data_10291_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10291
_Entry.PDB_ID 2DMN
_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 13 13 ASN HA H 13 4.787 4.755 0.032 1
1 6 . 1 1 1 A 13 13 ASN CA C 13 53.148 53.151 -0.003 1
1 7 . 1 1 1 A 13 13 ASN CB C 13 39.378 39.381 -0.003 1
1 9 . 1 1 1 A 14 14 LEU H H 14 8.418 8.269 0.149 1
1 10 . 1 1 1 A 14 14 LEU HA H 14 4.654 4.694 -0.040 1
1 20 . 1 1 1 A 14 14 LEU CA C 14 52.999 51.720 1.279 1
1 21 . 1 1 1 A 14 14 LEU CB C 14 41.919 42.796 -0.877 1
1 25 . 1 1 1 A 14 14 LEU N N 14 122.671 124.178 -1.507 1
1 26 . 1 1 1 A 15 15 PRO HA H 15 4.460 4.644 -0.184 1
1 33 . 1 1 1 A 15 15 PRO C C 15 178.156 177.690 0.466 1
1 34 . 1 1 1 A 15 15 PRO CA C 15 63.101 62.611 0.490 1
1 35 . 1 1 1 A 15 15 PRO CB C 15 32.304 31.869 0.435 1
1 38 . 1 1 1 A 16 16 ALA H H 16 8.973 8.619 0.354 1
1 39 . 1 1 1 A 16 16 ALA HA H 16 4.021 3.930 0.091 1
1 43 . 1 1 1 A 16 16 ALA C C 16 180.695 179.582 1.113 1
1 44 . 1 1 1 A 16 16 ALA CA C 16 55.642 55.574 0.068 1
1 45 . 1 1 1 A 16 16 ALA CB C 16 18.552 18.635 -0.083 1
1 46 . 1 1 1 A 16 16 ALA N N 16 128.311 127.298 1.013 1
1 47 . 1 1 1 A 17 17 GLU H H 17 9.558 8.403 1.155 1
1 48 . 1 1 1 A 17 17 GLU HA H 17 4.065 3.998 0.067 1
1 53 . 1 1 1 A 17 17 GLU C C 17 178.886 178.940 -0.054 1
1 54 . 1 1 1 A 17 17 GLU CA C 17 59.400 59.665 -0.265 1
1 55 . 1 1 1 A 17 17 GLU CB C 17 28.742 29.493 -0.751 1
1 57 . 1 1 1 A 17 17 GLU N N 17 117.113 118.641 -1.528 1
1 58 . 1 1 1 A 18 18 SER H H 18 7.263 8.165 -0.902 1
1 59 . 1 1 1 A 18 18 SER HA H 18 4.180 4.103 0.077 1
1 62 . 1 1 1 A 18 18 SER C C 18 174.951 175.693 -0.742 1
1 63 . 1 1 1 A 18 18 SER CA C 18 61.969 62.617 -0.648 1
1 64 . 1 1 1 A 18 18 SER CB C 18 62.554 62.885 -0.331 1
1 65 . 1 1 1 A 18 18 SER N N 18 114.932 117.379 -2.447 1
1 66 . 1 1 1 A 19 19 VAL H H 19 7.620 8.229 -0.609 1
1 67 . 1 1 1 A 19 19 VAL HA H 19 3.011 3.100 -0.089 1
1 75 . 1 1 1 A 19 19 VAL C C 19 176.953 177.645 -0.692 1
1 76 . 1 1 1 A 19 19 VAL CA C 19 66.479 66.946 -0.467 1
1 77 . 1 1 1 A 19 19 VAL CB C 19 31.569 31.389 0.180 1
1 80 . 1 1 1 A 19 19 VAL N N 19 121.086 121.812 -0.726 1
1 81 . 1 1 1 A 20 20 LYS H H 20 7.745 8.284 -0.539 1
1 82 . 1 1 1 A 20 20 LYS HA H 20 3.884 3.959 -0.075 1
1 91 . 1 1 1 A 20 20 LYS C C 20 178.150 178.598 -0.448 1
1 92 . 1 1 1 A 20 20 LYS CA C 20 59.984 59.828 0.156 1
1 93 . 1 1 1 A 20 20 LYS CB C 20 32.351 32.163 0.188 1
1 97 . 1 1 1 A 20 20 LYS N N 20 119.366 119.823 -0.457 1
1 98 . 1 1 1 A 21 21 ILE H H 21 6.943 7.827 -0.884 1
1 99 . 1 1 1 A 21 21 ILE HA H 21 3.783 3.622 0.161 1
1 109 . 1 1 1 A 21 21 ILE C C 21 178.996 178.644 0.352 1
1 110 . 1 1 1 A 21 21 ILE CA C 21 64.642 65.832 -1.190 1
1 111 . 1 1 1 A 21 21 ILE CB C 21 38.014 37.959 0.055 1
1 115 . 1 1 1 A 21 21 ILE N N 21 118.163 119.569 -1.406 1
1 116 . 1 1 1 A 22 22 LEU H H 22 7.267 8.080 -0.813 1
1 117 . 1 1 1 A 22 22 LEU HA H 22 3.748 3.917 -0.169 1
1 127 . 1 1 1 A 22 22 LEU C C 22 178.289 178.852 -0.563 1
1 128 . 1 1 1 A 22 22 LEU CA C 22 58.092 57.953 0.139 1
1 129 . 1 1 1 A 22 22 LEU CB C 22 38.551 40.790 -2.239 1
1 133 . 1 1 1 A 22 22 LEU N N 22 120.609 119.105 1.504 1
1 134 . 1 1 1 A 23 23 ARG H H 23 8.676 8.781 -0.105 1
1 135 . 1 1 1 A 23 23 ARG HA H 23 4.030 4.210 -0.180 1
1 142 . 1 1 1 A 23 23 ARG C C 23 178.861 178.245 0.616 1
1 143 . 1 1 1 A 23 23 ARG CA C 23 60.404 59.989 0.415 1
1 144 . 1 1 1 A 23 23 ARG CB C 23 30.351 30.238 0.113 1
1 147 . 1 1 1 A 23 23 ARG N N 23 119.148 117.859 1.289 1
1 148 . 1 1 1 A 24 24 ASP H H 24 8.515 8.433 0.082 1
1 149 . 1 1 1 A 24 24 ASP HA H 24 4.519 4.377 0.142 1
1 152 . 1 1 1 A 24 24 ASP C C 24 178.759 178.366 0.393 1
1 153 . 1 1 1 A 24 24 ASP CA C 24 57.556 57.205 0.351 1
1 154 . 1 1 1 A 24 24 ASP CB C 24 40.569 40.707 -0.138 1
1 155 . 1 1 1 A 24 24 ASP N N 24 120.027 119.315 0.712 1
1 156 . 1 1 1 A 25 25 TRP H H 25 8.158 7.990 0.168 1
1 157 . 1 1 1 A 25 25 TRP HA H 25 4.181 4.455 -0.274 1
1 166 . 1 1 1 A 25 25 TRP C C 25 179.946 178.511 1.435 1
1 167 . 1 1 1 A 25 25 TRP CA C 25 63.346 60.973 2.373 1
1 168 . 1 1 1 A 25 25 TRP CB C 25 29.433 29.545 -0.112 1
1 174 . 1 1 1 A 25 25 TRP N N 25 121.350 121.658 -0.308 1
1 176 . 1 1 1 A 26 26 MET H H 26 8.977 8.734 0.243 1
1 177 . 1 1 1 A 26 26 MET HA H 26 4.076 4.487 -0.411 1
1 185 . 1 1 1 A 26 26 MET C C 26 177.371 178.207 -0.836 1
1 186 . 1 1 1 A 26 26 MET CA C 26 60.454 58.762 1.692 1
1 187 . 1 1 1 A 26 26 MET CB C 26 33.567 32.507 1.060 1
1 190 . 1 1 1 A 26 26 MET N N 26 119.977 118.783 1.194 1
1 191 . 1 1 1 A 27 27 TYR H H 27 8.604 8.343 0.261 1
1 192 . 1 1 1 A 27 27 TYR HA H 27 4.138 4.165 -0.027 1
1 199 . 1 1 1 A 27 27 TYR C C 27 178.901 177.360 1.541 1
1 200 . 1 1 1 A 27 27 TYR CA C 27 61.846 61.482 0.364 1
1 201 . 1 1 1 A 27 27 TYR CB C 27 38.165 38.779 -0.614 1
1 206 . 1 1 1 A 27 27 TYR N N 27 117.797 121.185 -3.388 1
1 207 . 1 1 1 A 28 28 LYS H H 28 7.867 7.816 0.051 1
1 208 . 1 1 1 A 28 28 LYS HA H 28 3.797 3.637 0.160 1
1 217 . 1 1 1 A 28 28 LYS C C 28 176.858 177.615 -0.757 1
1 218 . 1 1 1 A 28 28 LYS CA C 28 58.174 58.840 -0.666 1
1 219 . 1 1 1 A 28 28 LYS CB C 28 32.516 32.192 0.324 1
1 223 . 1 1 1 A 28 28 LYS N N 28 118.982 117.912 1.070 1
1 224 . 1 1 1 A 29 29 HIS H H 29 7.443 7.172 0.271 1
1 225 . 1 1 1 A 29 29 HIS HA H 29 4.386 4.507 -0.121 1
1 230 . 1 1 1 A 29 29 HIS C C 29 176.085 175.720 0.365 1
1 231 . 1 1 1 A 29 29 HIS CA C 29 55.213 55.170 0.043 1
1 232 . 1 1 1 A 29 29 HIS CB C 29 27.085 28.997 -1.912 1
1 235 . 1 1 1 A 29 29 HIS N N 29 117.138 115.499 1.639 1
1 236 . 1 1 1 A 30 30 ARG H H 30 6.921 8.342 -1.421 1
1 237 . 1 1 1 A 30 30 ARG HA H 30 3.898 4.280 -0.382 1
1 244 . 1 1 1 A 30 30 ARG C C 30 175.808 177.892 -2.084 1
1 245 . 1 1 1 A 30 30 ARG CA C 30 58.609 58.413 0.196 1
1 246 . 1 1 1 A 30 30 ARG CB C 30 28.739 29.618 -0.879 1
1 249 . 1 1 1 A 30 30 ARG N N 30 117.911 119.361 -1.450 1
1 250 . 1 1 1 A 31 31 PHE H H 31 7.819 7.587 0.232 1
1 251 . 1 1 1 A 31 31 PHE HA H 31 4.533 4.255 0.278 1
1 259 . 1 1 1 A 31 31 PHE C C 31 175.577 176.852 -1.275 1
1 260 . 1 1 1 A 31 31 PHE CA C 31 58.029 60.822 -2.793 1
1 261 . 1 1 1 A 31 31 PHE CB C 31 37.792 38.965 -1.173 1
1 267 . 1 1 1 A 31 31 PHE N N 31 115.408 118.677 -3.269 1
1 268 . 1 1 1 A 32 32 LYS H H 32 7.858 7.971 -0.113 1
1 269 . 1 1 1 A 32 32 LYS HA H 32 4.487 4.519 -0.032 1
1 277 . 1 1 1 A 32 32 LYS C C 32 175.557 176.422 -0.865 1
1 278 . 1 1 1 A 32 32 LYS CA C 32 56.329 56.680 -0.351 1
1 279 . 1 1 1 A 32 32 LYS CB C 32 32.743 34.482 -1.739 1
1 283 . 1 1 1 A 32 32 LYS N N 32 122.453 113.332 9.121 1
1 284 . 1 1 1 A 33 33 ALA H H 33 8.643 8.342 0.301 1
1 285 . 1 1 1 A 33 33 ALA HA H 33 4.403 4.094 0.309 1
1 289 . 1 1 1 A 33 33 ALA C C 33 176.273 175.544 0.729 1
1 290 . 1 1 1 A 33 33 ALA CA C 33 53.579 53.341 0.238 1
1 291 . 1 1 1 A 33 33 ALA CB C 33 18.653 17.153 1.500 1
1 292 . 1 1 1 A 33 33 ALA N N 33 127.853 120.484 7.369 1
1 293 . 1 1 1 A 34 34 TYR H H 34 7.878 8.045 -0.167 1
1 294 . 1 1 1 A 34 34 TYR HA H 34 4.686 4.959 -0.273 1
1 301 . 1 1 1 A 34 34 TYR C C 34 173.133 173.352 -0.219 1
1 302 . 1 1 1 A 34 34 TYR CA C 34 54.778 54.890 -0.112 1
1 303 . 1 1 1 A 34 34 TYR CB C 34 39.619 38.946 0.673 1
1 308 . 1 1 1 A 34 34 TYR N N 34 116.539 117.871 -1.332 1
1 309 . 1 1 1 A 35 35 PRO HA H 35 4.526 4.603 -0.077 1
1 316 . 1 1 1 A 35 35 PRO C C 35 176.837 175.362 1.475 1
1 317 . 1 1 1 A 35 35 PRO CA C 35 61.864 62.119 -0.255 1
1 318 . 1 1 1 A 35 35 PRO CB C 35 30.904 32.010 -1.106 1
1 321 . 1 1 1 A 36 36 SER H H 36 9.634 8.272 1.362 1
1 322 . 1 1 1 A 36 36 SER HA H 36 4.518 4.872 -0.354 1
1 325 . 1 1 1 A 36 36 SER C C 36 175.001 175.315 -0.314 1
1 326 . 1 1 1 A 36 36 SER CA C 36 57.129 57.858 -0.729 1
1 327 . 1 1 1 A 36 36 SER CB C 36 65.374 65.119 0.255 1
1 328 . 1 1 1 A 36 36 SER N N 36 119.984 116.652 3.332 1
1 329 . 1 1 1 A 37 37 GLU H H 37 9.091 9.063 0.028 1
1 330 . 1 1 1 A 37 37 GLU HA H 37 3.884 3.940 -0.056 1
1 335 . 1 1 1 A 37 37 GLU C C 37 179.347 178.381 0.966 1
1 336 . 1 1 1 A 37 37 GLU CA C 37 60.454 59.385 1.069 1
1 337 . 1 1 1 A 37 37 GLU CB C 37 28.623 29.211 -0.588 1
1 339 . 1 1 1 A 37 37 GLU N N 37 120.748 123.960 -3.212 1
1 340 . 1 1 1 A 38 38 GLU H H 38 8.760 7.931 0.829 1
1 341 . 1 1 1 A 38 38 GLU HA H 38 4.048 4.076 -0.028 1
1 346 . 1 1 1 A 38 38 GLU C C 38 179.975 179.135 0.840 1
1 347 . 1 1 1 A 38 38 GLU CA C 38 60.243 59.188 1.055 1
1 348 . 1 1 1 A 38 38 GLU CB C 38 29.117 29.945 -0.828 1
1 350 . 1 1 1 A 38 38 GLU N N 38 119.272 120.109 -0.837 1
1 351 . 1 1 1 A 39 39 GLU H H 39 7.856 7.979 -0.123 1
1 352 . 1 1 1 A 39 39 GLU HA H 39 3.976 3.881 0.095 1
1 357 . 1 1 1 A 39 39 GLU C C 39 178.912 178.778 0.134 1
1 358 . 1 1 1 A 39 39 GLU CA C 39 59.131 59.123 0.008 1
1 359 . 1 1 1 A 39 39 GLU CB C 39 29.612 28.811 0.801 1
1 361 . 1 1 1 A 39 39 GLU N N 39 121.658 120.736 0.922 1
1 362 . 1 1 1 A 40 40 LYS H H 40 8.653 7.766 0.887 1
1 363 . 1 1 1 A 40 40 LYS HA H 40 3.508 3.824 -0.316 1
1 372 . 1 1 1 A 40 40 LYS C C 40 177.974 178.915 -0.941 1
1 373 . 1 1 1 A 40 40 LYS CA C 40 60.948 59.620 1.328 1
1 374 . 1 1 1 A 40 40 LYS CB C 40 32.714 32.166 0.548 1
1 378 . 1 1 1 A 40 40 LYS N N 40 119.152 119.499 -0.347 1
1 379 . 1 1 1 A 41 41 GLN H H 41 7.876 7.591 0.285 1
1 380 . 1 1 1 A 41 41 GLN HA H 41 3.911 3.948 -0.037 1
1 387 . 1 1 1 A 41 41 GLN C C 41 178.352 178.150 0.202 1
1 388 . 1 1 1 A 41 41 GLN CA C 41 58.973 58.948 0.025 1
1 389 . 1 1 1 A 41 41 GLN CB C 41 27.552 28.781 -1.229 1
1 391 . 1 1 1 A 41 41 GLN N N 41 118.910 119.660 -0.750 1
1 393 . 1 1 1 A 42 42 MET H H 42 7.771 7.876 -0.105 1
1 394 . 1 1 1 A 42 42 MET HA H 42 4.158 4.217 -0.059 1
1 402 . 1 1 1 A 42 42 MET C C 42 179.310 178.254 1.056 1
1 403 . 1 1 1 A 42 42 MET CA C 42 59.079 58.352 0.727 1
1 404 . 1 1 1 A 42 42 MET CB C 42 31.023 32.446 -1.423 1
1 407 . 1 1 1 A 42 42 MET N N 42 121.131 119.161 1.970 1
1 408 . 1 1 1 A 43 43 LEU H H 43 8.400 8.233 0.167 1
1 409 . 1 1 1 A 43 43 LEU HA H 43 3.888 3.990 -0.102 1
1 419 . 1 1 1 A 43 43 LEU C C 43 180.721 178.973 1.748 1
1 420 . 1 1 1 A 43 43 LEU CA C 43 57.916 58.011 -0.095 1
1 421 . 1 1 1 A 43 43 LEU CB C 43 42.080 41.589 0.491 1
1 425 . 1 1 1 A 43 43 LEU N N 43 120.124 120.686 -0.562 1
1 426 . 1 1 1 A 44 44 SER H H 44 8.658 8.502 0.156 1
1 427 . 1 1 1 A 44 44 SER HA H 44 4.088 4.181 -0.093 1
1 430 . 1 1 1 A 44 44 SER C C 44 176.859 176.646 0.213 1
1 431 . 1 1 1 A 44 44 SER CA C 44 61.371 61.002 0.369 1
1 432 . 1 1 1 A 44 44 SER CB C 44 63.314 62.895 0.419 1
1 433 . 1 1 1 A 44 44 SER N N 44 119.795 113.918 5.877 1
1 434 . 1 1 1 A 45 45 GLU H H 45 7.905 7.708 0.197 1
1 435 . 1 1 1 A 45 45 GLU HA H 45 4.094 4.162 -0.068 1
1 440 . 1 1 1 A 45 45 GLU C C 45 179.095 179.019 0.076 1
1 441 . 1 1 1 A 45 45 GLU CA C 45 59.255 58.887 0.368 1
1 442 . 1 1 1 A 45 45 GLU CB C 45 29.200 29.294 -0.094 1
1 444 . 1 1 1 A 45 45 GLU N N 45 120.609 121.140 -0.531 1
1 445 . 1 1 1 A 46 46 LYS H H 46 7.837 8.092 -0.255 1
1 446 . 1 1 1 A 46 46 LYS HA H 46 4.231 4.171 0.060 1
1 453 . 1 1 1 A 46 46 LYS C C 46 177.964 178.707 -0.743 1
1 454 . 1 1 1 A 46 46 LYS CA C 46 58.278 58.575 -0.297 1
1 455 . 1 1 1 A 46 46 LYS CB C 46 34.110 33.007 1.103 1
1 459 . 1 1 1 A 46 46 LYS N N 46 115.471 119.311 -3.840 1
1 460 . 1 1 1 A 47 47 THR H H 47 7.763 8.274 -0.511 1
1 461 . 1 1 1 A 47 47 THR HA H 47 4.271 4.203 0.068 1
1 466 . 1 1 1 A 47 47 THR C C 47 175.472 175.128 0.344 1
1 467 . 1 1 1 A 47 47 THR CA C 47 62.429 62.853 -0.424 1
1 468 . 1 1 1 A 47 47 THR CB C 47 71.966 70.080 1.886 1
1 470 . 1 1 1 A 47 47 THR N N 47 104.286 108.330 -4.044 1
1 471 . 1 1 1 A 48 48 ASN H H 48 8.169 8.390 -0.221 1
1 472 . 1 1 1 A 48 48 ASN HA H 48 4.437 4.529 -0.092 1
1 477 . 1 1 1 A 48 48 ASN C C 48 173.874 173.909 -0.035 1
1 478 . 1 1 1 A 48 48 ASN CA C 48 55.377 54.195 1.182 1
1 479 . 1 1 1 A 48 48 ASN CB C 48 37.770 37.389 0.381 1
1 480 . 1 1 1 A 48 48 ASN N N 48 117.458 119.831 -2.373 1
1 482 . 1 1 1 A 49 49 LEU H H 49 7.532 7.527 0.005 1
1 483 . 1 1 1 A 49 49 LEU HA H 49 4.733 4.868 -0.135 1
1 493 . 1 1 1 A 49 49 LEU C C 49 176.625 175.552 1.073 1
1 494 . 1 1 1 A 49 49 LEU CA C 49 53.226 53.136 0.090 1
1 495 . 1 1 1 A 49 49 LEU CB C 49 44.114 43.874 0.240 1
1 499 . 1 1 1 A 49 49 LEU N N 49 118.220 120.018 -1.798 1
1 500 . 1 1 1 A 50 50 SER H H 50 9.140 8.766 0.374 1
1 501 . 1 1 1 A 50 50 SER HA H 50 4.475 4.877 -0.402 1
1 504 . 1 1 1 A 50 50 SER C C 50 174.907 175.028 -0.121 1
1 505 . 1 1 1 A 50 50 SER CA C 50 56.964 57.697 -0.733 1
1 506 . 1 1 1 A 50 50 SER CB C 50 65.372 64.992 0.380 1
1 507 . 1 1 1 A 50 50 SER N N 50 117.569 117.627 -0.058 1
1 508 . 1 1 1 A 51 51 LEU H H 51 8.756 8.749 0.007 1
1 509 . 1 1 1 A 51 51 LEU HA H 51 3.874 3.924 -0.050 1
1 519 . 1 1 1 A 51 51 LEU C C 51 179.910 178.881 1.029 1
1 520 . 1 1 1 A 51 51 LEU CA C 51 58.916 58.168 0.748 1
1 521 . 1 1 1 A 51 51 LEU CB C 51 41.148 41.421 -0.273 1
1 525 . 1 1 1 A 51 51 LEU N N 51 120.905 125.873 -4.968 1
1 526 . 1 1 1 A 52 52 LEU H H 52 8.146 8.242 -0.096 1
1 527 . 1 1 1 A 52 52 LEU HA H 52 4.179 4.020 0.159 1
1 537 . 1 1 1 A 52 52 LEU C C 52 178.936 178.716 0.220 1
1 538 . 1 1 1 A 52 52 LEU CA C 52 58.162 58.456 -0.294 1
1 539 . 1 1 1 A 52 52 LEU CB C 52 42.137 41.494 0.643 1
1 543 . 1 1 1 A 52 52 LEU N N 52 120.685 120.114 0.571 1
1 544 . 1 1 1 A 53 53 GLN H H 53 7.924 8.214 -0.290 1
1 545 . 1 1 1 A 53 53 GLN HA H 53 4.102 4.134 -0.032 1
1 552 . 1 1 1 A 53 53 GLN C C 53 180.308 178.413 1.895 1
1 553 . 1 1 1 A 53 53 GLN CA C 53 59.326 58.335 0.991 1
1 554 . 1 1 1 A 53 53 GLN CB C 53 29.900 28.365 1.535 1
1 556 . 1 1 1 A 53 53 GLN N N 53 118.473 117.515 0.958 1
1 558 . 1 1 1 A 54 54 ILE H H 54 8.380 8.280 0.100 1
1 559 . 1 1 1 A 54 54 ILE HA H 54 3.677 3.777 -0.100 1
1 569 . 1 1 1 A 54 54 ILE C C 54 177.673 178.234 -0.561 1
1 570 . 1 1 1 A 54 54 ILE CA C 54 64.650 65.321 -0.671 1
1 571 . 1 1 1 A 54 54 ILE CB C 54 37.476 37.827 -0.351 1
1 575 . 1 1 1 A 54 54 ILE N N 54 120.113 121.468 -1.355 1
1 576 . 1 1 1 A 55 55 SER H H 55 8.854 7.916 0.938 1
1 577 . 1 1 1 A 55 55 SER HA H 55 4.267 4.295 -0.028 1
1 580 . 1 1 1 A 55 55 SER C C 55 177.127 177.589 -0.462 1
1 581 . 1 1 1 A 55 55 SER CA C 55 62.852 61.791 1.061 1
1 582 . 1 1 1 A 55 55 SER CB C 55 62.727 63.076 -0.349 1
1 583 . 1 1 1 A 55 55 SER N N 55 116.646 115.882 0.764 1
1 584 . 1 1 1 A 56 56 ASN H H 56 8.634 8.168 0.466 1
1 585 . 1 1 1 A 56 56 ASN HA H 56 4.549 4.467 0.082 1
1 590 . 1 1 1 A 56 56 ASN C C 56 177.481 178.385 -0.904 1
