 3.873 3.480 0.393 2
1 639 . 1 1 A 60 60 GLY HA3 H 60 4.025 3.589 0.436 2
1 640 . 1 1 A 60 60 GLY C C 60 174.918 175.536 -0.618 2
1 641 . 1 1 A 60 60 GLY CA C 60 45.559 46.742 -1.183 2
1 642 . 1 1 A 60 60 GLY N N 60 109.216 109.906 -0.690 2
1 643 . 1 1 A 61 61 LEU H H 61 8.280 8.235 0.045 2
1 644 . 1 1 A 61 61 LEU HA H 61 4.198 4.024 0.174 2
1 654 . 1 1 A 61 61 LEU C C 61 178.900 177.526 1.374 2
1 655 . 1 1 A 61 61 LEU CA C 61 55.758 57.512 -1.754 2
1 656 . 1 1 A 61 61 LEU CB C 61 42.544 41.999 0.545 2
1 660 . 1 1 A 61 61 LEU N N 61 120.521 122.447 -1.926 2
1 661 . 1 1 A 62 62 GLY H H 62 8.184 8.001 0.183 2
1 662 . 1 1 A 62 62 GLY HA2 H 62 3.978 3.854 0.124 2
1 663 . 1 1 A 62 62 GLY HA3 H 62 3.817 3.858 -0.041 2
1 664 . 1 1 A 62 62 GLY C C 62 176.012 175.210 0.802 2
1 665 . 1 1 A 62 62 GLY CA C 62 46.767 47.289 -0.522 2
1 666 . 1 1 A 62 62 GLY N N 62 108.987 108.462 0.525 2
1 667 . 1 1 A 63 63 SER HA H 63 4.322 4.264 0.058 2
1 670 . 1 1 A 63 63 SER C C 63 174.167 175.713 -1.546 2
1 671 . 1 1 A 63 63 SER CA C 63 59.919 61.350 -1.431 2
1 672 . 1 1 A 63 63 SER CB C 63 63.312 62.944 0.368 2
1 673 . 1 1 A 64 64 ASN H H 64 8.087 8.037 0.050 2
1 674 . 1 1 A 64 64 ASN HA H 64 4.850 4.972 -0.122 2
1 679 . 1 1 A 64 64 ASN C C 64 173.899 175.138 -1.239 2
1 680 . 1 1 A 64 64 ASN CA C 64 53.218 53.354 -0.136 2
1 681 . 1 1 A 64 64 ASN CB C 64 39.164 38.793 0.371 2
1 682 . 1 1 A 64 64 ASN N N 64 118.041 117.212 0.829 2
1 684 . 1 1 A 65 65 LEU H H 65 7.293 7.378 -0.085 2
1 685 . 1 1 A 65 65 LEU HA H 65 3.995 4.551 -0.556 2
1 695 . 1 1 A 65 65 LEU C C 65 175.696 175.296 0.400 2
1 696 . 1 1 A 65 65 LEU CA C 65 56.005 54.948 1.057 2
1 697 . 1 1 A 65 65 LEU CB C 65 43.120 43.423 -0.303 2
1 701 . 1 1 A 65 65 LEU N N 65 120.953 122.535 -1.582 2
1 702 . 1 1 A 66 66 VAL H H 66 9.517 8.889 0.628 2
1 703 . 1 1 A 66 66 VAL HA H 66 3.481 4.381 -0.900 2
1 711 . 1 1 A 66 66 VAL C C 66 175.429 175.024 0.405 2
1 712 . 1 1 A 66 66 VAL CA C 66 65.243 61.301 3.942 2
1 713 . 1 1 A 66 66 VAL CB C 66 31.335 33.220 -1.885 2
1 716 . 1 1 A 66 66 VAL N N 66 127.924 126.532 1.392 2
1 717 . 1 1 A 67 67 THR H H 67 6.253 8.315 -2.062 2
1 718 . 1 1 A 67 67 THR HA H 67 4.779 4.763 0.015 2
1 723 . 1 1 A 67 67 THR C C 67 174.894 174.835 0.059 2
1 724 . 1 1 A 67 67 THR CA C 67 58.719 59.583 -0.864 2
1 725 . 1 1 A 67 67 THR CB C 67 72.153 71.752 0.401 2
1 727 . 1 1 A 67 67 THR N N 67 113.376 116.025 -2.649 2
1 728 . 1 1 A 68 68 GLU H H 68 9.348 8.877 0.471 2
1 729 . 1 1 A 68 68 GLU HA H 68 3.634 4.004 -0.370 2