1 591 . 1 1 1 A 56 56 ASN CA C 56 55.951 56.526 -0.575 1
1 592 . 1 1 1 A 56 56 ASN CB C 56 37.852 38.164 -0.312 1
1 593 . 1 1 1 A 56 56 ASN N N 56 119.048 119.707 -0.659 1
1 595 . 1 1 1 A 57 57 TRP H H 57 8.373 8.488 -0.115 1
1 596 . 1 1 1 A 57 57 TRP HA H 57 4.065 4.361 -0.296 1
1 605 . 1 1 1 A 57 57 TRP C C 57 179.392 178.303 1.089 1
1 606 . 1 1 1 A 57 57 TRP CA C 57 63.204 61.201 2.003 1
1 607 . 1 1 1 A 57 57 TRP CB C 57 28.376 29.635 -1.259 1
1 613 . 1 1 1 A 57 57 TRP N N 57 122.950 123.384 -0.434 1
1 615 . 1 1 1 A 58 58 PHE H H 58 8.428 8.255 0.173 1
1 616 . 1 1 1 A 58 58 PHE HA H 58 3.922 3.775 0.147 1
1 624 . 1 1 1 A 58 58 PHE C C 58 178.237 177.900 0.337 1
1 625 . 1 1 1 A 58 58 PHE CA C 58 64.015 61.895 2.120 1
1 626 . 1 1 1 A 58 58 PHE CB C 58 39.602 38.357 1.245 1
1 632 . 1 1 1 A 58 58 PHE N N 58 116.774 117.815 -1.041 1
1 633 . 1 1 1 A 59 59 ILE H H 59 7.925 8.243 -0.318 1
1 634 . 1 1 1 A 59 59 ILE HA H 59 3.773 3.680 0.093 1
1 644 . 1 1 1 A 59 59 ILE C C 59 178.745 178.104 0.641 1
1 645 . 1 1 1 A 59 59 ILE CA C 59 65.531 65.353 0.178 1
1 646 . 1 1 1 A 59 59 ILE CB C 59 38.480 37.849 0.631 1
1 650 . 1 1 1 A 59 59 ILE N N 59 119.560 119.931 -0.371 1
1 651 . 1 1 1 A 60 60 ASN H H 60 7.506 7.864 -0.358 1
1 652 . 1 1 1 A 60 60 ASN HA H 60 4.407 4.347 0.060 1
1 657 . 1 1 1 A 60 60 ASN C C 60 177.163 177.182 -0.019 1
1 658 . 1 1 1 A 60 60 ASN CA C 60 55.871 56.677 -0.806 1
1 659 . 1 1 1 A 60 60 ASN CB C 60 38.878 39.434 -0.556 1
1 660 . 1 1 1 A 60 60 ASN N N 60 116.868 119.433 -2.565 1
1 662 . 1 1 1 A 61 61 ALA H H 61 8.410 8.155 0.255 1
1 663 . 1 1 1 A 61 61 ALA HA H 61 3.667 3.619 0.048 1
1 667 . 1 1 1 A 61 61 ALA C C 61 180.061 179.035 1.026 1
1 668 . 1 1 1 A 61 61 ALA CA C 61 54.601 54.527 0.074 1
1 669 . 1 1 1 A 61 61 ALA CB C 61 18.241 16.939 1.302 1
1 670 . 1 1 1 A 61 61 ALA N N 61 123.022 120.605 2.417 1
1 671 . 1 1 1 A 62 62 ARG H H 62 8.036 8.197 -0.161 1
1 672 . 1 1 1 A 62 62 ARG HA H 62 4.092 4.102 -0.010 1
1 679 . 1 1 1 A 62 62 ARG C C 62 176.756 177.130 -0.374 1
1 680 . 1 1 1 A 62 62 ARG CA C 62 58.762 57.982 0.780 1
1 681 . 1 1 1 A 62 62 ARG CB C 62 30.601 29.730 0.871 1
1 684 . 1 1 1 A 62 62 ARG N N 62 117.168 116.680 0.488 1
1 685 . 1 1 1 A 63 63 ARG H H 63 7.214 7.816 -0.602 1
1 686 . 1 1 1 A 63 63 ARG HA H 63 4.249 4.383 -0.134 1
1 693 . 1 1 1 A 63 63 ARG C C 63 176.945 176.865 0.080 1
1 694 . 1 1 1 A 63 63 ARG CA C 63 57.669 56.473 1.196 1
1 695 . 1 1 1 A 63 63 ARG CB C 63 30.765 31.155 -0.390 1
1 698 . 1 1 1 A 63 63 ARG N N 63 116.514 117.707 -1.193 1
1 699 . 1 1 1 A 64 64 ARG H H 64 7.913 7.444 0.469 1
1 700 . 1 1 1 A 64 64 ARG HA H 64 4.351 4.390 -0.039 1
1 707 . 1 1 1 A 64 64 ARG C C 64 176.413 177.724 -1.311 1
1 708 . 1 1 1 A 64 64 ARG CA C 64 57.105 56.786 0.319 1
1 709 . 1 1 1 A 64 64 ARG CB C 64 31.672 32.383 -0.711 1
1 712 . 1 1 1 A 64 64 ARG N N 64 116.818 116.610 0.208 1
1 713 . 1 1 1 A 65 65 ILE H H 65 8.169 8.362 -0.193 1
1 714 . 1 1 1 A 65 65 ILE HA H 65 4.285 3.644 0.641 1
1 724 . 1 1 1 A 65 65 ILE C C 65 176.208 177.922 -1.714 1
1 725 . 1 1 1 A 65 65 ILE CA C 65 62.005 65.135 -3.130 1
1 726 . 1 1 1 A 65 65 ILE CB C 65 39.088 37.543 1.545 1
1 730 . 1 1 1 A 65 65 ILE N N 65 119.185 120.967 -1.782 1
1 731 . 1 1 1 A 66 66 LEU H H 66 7.962 7.844 0.118 1
1 732 . 1 1 1 A 66 66 LEU HA H 66 4.485 4.029 0.456 1
1 742 . 1 1 1 A 66 66 LEU C C 66 176.216 175.108 1.108 1
1 743 . 1 1 1 A 66 66 LEU CA C 66 56.153 59.854 -3.701 1
1 744 . 1 1 1 A 66 66 LEU CB C 66 40.792 40.110 0.682 1
1 748 . 1 1 1 A 66 66 LEU N N 66 124.389 121.911 2.478 1
1 749 . 1 1 1 A 67 67 PRO HA H 67 4.283 4.373 -0.090 1
1 756 . 1 1 1 A 67 67 PRO C C 67 178.294 178.461 -0.167 1
1 757 . 1 1 1 A 67 67 PRO CA C 67 65.390 65.236 0.154 1
1 758 . 1 1 1 A 67 67 PRO CB C 67 31.095 30.956 0.139 1
1 761 . 1 1 1 A 68 68 ASP H H 68 7.913 8.659 -0.746 1
1 762 . 1 1 1 A 68 68 ASP HA H 68 4.507 4.416 0.091 1
1 765 . 1 1 1 A 68 68 ASP C C 68 177.927 177.740 0.187 1
1 766 . 1 1 1 A 68 68 ASP CA C 68 55.906 56.758 -0.852 1
1 767 . 1 1 1 A 68 68 ASP CB C 68 40.736 40.678 0.058 1
1 768 . 1 1 1 A 68 68 ASP N N 68 117.231 117.811 -0.580 1
1 769 . 1 1 1 A 69 69 MET H H 69 8.083 8.417 -0.334 1
1 770 . 1 1 1 A 69 69 MET HA H 69 4.362 4.437 -0.075 1
1 778 . 1 1 1 A 69 69 MET C C 69 177.374 178.369 -0.995 1
1 779 . 1 1 1 A 69 69 MET CA C 69 57.634 58.227 -0.593 1
1 780 . 1 1 1 A 69 69 MET CB C 69 32.816 33.057 -0.241 1
1 783 . 1 1 1 A 69 69 MET N N 69 119.391 117.208 2.183 1
1 784 . 1 1 1 A 70 70 LEU H H 70 7.907 8.530 -0.623 1
1 785 . 1 1 1 A 70 70 LEU HA H 70 4.232 4.082 0.150 1
1 795 . 1 1 1 A 70 70 LEU C C 70 177.745 176.470 1.275 1
1 796 . 1 1 1 A 70 70 LEU CA C 70 55.835 57.731 -1.896 1
1 797 . 1 1 1 A 70 70 LEU CB C 70 42.174 41.602 0.572 1
1 801 . 1 1 1 A 70 70 LEU N N 70 119.266 122.924 -3.658 1
1 802 . 1 1 1 A 71 71 GLN H H 71 7.865 7.792 0.073 1
1 803 . 1 1 1 A 71 71 GLN HA H 71 4.287 4.134 0.153 1
1 809 . 1 1 1 A 71 71 GLN C C 71 178.855 174.135 4.720 1
1 810 . 1 1 1 A 71 71 GLN CA C 71 56.383 56.921 -0.538 1
1 811 . 1 1 1 A 71 71 GLN CB C 71 29.092 26.091 3.001 1
1 813 . 1 1 1 A 71 71 GLN N N 71 118.603 117.288 1.315 1
1 815 . 1 1 1 A 72 72 GLN H H 72 8.189 7.723 0.466 1
1 816 . 1 1 1 A 72 72 GLN HA H 72 4.302 4.417 -0.115 1
1 821 . 1 1 1 A 72 72 GLN CA C 72 56.206 54.891 1.315 1
1 822 . 1 1 1 A 72 72 GLN CB C 72 29.298 28.089 1.209 1
1 824 . 1 1 1 A 72 72 GLN N N 72 120.267 118.563 1.704 1
1 825 . 1 1 1 A 73 73 ARG C C 73 176.105 176.617 -0.512 1
1 826 . 1 1 1 A 74 74 ARG HA H 74 4.334 3.818 0.516 1
1 833 . 1 1 1 A 74 74 ARG C C 74 176.188 176.133 0.055 1
1 834 . 1 1 1 A 74 74 ARG CA C 74 56.300 59.194 -2.894 1
1 835 . 1 1 1 A 74 74 ARG CB C 74 30.668 29.596 1.072 1
1 838 . 1 1 1 A 75 75 ASN C C 75 174.462 174.610 -0.148 1
1 839 . 1 1 1 A 75 75 ASN CA C 75 53.148 54.153 -1.005 1
1 840 . 1 1 1 A 75 75 ASN CB C 75 39.046 37.148 1.898 1
1 841 . 1 1 1 A 76 76 ASP H H 76 8.257 7.941 0.316 1
1 842 . 1 1 1 A 76 76 ASP HA H 76 4.877 5.169 -0.292 1
1 845 . 1 1 1 A 76 76 ASP C C 76 174.759 173.866 0.893 1
1 846 . 1 1 1 A 76 76 ASP CA C 76 52.380 51.034 1.346 1
1 847 . 1 1 1 A 76 76 ASP CB C 76 41.267 41.812 -0.545 1
1 848 . 1 1 1 A 76 76 ASP N N 76 122.030 118.642 3.388 1
1 849 . 1 1 1 A 77 77 PRO HA H 77 4.466 4.618 -0.152 1
1 856 . 1 1 1 A 77 77 PRO C C 77 177.133 176.973 0.160 1
1 857 . 1 1 1 A 77 77 PRO CA C 77 63.733 62.593 1.140 1
1 858 . 1 1 1 A 77 77 PRO CB C 77 31.919 31.506 0.413 1
1 861 . 1 1 1 A 78 78 SER H H 78 8.457 8.422 0.035 1
1 862 . 1 1 1 A 78 78 SER HA H 78 4.479 4.348 0.131 1
1 865 . 1 1 1 A 78 78 SER C C 78 174.731 175.215 -0.484 1
1 866 . 1 1 1 A 78 78 SER CA C 78 58.691 60.473 -1.782 1
1 867 . 1 1 1 A 78 78 SER CB C 78 63.973 63.771 0.202 1
1 868 . 1 1 1 A 78 78 SER N N 78 115.711 119.373 -3.662 1
1 869 . 1 1 1 A 79 79 GLY H H 79 8.090 8.625 -0.535 1
1 870 . 1 1 1 A 79 79 GLY HA2 H 79 4.179 4.028 0.151 1
1 871 . 1 1 1 A 79 79 GLY HA3 H 79 4.065 4.028 0.037 1
1 872 . 1 1 1 A 79 79 GLY CA C 79 44.746 45.271 -0.525 1
1 873 . 1 1 1 A 79 79 GLY N N 79 110.429 112.514 -2.085 1
1 874 . 1 1 1 A 80 80 PRO HA H 80 4.464 4.588 -0.124 1
1 880 . 1 1 1 A 80 80 PRO C C 80 177.499 176.100 1.399 1
1 881 . 1 1 1 A 80 80 PRO CA C 80 63.275 62.503 0.772 1
1 882 . 1 1 1 A 80 80 PRO CB C 80 32.249 33.310 -1.061 1
1 1 . 2 1 1 A 13 13 ASN HA H 13 4.787 5.550 -0.763 1
1 6 . 2 1 1 A 13 13 ASN CA C 13 53.148 52.071 1.077 1
1 7 . 2 1 1 A 13 13 ASN CB C 13 39.378 42.832 -3.454 1
1 9 . 2 1 1 A 14 14 LEU H H 14 8.418 8.687 -0.269 1
1 10 . 2 1 1 A 14 14 LEU HA H 14 4.654 4.551 0.103 1
1 20 . 2 1 1 A 14 14 LEU CA C 14 52.999 52.963 0.036 1
1 21 . 2 1 1 A 14 14 LEU CB C 14 41.919 41.042 0.877 1
1 25 . 2 1 1 A 14 14 LEU N N 14 122.671 123.660 -0.989 1
1 26 . 2 1 1 A 15 15 PRO HA H 15 4.460 4.621 -0.161 1
1 33 . 2 1 1 A 15 15 PRO C C 15 178.156 177.567 0.589 1
1 34 . 2 1 1 A 15 15 PRO CA C 15 63.101 62.615 0.486 1
1 35 . 2 1 1 A 15 15 PRO CB C 15 32.304 32.073 0.231 1
1 38 . 2 1 1 A 16 16 ALA H H 16 8.973 8.614 0.359 1
1 39 . 2 1 1 A 16 16 ALA HA H 16 4.021 3.932 0.089 1
1 43 . 2 1 1 A 16 16 ALA C C 16 180.695 179.576 1.119 1
1 44 . 2 1 1 A 16 16 ALA CA C 16 55.642 55.590 0.052 1
1 45 . 2 1 1 A 16 16 ALA CB C 16 18.552 18.629 -0.077 1
1 46 . 2 1 1 A 16 16 ALA N N 16 128.311 127.139 1.172 1
1 47 . 2 1 1 A 17 17 GLU H H 17 9.558 8.432 1.126 1
1 48 . 2 1 1 A 17 17 GLU HA H 17 4.065 3.985 0.080 1
1 53 . 2 1 1 A 17 17 GLU C C 17 178.886 178.879 0.007 1
1 54 . 2 1 1 A 17 17 GLU CA C 17 59.400 59.632 -0.232 1
1 55 . 2 1 1 A 17 17 GLU CB C 17 28.742 29.515 -0.773 1
1 57 . 2 1 1 A 17 17 GLU N N 17 117.113 118.889 -1.776 1
1 58 . 2 1 1 A 18 18 SER H H 18 7.263 8.041 -0.778 1
1 59 . 2 1 1 A 18 18 SER HA H 18 4.180 4.152 0.028 1
1 62 . 2 1 1 A 18 18 SER C C 18 174.951 176.034 -1.083 1
1 63 . 2 1 1 A 18 18 SER CA C 18 61.969 62.542 -0.573 1
1 64 . 2 1 1 A 18 18 SER CB C 18 62.554 63.060 -0.506 1
1 65 . 2 1 1 A 18 18 SER N N 18 114.932 117.490 -2.558 1
1 66 . 2 1 1 A 19 19 VAL H H 19 7.620 8.223 -0.603 1
1 67 . 2 1 1 A 19 19 VAL HA H 19 3.011 3.080 -0.069 1
1 75 . 2 1 1 A 19 19 VAL C C 19 176.953 177.679 -0.726 1
1 76 . 2 1 1 A 19 19 VAL CA C 19 66.479 66.832 -0.353 1
1 77 . 2 1 1 A 19 19 VAL CB C 19 31.569 31.344 0.225 1
1 80 . 2 1 1 A 19 19 VAL N N 19 121.086 121.536 -0.450 1
1 81 . 2 1 1 A 20 20 LYS H H 20 7.745 8.234 -0.489 1
1 82 . 2 1 1 A 20 20 LYS HA H 20 3.884 3.981 -0.097 1
1 91 . 2 1 1 A 20 20 LYS C C 20 178.150 178.794 -0.644 1
1 92 . 2 1 1 A 20 20 LYS CA C 20 59.984 59.617 0.367 1
1 93 . 2 1 1 A 20 20 LYS CB C 20 32.351 32.232 0.119 1
1 97 . 2 1 1 A 20 20 LYS N N 20 119.366 119.607 -0.241 1
1 98 . 2 1 1 A 21 21 ILE H H 21 6.943 7.541 -0.598 1
1 99 . 2 1 1 A 21 21 ILE HA H 21 3.783 3.686 0.097 1
1 109 . 2 1 1 A 21 21 ILE C C 21 178.996 178.663 0.333 1
1 110 . 2 1 1 A 21 21 ILE CA C 21 64.642 65.617 -0.975 1
1 111 . 2 1 1 A 21 21 ILE CB C 21 38.014 37.782 0.232 1
1 115 . 2 1 1 A 21 21 ILE N N 21 118.163 120.364 -2.201 1
1 116 . 2 1 1 A 22 22 LEU H H 22 7.267 8.070 -0.803 1
1 117 . 2 1 1 A 22 22 LEU HA H 22 3.748 3.901 -0.153 1
1 127 . 2 1 1 A 22 22 LEU C C 22 178.289 178.739 -0.450 1
1 128 . 2 1 1 A 22 22 LEU CA C 22 58.092 57.829 0.263 1
1 129 . 2 1 1 A 22 22 LEU CB C 22 38.551 40.969 -2.418 1
1 133 . 2 1 1 A 22 22 LEU N N 22 120.609 119.234 1.375 1
1 134 . 2 1 1 A 23 23 ARG H H 23 8.676 8.676 0.000 1
1 135 . 2 1 1 A 23 23 ARG HA H 23 4.030 4.217 -0.187 1
1 142 . 2 1 1 A 23 23 ARG C C 23 178.861 178.228 0.633 1
1 143 . 2 1 1 A 23 23 ARG CA C 23 60.404 60.026 0.378 1
1 144 . 2 1 1 A 23 23 ARG CB C 23 30.351 30.233 0.118 1
1 147 . 2 1 1 A 23 23 ARG N N 23 119.148 117.587 1.561 1
1 148 . 2 1 1 A 24 24 ASP H H 24 8.515 8.171 0.344 1
1 149 . 2 1 1 A 24 24 ASP HA H 24 4.519 4.362 0.157 1
1 152 . 2 1 1 A 24 24 ASP C C 24 178.759 178.519 0.240 1
1 153 . 2 1 1 A 24 24 ASP CA C 24 57.556 57.214 0.342 1
1 154 . 2 1 1 A 24 24 ASP CB C 24 40.569 41.065 -0.496 1
1 155 . 2 1 1 A 24 24 ASP N N 24 120.027 119.137 0.890 1
1 156 . 2 1 1 A 25 25 TRP H H 25 8.158 8.191 -0.033 1
1 157 . 2 1 1 A 25 25 TRP HA H 25 4.181 4.425 -0.244 1
1 166 . 2 1 1 A 25 25 TRP C C 25 179.946 178.531 1.415 1
1 167 . 2 1 1 A 25 25 TRP CA C 25 63.346 61.243 2.103 1
1 168 . 2 1 1 A 25 25 TRP CB C 25 29.433 29.625 -0.192 1
1 174 . 2 1 1 A 25 25 TRP N N 25 121.350 121.620 -0.270 1
1 176 . 2 1 1 A 26 26 MET H H 26 8.977 8.703 0.274 1
1 177 . 2 1 1 A 26 26 MET HA H 26 4.076 4.559 -0.483 1
1 185 . 2 1 1 A 26 26 MET C C 26 177.371 178.010 -0.639 1
1 186 . 2 1 1 A 26 26 MET CA C 26 60.454 58.693 1.761 1
1 187 . 2 1 1 A 26 26 MET CB C 26 33.567 32.723 0.844 1
1 190 . 2 1 1 A 26 26 MET N N 26 119.977 118.783 1.194 1
1 191 . 2 1 1 A 27 27 TYR H H 27 8.604 8.320 0.284 1
1 192 . 2 1 1 A 27 27 TYR HA H 27 4.138 4.084 0.054 1
1 199 . 2 1 1 A 27 27 TYR C C 27 178.901 177.673 1.228 1
1 200 . 2 1 1 A 27 27 TYR CA C 27 61.846 61.243 0.603 1
1 201 . 2 1 1 A 27 27 TYR CB C 27 38.165 38.590 -0.425 1
1 206 . 2 1 1 A 27 27 TYR N N 27 117.797 121.238 -3.441 1
1 207 . 2 1 1 A 28 28 LYS H H 28 7.867 7.659 0.208 1
1 208 . 2 1 1 A 28 28 LYS HA H 28 3.797 3.639 0.158 1
1 217 . 2 1 1 A 28 28 LYS C C 28 176.858 177.604 -0.746 1
1 218 . 2 1 1 A 28 28 LYS CA C 28 58.174 58.962 -0.788 1
1 219 . 2 1 1 A 28 28 LYS CB C 28 32.516 31.777 0.739 1
1 223 . 2 1 1 A 28 28 LYS N N 28 118.982 117.831 1.151 1
1 224 . 2 1 1 A 29 29 HIS H H 29 7.443 7.112 0.331 1
1 225 . 2 1 1 A 29 29 HIS HA H 29 4.386 4.371 0.015 1
1 230 . 2 1 1 A 29 29 HIS C C 29 176.085 175.683 0.402 1
1 231 . 2 1 1 A 29 29 HIS CA C 29 55.213 55.300 -0.087 1
1 232 . 2 1 1 A 29 29 HIS CB C 29 27.085 28.749 -1.664 1
1 235 . 2 1 1 A 29 29 HIS N N 29 117.138 115.644 1.494 1
1 236 . 2 1 1 A 30 30 ARG H H 30 6.921 8.058 -1.137 1
1 237 . 2 1 1 A 30 30 ARG HA H 30 3.898 4.304 -0.406 1
1 244 . 2 1 1 A 30 30 ARG C C 30 175.808 177.910 -2.102 1
1 245 . 2 1 1 A 30 30 ARG CA C 30 58.609 58.456 0.153 1
1 246 . 2 1 1 A 30 30 ARG CB C 30 28.739 29.604 -0.865 1
1 249 . 2 1 1 A 30 30 ARG N N 30 117.911 119.126 -1.215 1
1 250 . 2 1 1 A 31 31 PHE H H 31 7.819 7.519 0.300 1
1 251 . 2 1 1 A 31 31 PHE HA H 31 4.533 4.308 0.225 1
1 259 . 2 1 1 A 31 31 PHE C C 31 175.577 176.711 -1.134 1
1 260 . 2 1 1 A 31 31 PHE CA C 31 58.029 60.871 -2.842 1
1 261 . 2 1 1 A 31 31 PHE CB C 31 37.792 38.877 -1.085 1
1 267 . 2 1 1 A 31 31 PHE N N 31 115.408 118.549 -3.141 1
1 268 . 2 1 1 A 32 32 LYS H H 32 7.858 7.997 -0.139 1
1 269 . 2 1 1 A 32 32 LYS HA H 32 4.487 4.545 -0.058 1
1 277 . 2 1 1 A 32 32 LYS C C 32 175.557 176.513 -0.956 1
1 278 . 2 1 1 A 32 32 LYS CA C 32 56.329 56.641 -0.312 1
1 279 . 2 1 1 A 32 32 LYS CB C 32 32.743 34.667 -1.924 1
1 283 . 2 1 1 A 32 32 LYS N N 32 122.453 113.317 9.136 1
1 284 . 2 1 1 A 33 33 ALA H H 33 8.643 8.247 0.396 1
1 285 . 2 1 1 A 33 33 ALA HA H 33 4.403 4.126 0.277 1
1 289 . 2 1 1 A 33 33 ALA C C 33 176.273 175.625 0.648 1
1 290 . 2 1 1 A 33 33 ALA CA C 33 53.579 53.429 0.150 1
1 291 . 2 1 1 A 33 33 ALA CB C 33 18.653 17.191 1.462 1
1 292 . 2 1 1 A 33 33 ALA N N 33 127.853 120.559 7.294 1
1 293 . 2 1 1 A 34 34 TYR H H 34 7.878 8.049 -0.171 1
1 294 . 2 1 1 A 34 34 TYR HA H 34 4.686 4.971 -0.285 1
1 301 . 2 1 1 A 34 34 TYR C C 34 173.133 173.092 0.041 1
1 302 . 2 1 1 A 34 34 TYR CA C 34 54.778 54.906 -0.128 1
1 303 . 2 1 1 A 34 34 TYR CB C 34 39.619 38.932 0.687 1
1 308 . 2 1 1 A 34 34 TYR N N 34 116.539 117.990 -1.451 1
1 309 . 2 1 1 A 35 35 PRO HA H 35 4.526 4.689 -0.163 1
1 316 . 2 1 1 A 35 35 PRO C C 35 176.837 176.206 0.631 1
1 317 . 2 1 1 A 35 35 PRO CA C 35 61.864 62.190 -0.326 1
1 318 . 2 1 1 A 35 35 PRO CB C 35 30.904 32.119 -1.215 1
1 321 . 2 1 1 A 36 36 SER H H 36 9.634 8.276 1.358 1
1 322 . 2 1 1 A 36 36 SER HA H 36 4.518 4.785 -0.267 1
1 325 . 2 1 1 A 36 36 SER C C 36 175.001 175.231 -0.230 1
1 326 . 2 1 1 A 36 36 SER CA C 36 57.129 56.307 0.822 1
1 327 . 2 1 1 A 36 36 SER CB C 36 65.374 66.159 -0.785 1
1 328 . 2 1 1 A 36 36 SER N N 36 119.984 114.193 5.791 1
1 329 . 2 1 1 A 37 37 GLU H H 37 9.091 9.031 0.060 1
1 330 . 2 1 1 A 37 37 GLU HA H 37 3.884 3.910 -0.026 1
1 335 . 2 1 1 A 37 37 GLU C C 37 179.347 178.224 1.123 1
1 336 . 2 1 1 A 37 37 GLU CA C 37 60.454 59.573 0.881 1
1 337 . 2 1 1 A 37 37 GLU CB C 37 28.623 29.469 -0.846 1
1 339 . 2 1 1 A 37 37 GLU N N 37 120.748 121.458 -0.710 1
1 340 . 2 1 1 A 38 38 GLU H H 38 8.760 7.853 0.907 1
1 341 . 2 1 1 A 38 38 GLU HA H 38 4.048 4.064 -0.016 1
1 346 . 2 1 1 A 38 38 GLU C C 38 179.975 179.185 0.790 1
1 347 . 2 1 1 A 38 38 GLU CA C 38 60.243 59.189 1.054 1
1 348 . 2 1 1 A 38 38 GLU CB C 38 29.117 29.814 -0.697 1
1 350 . 2 1 1 A 38 38 GLU N N 38 119.272 119.451 -0.179 1
1 351 . 2 1 1 A 39 39 GLU H H 39 7.856 7.926 -0.070 1
1 352 . 2 1 1 A 39 39 GLU HA H 39 3.976 3.901 0.075 1
1 357 . 2 1 1 A 39 39 GLU C C 39 178.912 178.745 0.167 1
1 358 . 2 1 1 A 39 39 GLU CA C 39 59.131 59.151 -0.020 1
1 359 . 2 1 1 A 39 39 GLU CB C 39 29.612 28.780 0.832 1
1 361 . 2 1 1 A 39 39 GLU N N 39 121.658 120.704 0.954 1
1 362 . 2 1 1 A 40 40 LYS H H 40 8.653 7.756 0.897 1
1 363 . 2 1 1 A 40 40 LYS HA H 40 3.508 3.811 -0.303 1
1 372 . 2 1 1 A 40 40 LYS C C 40 177.974 178.934 -0.960 1
1 373 . 2 1 1 A 40 40 LYS CA C 40 60.948 59.471 1.477 1
1 374 . 2 1 1 A 40 40 LYS CB C 40 32.714 32.115 0.599 1
1 378 . 2 1 1 A 40 40 LYS N N 40 119.152 119.754 -0.602 1
1 379 . 2 1 1 A 41 41 GLN H H 41 7.876 7.594 0.282 1
1 380 . 2 1 1 A 41 41 GLN HA H 41 3.911 3.980 -0.069 1
1 387 . 2 1 1 A 41 41 GLN C C 41 178.352 178.102 0.250 1
1 388 . 2 1 1 A 41 41 GLN CA C 41 58.973 58.996 -0.023 1
1 389 . 2 1 1 A 41 41 GLN CB C 41 27.552 28.378 -0.826 1
1 391 . 2 1 1 A 41 41 GLN N N 41 118.910 119.622 -0.712 1
1 393 . 2 1 1 A 42 42 MET H H 42 7.771 7.854 -0.083 1
1 394 . 2 1 1 A 42 42 MET HA H 42 4.158 4.178 -0.020 1
1 402 . 2 1 1 A 42 42 MET C C 42 179.310 178.231 1.079 1
1 403 . 2 1 1 A 42 42 MET CA C 42 59.079 58.410 0.669 1
1 404 . 2 1 1 A 42 42 MET CB C 42 31.023 32.276 -1.253 1
1 407 . 2 1 1 A 42 42 MET N N 42 121.131 119.240 1.891 1
1 408 . 2 1 1 A 43 43 LEU H H 43 8.400 8.232 0.168 1
1 409 . 2 1 1 A 43 43 LEU HA H 43 3.888 3.945 -0.057 1
1 419 . 2 1 1 A 43 43 LEU C C 43 180.721 178.839 1.882 1
1 420 . 2 1 1 A 43 43 LEU CA C 43 57.916 58.133 -0.217 1
1 421 . 2 1 1 A 43 43 LEU CB C 43 42.080 41.313 0.767 1
1 425 . 2 1 1 A 43 43 LEU N N 43 120.124 120.803 -0.679 1
1 426 . 2 1 1 A 44 44 SER H H 44 8.658 8.685 -0.027 1
1 427 . 2 1 1 A 44 44 SER HA H 44 4.088 4.439 -0.351 1
1 430 . 2 1 1 A 44 44 SER C C 44 176.859 177.351 -0.492 1
1 431 . 2 1 1 A 44 44 SER CA C 44 61.371 61.555 -0.184 1
1 432 . 2 1 1 A 44 44 SER CB C 44 63.314 62.482 0.832 1
1 433 . 2 1 1 A 44 44 SER N N 44 119.795 113.110 6.685 1
1 434 . 2 1 1 A 45 45 GLU H H 45 7.905 7.586 0.319 1
1 435 . 2 1 1 A 45 45 GLU HA H 45 4.094 4.126 -0.032 1
1 440 . 2 1 1 A 45 45 GLU C C 45 179.095 179.379 -0.284 1
1 441 . 2 1 1 A 45 45 GLU CA C 45 59.255 59.042 0.213 1
1 442 . 2 1 1 A 45 45 GLU CB C 45 29.200 29.203 -0.003 1
1 444 . 2 1 1 A 45 45 GLU N N 45 120.609 122.942 -2.333 1
1 445 . 2 1 1 A 46 46 LYS H H 46 7.837 8.103 -0.266 1
1 446 . 2 1 1 A 46 46 LYS HA H 46 4.231 4.127 0.104 1
1 453 . 2 1 1 A 46 46 LYS C C 46 177.964 178.744 -0.780 1
1 454 . 2 1 1 A 46 46 LYS CA C 46 58.278 58.627 -0.349 1
1 455 . 2 1 1 A 46 46 LYS CB C 46 34.110 32.691 1.419 1
1 459 . 2 1 1 A 46 46 LYS N N 46 115.471 118.847 -3.376 1
1 460 . 2 1 1 A 47 47 THR H H 47 7.763 8.230 -0.467 1
1 461 . 2 1 1 A 47 47 THR HA H 47 4.271 4.253 0.018 1
1 466 . 2 1 1 A 47 47 THR C C 47 175.472 174.711 0.761 1
1 467 . 2 1 1 A 47 47 THR CA C 47 62.429 62.136 0.293 1
1 468 . 2 1 1 A 47 47 THR CB C 47 71.966 70.002 1.964 1
1 470 . 2 1 1 A 47 47 THR N N 47 104.286 108.281 -3.995 1
1 471 . 2 1 1 A 48 48 ASN H H 48 8.169 8.235 -0.066 1
1 472 . 2 1 1 A 48 48 ASN HA H 48 4.437 4.432 0.005 1
1 477 . 2 1 1 A 48 48 ASN C C 48 173.874 173.887 -0.013 1
1 478 . 2 1 1 A 48 48 ASN CA C 48 55.377 54.429 0.948 1
1 479 . 2 1 1 A 48 48 ASN CB C 48 37.770 36.646 1.124 1
1 480 . 2 1 1 A 48 48 ASN N N 48 117.458 116.230 1.228 1
1 482 . 2 1 1 A 49 49 LEU H H 49 7.532 7.303 0.229 1
1 483 . 2 1 1 A 49 49 LEU HA H 49 4.733 4.874 -0.141 1
1 493 . 2 1 1 A 49 49 LEU C C 49 176.625 175.437 1.188 1
1 494 . 2 1 1 A 49 49 LEU CA C 49 53.226 53.117 0.109 1
1 495 . 2 1 1 A 49 49 LEU CB C 49 44.114 44.079 0.035 1
1 499 . 2 1 1 A 49 49 LEU N N 49 118.220 119.159 -0.939 1
1 500 . 2 1 1 A 50 50 SER H H 50 9.140 8.838 0.302 1
1 501 . 2 1 1 A 50 50 SER HA H 50 4.475 4.779 -0.304 1
1 504 . 2 1 1 A 50 50 SER C C 50 174.907 175.185 -0.278 1
1 505 . 2 1 1 A 50 50 SER CA C 50 56.964 58.078 -1.114 1
1 506 . 2 1 1 A 50 50 SER CB C 50 65.372 64.691 0.681 1
1 507 . 2 1 1 A 50 50 SER N N 50 117.569 117.384 0.185 1
1 508 . 2 1 1 A 51 51 LEU H H 51 8.756 8.694 0.062 1
1 509 . 2 1 1 A 51 51 LEU HA H 51 3.874 3.936 -0.062 1
1 519 . 2 1 1 A 51 51 LEU C C 51 179.910 178.866 1.044 1
1 520 . 2 1 1 A 51 51 LEU CA C 51 58.916 57.938 0.978 1
1 521 . 2 1 1 A 51 51 LEU CB C 51 41.148 41.536 -0.388 1
1 525 . 2 1 1 A 51 51 LEU N N 51 120.905 125.913 -5.008 1
1 526 . 2 1 1 A 52 52 LEU H H 52 8.146 8.231 -0.085 1
1 527 . 2 1 1 A 52 52 LEU HA H 52 4.179 4.080 0.099 1
1 537 . 2 1 1 A 52 52 LEU C C 52 178.936 178.717 0.219 1
1 538 . 2 1 1 A 52 52 LEU CA C 52 58.162 58.375 -0.213 1
1 539 . 2 1 1 A 52 52 LEU CB C 52 42.137 41.642 0.495 1
1 543 . 2 1 1 A 52 52 LEU N N 52 120.685 120.246 0.439 1
1 544 . 2 1 1 A 53 53 GLN H H 53 7.924 8.128 -0.204 1
1 545 . 2 1 1 A 53 53 GLN HA H 53 4.102 4.134 -0.032 1
1 552 . 2 1 1 A 53 53 GLN C C 53 180.308 178.421 1.887 1
1 553 . 2 1 1 A 53 53 GLN CA C 53 59.326 58.380 0.946 1
1 554 . 2 1 1 A 53 53 GLN CB C 53 29.900 28.442 1.458 1
1 556 . 2 1 1 A 53 53 GLN N N 53 118.473 117.670 0.803 1
1 558 . 2 1 1 A 54 54 ILE H H 54 8.380 8.264 0.116 1
1 559 . 2 1 1 A 54 54 ILE HA H 54 3.677 3.759 -0.082 1
1 569 . 2 1 1 A 54 54 ILE C C 54 177.673 178.173 -0.500 1
1 570 . 2 1 1 A 54 54 ILE CA C 54 64.650 65.244 -0.594 1
1 571 . 2 1 1 A 54 54 ILE CB C 54 37.476 37.819 -0.343 1
1 575 . 2 1 1 A 54 54 ILE N N 54 120.113 121.389 -1.276 1
1 576 . 2 1 1 A 55 55 SER H H 55 8.854 7.862 0.992 1
1 577 . 2 1 1 A 55 55 SER HA H 55 4.267 4.325 -0.058 1
1 580 . 2 1 1 A 55 55 SER C C 55 177.127 177.705 -0.578 1
1 581 . 2 1 1 A 55 55 SER CA C 55 62.852 61.853 0.999 1
1 582 . 2 1 1 A 55 55 SER CB C 55 62.727 63.086 -0.359 1
1 583 . 2 1 1 A 55 55 SER N N 55 116.646 116.010 0.636 1
1 584 . 2 1 1 A 56 56 ASN H H 56 8.634 8.152 0.482 1
1 585 . 2 1 1 A 56 56 ASN HA H 56 4.549 4.457 0.092 1
1 590 . 2 1 1 A 56 56 ASN C C 56 177.481 178.304 -0.823 1
1 591 . 2 1 1 A 56 56 ASN CA C 56 55.951 56.498 -0.547 1
1 592 . 2 1 1 A 56 56 ASN CB C 56 37.852 38.060 -0.208 1
1 593 . 2 1 1 A 56 56 ASN N N 56 119.048 119.151 -0.103 1
1 595 . 2 1 1 A 57 57 TRP H H 57 8.373 8.147 0.226 1
1 596 . 2 1 1 A 57 57 TRP HA H 57 4.065 4.291 -0.226 1
1 605 . 2 1 1 A 57 57 TRP C C 57 179.392 178.340 1.052 1
1 606 . 2 1 1 A 57 57 TRP CA C 57 63.204 61.470 1.734 1
1 607 . 2 1 1 A 57 57 TRP CB C 57 28.376 29.248 -0.872 1
1 613 . 2 1 1 A 57 57 TRP N N 57 122.950 122.724 0.226 1
1 615 . 2 1 1 A 58 58 PHE H H 58 8.428 8.252 0.176 1
1 616 . 2 1 1 A 58 58 PHE HA H 58 3.922 3.935 -0.013 1
1 624 . 2 1 1 A 58 58 PHE C C 58 178.237 177.971 0.266 1
1 625 . 2 1 1 A 58 58 PHE CA C 58 64.015 61.287 2.728 1
1 626 . 2 1 1 A 58 58 PHE CB C 58 39.602 38.045 1.557 1
1 632 . 2 1 1 A 58 58 PHE N N 58 116.774 117.613 -0.839 1
1 633 . 2 1 1 A 59 59 ILE H H 59 7.925 8.137 -0.212 1
1 634 . 2 1 1 A 59 59 ILE HA H 59 3.773 3.625 0.148 1
1 644 . 2 1 1 A 59 59 ILE C C 59 178.745 177.732 1.013 1
1 645 . 2 1 1 A 59 59 ILE CA C 59 65.531 65.222 0.309 1
1 646 . 2 1 1 A 59 59 ILE CB C 59 38.480 37.909 0.571 1
1 650 . 2 1 1 A 59 59 ILE N N 59 119.560 120.447 -0.887 1
1 651 . 2 1 1 A 60 60 ASN H H 60 7.506 7.714 -0.208 1
1 652 . 2 1 1 A 60 60 ASN HA H 60 4.407 4.420 -0.013 1
1 657 . 2 1 1 A 60 60 ASN C C 60 177.163 177.824 -0.661 1
1 658 . 2 1 1 A 60 60 ASN CA C 60 55.871 55.968 -0.097 1
1 659 . 2 1 1 A 60 60 ASN CB C 60 38.878 37.966 0.912 1
1 660 . 2 1 1 A 60 60 ASN N N 60 116.868 117.421 -0.553 1
1 662 . 2 1 1 A 61 61 ALA H H 61 8.410 8.082 0.328 1
1 663 . 2 1 1 A 61 61 ALA HA H 61 3.667 3.617 0.050 1
1 667 . 2 1 1 A 61 61 ALA C C 61 180.061 179.314 0.747 1
1 668 . 2 1 1 A 61 61 ALA CA C 61 54.601 54.865 -0.264 1
1 669 . 2 1 1 A 61 61 ALA CB C 61 18.241 17.000 1.241 1
1 670 . 2 1 1 A 61 61 ALA N N 61 123.022 122.327 0.695 1
1 671 . 2 1 1 A 62 62 ARG H H 62 8.036 8.016 0.020 1
1 672 . 2 1 1 A 62 62 ARG HA H 62 4.092 4.037 0.055 1
1 679 . 2 1 1 A 62 62 ARG C C 62 176.756 177.422 -0.666 1
1 680 . 2 1 1 A 62 62 ARG CA C 62 58.762 58.113 0.649 1
1 681 . 2 1 1 A 62 62 ARG CB C 62 30.601 29.969 0.632 1
1 684 . 2 1 1 A 62 62 ARG N N 62 117.168 118.507 -1.339 1
1 685 . 2 1 1 A 63 63 ARG H H 63 7.214 7.793 -0.579 1
1 686 . 2 1 1 A 63 63 ARG HA H 63 4.249 4.425 -0.176 1
1 693 . 2 1 1 A 63 63 ARG C C 63 176.945 176.584 0.361 1
1 694 . 2 1 1 A 63 63 ARG CA C 63 57.669 56.740 0.929 1
1 695 . 2 1 1 A 63 63 ARG CB C 63 30.765 31.073 -0.308 1
1 698 . 2 1 1 A 63 63 ARG N N 63 116.514 118.410 -1.896 1
1 699 . 2 1 1 A 64 64 ARG H H 64 7.913 7.761 0.152 1
1 700 . 2 1 1 A 64 64 ARG HA H 64 4.351 4.597 -0.246 1
1 707 . 2 1 1 A 64 64 ARG C C 64 176.413 178.495 -2.082 1
1 708 . 2 1 1 A 64 64 ARG CA C 64 57.105 57.238 -0.133 1
1 709 . 2 1 1 A 64 64 ARG CB C 64 31.672 32.849 -1.177 1
1 712 . 2 1 1 A 64 64 ARG N N 64 116.818 118.766 -1.948 1
1 713 . 2 1 1 A 65 65 ILE H H 65 8.169 8.195 -0.026 1
1 714 . 2 1 1 A 65 65 ILE HA H 65 4.285 3.628 0.657 1
1 724 . 2 1 1 A 65 65 ILE C C 65 176.208 177.830 -1.622 1
1 725 . 2 1 1 A 65 65 ILE CA C 65 62.005 65.501 -3.496 1
1 726 . 2 1 1 A 65 65 ILE CB C 65 39.088 37.937 1.151 1
1 730 . 2 1 1 A 65 65 ILE N N 65 119.185 119.928 -0.743 1
1 731 . 2 1 1 A 66 66 LEU H H 66 7.962 8.223 -0.261 1
1 732 . 2 1 1 A 66 66 LEU HA H 66 4.485 4.056 0.429 1
1 742 . 2 1 1 A 66 66 LEU C C 66 176.216 175.347 0.869 1
1 743 . 2 1 1 A 66 66 LEU CA C 66 56.153 59.851 -3.698 1
1 744 . 2 1 1 A 66 66 LEU CB C 66 40.792 39.962 0.830 1
1 748 . 2 1 1 A 66 66 LEU N N 66 124.389 121.570 2.819 1
1 749 . 2 1 1 A 67 67 PRO HA H 67 4.283 4.410 -0.127 1
1 756 . 2 1 1 A 67 67 PRO C C 67 178.294 178.275 0.019 1
1 757 . 2 1 1 A 67 67 PRO CA C 67 65.390 64.840 0.550 1
1 758 . 2 1 1 A 67 67 PRO CB C 67 31.095 31.364 -0.269 1
1 761 . 2 1 1 A 68 68 ASP H H 68 7.913 8.426 -0.513 1
1 762 . 2 1 1 A 68 68 ASP HA H 68 4.507 4.614 -0.107 1
1 765 . 2 1 1 A 68 68 ASP C C 68 177.927 177.862 0.065 1
1 766 . 2 1 1 A 68 68 ASP CA C 68 55.906 56.579 -0.673 1
1 767 . 2 1 1 A 68 68 ASP CB C 68 40.736 41.702 -0.966 1
1 768 . 2 1 1 A 68 68 ASP N N 68 117.231 118.199 -0.968 1
1 769 . 2 1 1 A 69 69 MET H H 69 8.083 8.842 -0.759 1
1 770 . 2 1 1 A 69 69 MET HA H 69 4.362 4.182 0.180 1
1 778 . 2 1 1 A 69 69 MET C C 69 177.374 178.522 -1.148 1
1 779 . 2 1 1 A 69 69 MET CA C 69 57.634 58.518 -0.884 1
1 780 . 2 1 1 A 69 69 MET CB C 69 32.816 32.594 0.222 1
1 783 . 2 1 1 A 69 69 MET N N 69 119.391 118.655 0.736 1
1 784 . 2 1 1 A 70 70 LEU H H 70 7.907 8.044 -0.137 1
1 785 . 2 1 1 A 70 70 LEU HA H 70 4.232 4.126 0.106 1
1 795 . 2 1 1 A 70 70 LEU C C 70 177.745 177.575 0.170 1
1 796 . 2 1 1 A 70 70 LEU CA C 70 55.835 58.154 -2.319 1
1 797 . 2 1 1 A 70 70 LEU CB C 70 42.174 41.686 0.488 1
1 801 . 2 1 1 A 70 70 LEU N N 70 119.266 122.779 -3.513 1
1 802 . 2 1 1 A 71 71 GLN H H 71 7.865 7.596 0.269 1
1 803 . 2 1 1 A 71 71 GLN HA H 71 4.287 4.326 -0.039 1
1 809 . 2 1 1 A 71 71 GLN C C 71 178.855 176.195 2.660 1
1 810 . 2 1 1 A 71 71 GLN CA C 71 56.383 56.943 -0.560 1
1 811 . 2 1 1 A 71 71 GLN CB C 71 29.092 28.800 0.292 1
1 813 . 2 1 1 A 71 71 GLN N N 71 118.603 119.221 -0.618 1
1 815 . 2 1 1 A 72 72 GLN H H 72 8.189 8.491 -0.302 1
1 816 . 2 1 1 A 72 72 GLN HA H 72 4.302 4.388 -0.086 1
1 821 . 2 1 1 A 72 72 GLN CA C 72 56.206 56.278 -0.072 1
1 822 . 2 1 1 A 72 72 GLN CB C 72 29.298 28.913 0.385 1
1 824 . 2 1 1 A 72 72 GLN N N 72 120.267 122.837 -2.570 1
1 825 . 2 1 1 A 73 73 ARG C C 73 176.105 176.172 -0.067 1
1 826 . 2 1 1 A 74 74 ARG HA H 74 4.334 4.823 -0.489 1
1 833 . 2 1 1 A 74 74 ARG C C 74 176.188 174.903 1.285 1
1 834 . 2 1 1 A 74 74 ARG CA C 74 56.300 54.337 1.963 1
1 835 . 2 1 1 A 74 74 ARG CB C 74 30.668 33.348 -2.680 1
1 838 . 2 1 1 A 75 75 ASN C C 75 174.462 174.589 -0.127 1
1 839 . 2 1 1 A 75 75 ASN CA C 75 53.148 54.072 -0.924 1
1 840 . 2 1 1 A 75 75 ASN CB C 75 39.046 38.506 0.540 1
1 841 . 2 1 1 A 76 76 ASP H H 76 8.257 8.673 -0.416 1
1 842 . 2 1 1 A 76 76 ASP HA H 76 4.877 5.324 -0.447 1
1 845 . 2 1 1 A 76 76 ASP C C 76 174.759 174.330 0.429 1
1 846 . 2 1 1 A 76 76 ASP CA C 76 52.380 50.647 1.733 1
1 847 . 2 1 1 A 76 76 ASP CB C 76 41.267 42.272 -1.005 1
1 848 . 2 1 1 A 76 76 ASP N N 76 122.030 124.948 -2.918 1
1 849 . 2 1 1 A 77 77 PRO HA H 77 4.466 4.589 -0.123 1
1 856 . 2 1 1 A 77 77 PRO C C 77 177.133 175.996 1.137 1
1 857 . 2 1 1 A 77 77 PRO CA C 77 63.733 62.396 1.337 1
1 858 . 2 1 1 A 77 77 PRO CB C 77 31.919 32.502 -0.583 1
1 861 . 2 1 1 A 78 78 SER H H 78 8.457 8.500 -0.043 1
1 862 . 2 1 1 A 78 78 SER HA H 78 4.479 4.907 -0.428 1
1 865 . 2 1 1 A 78 78 SER C C 78 174.731 174.453 0.278 1
1 866 . 2 1 1 A 78 78 SER CA C 78 58.691 57.876 0.815 1
1 867 . 2 1 1 A 78 78 SER CB C 78 63.973 64.132 -0.159 1
1 868 . 2 1 1 A 78 78 SER N N 78 115.711 116.211 -0.500 1
1 869 . 2 1 1 A 79 79 GLY H H 79 8.090 8.641 -0.551 1
1 870 . 2 1 1 A 79 79 GLY HA2 H 79 4.179 4.288 -0.109 1
1 871 . 2 1 1 A 79 79 GLY HA3 H 79 4.065 4.289 -0.224 1
1 872 . 2 1 1 A 79 79 GLY CA C 79 44.746 43.820 0.926 1
1 873 . 2 1 1 A 79 79 GLY N N 79 110.429 112.653 -2.224 1
1 874 . 2 1 1 A 80 80 PRO HA H 80 4.464 4.715 -0.251 1
1 880 . 2 1 1 A 80 80 PRO C C 80 177.499 175.543 1.956 1
1 881 . 2 1 1 A 80 80 PRO CA C 80 63.275 62.764 0.511 1