1 734 . 1 1 A 68 68 GLU C C 68 177.809 178.328 -0.519 2
1 735 . 1 1 A 68 68 GLU CA C 68 61.505 60.041 1.465 2
1 736 . 1 1 A 68 68 GLU CB C 68 28.285 29.615 -1.330 2
1 738 . 1 1 A 68 68 GLU N N 68 124.534 122.167 2.367 2
1 739 . 1 1 A 69 69 VAL H H 69 8.126 7.910 0.215 2
1 740 . 1 1 A 69 69 VAL HA H 69 3.862 3.531 0.331 2
1 748 . 1 1 A 69 69 VAL C C 69 177.712 178.071 -0.359 2
1 749 . 1 1 A 69 69 VAL CA C 69 65.701 66.819 -1.118 2
1 750 . 1 1 A 69 69 VAL CB C 69 31.829 31.573 0.256 2
1 753 . 1 1 A 69 69 VAL N N 69 119.139 119.915 -0.776 2
1 754 . 1 1 A 70 70 ARG H H 70 7.235 8.120 -0.885 2
1 755 . 1 1 A 70 70 ARG HA H 70 4.265 3.969 0.296 2
1 762 . 1 1 A 70 70 ARG C C 70 180.430 179.441 0.989 2
1 763 . 1 1 A 70 70 ARG CA C 70 59.742 60.158 -0.416 2
1 764 . 1 1 A 70 70 ARG CB C 70 29.439 29.919 -0.480 2
1 767 . 1 1 A 70 70 ARG N N 70 119.541 119.224 0.317 2
1 768 . 1 1 A 71 71 VAL H H 71 8.144 8.058 0.086 2
1 769 . 1 1 A 71 71 VAL HA H 71 4.018 3.964 0.054 2
1 777 . 1 1 A 71 71 VAL C C 71 177.493 178.171 -0.678 2
1 778 . 1 1 A 71 71 VAL CA C 71 67.924 66.619 1.305 2
1 779 . 1 1 A 71 71 VAL CB C 71 32.289 31.750 0.539 2
1 782 . 1 1 A 71 71 VAL N N 71 120.755 120.255 0.499 2
1 783 . 1 1 A 72 72 TYR H H 72 9.411 8.469 0.942 2
1 784 . 1 1 A 72 72 TYR HA H 72 3.908 4.206 -0.298 2
1 791 . 1 1 A 72 72 TYR C C 72 178.464 177.823 0.641 2
1 792 . 1 1 A 72 72 TYR CA C 72 63.444 61.994 1.450 2
1 793 . 1 1 A 72 72 TYR CB C 72 38.211 38.773 -0.562 2
1 798 . 1 1 A 72 72 TYR N N 72 121.175 121.270 -0.095 2
1 799 . 1 1 A 73 73 ASN H H 73 8.816 8.721 0.095 2
1 800 . 1 1 A 73 73 ASN HA H 73 4.538 4.615 -0.077 2
1 805 . 1 1 A 73 73 ASN C C 73 176.958 178.065 -1.107 2
1 806 . 1 1 A 73 73 ASN CA C 73 56.109 56.661 -0.552 2
1 807 . 1 1 A 73 73 ASN CB C 73 38.422 38.714 -0.292 2
1 808 . 1 1 A 73 73 ASN N N 73 118.122 117.794 0.328 2
1 810 . 1 1 A 74 74 TRP H H 74 8.657 8.386 0.271 2
1 811 . 1 1 A 74 74 TRP HA H 74 4.111 4.461 -0.350 2
1 820 . 1 1 A 74 74 TRP C C 74 179.654 178.485 1.169 2
1 821 . 1 1 A 74 74 TRP CA C 74 62.950 61.271 1.679 2
1 822 . 1 1 A 74 74 TRP CB C 74 29.555 29.613 -0.058 2
1 828 . 1 1 A 74 74 TRP N N 74 123.988 123.020 0.968 2
1 830 . 1 1 A 75 75 PHE H H 75 8.562 8.424 0.138 2
1 831 . 1 1 A 75 75 PHE HA H 75 3.821 4.411 -0.590 2
1 839 . 1 1 A 75 75 PHE C C 75 177.614 178.136 -0.522 2
1 840 . 1 1 A 75 75 PHE CA C 75 63.374 61.954 1.420 2
1 841 . 1 1 A 75 75 PHE CB C 75 39.648 38.294 1.354 2
1 847 . 1 1 A 75 75 PHE N N 75 118.325 117.296 1.029 2