1 882 . 2 1 1 A 80 80 PRO CB C 80 32.249 32.900 -0.651 1
1 1 . 3 1 1 A 13 13 ASN HA H 13 4.787 5.705 -0.918 1
1 6 . 3 1 1 A 13 13 ASN CA C 13 53.148 51.975 1.173 1
1 7 . 3 1 1 A 13 13 ASN CB C 13 39.378 42.076 -2.698 1
1 9 . 3 1 1 A 14 14 LEU H H 14 8.418 8.960 -0.542 1
1 10 . 3 1 1 A 14 14 LEU HA H 14 4.654 4.740 -0.086 1
1 20 . 3 1 1 A 14 14 LEU CA C 14 52.999 52.233 0.766 1
1 21 . 3 1 1 A 14 14 LEU CB C 14 41.919 42.267 -0.348 1
1 25 . 3 1 1 A 14 14 LEU N N 14 122.671 122.277 0.394 1
1 26 . 3 1 1 A 15 15 PRO HA H 15 4.460 4.622 -0.162 1
1 33 . 3 1 1 A 15 15 PRO C C 15 178.156 177.596 0.560 1
1 34 . 3 1 1 A 15 15 PRO CA C 15 63.101 62.645 0.456 1
1 35 . 3 1 1 A 15 15 PRO CB C 15 32.304 32.137 0.167 1
1 38 . 3 1 1 A 16 16 ALA H H 16 8.973 8.626 0.347 1
1 39 . 3 1 1 A 16 16 ALA HA H 16 4.021 3.953 0.068 1
1 43 . 3 1 1 A 16 16 ALA C C 16 180.695 179.619 1.076 1
1 44 . 3 1 1 A 16 16 ALA CA C 16 55.642 55.619 0.023 1
1 45 . 3 1 1 A 16 16 ALA CB C 16 18.552 18.627 -0.075 1
1 46 . 3 1 1 A 16 16 ALA N N 16 128.311 127.131 1.180 1
1 47 . 3 1 1 A 17 17 GLU H H 17 9.558 8.434 1.124 1
1 48 . 3 1 1 A 17 17 GLU HA H 17 4.065 4.013 0.052 1
1 53 . 3 1 1 A 17 17 GLU C C 17 178.886 178.393 0.493 1
1 54 . 3 1 1 A 17 17 GLU CA C 17 59.400 59.833 -0.433 1
1 55 . 3 1 1 A 17 17 GLU CB C 17 28.742 29.455 -0.713 1
1 57 . 3 1 1 A 17 17 GLU N N 17 117.113 118.778 -1.665 1
1 58 . 3 1 1 A 18 18 SER H H 18 7.263 8.244 -0.981 1
1 59 . 3 1 1 A 18 18 SER HA H 18 4.180 4.106 0.074 1
1 62 . 3 1 1 A 18 18 SER C C 18 174.951 177.098 -2.147 1
1 63 . 3 1 1 A 18 18 SER CA C 18 61.969 61.342 0.627 1
1 64 . 3 1 1 A 18 18 SER CB C 18 62.554 62.358 0.196 1
1 65 . 3 1 1 A 18 18 SER N N 18 114.932 115.799 -0.867 1
1 66 . 3 1 1 A 19 19 VAL H H 19 7.620 7.985 -0.365 1
1 67 . 3 1 1 A 19 19 VAL HA H 19 3.011 3.161 -0.150 1
1 75 . 3 1 1 A 19 19 VAL C C 19 176.953 177.719 -0.766 1
1 76 . 3 1 1 A 19 19 VAL CA C 19 66.479 66.744 -0.265 1
1 77 . 3 1 1 A 19 19 VAL CB C 19 31.569 31.482 0.087 1
1 80 . 3 1 1 A 19 19 VAL N N 19 121.086 122.137 -1.051 1
1 81 . 3 1 1 A 20 20 LYS H H 20 7.745 8.317 -0.572 1
1 82 . 3 1 1 A 20 20 LYS HA H 20 3.884 3.998 -0.114 1
1 91 . 3 1 1 A 20 20 LYS C C 20 178.150 178.806 -0.656 1
1 92 . 3 1 1 A 20 20 LYS CA C 20 59.984 59.896 0.088 1
1 93 . 3 1 1 A 20 20 LYS CB C 20 32.351 32.174 0.177 1
1 97 . 3 1 1 A 20 20 LYS N N 20 119.366 119.652 -0.286 1
1 98 . 3 1 1 A 21 21 ILE H H 21 6.943 7.843 -0.900 1
1 99 . 3 1 1 A 21 21 ILE HA H 21 3.783 3.658 0.125 1
1 109 . 3 1 1 A 21 21 ILE C C 21 178.996 178.628 0.368 1
1 110 . 3 1 1 A 21 21 ILE CA C 21 64.642 65.797 -1.155 1
1 111 . 3 1 1 A 21 21 ILE CB C 21 38.014 37.723 0.291 1
1 115 . 3 1 1 A 21 21 ILE N N 21 118.163 119.823 -1.660 1
1 116 . 3 1 1 A 22 22 LEU H H 22 7.267 8.005 -0.738 1
1 117 . 3 1 1 A 22 22 LEU HA H 22 3.748 3.876 -0.128 1
1 127 . 3 1 1 A 22 22 LEU C C 22 178.289 178.683 -0.394 1
1 128 . 3 1 1 A 22 22 LEU CA C 22 58.092 58.158 -0.066 1
1 129 . 3 1 1 A 22 22 LEU CB C 22 38.551 40.780 -2.229 1
1 133 . 3 1 1 A 22 22 LEU N N 22 120.609 119.061 1.548 1
1 134 . 3 1 1 A 23 23 ARG H H 23 8.676 8.780 -0.104 1
1 135 . 3 1 1 A 23 23 ARG HA H 23 4.030 4.202 -0.172 1
1 142 . 3 1 1 A 23 23 ARG C C 23 178.861 178.318 0.543 1
1 143 . 3 1 1 A 23 23 ARG CA C 23 60.404 60.086 0.318 1
1 144 . 3 1 1 A 23 23 ARG CB C 23 30.351 30.154 0.197 1
1 147 . 3 1 1 A 23 23 ARG N N 23 119.148 117.721 1.427 1
1 148 . 3 1 1 A 24 24 ASP H H 24 8.515 8.265 0.250 1
1 149 . 3 1 1 A 24 24 ASP HA H 24 4.519 4.387 0.132 1
1 152 . 3 1 1 A 24 24 ASP C C 24 178.759 178.568 0.191 1
1 153 . 3 1 1 A 24 24 ASP CA C 24 57.556 57.163 0.393 1
1 154 . 3 1 1 A 24 24 ASP CB C 24 40.569 40.890 -0.321 1
1 155 . 3 1 1 A 24 24 ASP N N 24 120.027 119.501 0.526 1
1 156 . 3 1 1 A 25 25 TRP H H 25 8.158 8.136 0.022 1
1 157 . 3 1 1 A 25 25 TRP HA H 25 4.181 4.483 -0.302 1
1 166 . 3 1 1 A 25 25 TRP C C 25 179.946 178.508 1.438 1
1 167 . 3 1 1 A 25 25 TRP CA C 25 63.346 61.335 2.011 1
1 168 . 3 1 1 A 25 25 TRP CB C 25 29.433 29.581 -0.148 1
1 174 . 3 1 1 A 25 25 TRP N N 25 121.350 121.634 -0.284 1
1 176 . 3 1 1 A 26 26 MET H H 26 8.977 8.689 0.288 1
1 177 . 3 1 1 A 26 26 MET HA H 26 4.076 4.560 -0.484 1
1 185 . 3 1 1 A 26 26 MET C C 26 177.371 178.170 -0.799 1
1 186 . 3 1 1 A 26 26 MET CA C 26 60.454 58.852 1.602 1
1 187 . 3 1 1 A 26 26 MET CB C 26 33.567 32.575 0.992 1
1 190 . 3 1 1 A 26 26 MET N N 26 119.977 118.807 1.170 1
1 191 . 3 1 1 A 27 27 TYR H H 27 8.604 8.446 0.158 1
1 192 . 3 1 1 A 27 27 TYR HA H 27 4.138 4.250 -0.112 1
1 199 . 3 1 1 A 27 27 TYR C C 27 178.901 177.864 1.037 1
1 200 . 3 1 1 A 27 27 TYR CA C 27 61.846 61.260 0.586 1
1 201 . 3 1 1 A 27 27 TYR CB C 27 38.165 38.747 -0.582 1
1 206 . 3 1 1 A 27 27 TYR N N 27 117.797 121.800 -4.003 1
1 207 . 3 1 1 A 28 28 LYS H H 28 7.867 7.715 0.152 1
1 208 . 3 1 1 A 28 28 LYS HA H 28 3.797 3.789 0.008 1
1 217 . 3 1 1 A 28 28 LYS C C 28 176.858 177.880 -1.022 1
1 218 . 3 1 1 A 28 28 LYS CA C 28 58.174 59.139 -0.965 1
1 219 . 3 1 1 A 28 28 LYS CB C 28 32.516 31.782 0.734 1
1 223 . 3 1 1 A 28 28 LYS N N 28 118.982 117.735 1.247 1
1 224 . 3 1 1 A 29 29 HIS H H 29 7.443 7.121 0.322 1
1 225 . 3 1 1 A 29 29 HIS HA H 29 4.386 4.375 0.011 1
1 230 . 3 1 1 A 29 29 HIS C C 29 176.085 175.973 0.112 1
1 231 . 3 1 1 A 29 29 HIS CA C 29 55.213 55.891 -0.678 1
1 232 . 3 1 1 A 29 29 HIS CB C 29 27.085 28.692 -1.607 1
1 235 . 3 1 1 A 29 29 HIS N N 29 117.138 115.888 1.250 1
1 236 . 3 1 1 A 30 30 ARG H H 30 6.921 8.213 -1.292 1
1 237 . 3 1 1 A 30 30 ARG HA H 30 3.898 4.363 -0.465 1
1 244 . 3 1 1 A 30 30 ARG C C 30 175.808 178.039 -2.231 1
1 245 . 3 1 1 A 30 30 ARG CA C 30 58.609 58.642 -0.033 1
1 246 . 3 1 1 A 30 30 ARG CB C 30 28.739 29.910 -1.171 1
1 249 . 3 1 1 A 30 30 ARG N N 30 117.911 119.351 -1.440 1
1 250 . 3 1 1 A 31 31 PHE H H 31 7.819 8.265 -0.446 1
1 251 . 3 1 1 A 31 31 PHE HA H 31 4.533 4.263 0.270 1
1 259 . 3 1 1 A 31 31 PHE C C 31 175.577 177.140 -1.563 1
1 260 . 3 1 1 A 31 31 PHE CA C 31 58.029 60.835 -2.806 1
1 261 . 3 1 1 A 31 31 PHE CB C 31 37.792 38.813 -1.021 1
1 267 . 3 1 1 A 31 31 PHE N N 31 115.408 118.961 -3.553 1
1 268 . 3 1 1 A 32 32 LYS H H 32 7.858 8.208 -0.350 1
1 269 . 3 1 1 A 32 32 LYS HA H 32 4.487 4.405 0.082 1
1 277 . 3 1 1 A 32 32 LYS C C 32 175.557 176.534 -0.977 1
1 278 . 3 1 1 A 32 32 LYS CA C 32 56.329 57.765 -1.436 1
1 279 . 3 1 1 A 32 32 LYS CB C 32 32.743 34.350 -1.607 1
1 283 . 3 1 1 A 32 32 LYS N N 32 122.453 114.307 8.146 1
1 284 . 3 1 1 A 33 33 ALA H H 33 8.643 8.245 0.398 1
1 285 . 3 1 1 A 33 33 ALA HA H 33 4.403 4.072 0.331 1
1 289 . 3 1 1 A 33 33 ALA C C 33 176.273 175.267 1.006 1
1 290 . 3 1 1 A 33 33 ALA CA C 33 53.579 53.198 0.381 1
1 291 . 3 1 1 A 33 33 ALA CB C 33 18.653 17.180 1.473 1
1 292 . 3 1 1 A 33 33 ALA N N 33 127.853 120.365 7.488 1
1 293 . 3 1 1 A 34 34 TYR H H 34 7.878 8.007 -0.129 1
1 294 . 3 1 1 A 34 34 TYR HA H 34 4.686 4.872 -0.186 1
1 301 . 3 1 1 A 34 34 TYR C C 34 173.133 173.229 -0.096 1
1 302 . 3 1 1 A 34 34 TYR CA C 34 54.778 54.901 -0.123 1
1 303 . 3 1 1 A 34 34 TYR CB C 34 39.619 40.577 -0.958 1
1 308 . 3 1 1 A 34 34 TYR N N 34 116.539 116.786 -0.247 1
1 309 . 3 1 1 A 35 35 PRO HA H 35 4.526 4.650 -0.124 1
1 316 . 3 1 1 A 35 35 PRO C C 35 176.837 175.417 1.420 1
1 317 . 3 1 1 A 35 35 PRO CA C 35 61.864 62.133 -0.269 1
1 318 . 3 1 1 A 35 35 PRO CB C 35 30.904 32.372 -1.468 1
1 321 . 3 1 1 A 36 36 SER H H 36 9.634 8.417 1.217 1
1 322 . 3 1 1 A 36 36 SER HA H 36 4.518 4.768 -0.250 1
1 325 . 3 1 1 A 36 36 SER C C 36 175.001 174.984 0.017 1
1 326 . 3 1 1 A 36 36 SER CA C 36 57.129 56.588 0.541 1
1 327 . 3 1 1 A 36 36 SER CB C 36 65.374 65.504 -0.130 1
1 328 . 3 1 1 A 36 36 SER N N 36 119.984 116.683 3.301 1
1 329 . 3 1 1 A 37 37 GLU H H 37 9.091 9.073 0.018 1
1 330 . 3 1 1 A 37 37 GLU HA H 37 3.884 3.912 -0.028 1
1 335 . 3 1 1 A 37 37 GLU C C 37 179.347 178.162 1.185 1
1 336 . 3 1 1 A 37 37 GLU CA C 37 60.454 59.678 0.776 1
1 337 . 3 1 1 A 37 37 GLU CB C 37 28.623 29.461 -0.838 1
1 339 . 3 1 1 A 37 37 GLU N N 37 120.748 126.498 -5.750 1
1 340 . 3 1 1 A 38 38 GLU H H 38 8.760 7.865 0.895 1
1 341 . 3 1 1 A 38 38 GLU HA H 38 4.048 4.078 -0.030 1
1 346 . 3 1 1 A 38 38 GLU C C 38 179.975 179.193 0.782 1
1 347 . 3 1 1 A 38 38 GLU CA C 38 60.243 59.226 1.017 1
1 348 . 3 1 1 A 38 38 GLU CB C 38 29.117 29.879 -0.762 1
1 350 . 3 1 1 A 38 38 GLU N N 38 119.272 119.641 -0.369 1
1 351 . 3 1 1 A 39 39 GLU H H 39 7.856 8.019 -0.163 1
1 352 . 3 1 1 A 39 39 GLU HA H 39 3.976 3.898 0.078 1
1 357 . 3 1 1 A 39 39 GLU C C 39 178.912 178.790 0.122 1
1 358 . 3 1 1 A 39 39 GLU CA C 39 59.131 59.189 -0.058 1
1 359 . 3 1 1 A 39 39 GLU CB C 39 29.612 28.768 0.844 1
1 361 . 3 1 1 A 39 39 GLU N N 39 121.658 120.719 0.939 1
1 362 . 3 1 1 A 40 40 LYS H H 40 8.653 7.797 0.856 1
1 363 . 3 1 1 A 40 40 LYS HA H 40 3.508 3.845 -0.337 1
1 372 . 3 1 1 A 40 40 LYS C C 40 177.974 178.937 -0.963 1
1 373 . 3 1 1 A 40 40 LYS CA C 40 60.948 59.568 1.380 1
1 374 . 3 1 1 A 40 40 LYS CB C 40 32.714 32.138 0.576 1
1 378 . 3 1 1 A 40 40 LYS N N 40 119.152 119.678 -0.526 1
1 379 . 3 1 1 A 41 41 GLN H H 41 7.876 7.577 0.299 1
1 380 . 3 1 1 A 41 41 GLN HA H 41 3.911 3.951 -0.040 1
1 387 . 3 1 1 A 41 41 GLN C C 41 178.352 177.994 0.358 1
1 388 . 3 1 1 A 41 41 GLN CA C 41 58.973 58.865 0.108 1
1 389 . 3 1 1 A 41 41 GLN CB C 41 27.552 28.792 -1.240 1
1 391 . 3 1 1 A 41 41 GLN N N 41 118.910 119.503 -0.593 1
1 393 . 3 1 1 A 42 42 MET H H 42 7.771 7.836 -0.065 1
1 394 . 3 1 1 A 42 42 MET HA H 42 4.158 4.230 -0.072 1
1 402 . 3 1 1 A 42 42 MET C C 42 179.310 178.186 1.124 1
1 403 . 3 1 1 A 42 42 MET CA C 42 59.079 58.187 0.892 1
1 404 . 3 1 1 A 42 42 MET CB C 42 31.023 32.351 -1.328 1
1 407 . 3 1 1 A 42 42 MET N N 42 121.131 119.302 1.829 1
1 408 . 3 1 1 A 43 43 LEU H H 43 8.400 8.544 -0.144 1
1 409 . 3 1 1 A 43 43 LEU HA H 43 3.888 3.915 -0.027 1
1 419 . 3 1 1 A 43 43 LEU C C 43 180.721 179.019 1.702 1
1 420 . 3 1 1 A 43 43 LEU CA C 43 57.916 58.071 -0.155 1
1 421 . 3 1 1 A 43 43 LEU CB C 43 42.080 41.169 0.911 1
1 425 . 3 1 1 A 43 43 LEU N N 43 120.124 120.867 -0.743 1
1 426 . 3 1 1 A 44 44 SER H H 44 8.658 8.515 0.143 1
1 427 . 3 1 1 A 44 44 SER HA H 44 4.088 4.103 -0.015 1
1 430 . 3 1 1 A 44 44 SER C C 44 176.859 176.633 0.226 1
1 431 . 3 1 1 A 44 44 SER CA C 44 61.371 61.052 0.319 1
1 432 . 3 1 1 A 44 44 SER CB C 44 63.314 63.135 0.179 1
1 433 . 3 1 1 A 44 44 SER N N 44 119.795 113.651 6.144 1
1 434 . 3 1 1 A 45 45 GLU H H 45 7.905 7.744 0.161 1
1 435 . 3 1 1 A 45 45 GLU HA H 45 4.094 4.223 -0.129 1
1 440 . 3 1 1 A 45 45 GLU C C 45 179.095 179.027 0.068 1
1 441 . 3 1 1 A 45 45 GLU CA C 45 59.255 59.014 0.241 1
1 442 . 3 1 1 A 45 45 GLU CB C 45 29.200 29.660 -0.460 1
1 444 . 3 1 1 A 45 45 GLU N N 45 120.609 120.965 -0.356 1
1 445 . 3 1 1 A 46 46 LYS H H 46 7.837 8.075 -0.238 1
1 446 . 3 1 1 A 46 46 LYS HA H 46 4.231 4.153 0.078 1
1 453 . 3 1 1 A 46 46 LYS C C 46 177.964 178.684 -0.720 1
1 454 . 3 1 1 A 46 46 LYS CA C 46 58.278 58.851 -0.573 1
1 455 . 3 1 1 A 46 46 LYS CB C 46 34.110 32.697 1.413 1
1 459 . 3 1 1 A 46 46 LYS N N 46 115.471 119.355 -3.884 1
1 460 . 3 1 1 A 47 47 THR H H 47 7.763 8.250 -0.487 1
1 461 . 3 1 1 A 47 47 THR HA H 47 4.271 4.249 0.022 1
1 466 . 3 1 1 A 47 47 THR C C 47 175.472 174.993 0.479 1
1 467 . 3 1 1 A 47 47 THR CA C 47 62.429 62.187 0.242 1
1 468 . 3 1 1 A 47 47 THR CB C 47 71.966 70.062 1.904 1
1 470 . 3 1 1 A 47 47 THR N N 47 104.286 108.337 -4.051 1
1 471 . 3 1 1 A 48 48 ASN H H 48 8.169 8.160 0.009 1
1 472 . 3 1 1 A 48 48 ASN HA H 48 4.437 4.570 -0.133 1
1 477 . 3 1 1 A 48 48 ASN C C 48 173.874 173.913 -0.039 1
1 478 . 3 1 1 A 48 48 ASN CA C 48 55.377 54.340 1.037 1
1 479 . 3 1 1 A 48 48 ASN CB C 48 37.770 37.574 0.196 1
1 480 . 3 1 1 A 48 48 ASN N N 48 117.458 119.543 -2.085 1
1 482 . 3 1 1 A 49 49 LEU H H 49 7.532 7.153 0.379 1
1 483 . 3 1 1 A 49 49 LEU HA H 49 4.733 4.740 -0.007 1
1 493 . 3 1 1 A 49 49 LEU C C 49 176.625 175.801 0.824 1
1 494 . 3 1 1 A 49 49 LEU CA C 49 53.226 53.408 -0.182 1
1 495 . 3 1 1 A 49 49 LEU CB C 49 44.114 43.381 0.733 1
1 499 . 3 1 1 A 49 49 LEU N N 49 118.220 120.214 -1.994 1
1 500 . 3 1 1 A 50 50 SER H H 50 9.140 8.717 0.423 1
1 501 . 3 1 1 A 50 50 SER HA H 50 4.475 4.981 -0.506 1
1 504 . 3 1 1 A 50 50 SER C C 50 174.907 174.837 0.070 1
1 505 . 3 1 1 A 50 50 SER CA C 50 56.964 57.577 -0.613 1
1 506 . 3 1 1 A 50 50 SER CB C 50 65.372 65.013 0.359 1
1 507 . 3 1 1 A 50 50 SER N N 50 117.569 117.284 0.285 1
1 508 . 3 1 1 A 51 51 LEU H H 51 8.756 8.773 -0.017 1
1 509 . 3 1 1 A 51 51 LEU HA H 51 3.874 3.931 -0.057 1
1 519 . 3 1 1 A 51 51 LEU C C 51 179.910 178.887 1.023 1
1 520 . 3 1 1 A 51 51 LEU CA C 51 58.916 58.203 0.713 1
1 521 . 3 1 1 A 51 51 LEU CB C 51 41.148 41.395 -0.247 1
1 525 . 3 1 1 A 51 51 LEU N N 51 120.905 125.683 -4.778 1
1 526 . 3 1 1 A 52 52 LEU H H 52 8.146 8.242 -0.096 1
1 527 . 3 1 1 A 52 52 LEU HA H 52 4.179 4.005 0.174 1
1 537 . 3 1 1 A 52 52 LEU C C 52 178.936 178.612 0.324 1
1 538 . 3 1 1 A 52 52 LEU CA C 52 58.162 58.350 -0.188 1
1 539 . 3 1 1 A 52 52 LEU CB C 52 42.137 41.343 0.794 1
1 543 . 3 1 1 A 52 52 LEU N N 52 120.685 120.105 0.580 1
1 544 . 3 1 1 A 53 53 GLN H H 53 7.924 8.203 -0.279 1
1 545 . 3 1 1 A 53 53 GLN HA H 53 4.102 4.228 -0.126 1
1 552 . 3 1 1 A 53 53 GLN C C 53 180.308 178.703 1.605 1
1 553 . 3 1 1 A 53 53 GLN CA C 53 59.326 58.660 0.666 1
1 554 . 3 1 1 A 53 53 GLN CB C 53 29.900 28.327 1.573 1
1 556 . 3 1 1 A 53 53 GLN N N 53 118.473 117.654 0.819 1
1 558 . 3 1 1 A 54 54 ILE H H 54 8.380 8.158 0.222 1
1 559 . 3 1 1 A 54 54 ILE HA H 54 3.677 3.678 -0.001 1
1 569 . 3 1 1 A 54 54 ILE C C 54 177.673 178.052 -0.379 1
1 570 . 3 1 1 A 54 54 ILE CA C 54 64.650 65.485 -0.835 1
1 571 . 3 1 1 A 54 54 ILE CB C 54 37.476 37.747 -0.271 1
1 575 . 3 1 1 A 54 54 ILE N N 54 120.113 121.585 -1.472 1
1 576 . 3 1 1 A 55 55 SER H H 55 8.854 8.179 0.675 1
1 577 . 3 1 1 A 55 55 SER HA H 55 4.267 4.318 -0.051 1
1 580 . 3 1 1 A 55 55 SER C C 55 177.127 177.623 -0.496 1
1 581 . 3 1 1 A 55 55 SER CA C 55 62.852 61.842 1.010 1
1 582 . 3 1 1 A 55 55 SER CB C 55 62.727 63.081 -0.354 1
1 583 . 3 1 1 A 55 55 SER N N 55 116.646 115.892 0.754 1
1 584 . 3 1 1 A 56 56 ASN H H 56 8.634 8.127 0.507 1
1 585 . 3 1 1 A 56 56 ASN HA H 56 4.549 4.463 0.086 1
1 590 . 3 1 1 A 56 56 ASN C C 56 177.481 178.326 -0.845 1
1 591 . 3 1 1 A 56 56 ASN CA C 56 55.951 56.588 -0.637 1
1 592 . 3 1 1 A 56 56 ASN CB C 56 37.852 38.172 -0.320 1
1 593 . 3 1 1 A 56 56 ASN N N 56 119.048 119.417 -0.369 1
1 595 . 3 1 1 A 57 57 TRP H H 57 8.373 8.065 0.308 1
1 596 . 3 1 1 A 57 57 TRP HA H 57 4.065 4.416 -0.351 1
1 605 . 3 1 1 A 57 57 TRP C C 57 179.392 178.148 1.244 1
1 606 . 3 1 1 A 57 57 TRP CA C 57 63.204 61.116 2.088 1
1 607 . 3 1 1 A 57 57 TRP CB C 57 28.376 29.592 -1.216 1
1 613 . 3 1 1 A 57 57 TRP N N 57 122.950 123.115 -0.165 1
1 615 . 3 1 1 A 58 58 PHE H H 58 8.428 8.301 0.127 1
1 616 . 3 1 1 A 58 58 PHE HA H 58 3.922 3.753 0.169 1
1 624 . 3 1 1 A 58 58 PHE C C 58 178.237 177.847 0.390 1
1 625 . 3 1 1 A 58 58 PHE CA C 58 64.015 61.504 2.511 1
1 626 . 3 1 1 A 58 58 PHE CB C 58 39.602 38.245 1.357 1
1 632 . 3 1 1 A 58 58 PHE N N 58 116.774 117.556 -0.782 1
1 633 . 3 1 1 A 59 59 ILE H H 59 7.925 8.042 -0.117 1
1 634 . 3 1 1 A 59 59 ILE HA H 59 3.773 3.672 0.101 1
1 644 . 3 1 1 A 59 59 ILE C C 59 178.745 177.865 0.880 1
1 645 . 3 1 1 A 59 59 ILE CA C 59 65.531 65.272 0.259 1
1 646 . 3 1 1 A 59 59 ILE CB C 59 38.480 37.709 0.771 1
1 650 . 3 1 1 A 59 59 ILE N N 59 119.560 120.204 -0.644 1
1 651 . 3 1 1 A 60 60 ASN H H 60 7.506 7.827 -0.321 1
1 652 . 3 1 1 A 60 60 ASN HA H 60 4.407 4.405 0.002 1
1 657 . 3 1 1 A 60 60 ASN C C 60 177.163 177.143 0.020 1
1 658 . 3 1 1 A 60 60 ASN CA C 60 55.871 55.485 0.386 1
1 659 . 3 1 1 A 60 60 ASN CB C 60 38.878 38.243 0.635 1
1 660 . 3 1 1 A 60 60 ASN N N 60 116.868 117.774 -0.906 1
1 662 . 3 1 1 A 61 61 ALA H H 61 8.410 7.930 0.480 1
1 663 . 3 1 1 A 61 61 ALA HA H 61 3.667 3.731 -0.064 1
1 667 . 3 1 1 A 61 61 ALA C C 61 180.061 179.849 0.212 1
1 668 . 3 1 1 A 61 61 ALA CA C 61 54.601 54.075 0.526 1
1 669 . 3 1 1 A 61 61 ALA CB C 61 18.241 17.028 1.213 1
1 670 . 3 1 1 A 61 61 ALA N N 61 123.022 121.467 1.555 1
1 671 . 3 1 1 A 62 62 ARG H H 62 8.036 8.082 -0.046 1
1 672 . 3 1 1 A 62 62 ARG HA H 62 4.092 3.993 0.099 1
1 679 . 3 1 1 A 62 62 ARG C C 62 176.756 177.387 -0.631 1
1 680 . 3 1 1 A 62 62 ARG CA C 62 58.762 58.380 0.382 1
1 681 . 3 1 1 A 62 62 ARG CB C 62 30.601 29.895 0.706 1
1 684 . 3 1 1 A 62 62 ARG N N 62 117.168 118.809 -1.641 1
1 685 . 3 1 1 A 63 63 ARG H H 63 7.214 7.852 -0.638 1
1 686 . 3 1 1 A 63 63 ARG HA H 63 4.249 4.320 -0.071 1
1 693 . 3 1 1 A 63 63 ARG C C 63 176.945 176.912 0.033 1
1 694 . 3 1 1 A 63 63 ARG CA C 63 57.669 57.118 0.551 1
1 695 . 3 1 1 A 63 63 ARG CB C 63 30.765 30.866 -0.101 1
1 698 . 3 1 1 A 63 63 ARG N N 63 116.514 116.626 -0.112 1
1 699 . 3 1 1 A 64 64 ARG H H 64 7.913 8.031 -0.118 1
1 700 . 3 1 1 A 64 64 ARG HA H 64 4.351 4.594 -0.243 1
1 707 . 3 1 1 A 64 64 ARG C C 64 176.413 178.244 -1.831 1
1 708 . 3 1 1 A 64 64 ARG CA C 64 57.105 57.194 -0.089 1
1 709 . 3 1 1 A 64 64 ARG CB C 64 31.672 32.956 -1.284 1
1 712 . 3 1 1 A 64 64 ARG N N 64 116.818 118.465 -1.647 1
1 713 . 3 1 1 A 65 65 ILE H H 65 8.169 8.368 -0.199 1
1 714 . 3 1 1 A 65 65 ILE HA H 65 4.285 3.685 0.600 1
1 724 . 3 1 1 A 65 65 ILE C C 65 176.208 177.946 -1.738 1
1 725 . 3 1 1 A 65 65 ILE CA C 65 62.005 65.130 -3.125 1
1 726 . 3 1 1 A 65 65 ILE CB C 65 39.088 37.612 1.476 1
1 730 . 3 1 1 A 65 65 ILE N N 65 119.185 119.709 -0.524 1
1 731 . 3 1 1 A 66 66 LEU H H 66 7.962 7.806 0.156 1
1 732 . 3 1 1 A 66 66 LEU HA H 66 4.485 4.075 0.410 1
1 742 . 3 1 1 A 66 66 LEU C C 66 176.216 175.152 1.064 1
1 743 . 3 1 1 A 66 66 LEU CA C 66 56.153 59.867 -3.714 1
1 744 . 3 1 1 A 66 66 LEU CB C 66 40.792 40.080 0.712 1
1 748 . 3 1 1 A 66 66 LEU N N 66 124.389 121.605 2.784 1
1 749 . 3 1 1 A 67 67 PRO HA H 67 4.283 4.373 -0.090 1
1 756 . 3 1 1 A 67 67 PRO C C 67 178.294 177.967 0.327 1
1 757 . 3 1 1 A 67 67 PRO CA C 67 65.390 65.322 0.068 1
1 758 . 3 1 1 A 67 67 PRO CB C 67 31.095 31.219 -0.124 1
1 761 . 3 1 1 A 68 68 ASP H H 68 7.913 8.878 -0.965 1
1 762 . 3 1 1 A 68 68 ASP HA H 68 4.507 4.463 0.044 1
1 765 . 3 1 1 A 68 68 ASP C C 68 177.927 178.448 -0.521 1
1 766 . 3 1 1 A 68 68 ASP CA C 68 55.906 56.380 -0.474 1
1 767 . 3 1 1 A 68 68 ASP CB C 68 40.736 40.866 -0.130 1
1 768 . 3 1 1 A 68 68 ASP N N 68 117.231 117.195 0.036 1
1 769 . 3 1 1 A 69 69 MET H H 69 8.083 8.695 -0.612 1
1 770 . 3 1 1 A 69 69 MET HA H 69 4.362 4.222 0.140 1
1 778 . 3 1 1 A 69 69 MET C C 69 177.374 179.096 -1.722 1
1 779 . 3 1 1 A 69 69 MET CA C 69 57.634 58.716 -1.082 1
1 780 . 3 1 1 A 69 69 MET CB C 69 32.816 32.559 0.257 1
1 783 . 3 1 1 A 69 69 MET N N 69 119.391 118.664 0.727 1
1 784 . 3 1 1 A 70 70 LEU H H 70 7.907 7.547 0.360 1
1 785 . 3 1 1 A 70 70 LEU HA H 70 4.232 4.045 0.187 1
1 795 . 3 1 1 A 70 70 LEU C C 70 177.745 176.618 1.127 1
1 796 . 3 1 1 A 70 70 LEU CA C 70 55.835 57.730 -1.895 1
1 797 . 3 1 1 A 70 70 LEU CB C 70 42.174 41.922 0.252 1
1 801 . 3 1 1 A 70 70 LEU N N 70 119.266 121.626 -2.360 1
1 802 . 3 1 1 A 71 71 GLN H H 71 7.865 7.791 0.074 1
1 803 . 3 1 1 A 71 71 GLN HA H 71 4.287 3.889 0.398 1
1 809 . 3 1 1 A 71 71 GLN C C 71 178.855 174.938 3.917 1
1 810 . 3 1 1 A 71 71 GLN CA C 71 56.383 57.024 -0.641 1
1 811 . 3 1 1 A 71 71 GLN CB C 71 29.092 26.534 2.558 1
1 813 . 3 1 1 A 71 71 GLN N N 71 118.603 115.652 2.951 1
1 815 . 3 1 1 A 72 72 GLN H H 72 8.189 7.838 0.351 1
1 816 . 3 1 1 A 72 72 GLN HA H 72 4.302 4.449 -0.147 1
1 821 . 3 1 1 A 72 72 GLN CA C 72 56.206 55.138 1.068 1
1 822 . 3 1 1 A 72 72 GLN CB C 72 29.298 27.968 1.330 1
1 824 . 3 1 1 A 72 72 GLN N N 72 120.267 118.268 1.999 1
1 825 . 3 1 1 A 73 73 ARG C C 73 176.105 176.299 -0.194 1
1 826 . 3 1 1 A 74 74 ARG HA H 74 4.334 4.255 0.079 1
1 833 . 3 1 1 A 74 74 ARG C C 74 176.188 176.975 -0.787 1
1 834 . 3 1 1 A 74 74 ARG CA C 74 56.300 58.132 -1.832 1
1 835 . 3 1 1 A 74 74 ARG CB C 74 30.668 30.832 -0.164 1
1 838 . 3 1 1 A 75 75 ASN C C 75 174.462 174.952 -0.490 1
1 839 . 3 1 1 A 75 75 ASN CA C 75 53.148 53.927 -0.779 1
1 840 . 3 1 1 A 75 75 ASN CB C 75 39.046 38.492 0.554 1
1 841 . 3 1 1 A 76 76 ASP H H 76 8.257 8.723 -0.466 1
1 842 . 3 1 1 A 76 76 ASP HA H 76 4.877 5.067 -0.190 1
1 845 . 3 1 1 A 76 76 ASP C C 76 174.759 173.952 0.807 1
1 846 . 3 1 1 A 76 76 ASP CA C 76 52.380 50.471 1.909 1
1 847 . 3 1 1 A 76 76 ASP CB C 76 41.267 42.766 -1.499 1
1 848 . 3 1 1 A 76 76 ASP N N 76 122.030 123.995 -1.965 1
1 849 . 3 1 1 A 77 77 PRO HA H 77 4.466 4.733 -0.267 1
1 856 . 3 1 1 A 77 77 PRO C C 77 177.133 176.272 0.861 1
1 857 . 3 1 1 A 77 77 PRO CA C 77 63.733 62.778 0.955 1
1 858 . 3 1 1 A 77 77 PRO CB C 77 31.919 31.849 0.070 1
1 861 . 3 1 1 A 78 78 SER H H 78 8.457 8.489 -0.032 1
1 862 . 3 1 1 A 78 78 SER HA H 78 4.479 4.979 -0.500 1
1 865 . 3 1 1 A 78 78 SER C C 78 174.731 174.641 0.090 1
1 866 . 3 1 1 A 78 78 SER CA C 78 58.691 57.479 1.212 1
1 867 . 3 1 1 A 78 78 SER CB C 78 63.973 64.642 -0.669 1
1 868 . 3 1 1 A 78 78 SER N N 78 115.711 118.001 -2.290 1
1 869 . 3 1 1 A 79 79 GLY H H 79 8.090 8.691 -0.601 1
1 870 . 3 1 1 A 79 79 GLY HA2 H 79 4.179 4.022 0.157 1
1 871 . 3 1 1 A 79 79 GLY HA3 H 79 4.065 4.022 0.043 1
1 872 . 3 1 1 A 79 79 GLY CA C 79 44.746 44.988 -0.242 1
1 873 . 3 1 1 A 79 79 GLY N N 79 110.429 113.407 -2.978 1
1 874 . 3 1 1 A 80 80 PRO HA H 80 4.464 4.764 -0.300 1
1 880 . 3 1 1 A 80 80 PRO C C 80 177.499 176.022 1.477 1
1 881 . 3 1 1 A 80 80 PRO CA C 80 63.275 62.801 0.474 1
1 882 . 3 1 1 A 80 80 PRO CB C 80 32.249 32.307 -0.058 1
1 1 . 4 1 1 A 13 13 ASN HA H 13 4.787 4.770 0.017 1
1 6 . 4 1 1 A 13 13 ASN CA C 13 53.148 53.124 0.024 1
1 7 . 4 1 1 A 13 13 ASN CB C 13 39.378 39.345 0.033 1
1 9 . 4 1 1 A 14 14 LEU H H 14 8.418 8.459 -0.041 1
1 10 . 4 1 1 A 14 14 LEU HA H 14 4.654 4.642 0.012 1
1 20 . 4 1 1 A 14 14 LEU CA C 14 52.999 52.934 0.065 1
1 21 . 4 1 1 A 14 14 LEU CB C 14 41.919 40.818 1.101 1
1 25 . 4 1 1 A 14 14 LEU N N 14 122.671 124.972 -2.301 1
1 26 . 4 1 1 A 15 15 PRO HA H 15 4.460 4.627 -0.167 1
1 33 . 4 1 1 A 15 15 PRO C C 15 178.156 177.579 0.577 1
1 34 . 4 1 1 A 15 15 PRO CA C 15 63.101 62.620 0.481 1
1 35 . 4 1 1 A 15 15 PRO CB C 15 32.304 32.084 0.220 1
1 38 . 4 1 1 A 16 16 ALA H H 16 8.973 8.636 0.337 1
1 39 . 4 1 1 A 16 16 ALA HA H 16 4.021 3.940 0.081 1
1 43 . 4 1 1 A 16 16 ALA C C 16 180.695 179.600 1.095 1
1 44 . 4 1 1 A 16 16 ALA CA C 16 55.642 55.606 0.036 1
1 45 . 4 1 1 A 16 16 ALA CB C 16 18.552 18.643 -0.091 1
1 46 . 4 1 1 A 16 16 ALA N N 16 128.311 127.158 1.153 1
1 47 . 4 1 1 A 17 17 GLU H H 17 9.558 8.435 1.123 1
1 48 . 4 1 1 A 17 17 GLU HA H 17 4.065 4.000 0.065 1
1 53 . 4 1 1 A 17 17 GLU C C 17 178.886 179.127 -0.241 1
1 54 . 4 1 1 A 17 17 GLU CA C 17 59.400 59.913 -0.513 1
1 55 . 4 1 1 A 17 17 GLU CB C 17 28.742 29.513 -0.771 1
1 57 . 4 1 1 A 17 17 GLU N N 17 117.113 118.806 -1.693 1
1 58 . 4 1 1 A 18 18 SER H H 18 7.263 7.891 -0.628 1
1 59 . 4 1 1 A 18 18 SER HA H 18 4.180 4.083 0.097 1
1 62 . 4 1 1 A 18 18 SER C C 18 174.951 175.765 -0.814 1
1 63 . 4 1 1 A 18 18 SER CA C 18 61.969 62.419 -0.450 1
1 64 . 4 1 1 A 18 18 SER CB C 18 62.554 63.044 -0.490 1
1 65 . 4 1 1 A 18 18 SER N N 18 114.932 117.296 -2.364 1
1 66 . 4 1 1 A 19 19 VAL H H 19 7.620 8.265 -0.645 1
1 67 . 4 1 1 A 19 19 VAL HA H 19 3.011 3.078 -0.067 1
1 75 . 4 1 1 A 19 19 VAL C C 19 176.953 177.776 -0.823 1
1 76 . 4 1 1 A 19 19 VAL CA C 19 66.479 66.930 -0.451 1
1 77 . 4 1 1 A 19 19 VAL CB C 19 31.569 31.356 0.213 1
1 80 . 4 1 1 A 19 19 VAL N N 19 121.086 122.057 -0.971 1
1 81 . 4 1 1 A 20 20 LYS H H 20 7.745 8.384 -0.639 1
1 82 . 4 1 1 A 20 20 LYS HA H 20 3.884 4.016 -0.132 1
1 91 . 4 1 1 A 20 20 LYS C C 20 178.150 178.503 -0.353 1
1 92 . 4 1 1 A 20 20 LYS CA C 20 59.984 59.617 0.367 1
1 93 . 4 1 1 A 20 20 LYS CB C 20 32.351 32.211 0.140 1
1 97 . 4 1 1 A 20 20 LYS N N 20 119.366 119.610 -0.244 1
1 98 . 4 1 1 A 21 21 ILE H H 21 6.943 7.713 -0.770 1
1 99 . 4 1 1 A 21 21 ILE HA H 21 3.783 3.697 0.086 1
1 109 . 4 1 1 A 21 21 ILE C C 21 178.996 178.538 0.458 1
1 110 . 4 1 1 A 21 21 ILE CA C 21 64.642 65.427 -0.785 1
1 111 . 4 1 1 A 21 21 ILE CB C 21 38.014 37.953 0.061 1
1 115 . 4 1 1 A 21 21 ILE N N 21 118.163 120.513 -2.350 1
1 116 . 4 1 1 A 22 22 LEU H H 22 7.267 8.254 -0.987 1
1 117 . 4 1 1 A 22 22 LEU HA H 22 3.748 3.968 -0.220 1
1 127 . 4 1 1 A 22 22 LEU C C 22 178.289 178.772 -0.483 1
1 128 . 4 1 1 A 22 22 LEU CA C 22 58.092 57.890 0.202 1
1 129 . 4 1 1 A 22 22 LEU CB C 22 38.551 40.588 -2.037 1
1 133 . 4 1 1 A 22 22 LEU N N 22 120.609 119.194 1.415 1
1 134 . 4 1 1 A 23 23 ARG H H 23 8.676 8.737 -0.061 1
1 135 . 4 1 1 A 23 23 ARG HA H 23 4.030 4.258 -0.228 1
1 142 . 4 1 1 A 23 23 ARG C C 23 178.861 178.431 0.430 1
1 143 . 4 1 1 A 23 23 ARG CA C 23 60.404 60.054 0.350 1
1 144 . 4 1 1 A 23 23 ARG CB C 23 30.351 30.310 0.041 1
1 147 . 4 1 1 A 23 23 ARG N N 23 119.148 118.452 0.696 1
1 148 . 4 1 1 A 24 24 ASP H H 24 8.515 8.188 0.327 1
1 149 . 4 1 1 A 24 24 ASP HA H 24 4.519 4.398 0.121 1
1 152 . 4 1 1 A 24 24 ASP C C 24 178.759 178.498 0.261 1
1 153 . 4 1 1 A 24 24 ASP CA C 24 57.556 57.299 0.257 1
1 154 . 4 1 1 A 24 24 ASP CB C 24 40.569 41.068 -0.499 1
1 155 . 4 1 1 A 24 24 ASP N N 24 120.027 119.351 0.676 1
1 156 . 4 1 1 A 25 25 TRP H H 25 8.158 8.193 -0.035 1
1 157 . 4 1 1 A 25 25 TRP HA H 25 4.181 4.443 -0.262 1
1 166 . 4 1 1 A 25 25 TRP C C 25 179.946 178.488 1.458 1
1 167 . 4 1 1 A 25 25 TRP CA C 25 63.346 61.282 2.064 1
1 168 . 4 1 1 A 25 25 TRP CB C 25 29.433 29.705 -0.272 1
1 174 . 4 1 1 A 25 25 TRP N N 25 121.350 121.542 -0.192 1
1 176 . 4 1 1 A 26 26 MET H H 26 8.977 8.761 0.216 1
1 177 . 4 1 1 A 26 26 MET HA H 26 4.076 4.506 -0.430 1
1 185 . 4 1 1 A 26 26 MET C C 26 177.371 178.054 -0.683 1
1 186 . 4 1 1 A 26 26 MET CA C 26 60.454 59.010 1.444 1
1 187 . 4 1 1 A 26 26 MET CB C 26 33.567 32.486 1.081 1
1 190 . 4 1 1 A 26 26 MET N N 26 119.977 118.773 1.204 1
1 191 . 4 1 1 A 27 27 TYR H H 27 8.604 8.195 0.409 1
1 192 . 4 1 1 A 27 27 TYR HA H 27 4.138 4.077 0.061 1
1 199 . 4 1 1 A 27 27 TYR C C 27 178.901 177.474 1.427 1
1 200 . 4 1 1 A 27 27 TYR CA C 27 61.846 61.459 0.387 1
1 201 . 4 1 1 A 27 27 TYR CB C 27 38.165 38.456 -0.291 1
1 206 . 4 1 1 A 27 27 TYR N N 27 117.797 121.426 -3.629 1
1 207 . 4 1 1 A 28 28 LYS H H 28 7.867 7.849 0.018 1
1 208 . 4 1 1 A 28 28 LYS HA H 28 3.797 3.781 0.016 1
1 217 . 4 1 1 A 28 28 LYS C C 28 176.858 178.130 -1.272 1
1 218 . 4 1 1 A 28 28 LYS CA C 28 58.174 59.440 -1.266 1
1 219 . 4 1 1 A 28 28 LYS CB C 28 32.516 32.231 0.285 1
1 223 . 4 1 1 A 28 28 LYS N N 28 118.982 118.018 0.964 1
1 224 . 4 1 1 A 29 29 HIS H H 29 7.443 7.478 -0.035 1
1 225 . 4 1 1 A 29 29 HIS HA H 29 4.386 4.377 0.009 1
1 230 . 4 1 1 A 29 29 HIS C C 29 176.085 176.034 0.051 1
1 231 . 4 1 1 A 29 29 HIS CA C 29 55.213 56.372 -1.159 1
1 232 . 4 1 1 A 29 29 HIS CB C 29 27.085 28.138 -1.053 1
1 235 . 4 1 1 A 29 29 HIS N N 29 117.138 116.008 1.130 1
1 236 . 4 1 1 A 30 30 ARG H H 30 6.921 8.113 -1.192 1
1 237 . 4 1 1 A 30 30 ARG HA H 30 3.898 4.223 -0.325 1
1 244 . 4 1 1 A 30 30 ARG C C 30 175.808 177.969 -2.161 1
1 245 . 4 1 1 A 30 30 ARG CA C 30 58.609 58.475 0.134 1
1 246 . 4 1 1 A 30 30 ARG CB C 30 28.739 29.502 -0.763 1
1 249 . 4 1 1 A 30 30 ARG N N 30 117.911 119.223 -1.312 1
1 250 . 4 1 1 A 31 31 PHE H H 31 7.819 7.663 0.156 1
1 251 . 4 1 1 A 31 31 PHE HA H 31 4.533 4.273 0.260 1
1 259 . 4 1 1 A 31 31 PHE C C 31 175.577 176.922 -1.345 1
1 260 . 4 1 1 A 31 31 PHE CA C 31 58.029 60.840 -2.811 1
1 261 . 4 1 1 A 31 31 PHE CB C 31 37.792 38.982 -1.190 1
1 267 . 4 1 1 A 31 31 PHE N N 31 115.408 118.736 -3.328 1
1 268 . 4 1 1 A 32 32 LYS H H 32 7.858 7.829 0.029 1
1 269 . 4 1 1 A 32 32 LYS HA H 32 4.487 4.377 0.110 1
1 277 . 4 1 1 A 32 32 LYS C C 32 175.557 175.934 -0.377 1
1 278 . 4 1 1 A 32 32 LYS CA C 32 56.329 56.470 -0.141 1
1 279 . 4 1 1 A 32 32 LYS CB C 32 32.743 33.976 -1.233 1
1 283 . 4 1 1 A 32 32 LYS N N 32 122.453 113.473 8.980 1
1 284 . 4 1 1 A 33 33 ALA H H 33 8.643 8.081 0.562 1
1 285 . 4 1 1 A 33 33 ALA HA H 33 4.403 3.979 0.424 1
1 289 . 4 1 1 A 33 33 ALA C C 33 176.273 175.125 1.148 1
1 290 . 4 1 1 A 33 33 ALA CA C 33 53.579 52.971 0.608 1
1 291 . 4 1 1 A 33 33 ALA CB C 33 18.653 17.055 1.598 1
1 292 . 4 1 1 A 33 33 ALA N N 33 127.853 121.118 6.735 1
1 293 . 4 1 1 A 34 34 TYR H H 34 7.878 7.988 -0.110 1
1 294 . 4 1 1 A 34 34 TYR HA H 34 4.686 4.834 -0.148 1
1 301 . 4 1 1 A 34 34 TYR C C 34 173.133 173.423 -0.290 1
1 302 . 4 1 1 A 34 34 TYR CA C 34 54.778 54.883 -0.105 1
1 303 . 4 1 1 A 34 34 TYR CB C 34 39.619 40.737 -1.118 1
1 308 . 4 1 1 A 34 34 TYR N N 34 116.539 116.520 0.019 1
1 309 . 4 1 1 A 35 35 PRO HA H 35 4.526 4.656 -0.130 1
1 316 . 4 1 1 A 35 35 PRO C C 35 176.837 175.340 1.497 1