1 848 . 1 1 A 76 76 ALA H H 76 8.305 8.237 0.068 2
1 849 . 1 1 A 76 76 ALA HA H 76 3.909 3.941 -0.032 2
1 853 . 1 1 A 76 76 ALA C C 76 180.868 179.650 1.218 2
1 854 . 1 1 A 76 76 ALA CA C 76 55.566 55.197 0.369 2
1 855 . 1 1 A 76 76 ALA CB C 76 17.820 18.064 -0.244 2
1 856 . 1 1 A 76 76 ALA N N 76 121.119 122.363 -1.244 2
1 857 . 1 1 A 77 77 ASN H H 77 8.335 8.138 0.197 2
1 858 . 1 1 A 77 77 ASN HA H 77 4.355 4.374 -0.019 2
1 863 . 1 1 A 77 77 ASN C C 77 177.105 177.629 -0.524 2
1 864 . 1 1 A 77 77 ASN CA C 77 56.145 56.157 -0.012 2
1 865 . 1 1 A 77 77 ASN CB C 77 38.063 38.678 -0.615 2
1 866 . 1 1 A 77 77 ASN N N 77 117.433 116.442 0.992 2
1 868 . 1 1 A 78 78 ARG H H 78 7.664 7.319 0.345 2
1 869 . 1 1 A 78 78 ARG HA H 78 3.629 3.834 -0.205 2
1 876 . 1 1 A 78 78 ARG C C 78 179.216 177.830 1.386 2
1 877 . 1 1 A 78 78 ARG CA C 78 58.773 58.717 0.056 2
1 878 . 1 1 A 78 78 ARG CB C 78 29.605 29.206 0.400 2
1 881 . 1 1 A 78 78 ARG N N 78 121.999 118.444 3.555 2
1 882 . 1 1 A 79 79 ARG H H 79 8.320 7.570 0.750 2
1 883 . 1 1 A 79 79 ARG HA H 79 4.307 4.366 -0.059 2
1 890 . 1 1 A 79 79 ARG C C 79 180.406 178.503 1.903 2
1 891 . 1 1 A 79 79 ARG CA C 79 60.270 57.691 2.579 2
1 892 . 1 1 A 79 79 ARG CB C 79 31.335 30.612 0.723 2
1 895 . 1 1 A 79 79 ARG N N 79 118.139 117.966 0.173 2
1 896 . 1 1 A 80 80 LYS H H 80 7.759 7.982 -0.223 2
1 897 . 1 1 A 80 80 LYS HA H 80 4.052 4.150 -0.098 2
1 905 . 1 1 A 80 80 LYS C C 80 178.999 179.054 -0.055 2
1 906 . 1 1 A 80 80 LYS CA C 80 59.531 59.240 0.291 2
1 907 . 1 1 A 80 80 LYS CB C 80 32.374 32.231 0.143 2
1 911 . 1 1 A 80 80 LYS N N 80 120.899 119.059 1.840 2
1 912 . 1 1 A 81 81 GLU H H 81 8.041 8.292 -0.251 2
1 913 . 1 1 A 81 81 GLU HA H 81 4.044 4.167 -0.123 2
1 918 . 1 1 A 81 81 GLU C C 81 179.168 178.567 0.601 2
1 919 . 1 1 A 81 81 GLU CA C 81 59.036 59.554 -0.518 2
1 920 . 1 1 A 81 81 GLU CB C 81 29.561 29.169 0.392 2
1 922 . 1 1 A 81 81 GLU N N 81 120.193 119.073 1.120 2
1 923 . 1 1 A 82 82 GLU H H 82 8.131 8.334 -0.203 2
1 924 . 1 1 A 82 82 GLU HA H 82 4.017 4.077 -0.060 2
1 929 . 1 1 A 82 82 GLU C C 82 178.343 178.217 0.126 2
1 930 . 1 1 A 82 82 GLU CA C 82 59.319 59.266 0.053 2
1 931 . 1 1 A 82 82 GLU CB C 82 29.770 29.167 0.603 2
1 933 . 1 1 A 82 82 GLU N N 82 119.626 118.734 0.892 2
1 934 . 1 1 A 83 83 ALA H H 83 7.935 7.711 0.224 2
1 935 . 1 1 A 83 83 ALA HA H 83 4.180 4.201 -0.021 2
1 939 . 1 1 A 83 83 ALA C C 83 179.994 179.507 0.487 2
1 940 . 1 1 A 83 83 ALA CA C 83 54.629 53.948 0.681 2