1 317 . 4 1 1 A 35 35 PRO CA C 35 61.864 62.147 -0.283 1
1 318 . 4 1 1 A 35 35 PRO CB C 35 30.904 32.340 -1.436 1
1 321 . 4 1 1 A 36 36 SER H H 36 9.634 8.307 1.327 1
1 322 . 4 1 1 A 36 36 SER HA H 36 4.518 4.923 -0.405 1
1 325 . 4 1 1 A 36 36 SER C C 36 175.001 175.317 -0.316 1
1 326 . 4 1 1 A 36 36 SER CA C 36 57.129 57.805 -0.676 1
1 327 . 4 1 1 A 36 36 SER CB C 36 65.374 65.379 -0.005 1
1 328 . 4 1 1 A 36 36 SER N N 36 119.984 116.910 3.074 1
1 329 . 4 1 1 A 37 37 GLU H H 37 9.091 9.124 -0.033 1
1 330 . 4 1 1 A 37 37 GLU HA H 37 3.884 3.923 -0.039 1
1 335 . 4 1 1 A 37 37 GLU C C 37 179.347 178.389 0.958 1
1 336 . 4 1 1 A 37 37 GLU CA C 37 60.454 59.398 1.056 1
1 337 . 4 1 1 A 37 37 GLU CB C 37 28.623 29.220 -0.597 1
1 339 . 4 1 1 A 37 37 GLU N N 37 120.748 124.299 -3.551 1
1 340 . 4 1 1 A 38 38 GLU H H 38 8.760 7.947 0.813 1
1 341 . 4 1 1 A 38 38 GLU HA H 38 4.048 4.112 -0.064 1
1 346 . 4 1 1 A 38 38 GLU C C 38 179.975 179.068 0.907 1
1 347 . 4 1 1 A 38 38 GLU CA C 38 60.243 59.240 1.003 1
1 348 . 4 1 1 A 38 38 GLU CB C 38 29.117 29.825 -0.708 1
1 350 . 4 1 1 A 38 38 GLU N N 38 119.272 120.337 -1.065 1
1 351 . 4 1 1 A 39 39 GLU H H 39 7.856 8.034 -0.178 1
1 352 . 4 1 1 A 39 39 GLU HA H 39 3.976 3.903 0.073 1
1 357 . 4 1 1 A 39 39 GLU C C 39 178.912 178.860 0.052 1
1 358 . 4 1 1 A 39 39 GLU CA C 39 59.131 59.079 0.052 1
1 359 . 4 1 1 A 39 39 GLU CB C 39 29.612 29.071 0.541 1
1 361 . 4 1 1 A 39 39 GLU N N 39 121.658 120.776 0.882 1
1 362 . 4 1 1 A 40 40 LYS H H 40 8.653 7.633 1.020 1
1 363 . 4 1 1 A 40 40 LYS HA H 40 3.508 3.832 -0.324 1
1 372 . 4 1 1 A 40 40 LYS C C 40 177.974 179.218 -1.244 1
1 373 . 4 1 1 A 40 40 LYS CA C 40 60.948 59.469 1.479 1
1 374 . 4 1 1 A 40 40 LYS CB C 40 32.714 32.124 0.590 1
1 378 . 4 1 1 A 40 40 LYS N N 40 119.152 119.779 -0.627 1
1 379 . 4 1 1 A 41 41 GLN H H 41 7.876 7.493 0.383 1
1 380 . 4 1 1 A 41 41 GLN HA H 41 3.911 3.974 -0.063 1
1 387 . 4 1 1 A 41 41 GLN C C 41 178.352 178.179 0.173 1
1 388 . 4 1 1 A 41 41 GLN CA C 41 58.973 59.055 -0.082 1
1 389 . 4 1 1 A 41 41 GLN CB C 41 27.552 28.572 -1.020 1
1 391 . 4 1 1 A 41 41 GLN N N 41 118.910 119.554 -0.644 1
1 393 . 4 1 1 A 42 42 MET H H 42 7.771 7.894 -0.123 1
1 394 . 4 1 1 A 42 42 MET HA H 42 4.158 4.200 -0.042 1
1 402 . 4 1 1 A 42 42 MET C C 42 179.310 178.267 1.043 1
1 403 . 4 1 1 A 42 42 MET CA C 42 59.079 58.385 0.694 1
1 404 . 4 1 1 A 42 42 MET CB C 42 31.023 32.405 -1.382 1
1 407 . 4 1 1 A 42 42 MET N N 42 121.131 119.199 1.932 1
1 408 . 4 1 1 A 43 43 LEU H H 43 8.400 8.627 -0.227 1
1 409 . 4 1 1 A 43 43 LEU HA H 43 3.888 3.939 -0.051 1
1 419 . 4 1 1 A 43 43 LEU C C 43 180.721 178.982 1.739 1
1 420 . 4 1 1 A 43 43 LEU CA C 43 57.916 58.088 -0.172 1
1 421 . 4 1 1 A 43 43 LEU CB C 43 42.080 41.283 0.797 1
1 425 . 4 1 1 A 43 43 LEU N N 43 120.124 120.766 -0.642 1
1 426 . 4 1 1 A 44 44 SER H H 44 8.658 8.508 0.150 1
1 427 . 4 1 1 A 44 44 SER HA H 44 4.088 4.138 -0.050 1
1 430 . 4 1 1 A 44 44 SER C C 44 176.859 176.700 0.159 1
1 431 . 4 1 1 A 44 44 SER CA C 44 61.371 61.058 0.313 1
1 432 . 4 1 1 A 44 44 SER CB C 44 63.314 62.908 0.406 1
1 433 . 4 1 1 A 44 44 SER N N 44 119.795 113.657 6.138 1
1 434 . 4 1 1 A 45 45 GLU H H 45 7.905 7.740 0.165 1
1 435 . 4 1 1 A 45 45 GLU HA H 45 4.094 4.156 -0.062 1
1 440 . 4 1 1 A 45 45 GLU C C 45 179.095 179.114 -0.019 1
1 441 . 4 1 1 A 45 45 GLU CA C 45 59.255 58.954 0.301 1
1 442 . 4 1 1 A 45 45 GLU CB C 45 29.200 29.331 -0.131 1
1 444 . 4 1 1 A 45 45 GLU N N 45 120.609 121.343 -0.734 1
1 445 . 4 1 1 A 46 46 LYS H H 46 7.837 8.114 -0.277 1
1 446 . 4 1 1 A 46 46 LYS HA H 46 4.231 4.149 0.082 1
1 453 . 4 1 1 A 46 46 LYS C C 46 177.964 178.468 -0.504 1
1 454 . 4 1 1 A 46 46 LYS CA C 46 58.278 58.514 -0.236 1
1 455 . 4 1 1 A 46 46 LYS CB C 46 34.110 32.897 1.213 1
1 459 . 4 1 1 A 46 46 LYS N N 46 115.471 118.775 -3.304 1
1 460 . 4 1 1 A 47 47 THR H H 47 7.763 8.060 -0.297 1
1 461 . 4 1 1 A 47 47 THR HA H 47 4.271 4.277 -0.006 1
1 466 . 4 1 1 A 47 47 THR C C 47 175.472 174.850 0.622 1
1 467 . 4 1 1 A 47 47 THR CA C 47 62.429 62.021 0.408 1
1 468 . 4 1 1 A 47 47 THR CB C 47 71.966 70.163 1.803 1
1 470 . 4 1 1 A 47 47 THR N N 47 104.286 108.027 -3.741 1
1 471 . 4 1 1 A 48 48 ASN H H 48 8.169 8.233 -0.064 1
1 472 . 4 1 1 A 48 48 ASN HA H 48 4.437 4.702 -0.265 1
1 477 . 4 1 1 A 48 48 ASN C C 48 173.874 173.935 -0.061 1
1 478 . 4 1 1 A 48 48 ASN CA C 48 55.377 54.377 1.000 1
1 479 . 4 1 1 A 48 48 ASN CB C 48 37.770 36.814 0.956 1
1 480 . 4 1 1 A 48 48 ASN N N 48 117.458 116.216 1.242 1
1 482 . 4 1 1 A 49 49 LEU H H 49 7.532 7.166 0.366 1
1 483 . 4 1 1 A 49 49 LEU HA H 49 4.733 4.652 0.081 1
1 493 . 4 1 1 A 49 49 LEU C C 49 176.625 175.681 0.944 1
1 494 . 4 1 1 A 49 49 LEU CA C 49 53.226 53.610 -0.384 1
1 495 . 4 1 1 A 49 49 LEU CB C 49 44.114 42.910 1.204 1
1 499 . 4 1 1 A 49 49 LEU N N 49 118.220 119.063 -0.843 1
1 500 . 4 1 1 A 50 50 SER H H 50 9.140 8.733 0.407 1
1 501 . 4 1 1 A 50 50 SER HA H 50 4.475 4.804 -0.329 1
1 504 . 4 1 1 A 50 50 SER C C 50 174.907 175.119 -0.212 1
1 505 . 4 1 1 A 50 50 SER CA C 50 56.964 57.872 -0.908 1
1 506 . 4 1 1 A 50 50 SER CB C 50 65.372 64.937 0.435 1
1 507 . 4 1 1 A 50 50 SER N N 50 117.569 117.557 0.012 1
1 508 . 4 1 1 A 51 51 LEU H H 51 8.756 8.744 0.012 1
1 509 . 4 1 1 A 51 51 LEU HA H 51 3.874 3.916 -0.042 1
1 519 . 4 1 1 A 51 51 LEU C C 51 179.910 178.913 0.997 1
1 520 . 4 1 1 A 51 51 LEU CA C 51 58.916 57.977 0.939 1
1 521 . 4 1 1 A 51 51 LEU CB C 51 41.148 41.644 -0.496 1
1 525 . 4 1 1 A 51 51 LEU N N 51 120.905 125.907 -5.002 1
1 526 . 4 1 1 A 52 52 LEU H H 52 8.146 8.195 -0.049 1
1 527 . 4 1 1 A 52 52 LEU HA H 52 4.179 4.082 0.097 1
1 537 . 4 1 1 A 52 52 LEU C C 52 178.936 178.794 0.142 1
1 538 . 4 1 1 A 52 52 LEU CA C 52 58.162 58.249 -0.087 1
1 539 . 4 1 1 A 52 52 LEU CB C 52 42.137 41.653 0.484 1
1 543 . 4 1 1 A 52 52 LEU N N 52 120.685 120.280 0.405 1
1 544 . 4 1 1 A 53 53 GLN H H 53 7.924 8.041 -0.117 1
1 545 . 4 1 1 A 53 53 GLN HA H 53 4.102 4.146 -0.044 1
1 552 . 4 1 1 A 53 53 GLN C C 53 180.308 178.612 1.696 1
1 553 . 4 1 1 A 53 53 GLN CA C 53 59.326 58.607 0.719 1
1 554 . 4 1 1 A 53 53 GLN CB C 53 29.900 28.355 1.545 1
1 556 . 4 1 1 A 53 53 GLN N N 53 118.473 117.492 0.981 1
1 558 . 4 1 1 A 54 54 ILE H H 54 8.380 8.289 0.091 1
1 559 . 4 1 1 A 54 54 ILE HA H 54 3.677 3.702 -0.025 1
1 569 . 4 1 1 A 54 54 ILE C C 54 177.673 178.126 -0.453 1
1 570 . 4 1 1 A 54 54 ILE CA C 54 64.650 65.582 -0.932 1
1 571 . 4 1 1 A 54 54 ILE CB C 54 37.476 37.744 -0.268 1
1 575 . 4 1 1 A 54 54 ILE N N 54 120.113 121.514 -1.401 1
1 576 . 4 1 1 A 55 55 SER H H 55 8.854 7.855 0.999 1
1 577 . 4 1 1 A 55 55 SER HA H 55 4.267 4.333 -0.066 1
1 580 . 4 1 1 A 55 55 SER C C 55 177.127 177.658 -0.531 1
1 581 . 4 1 1 A 55 55 SER CA C 55 62.852 61.797 1.055 1
1 582 . 4 1 1 A 55 55 SER CB C 55 62.727 63.081 -0.354 1
1 583 . 4 1 1 A 55 55 SER N N 55 116.646 115.758 0.888 1
1 584 . 4 1 1 A 56 56 ASN H H 56 8.634 8.278 0.356 1
1 585 . 4 1 1 A 56 56 ASN HA H 56 4.549 4.448 0.101 1
1 590 . 4 1 1 A 56 56 ASN C C 56 177.481 178.282 -0.801 1
1 591 . 4 1 1 A 56 56 ASN CA C 56 55.951 56.560 -0.609 1
1 592 . 4 1 1 A 56 56 ASN CB C 56 37.852 38.234 -0.382 1
1 593 . 4 1 1 A 56 56 ASN N N 56 119.048 119.753 -0.705 1
1 595 . 4 1 1 A 57 57 TRP H H 57 8.373 8.406 -0.033 1
1 596 . 4 1 1 A 57 57 TRP HA H 57 4.065 4.363 -0.298 1
1 605 . 4 1 1 A 57 57 TRP C C 57 179.392 178.601 0.791 1
1 606 . 4 1 1 A 57 57 TRP CA C 57 63.204 61.085 2.119 1
1 607 . 4 1 1 A 57 57 TRP CB C 57 28.376 29.425 -1.049 1
1 613 . 4 1 1 A 57 57 TRP N N 57 122.950 122.950 0.000 1
1 615 . 4 1 1 A 58 58 PHE H H 58 8.428 7.927 0.501 1
1 616 . 4 1 1 A 58 58 PHE HA H 58 3.922 3.897 0.025 1
1 624 . 4 1 1 A 58 58 PHE C C 58 178.237 178.269 -0.032 1
1 625 . 4 1 1 A 58 58 PHE CA C 58 64.015 60.825 3.190 1
1 626 . 4 1 1 A 58 58 PHE CB C 58 39.602 38.123 1.479 1
1 632 . 4 1 1 A 58 58 PHE N N 58 116.774 116.634 0.140 1
1 633 . 4 1 1 A 59 59 ILE H H 59 7.925 8.215 -0.290 1
1 634 . 4 1 1 A 59 59 ILE HA H 59 3.773 3.668 0.105 1
1 644 . 4 1 1 A 59 59 ILE C C 59 178.745 177.673 1.072 1
1 645 . 4 1 1 A 59 59 ILE CA C 59 65.531 65.112 0.419 1
1 646 . 4 1 1 A 59 59 ILE CB C 59 38.480 37.680 0.800 1
1 650 . 4 1 1 A 59 59 ILE N N 59 119.560 120.687 -1.127 1
1 651 . 4 1 1 A 60 60 ASN H H 60 7.506 7.730 -0.224 1
1 652 . 4 1 1 A 60 60 ASN HA H 60 4.407 4.434 -0.027 1
1 657 . 4 1 1 A 60 60 ASN C C 60 177.163 177.772 -0.609 1
1 658 . 4 1 1 A 60 60 ASN CA C 60 55.871 55.891 -0.020 1
1 659 . 4 1 1 A 60 60 ASN CB C 60 38.878 37.923 0.955 1
1 660 . 4 1 1 A 60 60 ASN N N 60 116.868 117.487 -0.619 1
1 662 . 4 1 1 A 61 61 ALA H H 61 8.410 7.939 0.471 1
1 663 . 4 1 1 A 61 61 ALA HA H 61 3.667 3.730 -0.063 1
1 667 . 4 1 1 A 61 61 ALA C C 61 180.061 179.506 0.555 1
1 668 . 4 1 1 A 61 61 ALA CA C 61 54.601 54.715 -0.114 1
1 669 . 4 1 1 A 61 61 ALA CB C 61 18.241 16.804 1.437 1
1 670 . 4 1 1 A 61 61 ALA N N 61 123.022 122.033 0.989 1
1 671 . 4 1 1 A 62 62 ARG H H 62 8.036 7.653 0.383 1
1 672 . 4 1 1 A 62 62 ARG HA H 62 4.092 4.064 0.028 1
1 679 . 4 1 1 A 62 62 ARG C C 62 176.756 177.087 -0.331 1
1 680 . 4 1 1 A 62 62 ARG CA C 62 58.762 58.038 0.724 1
1 681 . 4 1 1 A 62 62 ARG CB C 62 30.601 29.608 0.993 1
1 684 . 4 1 1 A 62 62 ARG N N 62 117.168 117.504 -0.336 1
1 685 . 4 1 1 A 63 63 ARG H H 63 7.214 7.752 -0.538 1
1 686 . 4 1 1 A 63 63 ARG HA H 63 4.249 4.354 -0.105 1
1 693 . 4 1 1 A 63 63 ARG C C 63 176.945 176.571 0.374 1
1 694 . 4 1 1 A 63 63 ARG CA C 63 57.669 57.095 0.574 1
1 695 . 4 1 1 A 63 63 ARG CB C 63 30.765 31.111 -0.346 1
1 698 . 4 1 1 A 63 63 ARG N N 63 116.514 118.244 -1.730 1
1 699 . 4 1 1 A 64 64 ARG H H 64 7.913 7.707 0.206 1
1 700 . 4 1 1 A 64 64 ARG HA H 64 4.351 4.591 -0.240 1
1 707 . 4 1 1 A 64 64 ARG C C 64 176.413 178.354 -1.941 1
1 708 . 4 1 1 A 64 64 ARG CA C 64 57.105 57.184 -0.079 1
1 709 . 4 1 1 A 64 64 ARG CB C 64 31.672 32.876 -1.204 1
1 712 . 4 1 1 A 64 64 ARG N N 64 116.818 118.753 -1.935 1
1 713 . 4 1 1 A 65 65 ILE H H 65 8.169 8.206 -0.037 1
1 714 . 4 1 1 A 65 65 ILE HA H 65 4.285 3.648 0.637 1
1 724 . 4 1 1 A 65 65 ILE C C 65 176.208 177.851 -1.643 1
1 725 . 4 1 1 A 65 65 ILE CA C 65 62.005 65.529 -3.524 1
1 726 . 4 1 1 A 65 65 ILE CB C 65 39.088 37.961 1.127 1
1 730 . 4 1 1 A 65 65 ILE N N 65 119.185 119.953 -0.768 1
1 731 . 4 1 1 A 66 66 LEU H H 66 7.962 8.065 -0.103 1
1 732 . 4 1 1 A 66 66 LEU HA H 66 4.485 3.982 0.503 1
1 742 . 4 1 1 A 66 66 LEU C C 66 176.216 175.226 0.990 1
1 743 . 4 1 1 A 66 66 LEU CA C 66 56.153 59.733 -3.580 1
1 744 . 4 1 1 A 66 66 LEU CB C 66 40.792 39.863 0.929 1
1 748 . 4 1 1 A 66 66 LEU N N 66 124.389 121.550 2.839 1
1 749 . 4 1 1 A 67 67 PRO HA H 67 4.283 4.352 -0.069 1
1 756 . 4 1 1 A 67 67 PRO C C 67 178.294 178.418 -0.124 1
1 757 . 4 1 1 A 67 67 PRO CA C 67 65.390 64.832 0.558 1
1 758 . 4 1 1 A 67 67 PRO CB C 67 31.095 31.340 -0.245 1
1 761 . 4 1 1 A 68 68 ASP H H 68 7.913 8.573 -0.660 1
1 762 . 4 1 1 A 68 68 ASP HA H 68 4.507 4.412 0.095 1
1 765 . 4 1 1 A 68 68 ASP C C 68 177.927 177.834 0.093 1
1 766 . 4 1 1 A 68 68 ASP CA C 68 55.906 56.697 -0.791 1
1 767 . 4 1 1 A 68 68 ASP CB C 68 40.736 41.307 -0.571 1
1 768 . 4 1 1 A 68 68 ASP N N 68 117.231 118.667 -1.436 1
1 769 . 4 1 1 A 69 69 MET H H 69 8.083 8.040 0.043 1
1 770 . 4 1 1 A 69 69 MET HA H 69 4.362 4.350 0.012 1
1 778 . 4 1 1 A 69 69 MET C C 69 177.374 178.310 -0.936 1
1 779 . 4 1 1 A 69 69 MET CA C 69 57.634 58.372 -0.738 1
1 780 . 4 1 1 A 69 69 MET CB C 69 32.816 32.672 0.144 1
1 783 . 4 1 1 A 69 69 MET N N 69 119.391 117.683 1.708 1
1 784 . 4 1 1 A 70 70 LEU H H 70 7.907 7.993 -0.086 1
1 785 . 4 1 1 A 70 70 LEU HA H 70 4.232 3.894 0.338 1
1 795 . 4 1 1 A 70 70 LEU C C 70 177.745 176.298 1.447 1
1 796 . 4 1 1 A 70 70 LEU CA C 70 55.835 57.028 -1.193 1
1 797 . 4 1 1 A 70 70 LEU CB C 70 42.174 42.512 -0.338 1
1 801 . 4 1 1 A 70 70 LEU N N 70 119.266 123.132 -3.866 1
1 802 . 4 1 1 A 71 71 GLN H H 71 7.865 7.729 0.136 1
1 803 . 4 1 1 A 71 71 GLN HA H 71 4.287 4.223 0.064 1
1 809 . 4 1 1 A 71 71 GLN C C 71 178.855 174.427 4.428 1
1 810 . 4 1 1 A 71 71 GLN CA C 71 56.383 56.829 -0.446 1
1 811 . 4 1 1 A 71 71 GLN CB C 71 29.092 26.430 2.662 1
1 813 . 4 1 1 A 71 71 GLN N N 71 118.603 117.325 1.278 1
1 815 . 4 1 1 A 72 72 GLN H H 72 8.189 7.852 0.337 1
1 816 . 4 1 1 A 72 72 GLN HA H 72 4.302 4.289 0.013 1
1 821 . 4 1 1 A 72 72 GLN CA C 72 56.206 54.887 1.319 1
1 822 . 4 1 1 A 72 72 GLN CB C 72 29.298 27.406 1.892 1
1 824 . 4 1 1 A 72 72 GLN N N 72 120.267 118.418 1.849 1
1 825 . 4 1 1 A 73 73 ARG C C 73 176.105 176.026 0.079 1
1 826 . 4 1 1 A 74 74 ARG HA H 74 4.334 4.555 -0.221 1
1 833 . 4 1 1 A 74 74 ARG C C 74 176.188 176.120 0.068 1
1 834 . 4 1 1 A 74 74 ARG CA C 74 56.300 57.196 -0.896 1
1 835 . 4 1 1 A 74 74 ARG CB C 74 30.668 33.306 -2.638 1
1 838 . 4 1 1 A 75 75 ASN C C 75 174.462 173.674 0.788 1
1 839 . 4 1 1 A 75 75 ASN CA C 75 53.148 51.919 1.229 1
1 840 . 4 1 1 A 75 75 ASN CB C 75 39.046 39.626 -0.580 1
1 841 . 4 1 1 A 76 76 ASP H H 76 8.257 7.647 0.610 1
1 842 . 4 1 1 A 76 76 ASP HA H 76 4.877 5.188 -0.311 1
1 845 . 4 1 1 A 76 76 ASP C C 76 174.759 173.742 1.017 1
1 846 . 4 1 1 A 76 76 ASP CA C 76 52.380 50.709 1.671 1
1 847 . 4 1 1 A 76 76 ASP CB C 76 41.267 42.453 -1.186 1
1 848 . 4 1 1 A 76 76 ASP N N 76 122.030 123.325 -1.295 1
1 849 . 4 1 1 A 77 77 PRO HA H 77 4.466 4.509 -0.043 1
1 856 . 4 1 1 A 77 77 PRO C C 77 177.133 176.809 0.324 1
1 857 . 4 1 1 A 77 77 PRO CA C 77 63.733 62.891 0.842 1
1 858 . 4 1 1 A 77 77 PRO CB C 77 31.919 32.141 -0.222 1
1 861 . 4 1 1 A 78 78 SER H H 78 8.457 8.469 -0.012 1
1 862 . 4 1 1 A 78 78 SER HA H 78 4.479 4.358 0.121 1
1 865 . 4 1 1 A 78 78 SER C C 78 174.731 174.000 0.731 1
1 866 . 4 1 1 A 78 78 SER CA C 78 58.691 59.663 -0.972 1
1 867 . 4 1 1 A 78 78 SER CB C 78 63.973 63.176 0.797 1
1 868 . 4 1 1 A 78 78 SER N N 78 115.711 118.309 -2.598 1
1 869 . 4 1 1 A 79 79 GLY H H 79 8.090 8.392 -0.302 1
1 870 . 4 1 1 A 79 79 GLY HA2 H 79 4.179 4.113 0.066 1
1 871 . 4 1 1 A 79 79 GLY HA3 H 79 4.065 4.113 -0.048 1
1 872 . 4 1 1 A 79 79 GLY CA C 79 44.746 45.928 -1.182 1
1 873 . 4 1 1 A 79 79 GLY N N 79 110.429 113.687 -3.258 1
1 874 . 4 1 1 A 80 80 PRO HA H 80 4.464 4.671 -0.207 1
1 880 . 4 1 1 A 80 80 PRO C C 80 177.499 175.077 2.422 1
1 881 . 4 1 1 A 80 80 PRO CA C 80 63.275 62.742 0.533 1
1 882 . 4 1 1 A 80 80 PRO CB C 80 32.249 32.656 -0.407 1