1 941 . 1 1 A 83 83 ALA CB C 83 18.090 18.899 -0.809 2
1 942 . 1 1 A 83 83 ALA N N 83 121.476 122.084 -0.608 2
1 943 . 1 1 A 84 84 PHE H H 84 8.043 8.107 -0.064 2
1 944 . 1 1 A 84 84 PHE HA H 84 4.420 4.041 0.379 2
1 952 . 1 1 A 84 84 PHE C C 84 177.250 177.088 0.162 2
1 953 . 1 1 A 84 84 PHE CA C 84 60.059 61.714 -1.655 2
1 954 . 1 1 A 84 84 PHE CB C 84 38.952 39.380 -0.428 2
1 960 . 1 1 A 84 84 PHE N N 84 119.074 120.399 -1.325 2
1 961 . 1 1 A 85 85 ARG H H 85 8.031 8.132 -0.101 2
1 962 . 1 1 A 85 85 ARG HA H 85 3.992 4.124 -0.132 2
1 968 . 1 1 A 85 85 ARG C C 85 178.319 178.365 -0.046 2
1 969 . 1 1 A 85 85 ARG CA C 85 58.523 59.588 -1.065 2
1 970 . 1 1 A 85 85 ARG CB C 85 30.346 29.966 0.380 2
1 973 . 1 1 A 85 85 ARG N N 85 119.291 117.609 1.682 2
1 974 . 1 1 A 86 86 GLN H H 86 8.091 7.913 0.178 2
1 975 . 1 1 A 86 86 GLN HA H 86 4.148 4.272 -0.124 2
1 982 . 1 1 A 86 86 GLN C C 86 177.105 178.309 -1.204 2
1 983 . 1 1 A 86 86 GLN CA C 86 57.556 57.543 0.013 2
1 984 . 1 1 A 86 86 GLN CB C 86 28.855 29.360 -0.505 2
1 986 . 1 1 A 86 86 GLN N N 86 119.097 117.587 1.510 2
1 988 . 1 1 A 87 87 LYS H H 87 7.898 8.296 -0.398 2
1 989 . 1 1 A 87 87 LYS HA H 87 4.116 4.055 0.061 2
1 997 . 1 1 A 87 87 LYS C C 87 177.542 179.147 -1.605 2
1 998 . 1 1 A 87 87 LYS CA C 87 57.944 59.093 -1.149 2
1 999 . 1 1 A 87 87 LYS CB C 87 32.242 31.941 0.301 2
1 1003 . 1 1 A 87 87 LYS N N 87 120.968 122.043 -1.075 2
1 1004 . 1 1 A 88 88 LEU H H 88 7.903 8.102 -0.199 2
1 1005 . 1 1 A 88 88 LEU HA H 88 4.144 4.204 -0.060 2
1 1015 . 1 1 A 88 88 LEU C C 88 178.221 177.950 0.271 2
1 1016 . 1 1 A 88 88 LEU CA C 88 56.145 56.953 -0.808 2
1 1017 . 1 1 A 88 88 LEU CB C 88 42.215 41.373 0.842 2
1 1021 . 1 1 A 88 88 LEU N N 88 120.558 117.260 3.298 2
1 1022 . 1 1 A 89 89 ALA H H 89 7.894 7.579 0.315 2
1 1023 . 1 1 A 89 89 ALA HA H 89 4.224 4.340 -0.116 2
1 1027 . 1 1 A 89 89 ALA C C 89 178.609 179.156 -0.547 2
1 1028 . 1 1 A 89 89 ALA CA C 89 53.392 53.640 -0.248 2
1 1029 . 1 1 A 89 89 ALA CB C 89 18.695 19.350 -0.655 2
1 1030 . 1 1 A 89 89 ALA N N 89 122.387 122.105 0.282 2
1 1031 . 1 1 A 90 90 MET H H 90 8.084 7.931 0.153 2
1 1032 . 1 1 A 90 90 MET HA H 90 4.356 4.216 0.140 2
1 1040 . 1 1 A 90 90 MET C C 90 176.982 176.671 0.311 2
1 1041 . 1 1 A 90 90 MET CA C 90 56.551 57.805 -1.254 2
1 1042 . 1 1 A 90 90 MET CB C 90 32.719 32.425 0.294 2
1 1045 . 1 1 A 90 90 MET N N 90 118.509 116.296 2.213 2
1 1046 . 1 1 A 91 91 ASP H H 91 8.261 7.605 0.656 2