1 1 . 5 1 1 A 13 13 ASN HA H 13 4.787 5.197 -0.410 1
1 6 . 5 1 1 A 13 13 ASN CA C 13 53.148 52.601 0.547 1
1 7 . 5 1 1 A 13 13 ASN CB C 13 39.378 40.161 -0.783 1
1 9 . 5 1 1 A 14 14 LEU H H 14 8.418 8.600 -0.182 1
1 10 . 5 1 1 A 14 14 LEU HA H 14 4.654 4.723 -0.069 1
1 20 . 5 1 1 A 14 14 LEU CA C 14 52.999 52.140 0.859 1
1 21 . 5 1 1 A 14 14 LEU CB C 14 41.919 41.671 0.248 1
1 25 . 5 1 1 A 14 14 LEU N N 14 122.671 124.355 -1.684 1
1 26 . 5 1 1 A 15 15 PRO HA H 15 4.460 4.570 -0.110 1
1 33 . 5 1 1 A 15 15 PRO C C 15 178.156 177.583 0.573 1
1 34 . 5 1 1 A 15 15 PRO CA C 15 63.101 62.697 0.404 1
1 35 . 5 1 1 A 15 15 PRO CB C 15 32.304 32.623 -0.319 1
1 38 . 5 1 1 A 16 16 ALA H H 16 8.973 8.627 0.346 1
1 39 . 5 1 1 A 16 16 ALA HA H 16 4.021 3.942 0.079 1
1 43 . 5 1 1 A 16 16 ALA C C 16 180.695 179.185 1.510 1
1 44 . 5 1 1 A 16 16 ALA CA C 16 55.642 55.618 0.024 1
1 45 . 5 1 1 A 16 16 ALA CB C 16 18.552 18.666 -0.114 1
1 46 . 5 1 1 A 16 16 ALA N N 16 128.311 126.532 1.779 1
1 47 . 5 1 1 A 17 17 GLU H H 17 9.558 8.208 1.350 1
1 48 . 5 1 1 A 17 17 GLU HA H 17 4.065 4.077 -0.012 1
1 53 . 5 1 1 A 17 17 GLU C C 17 178.886 178.489 0.397 1
1 54 . 5 1 1 A 17 17 GLU CA C 17 59.400 59.342 0.058 1
1 55 . 5 1 1 A 17 17 GLU CB C 17 28.742 29.273 -0.531 1
1 57 . 5 1 1 A 17 17 GLU N N 17 117.113 117.331 -0.218 1
1 58 . 5 1 1 A 18 18 SER H H 18 7.263 7.693 -0.430 1
1 59 . 5 1 1 A 18 18 SER HA H 18 4.180 4.178 0.002 1
1 62 . 5 1 1 A 18 18 SER C C 18 174.951 177.251 -2.300 1
1 63 . 5 1 1 A 18 18 SER CA C 18 61.969 61.284 0.685 1
1 64 . 5 1 1 A 18 18 SER CB C 18 62.554 62.609 -0.055 1
1 65 . 5 1 1 A 18 18 SER N N 18 114.932 115.086 -0.154 1
1 66 . 5 1 1 A 19 19 VAL H H 19 7.620 8.176 -0.556 1
1 67 . 5 1 1 A 19 19 VAL HA H 19 3.011 3.076 -0.065 1
1 75 . 5 1 1 A 19 19 VAL C C 19 176.953 177.684 -0.731 1
1 76 . 5 1 1 A 19 19 VAL CA C 19 66.479 66.873 -0.394 1
1 77 . 5 1 1 A 19 19 VAL CB C 19 31.569 31.378 0.191 1
1 80 . 5 1 1 A 19 19 VAL N N 19 121.086 121.501 -0.415 1
1 81 . 5 1 1 A 20 20 LYS H H 20 7.745 8.345 -0.600 1
1 82 . 5 1 1 A 20 20 LYS HA H 20 3.884 3.975 -0.091 1
1 91 . 5 1 1 A 20 20 LYS C C 20 178.150 178.788 -0.638 1
1 92 . 5 1 1 A 20 20 LYS CA C 20 59.984 59.879 0.105 1
1 93 . 5 1 1 A 20 20 LYS CB C 20 32.351 32.161 0.190 1
1 97 . 5 1 1 A 20 20 LYS N N 20 119.366 119.635 -0.269 1
1 98 . 5 1 1 A 21 21 ILE H H 21 6.943 7.516 -0.573 1
1 99 . 5 1 1 A 21 21 ILE HA H 21 3.783 3.642 0.141 1
1 109 . 5 1 1 A 21 21 ILE C C 21 178.996 178.689 0.307 1
1 110 . 5 1 1 A 21 21 ILE CA C 21 64.642 65.859 -1.217 1
1 111 . 5 1 1 A 21 21 ILE CB C 21 38.014 37.956 0.058 1
1 115 . 5 1 1 A 21 21 ILE N N 21 118.163 119.831 -1.668 1
1 116 . 5 1 1 A 22 22 LEU H H 22 7.267 7.874 -0.607 1
1 117 . 5 1 1 A 22 22 LEU HA H 22 3.748 3.939 -0.191 1
1 127 . 5 1 1 A 22 22 LEU C C 22 178.289 178.621 -0.332 1
1 128 . 5 1 1 A 22 22 LEU CA C 22 58.092 58.155 -0.063 1
1 129 . 5 1 1 A 22 22 LEU CB C 22 38.551 41.049 -2.498 1
1 133 . 5 1 1 A 22 22 LEU N N 22 120.609 119.295 1.314 1
1 134 . 5 1 1 A 23 23 ARG H H 23 8.676 8.725 -0.049 1
1 135 . 5 1 1 A 23 23 ARG HA H 23 4.030 4.178 -0.148 1
1 142 . 5 1 1 A 23 23 ARG C C 23 178.861 178.438 0.423 1
1 143 . 5 1 1 A 23 23 ARG CA C 23 60.404 60.059 0.345 1
1 144 . 5 1 1 A 23 23 ARG CB C 23 30.351 30.150 0.201 1
1 147 . 5 1 1 A 23 23 ARG N N 23 119.148 117.387 1.761 1
1 148 . 5 1 1 A 24 24 ASP H H 24 8.515 8.267 0.248 1
1 149 . 5 1 1 A 24 24 ASP HA H 24 4.519 4.364 0.155 1
1 152 . 5 1 1 A 24 24 ASP C C 24 178.759 178.546 0.213 1
1 153 . 5 1 1 A 24 24 ASP CA C 24 57.556 57.206 0.350 1
1 154 . 5 1 1 A 24 24 ASP CB C 24 40.569 41.098 -0.529 1
1 155 . 5 1 1 A 24 24 ASP N N 24 120.027 119.411 0.616 1
1 156 . 5 1 1 A 25 25 TRP H H 25 8.158 8.022 0.136 1
1 157 . 5 1 1 A 25 25 TRP HA H 25 4.181 4.481 -0.300 1
1 166 . 5 1 1 A 25 25 TRP C C 25 179.946 178.298 1.648 1
1 167 . 5 1 1 A 25 25 TRP CA C 25 63.346 61.271 2.075 1
1 168 . 5 1 1 A 25 25 TRP CB C 25 29.433 29.617 -0.184 1
1 174 . 5 1 1 A 25 25 TRP N N 25 121.350 121.756 -0.406 1
1 176 . 5 1 1 A 26 26 MET H H 26 8.977 9.014 -0.037 1
1 177 . 5 1 1 A 26 26 MET HA H 26 4.076 4.604 -0.528 1
1 185 . 5 1 1 A 26 26 MET C C 26 177.371 178.236 -0.865 1
1 186 . 5 1 1 A 26 26 MET CA C 26 60.454 58.745 1.709 1
1 187 . 5 1 1 A 26 26 MET CB C 26 33.567 32.516 1.051 1
1 190 . 5 1 1 A 26 26 MET N N 26 119.977 118.729 1.248 1
1 191 . 5 1 1 A 27 27 TYR H H 27 8.604 8.458 0.146 1
1 192 . 5 1 1 A 27 27 TYR HA H 27 4.138 4.173 -0.035 1
1 199 . 5 1 1 A 27 27 TYR C C 27 178.901 177.641 1.260 1
1 200 . 5 1 1 A 27 27 TYR CA C 27 61.846 61.483 0.363 1
1 201 . 5 1 1 A 27 27 TYR CB C 27 38.165 38.667 -0.502 1
1 206 . 5 1 1 A 27 27 TYR N N 27 117.797 121.236 -3.439 1
1 207 . 5 1 1 A 28 28 LYS H H 28 7.867 7.784 0.083 1
1 208 . 5 1 1 A 28 28 LYS HA H 28 3.797 3.541 0.256 1
1 217 . 5 1 1 A 28 28 LYS C C 28 176.858 177.396 -0.538 1
1 218 . 5 1 1 A 28 28 LYS CA C 28 58.174 58.800 -0.626 1
1 219 . 5 1 1 A 28 28 LYS CB C 28 32.516 31.753 0.763 1
1 223 . 5 1 1 A 28 28 LYS N N 28 118.982 117.858 1.124 1
1 224 . 5 1 1 A 29 29 HIS H H 29 7.443 7.397 0.046 1
1 225 . 5 1 1 A 29 29 HIS HA H 29 4.386 4.373 0.013 1
1 230 . 5 1 1 A 29 29 HIS C C 29 176.085 175.696 0.389 1
1 231 . 5 1 1 A 29 29 HIS CA C 29 55.213 54.941 0.272 1
1 232 . 5 1 1 A 29 29 HIS CB C 29 27.085 28.846 -1.761 1
1 235 . 5 1 1 A 29 29 HIS N N 29 117.138 115.473 1.665 1
1 236 . 5 1 1 A 30 30 ARG H H 30 6.921 8.057 -1.136 1
1 237 . 5 1 1 A 30 30 ARG HA H 30 3.898 4.359 -0.461 1
1 244 . 5 1 1 A 30 30 ARG C C 30 175.808 177.949 -2.141 1
1 245 . 5 1 1 A 30 30 ARG CA C 30 58.609 58.473 0.136 1
1 246 . 5 1 1 A 30 30 ARG CB C 30 28.739 29.619 -0.880 1
1 249 . 5 1 1 A 30 30 ARG N N 30 117.911 119.281 -1.370 1
1 250 . 5 1 1 A 31 31 PHE H H 31 7.819 7.593 0.226 1
1 251 . 5 1 1 A 31 31 PHE HA H 31 4.533 4.272 0.261 1
1 259 . 5 1 1 A 31 31 PHE C C 31 175.577 176.992 -1.415 1
1 260 . 5 1 1 A 31 31 PHE CA C 31 58.029 60.844 -2.815 1
1 261 . 5 1 1 A 31 31 PHE CB C 31 37.792 38.716 -0.924 1
1 267 . 5 1 1 A 31 31 PHE N N 31 115.408 118.788 -3.380 1
1 268 . 5 1 1 A 32 32 LYS H H 32 7.858 8.113 -0.255 1
1 269 . 5 1 1 A 32 32 LYS HA H 32 4.487 4.547 -0.060 1
1 277 . 5 1 1 A 32 32 LYS C C 32 175.557 176.925 -1.368 1
1 278 . 5 1 1 A 32 32 LYS CA C 32 56.329 57.106 -0.777 1
1 279 . 5 1 1 A 32 32 LYS CB C 32 32.743 34.692 -1.949 1
1 283 . 5 1 1 A 32 32 LYS N N 32 122.453 114.068 8.385 1
1 284 . 5 1 1 A 33 33 ALA H H 33 8.643 8.444 0.199 1
1 285 . 5 1 1 A 33 33 ALA HA H 33 4.403 4.266 0.137 1
1 289 . 5 1 1 A 33 33 ALA C C 33 176.273 175.641 0.632 1
1 290 . 5 1 1 A 33 33 ALA CA C 33 53.579 53.457 0.122 1
1 291 . 5 1 1 A 33 33 ALA CB C 33 18.653 17.610 1.043 1
1 292 . 5 1 1 A 33 33 ALA N N 33 127.853 120.039 7.814 1
1 293 . 5 1 1 A 34 34 TYR H H 34 7.878 8.115 -0.237 1
1 294 . 5 1 1 A 34 34 TYR HA H 34 4.686 4.982 -0.296 1
1 301 . 5 1 1 A 34 34 TYR C C 34 173.133 172.966 0.167 1
1 302 . 5 1 1 A 34 34 TYR CA C 34 54.778 54.866 -0.088 1
1 303 . 5 1 1 A 34 34 TYR CB C 34 39.619 38.719 0.900 1
1 308 . 5 1 1 A 34 34 TYR N N 34 116.539 118.539 -2.000 1
1 309 . 5 1 1 A 35 35 PRO HA H 35 4.526 4.938 -0.412 1
1 316 . 5 1 1 A 35 35 PRO C C 35 176.837 175.589 1.248 1
1 317 . 5 1 1 A 35 35 PRO CA C 35 61.864 62.141 -0.277 1
1 318 . 5 1 1 A 35 35 PRO CB C 35 30.904 32.078 -1.174 1
1 321 . 5 1 1 A 36 36 SER H H 36 9.634 8.403 1.231 1
1 322 . 5 1 1 A 36 36 SER HA H 36 4.518 4.729 -0.211 1
1 325 . 5 1 1 A 36 36 SER C C 36 175.001 175.342 -0.341 1
1 326 . 5 1 1 A 36 36 SER CA C 36 57.129 56.642 0.487 1
1 327 . 5 1 1 A 36 36 SER CB C 36 65.374 65.105 0.269 1
1 328 . 5 1 1 A 36 36 SER N N 36 119.984 116.989 2.995 1
1 329 . 5 1 1 A 37 37 GLU H H 37 9.091 8.914 0.177 1
1 330 . 5 1 1 A 37 37 GLU HA H 37 3.884 3.900 -0.016 1
1 335 . 5 1 1 A 37 37 GLU C C 37 179.347 178.384 0.963 1
1 336 . 5 1 1 A 37 37 GLU CA C 37 60.454 59.562 0.892 1
1 337 . 5 1 1 A 37 37 GLU CB C 37 28.623 29.128 -0.505 1
1 339 . 5 1 1 A 37 37 GLU N N 37 120.748 126.436 -5.688 1
1 340 . 5 1 1 A 38 38 GLU H H 38 8.760 7.832 0.928 1
1 341 . 5 1 1 A 38 38 GLU HA H 38 4.048 4.084 -0.036 1
1 346 . 5 1 1 A 38 38 GLU C C 38 179.975 179.215 0.760 1
1 347 . 5 1 1 A 38 38 GLU CA C 38 60.243 59.182 1.061 1
1 348 . 5 1 1 A 38 38 GLU CB C 38 29.117 29.778 -0.661 1
1 350 . 5 1 1 A 38 38 GLU N N 38 119.272 120.286 -1.014 1
1 351 . 5 1 1 A 39 39 GLU H H 39 7.856 8.059 -0.203 1
1 352 . 5 1 1 A 39 39 GLU HA H 39 3.976 3.947 0.029 1
1 357 . 5 1 1 A 39 39 GLU C C 39 178.912 178.828 0.084 1
1 358 . 5 1 1 A 39 39 GLU CA C 39 59.131 59.039 0.092 1
1 359 . 5 1 1 A 39 39 GLU CB C 39 29.612 28.852 0.760 1
1 361 . 5 1 1 A 39 39 GLU N N 39 121.658 120.714 0.944 1
1 362 . 5 1 1 A 40 40 LYS H H 40 8.653 7.807 0.846 1
1 363 . 5 1 1 A 40 40 LYS HA H 40 3.508 3.757 -0.249 1
1 372 . 5 1 1 A 40 40 LYS C C 40 177.974 179.048 -1.074 1
1 373 . 5 1 1 A 40 40 LYS CA C 40 60.948 59.589 1.359 1
1 374 . 5 1 1 A 40 40 LYS CB C 40 32.714 32.071 0.643 1
1 378 . 5 1 1 A 40 40 LYS N N 40 119.152 119.454 -0.302 1
1 379 . 5 1 1 A 41 41 GLN H H 41 7.876 7.538 0.338 1
1 380 . 5 1 1 A 41 41 GLN HA H 41 3.911 3.999 -0.088 1
1 387 . 5 1 1 A 41 41 GLN C C 41 178.352 178.176 0.176 1
1 388 . 5 1 1 A 41 41 GLN CA C 41 58.973 59.035 -0.062 1
1 389 . 5 1 1 A 41 41 GLN CB C 41 27.552 28.381 -0.829 1
1 391 . 5 1 1 A 41 41 GLN N N 41 118.910 119.644 -0.734 1
1 393 . 5 1 1 A 42 42 MET H H 42 7.771 7.706 0.065 1
1 394 . 5 1 1 A 42 42 MET HA H 42 4.158 4.202 -0.044 1
1 402 . 5 1 1 A 42 42 MET C C 42 179.310 178.275 1.035 1
1 403 . 5 1 1 A 42 42 MET CA C 42 59.079 58.444 0.635 1
1 404 . 5 1 1 A 42 42 MET CB C 42 31.023 32.197 -1.174 1
1 407 . 5 1 1 A 42 42 MET N N 42 121.131 119.211 1.920 1
1 408 . 5 1 1 A 43 43 LEU H H 43 8.400 7.920 0.480 1
1 409 . 5 1 1 A 43 43 LEU HA H 43 3.888 4.031 -0.143 1
1 419 . 5 1 1 A 43 43 LEU C C 43 180.721 179.240 1.481 1
1 420 . 5 1 1 A 43 43 LEU CA C 43 57.916 57.822 0.094 1
1 421 . 5 1 1 A 43 43 LEU CB C 43 42.080 41.118 0.962 1
1 425 . 5 1 1 A 43 43 LEU N N 43 120.124 120.417 -0.293 1
1 426 . 5 1 1 A 44 44 SER H H 44 8.658 8.363 0.295 1
1 427 . 5 1 1 A 44 44 SER HA H 44 4.088 4.222 -0.134 1
1 430 . 5 1 1 A 44 44 SER C C 44 176.859 176.680 0.179 1
1 431 . 5 1 1 A 44 44 SER CA C 44 61.371 60.987 0.384 1
1 432 . 5 1 1 A 44 44 SER CB C 44 63.314 63.115 0.199 1
1 433 . 5 1 1 A 44 44 SER N N 44 119.795 113.998 5.797 1
1 434 . 5 1 1 A 45 45 GLU H H 45 7.905 7.727 0.178 1
1 435 . 5 1 1 A 45 45 GLU HA H 45 4.094 4.259 -0.165 1
1 440 . 5 1 1 A 45 45 GLU C C 45 179.095 179.100 -0.005 1
1 441 . 5 1 1 A 45 45 GLU CA C 45 59.255 58.983 0.272 1
1 442 . 5 1 1 A 45 45 GLU CB C 45 29.200 29.903 -0.703 1
1 444 . 5 1 1 A 45 45 GLU N N 45 120.609 121.009 -0.400 1
1 445 . 5 1 1 A 46 46 LYS H H 46 7.837 7.690 0.147 1
1 446 . 5 1 1 A 46 46 LYS HA H 46 4.231 4.147 0.084 1
1 453 . 5 1 1 A 46 46 LYS C C 46 177.964 178.162 -0.198 1
1 454 . 5 1 1 A 46 46 LYS CA C 46 58.278 58.744 -0.466 1
1 455 . 5 1 1 A 46 46 LYS CB C 46 34.110 32.376 1.734 1
1 459 . 5 1 1 A 46 46 LYS N N 46 115.471 119.064 -3.593 1
1 460 . 5 1 1 A 47 47 THR H H 47 7.763 7.961 -0.198 1
1 461 . 5 1 1 A 47 47 THR HA H 47 4.271 4.335 -0.064 1
1 466 . 5 1 1 A 47 47 THR C C 47 175.472 174.960 0.512 1
1 467 . 5 1 1 A 47 47 THR CA C 47 62.429 61.972 0.457 1
1 468 . 5 1 1 A 47 47 THR CB C 47 71.966 70.304 1.662 1
1 470 . 5 1 1 A 47 47 THR N N 47 104.286 107.919 -3.633 1
1 471 . 5 1 1 A 48 48 ASN H H 48 8.169 8.473 -0.304 1
1 472 . 5 1 1 A 48 48 ASN HA H 48 4.437 4.659 -0.222 1
1 477 . 5 1 1 A 48 48 ASN C C 48 173.874 173.913 -0.039 1
1 478 . 5 1 1 A 48 48 ASN CA C 48 55.377 54.310 1.067 1
1 479 . 5 1 1 A 48 48 ASN CB C 48 37.770 37.554 0.216 1
1 480 . 5 1 1 A 48 48 ASN N N 48 117.458 119.559 -2.101 1
1 482 . 5 1 1 A 49 49 LEU H H 49 7.532 7.118 0.414 1
1 483 . 5 1 1 A 49 49 LEU HA H 49 4.733 4.769 -0.036 1
1 493 . 5 1 1 A 49 49 LEU C C 49 176.625 175.777 0.848 1
1 494 . 5 1 1 A 49 49 LEU CA C 49 53.226 53.416 -0.190 1
1 495 . 5 1 1 A 49 49 LEU CB C 49 44.114 43.465 0.649 1
1 499 . 5 1 1 A 49 49 LEU N N 49 118.220 120.177 -1.957 1
1 500 . 5 1 1 A 50 50 SER H H 50 9.140 8.776 0.364 1
1 501 . 5 1 1 A 50 50 SER HA H 50 4.475 4.994 -0.519 1
1 504 . 5 1 1 A 50 50 SER C C 50 174.907 174.832 0.075 1
1 505 . 5 1 1 A 50 50 SER CA C 50 56.964 57.620 -0.656 1
1 506 . 5 1 1 A 50 50 SER CB C 50 65.372 64.981 0.391 1
1 507 . 5 1 1 A 50 50 SER N N 50 117.569 117.105 0.464 1
1 508 . 5 1 1 A 51 51 LEU H H 51 8.756 8.770 -0.014 1
1 509 . 5 1 1 A 51 51 LEU HA H 51 3.874 3.896 -0.022 1
1 519 . 5 1 1 A 51 51 LEU C C 51 179.910 178.873 1.037 1
1 520 . 5 1 1 A 51 51 LEU CA C 51 58.916 58.160 0.756 1
1 521 . 5 1 1 A 51 51 LEU CB C 51 41.148 41.446 -0.298 1
1 525 . 5 1 1 A 51 51 LEU N N 51 120.905 125.761 -4.856 1
1 526 . 5 1 1 A 52 52 LEU H H 52 8.146 8.215 -0.069 1
1 527 . 5 1 1 A 52 52 LEU HA H 52 4.179 4.009 0.170 1
1 537 . 5 1 1 A 52 52 LEU C C 52 178.936 178.587 0.349 1
1 538 . 5 1 1 A 52 52 LEU CA C 52 58.162 58.408 -0.246 1
1 539 . 5 1 1 A 52 52 LEU CB C 52 42.137 41.269 0.868 1
1 543 . 5 1 1 A 52 52 LEU N N 52 120.685 120.099 0.586 1
1 544 . 5 1 1 A 53 53 GLN H H 53 7.924 8.209 -0.285 1
1 545 . 5 1 1 A 53 53 GLN HA H 53 4.102 4.169 -0.067 1
1 552 . 5 1 1 A 53 53 GLN C C 53 180.308 178.580 1.728 1
1 553 . 5 1 1 A 53 53 GLN CA C 53 59.326 58.430 0.896 1
1 554 . 5 1 1 A 53 53 GLN CB C 53 29.900 28.337 1.563 1
1 556 . 5 1 1 A 53 53 GLN N N 53 118.473 117.554 0.919 1
1 558 . 5 1 1 A 54 54 ILE H H 54 8.380 8.296 0.084 1
1 559 . 5 1 1 A 54 54 ILE HA H 54 3.677 3.742 -0.065 1
1 569 . 5 1 1 A 54 54 ILE C C 54 177.673 178.125 -0.452 1
1 570 . 5 1 1 A 54 54 ILE CA C 54 64.650 65.518 -0.868 1
1 571 . 5 1 1 A 54 54 ILE CB C 54 37.476 37.800 -0.324 1
1 575 . 5 1 1 A 54 54 ILE N N 54 120.113 121.636 -1.523 1
1 576 . 5 1 1 A 55 55 SER H H 55 8.854 8.010 0.844 1
1 577 . 5 1 1 A 55 55 SER HA H 55 4.267 4.209 0.058 1
1 580 . 5 1 1 A 55 55 SER C C 55 177.127 177.706 -0.579 1
1 581 . 5 1 1 A 55 55 SER CA C 55 62.852 61.740 1.112 1
1 582 . 5 1 1 A 55 55 SER CB C 55 62.727 62.965 -0.238 1
1 583 . 5 1 1 A 55 55 SER N N 55 116.646 115.855 0.791 1
1 584 . 5 1 1 A 56 56 ASN H H 56 8.634 8.068 0.566 1
1 585 . 5 1 1 A 56 56 ASN HA H 56 4.549 4.453 0.096 1
1 590 . 5 1 1 A 56 56 ASN C C 56 177.481 178.377 -0.896 1
1 591 . 5 1 1 A 56 56 ASN CA C 56 55.951 56.476 -0.525 1
1 592 . 5 1 1 A 56 56 ASN CB C 56 37.852 38.142 -0.290 1