1 1047 . 1 1 A 91 91 ASP HA H 91 4.524 4.579 -0.055 2
1 1050 . 1 1 A 91 91 ASP C C 91 176.643 175.912 0.731 2
1 1051 . 1 1 A 91 91 ASP CA C 91 54.981 54.394 0.587 2
1 1052 . 1 1 A 91 91 ASP CB C 91 40.870 41.577 -0.707 2
1 1053 . 1 1 A 91 91 ASP N N 91 120.771 119.863 0.908 2
1 1054 . 1 1 A 92 92 ALA H H 92 7.971 8.309 -0.338 2
1 1055 . 1 1 A 92 92 ALA HA H 92 4.200 4.392 -0.192 2
1 1059 . 1 1 A 92 92 ALA C C 92 177.929 176.767 1.162 2
1 1060 . 1 1 A 92 92 ALA CA C 92 53.184 51.912 1.272 2
1 1061 . 1 1 A 92 92 ALA CB C 92 18.890 20.038 -1.148 2
1 1062 . 1 1 A 92 92 ALA N N 92 123.057 123.017 0.040 2
1 1063 . 1 1 A 93 93 TYR H H 93 8.019 8.481 -0.462 2
1 1064 . 1 1 A 93 93 TYR HA H 93 4.523 4.601 -0.079 2
1 1071 . 1 1 A 93 93 TYR C C 93 176.279 175.132 1.147 2
1 1072 . 1 1 A 93 93 TYR CA C 93 58.401 57.904 0.497 2
1 1073 . 1 1 A 93 93 TYR CB C 93 38.669 38.609 0.060 2
1 1078 . 1 1 A 93 93 TYR N N 93 118.337 119.024 -0.687 2
1 1079 . 1 1 A 94 94 SER H H 94 8.037 8.351 -0.314 2
1 1080 . 1 1 A 94 94 SER HA H 94 4.484 4.692 -0.208 2
1 1082 . 1 1 A 94 94 SER C C 94 174.554 173.868 0.686 2
1 1083 . 1 1 A 94 94 SER CA C 94 58.401 57.625 0.776 2
1 1084 . 1 1 A 94 94 SER CB C 94 63.806 64.765 -0.959 2
1 1085 . 1 1 A 94 94 SER N N 94 116.640 117.511 -0.871 2
1 1086 . 1 1 A 96 96 ASN HA H 96 4.770 4.951 -0.181 2
1 1091 . 1 1 A 96 96 ASN C C 96 175.161 174.699 0.462 2
1 1092 . 1 1 A 96 96 ASN CA C 96 53.395 53.129 0.266 2
1 1093 . 1 1 A 96 96 ASN CB C 96 38.999 40.012 -1.013 2
1 1095 . 1 1 A 97 97 SER H H 97 8.230 8.495 -0.265 2
1 1096 . 1 1 A 97 97 SER HA H 97 4.481 4.750 -0.269 2
1 1099 . 1 1 A 97 97 SER C C 97 174.482 174.347 0.135 2
1 1100 . 1 1 A 97 97 SER CA C 97 58.300 58.046 0.254 2
1 1101 . 1 1 A 97 97 SER CB C 97 63.697 64.790 -1.093 2
1 1102 . 1 1 A 97 97 SER N N 97 115.866 115.883 -0.017 2
1 1103 . 1 1 A 98 98 GLY H H 98 8.228 8.475 -0.247 2
1 1104 . 1 1 A 98 98 GLY HA2 H 98 4.098 4.090 0.008 2
1 1105 . 1 1 A 98 98 GLY HA3 H 98 4.098 4.093 0.005 2
1 1106 . 1 1 A 98 98 GLY C C 98 171.788 173.361 -1.573 2
1 1107 . 1 1 A 98 98 GLY CA C 98 44.803 45.454 -0.651 2
1 1108 . 1 1 A 98 98 GLY N N 98 110.658 111.503 -0.845 2
1 1109 . 1 1 A 99 99 PRO HA H 99 4.463 4.587 -0.124 2
1 1116 . 1 1 A 99 99 PRO CA C 99 63.230 63.065 0.165 2
1 1117 . 1 1 A 99 99 PRO CB C 99 32.044 31.789 0.255 2
1 1120 . 1 1 A 100 100 SER H H 100 8.514 8.378 0.136 2
1 1121 . 1 1 A 100 100 SER CA C 100 58.450 58.750 -0.300 2
1 1122 . 1 1 A 100 100 SER CB C 100 63.889 64.396 -0.507 2
stop_
save_