1 593 . 5 1 1 A 56 56 ASN N N 56 119.048 119.412 -0.364 1
1 595 . 5 1 1 A 57 57 TRP H H 57 8.373 8.230 0.143 1
1 596 . 5 1 1 A 57 57 TRP HA H 57 4.065 4.358 -0.293 1
1 605 . 5 1 1 A 57 57 TRP C C 57 179.392 178.265 1.127 1
1 606 . 5 1 1 A 57 57 TRP CA C 57 63.204 61.392 1.812 1
1 607 . 5 1 1 A 57 57 TRP CB C 57 28.376 29.640 -1.264 1
1 613 . 5 1 1 A 57 57 TRP N N 57 122.950 123.061 -0.111 1
1 615 . 5 1 1 A 58 58 PHE H H 58 8.428 8.258 0.170 1
1 616 . 5 1 1 A 58 58 PHE HA H 58 3.922 3.761 0.161 1
1 624 . 5 1 1 A 58 58 PHE C C 58 178.237 177.786 0.451 1
1 625 . 5 1 1 A 58 58 PHE CA C 58 64.015 61.803 2.212 1
1 626 . 5 1 1 A 58 58 PHE CB C 58 39.602 38.644 0.958 1
1 632 . 5 1 1 A 58 58 PHE N N 58 116.774 117.767 -0.993 1
1 633 . 5 1 1 A 59 59 ILE H H 59 7.925 8.415 -0.490 1
1 634 . 5 1 1 A 59 59 ILE HA H 59 3.773 3.711 0.062 1
1 644 . 5 1 1 A 59 59 ILE C C 59 178.745 177.748 0.997 1
1 645 . 5 1 1 A 59 59 ILE CA C 59 65.531 65.435 0.096 1
1 646 . 5 1 1 A 59 59 ILE CB C 59 38.480 37.874 0.606 1
1 650 . 5 1 1 A 59 59 ILE N N 59 119.560 119.906 -0.346 1
1 651 . 5 1 1 A 60 60 ASN H H 60 7.506 7.807 -0.301 1
1 652 . 5 1 1 A 60 60 ASN HA H 60 4.407 4.369 0.038 1
1 657 . 5 1 1 A 60 60 ASN C C 60 177.163 177.431 -0.268 1
1 658 . 5 1 1 A 60 60 ASN CA C 60 55.871 56.413 -0.542 1
1 659 . 5 1 1 A 60 60 ASN CB C 60 38.878 38.249 0.629 1
1 660 . 5 1 1 A 60 60 ASN N N 60 116.868 118.029 -1.161 1
1 662 . 5 1 1 A 61 61 ALA H H 61 8.410 8.043 0.367 1
1 663 . 5 1 1 A 61 61 ALA HA H 61 3.667 3.653 0.014 1
1 667 . 5 1 1 A 61 61 ALA C C 61 180.061 179.095 0.966 1
1 668 . 5 1 1 A 61 61 ALA CA C 61 54.601 54.722 -0.121 1
1 669 . 5 1 1 A 61 61 ALA CB C 61 18.241 17.439 0.802 1
1 670 . 5 1 1 A 61 61 ALA N N 61 123.022 122.384 0.638 1
1 671 . 5 1 1 A 62 62 ARG H H 62 8.036 8.207 -0.171 1
1 672 . 5 1 1 A 62 62 ARG HA H 62 4.092 4.059 0.033 1
1 679 . 5 1 1 A 62 62 ARG C C 62 176.756 177.058 -0.302 1
1 680 . 5 1 1 A 62 62 ARG CA C 62 58.762 58.068 0.694 1
1 681 . 5 1 1 A 62 62 ARG CB C 62 30.601 29.638 0.963 1
1 684 . 5 1 1 A 62 62 ARG N N 62 117.168 117.063 0.105 1
1 685 . 5 1 1 A 63 63 ARG H H 63 7.214 8.129 -0.915 1
1 686 . 5 1 1 A 63 63 ARG HA H 63 4.249 4.422 -0.173 1
1 693 . 5 1 1 A 63 63 ARG C C 63 176.945 176.700 0.245 1
1 694 . 5 1 1 A 63 63 ARG CA C 63 57.669 56.545 1.124 1
1 695 . 5 1 1 A 63 63 ARG CB C 63 30.765 31.187 -0.422 1
1 698 . 5 1 1 A 63 63 ARG N N 63 116.514 117.715 -1.201 1
1 699 . 5 1 1 A 64 64 ARG H H 64 7.913 7.741 0.172 1
1 700 . 5 1 1 A 64 64 ARG HA H 64 4.351 4.596 -0.245 1
1 707 . 5 1 1 A 64 64 ARG C C 64 176.413 178.100 -1.687 1
1 708 . 5 1 1 A 64 64 ARG CA C 64 57.105 57.052 0.053 1
1 709 . 5 1 1 A 64 64 ARG CB C 64 31.672 32.766 -1.094 1
1 712 . 5 1 1 A 64 64 ARG N N 64 116.818 119.186 -2.368 1
1 713 . 5 1 1 A 65 65 ILE H H 65 8.169 8.231 -0.062 1
1 714 . 5 1 1 A 65 65 ILE HA H 65 4.285 3.644 0.641 1
1 724 . 5 1 1 A 65 65 ILE C C 65 176.208 177.929 -1.721 1
1 725 . 5 1 1 A 65 65 ILE CA C 65 62.005 65.436 -3.431 1
1 726 . 5 1 1 A 65 65 ILE CB C 65 39.088 37.620 1.468 1
1 730 . 5 1 1 A 65 65 ILE N N 65 119.185 119.495 -0.310 1
1 731 . 5 1 1 A 66 66 LEU H H 66 7.962 8.037 -0.075 1
1 732 . 5 1 1 A 66 66 LEU HA H 66 4.485 4.023 0.462 1
1 742 . 5 1 1 A 66 66 LEU C C 66 176.216 175.267 0.949 1
1 743 . 5 1 1 A 66 66 LEU CA C 66 56.153 59.840 -3.687 1
1 744 . 5 1 1 A 66 66 LEU CB C 66 40.792 40.058 0.734 1
1 748 . 5 1 1 A 66 66 LEU N N 66 124.389 121.646 2.743 1
1 749 . 5 1 1 A 67 67 PRO HA H 67 4.283 4.393 -0.110 1
1 756 . 5 1 1 A 67 67 PRO C C 67 178.294 178.455 -0.161 1
1 757 . 5 1 1 A 67 67 PRO CA C 67 65.390 64.977 0.413 1
1 758 . 5 1 1 A 67 67 PRO CB C 67 31.095 31.299 -0.204 1
1 761 . 5 1 1 A 68 68 ASP H H 68 7.913 8.553 -0.640 1
1 762 . 5 1 1 A 68 68 ASP HA H 68 4.507 4.444 0.063 1
1 765 . 5 1 1 A 68 68 ASP C C 68 177.927 178.162 -0.235 1
1 766 . 5 1 1 A 68 68 ASP CA C 68 55.906 56.802 -0.896 1
1 767 . 5 1 1 A 68 68 ASP CB C 68 40.736 41.132 -0.396 1
1 768 . 5 1 1 A 68 68 ASP N N 68 117.231 118.022 -0.791 1
1 769 . 5 1 1 A 69 69 MET H H 69 8.083 8.692 -0.609 1
1 770 . 5 1 1 A 69 69 MET HA H 69 4.362 4.187 0.175 1
1 778 . 5 1 1 A 69 69 MET C C 69 177.374 179.121 -1.747 1
1 779 . 5 1 1 A 69 69 MET CA C 69 57.634 58.764 -1.130 1
1 780 . 5 1 1 A 69 69 MET CB C 69 32.816 32.398 0.418 1
1 783 . 5 1 1 A 69 69 MET N N 69 119.391 118.652 0.739 1
1 784 . 5 1 1 A 70 70 LEU H H 70 7.907 8.077 -0.170 1
1 785 . 5 1 1 A 70 70 LEU HA H 70 4.232 3.962 0.270 1
1 795 . 5 1 1 A 70 70 LEU C C 70 177.745 179.027 -1.282 1
1 796 . 5 1 1 A 70 70 LEU CA C 70 55.835 58.159 -2.324 1
1 797 . 5 1 1 A 70 70 LEU CB C 70 42.174 41.636 0.538 1
1 801 . 5 1 1 A 70 70 LEU N N 70 119.266 120.759 -1.493 1
1 802 . 5 1 1 A 71 71 GLN H H 71 7.865 8.215 -0.350 1
1 803 . 5 1 1 A 71 71 GLN HA H 71 4.287 4.002 0.285 1
1 809 . 5 1 1 A 71 71 GLN C C 71 178.855 176.972 1.883 1
1 810 . 5 1 1 A 71 71 GLN CA C 71 56.383 59.447 -3.064 1
1 811 . 5 1 1 A 71 71 GLN CB C 71 29.092 28.378 0.714 1
1 813 . 5 1 1 A 71 71 GLN N N 71 118.603 117.117 1.486 1
1 815 . 5 1 1 A 72 72 GLN H H 72 8.189 7.320 0.869 1
1 816 . 5 1 1 A 72 72 GLN HA H 72 4.302 4.205 0.097 1
1 821 . 5 1 1 A 72 72 GLN CA C 72 56.206 56.032 0.174 1
1 822 . 5 1 1 A 72 72 GLN CB C 72 29.298 29.903 -0.605 1
1 824 . 5 1 1 A 72 72 GLN N N 72 120.267 119.285 0.982 1
1 825 . 5 1 1 A 73 73 ARG C C 73 176.105 176.146 -0.041 1
1 826 . 5 1 1 A 74 74 ARG HA H 74 4.334 4.610 -0.276 1
1 833 . 5 1 1 A 74 74 ARG C C 74 176.188 175.914 0.274 1
1 834 . 5 1 1 A 74 74 ARG CA C 74 56.300 55.706 0.594 1
1 835 . 5 1 1 A 74 74 ARG CB C 74 30.668 31.680 -1.012 1
1 838 . 5 1 1 A 75 75 ASN C C 75 174.462 173.584 0.878 1
1 839 . 5 1 1 A 75 75 ASN CA C 75 53.148 51.254 1.894 1
1 840 . 5 1 1 A 75 75 ASN CB C 75 39.046 41.833 -2.787 1
1 841 . 5 1 1 A 76 76 ASP H H 76 8.257 8.985 -0.728 1
1 842 . 5 1 1 A 76 76 ASP HA H 76 4.877 5.264 -0.387 1
1 845 . 5 1 1 A 76 76 ASP C C 76 174.759 173.807 0.952 1
1 846 . 5 1 1 A 76 76 ASP CA C 76 52.380 51.381 0.999 1
1 847 . 5 1 1 A 76 76 ASP CB C 76 41.267 41.464 -0.197 1
1 848 . 5 1 1 A 76 76 ASP N N 76 122.030 123.747 -1.717 1
1 849 . 5 1 1 A 77 77 PRO HA H 77 4.466 4.486 -0.020 1
1 856 . 5 1 1 A 77 77 PRO C C 77 177.133 177.023 0.110 1
1 857 . 5 1 1 A 77 77 PRO CA C 77 63.733 62.858 0.875 1
1 858 . 5 1 1 A 77 77 PRO CB C 77 31.919 32.194 -0.275 1
1 861 . 5 1 1 A 78 78 SER H H 78 8.457 8.396 0.061 1
1 862 . 5 1 1 A 78 78 SER HA H 78 4.479 4.299 0.180 1
1 865 . 5 1 1 A 78 78 SER C C 78 174.731 174.839 -0.108 1
1 866 . 5 1 1 A 78 78 SER CA C 78 58.691 60.534 -1.843 1
1 867 . 5 1 1 A 78 78 SER CB C 78 63.973 63.051 0.922 1
1 868 . 5 1 1 A 78 78 SER N N 78 115.711 119.222 -3.511 1
1 869 . 5 1 1 A 79 79 GLY H H 79 8.090 8.237 -0.147 1
1 870 . 5 1 1 A 79 79 GLY HA2 H 79 4.179 4.123 0.056 1
1 871 . 5 1 1 A 79 79 GLY HA3 H 79 4.065 4.130 -0.065 1
1 872 . 5 1 1 A 79 79 GLY CA C 79 44.746 45.584 -0.838 1
1 873 . 5 1 1 A 79 79 GLY N N 79 110.429 112.280 -1.851 1
1 874 . 5 1 1 A 80 80 PRO HA H 80 4.464 4.570 -0.106 1
1 880 . 5 1 1 A 80 80 PRO C C 80 177.499 175.745 1.754 1
1 881 . 5 1 1 A 80 80 PRO CA C 80 63.275 62.440 0.835 1
1 882 . 5 1 1 A 80 80 PRO CB C 80 32.249 33.166 -0.917 1
1 1 . 6 1 1 A 13 13 ASN HA H 13 4.787 5.183 -0.396 1
1 6 . 6 1 1 A 13 13 ASN CA C 13 53.148 53.205 -0.057 1
1 7 . 6 1 1 A 13 13 ASN CB C 13 39.378 39.984 -0.606 1
1 9 . 6 1 1 A 14 14 LEU H H 14 8.418 8.571 -0.153 1
1 10 . 6 1 1 A 14 14 LEU HA H 14 4.654 4.700 -0.046 1
1 20 . 6 1 1 A 14 14 LEU CA C 14 52.999 51.658 1.341 1
1 21 . 6 1 1 A 14 14 LEU CB C 14 41.919 43.259 -1.340 1
1 25 . 6 1 1 A 14 14 LEU N N 14 122.671 121.438 1.233 1
1 26 . 6 1 1 A 15 15 PRO HA H 15 4.460 4.605 -0.145 1
1 33 . 6 1 1 A 15 15 PRO C C 15 178.156 177.538 0.618 1
1 34 . 6 1 1 A 15 15 PRO CA C 15 63.101 62.624 0.477 1
1 35 . 6 1 1 A 15 15 PRO CB C 15 32.304 32.535 -0.231 1
1 38 . 6 1 1 A 16 16 ALA H H 16 8.973 8.641 0.332 1
1 39 . 6 1 1 A 16 16 ALA HA H 16 4.021 3.935 0.086 1
1 43 . 6 1 1 A 16 16 ALA C C 16 180.695 179.571 1.124 1
1 44 . 6 1 1 A 16 16 ALA CA C 16 55.642 55.579 0.063 1
1 45 . 6 1 1 A 16 16 ALA CB C 16 18.552 18.749 -0.197 1
1 46 . 6 1 1 A 16 16 ALA N N 16 128.311 126.769 1.542 1
1 47 . 6 1 1 A 17 17 GLU H H 17 9.558 8.413 1.145 1
1 48 . 6 1 1 A 17 17 GLU HA H 17 4.065 3.989 0.076 1
1 53 . 6 1 1 A 17 17 GLU C C 17 178.886 178.931 -0.045 1
1 54 . 6 1 1 A 17 17 GLU CA C 17 59.400 59.838 -0.438 1
1 55 . 6 1 1 A 17 17 GLU CB C 17 28.742 29.503 -0.761 1
1 57 . 6 1 1 A 17 17 GLU N N 17 117.113 118.771 -1.658 1
1 58 . 6 1 1 A 18 18 SER H H 18 7.263 8.015 -0.752 1
1 59 . 6 1 1 A 18 18 SER HA H 18 4.180 4.149 0.031 1
1 62 . 6 1 1 A 18 18 SER C C 18 174.951 176.190 -1.239 1
1 63 . 6 1 1 A 18 18 SER CA C 18 61.969 62.522 -0.553 1
1 64 . 6 1 1 A 18 18 SER CB C 18 62.554 62.997 -0.443 1
1 65 . 6 1 1 A 18 18 SER N N 18 114.932 117.389 -2.457 1
1 66 . 6 1 1 A 19 19 VAL H H 19 7.620 8.294 -0.674 1
1 67 . 6 1 1 A 19 19 VAL HA H 19 3.011 3.158 -0.147 1
1 75 . 6 1 1 A 19 19 VAL C C 19 176.953 177.716 -0.763 1
1 76 . 6 1 1 A 19 19 VAL CA C 19 66.479 66.627 -0.148 1
1 77 . 6 1 1 A 19 19 VAL CB C 19 31.569 31.427 0.142 1
1 80 . 6 1 1 A 19 19 VAL N N 19 121.086 121.574 -0.488 1
1 81 . 6 1 1 A 20 20 LYS H H 20 7.745 8.467 -0.722 1
1 82 . 6 1 1 A 20 20 LYS HA H 20 3.884 3.997 -0.113 1
1 91 . 6 1 1 A 20 20 LYS C C 20 178.150 178.743 -0.593 1
1 92 . 6 1 1 A 20 20 LYS CA C 20 59.984 59.741 0.243 1
1 93 . 6 1 1 A 20 20 LYS CB C 20 32.351 32.159 0.192 1
1 97 . 6 1 1 A 20 20 LYS N N 20 119.366 119.618 -0.252 1
1 98 . 6 1 1 A 21 21 ILE H H 21 6.943 7.911 -0.968 1
1 99 . 6 1 1 A 21 21 ILE HA H 21 3.783 3.638 0.145 1
1 109 . 6 1 1 A 21 21 ILE C C 21 178.996 178.601 0.395 1
1 110 . 6 1 1 A 21 21 ILE CA C 21 64.642 65.577 -0.935 1
1 111 . 6 1 1 A 21 21 ILE CB C 21 38.014 37.678 0.336 1
1 115 . 6 1 1 A 21 21 ILE N N 21 118.163 119.774 -1.611 1
1 116 . 6 1 1 A 22 22 LEU H H 22 7.267 8.251 -0.984 1
1 117 . 6 1 1 A 22 22 LEU HA H 22 3.748 4.039 -0.291 1
1 127 . 6 1 1 A 22 22 LEU C C 22 178.289 178.756 -0.467 1
1 128 . 6 1 1 A 22 22 LEU CA C 22 58.092 57.831 0.261 1
1 129 . 6 1 1 A 22 22 LEU CB C 22 38.551 40.757 -2.206 1
1 133 . 6 1 1 A 22 22 LEU N N 22 120.609 119.280 1.329 1
1 134 . 6 1 1 A 23 23 ARG H H 23 8.676 8.804 -0.128 1
1 135 . 6 1 1 A 23 23 ARG HA H 23 4.030 4.201 -0.171 1
1 142 . 6 1 1 A 23 23 ARG C C 23 178.861 178.400 0.461 1
1 143 . 6 1 1 A 23 23 ARG CA C 23 60.404 60.103 0.301 1
1 144 . 6 1 1 A 23 23 ARG CB C 23 30.351 30.335 0.016 1
1 147 . 6 1 1 A 23 23 ARG N N 23 119.148 118.109 1.039 1
1 148 . 6 1 1 A 24 24 ASP H H 24 8.515 8.452 0.063 1
1 149 . 6 1 1 A 24 24 ASP HA H 24 4.519 4.391 0.128 1
1 152 . 6 1 1 A 24 24 ASP C C 24 178.759 178.550 0.209 1
1 153 . 6 1 1 A 24 24 ASP CA C 24 57.556 57.271 0.285 1
1 154 . 6 1 1 A 24 24 ASP CB C 24 40.569 41.413 -0.844 1
1 155 . 6 1 1 A 24 24 ASP N N 24 120.027 119.535 0.492 1
1 156 . 6 1 1 A 25 25 TRP H H 25 8.158 8.177 -0.019 1
1 157 . 6 1 1 A 25 25 TRP HA H 25 4.181 4.450 -0.269 1
1 166 . 6 1 1 A 25 25 TRP C C 25 179.946 178.406 1.540 1
1 167 . 6 1 1 A 25 25 TRP CA C 25 63.346 61.346 2.000 1
1 168 . 6 1 1 A 25 25 TRP CB C 25 29.433 29.693 -0.260 1
1 174 . 6 1 1 A 25 25 TRP N N 25 121.350 121.569 -0.219 1
1 176 . 6 1 1 A 26 26 MET H H 26 8.977 8.863 0.114 1
1 177 . 6 1 1 A 26 26 MET HA H 26 4.076 4.471 -0.395 1
1 185 . 6 1 1 A 26 26 MET C C 26 177.371 178.179 -0.808 1
1 186 . 6 1 1 A 26 26 MET CA C 26 60.454 58.840 1.614 1
1 187 . 6 1 1 A 26 26 MET CB C 26 33.567 32.590 0.977 1
1 190 . 6 1 1 A 26 26 MET N N 26 119.977 118.792 1.185 1
1 191 . 6 1 1 A 27 27 TYR H H 27 8.604 8.092 0.512 1
1 192 . 6 1 1 A 27 27 TYR HA H 27 4.138 4.279 -0.141 1
1 199 . 6 1 1 A 27 27 TYR C C 27 178.901 177.596 1.305 1
1 200 . 6 1 1 A 27 27 TYR CA C 27 61.846 61.534 0.312 1
1 201 . 6 1 1 A 27 27 TYR CB C 27 38.165 38.547 -0.382 1
1 206 . 6 1 1 A 27 27 TYR N N 27 117.797 121.422 -3.625 1
1 207 . 6 1 1 A 28 28 LYS H H 28 7.867 7.737 0.130 1
1 208 . 6 1 1 A 28 28 LYS HA H 28 3.797 3.651 0.146 1
1 217 . 6 1 1 A 28 28 LYS C C 28 176.858 177.662 -0.804 1
1 218 . 6 1 1 A 28 28 LYS CA C 28 58.174 59.041 -0.867 1
1 219 . 6 1 1 A 28 28 LYS CB C 28 32.516 32.245 0.271 1
1 223 . 6 1 1 A 28 28 LYS N N 28 118.982 117.764 1.218 1
1 224 . 6 1 1 A 29 29 HIS H H 29 7.443 7.195 0.248 1
1 225 . 6 1 1 A 29 29 HIS HA H 29 4.386 4.390 -0.004 1
1 230 . 6 1 1 A 29 29 HIS C C 29 176.085 175.829 0.256 1
1 231 . 6 1 1 A 29 29 HIS CA C 29 55.213 55.063 0.150 1
1 232 . 6 1 1 A 29 29 HIS CB C 29 27.085 28.875 -1.790 1
1 235 . 6 1 1 A 29 29 HIS N N 29 117.138 115.551 1.587 1
1 236 . 6 1 1 A 30 30 ARG H H 30 6.921 8.155 -1.234 1
1 237 . 6 1 1 A 30 30 ARG HA H 30 3.898 4.394 -0.496 1
1 244 . 6 1 1 A 30 30 ARG C C 30 175.808 178.093 -2.285 1
1 245 . 6 1 1 A 30 30 ARG CA C 30 58.609 58.656 -0.047 1
1 246 . 6 1 1 A 30 30 ARG CB C 30 28.739 29.960 -1.221 1
1 249 . 6 1 1 A 30 30 ARG N N 30 117.911 119.472 -1.561 1
1 250 . 6 1 1 A 31 31 PHE H H 31 7.819 8.343 -0.524 1
1 251 . 6 1 1 A 31 31 PHE HA H 31 4.533 4.204 0.329 1
1 259 . 6 1 1 A 31 31 PHE C C 31 175.577 178.456 -2.879 1
1 260 . 6 1 1 A 31 31 PHE CA C 31 58.029 61.259 -3.230 1
1 261 . 6 1 1 A 31 31 PHE CB C 31 37.792 38.924 -1.132 1
1 267 . 6 1 1 A 31 31 PHE N N 31 115.408 119.001 -3.593 1
1 268 . 6 1 1 A 32 32 LYS H H 32 7.858 7.716 0.142 1
1 269 . 6 1 1 A 32 32 LYS HA H 32 4.487 4.259 0.228 1
1 277 . 6 1 1 A 32 32 LYS C C 32 175.557 176.526 -0.969 1
1 278 . 6 1 1 A 32 32 LYS CA C 32 56.329 58.985 -2.656 1
1 279 . 6 1 1 A 32 32 LYS CB C 32 32.743 33.111 -0.368 1
1 283 . 6 1 1 A 32 32 LYS N N 32 122.453 116.371 6.082 1
1 284 . 6 1 1 A 33 33 ALA H H 33 8.643 8.258 0.385 1
1 285 . 6 1 1 A 33 33 ALA HA H 33 4.403 4.004 0.399 1
1 289 . 6 1 1 A 33 33 ALA C C 33 176.273 175.208 1.065 1
1 290 . 6 1 1 A 33 33 ALA CA C 33 53.579 53.305 0.274 1
1 291 . 6 1 1 A 33 33 ALA CB C 33 18.653 17.157 1.496 1
1 292 . 6 1 1 A 33 33 ALA N N 33 127.853 119.781 8.072 1
1 293 . 6 1 1 A 34 34 TYR H H 34 7.878 7.958 -0.080 1
1 294 . 6 1 1 A 34 34 TYR HA H 34 4.686 4.948 -0.262 1
1 301 . 6 1 1 A 34 34 TYR C C 34 173.133 173.307 -0.174 1
1 302 . 6 1 1 A 34 34 TYR CA C 34 54.778 54.922 -0.144 1
1 303 . 6 1 1 A 34 34 TYR CB C 34 39.619 40.672 -1.053 1
1 308 . 6 1 1 A 34 34 TYR N N 34 116.539 116.785 -0.246 1
1 309 . 6 1 1 A 35 35 PRO HA H 35 4.526 4.644 -0.118 1
1 316 . 6 1 1 A 35 35 PRO C C 35 176.837 175.520 1.317 1
1 317 . 6 1 1 A 35 35 PRO CA C 35 61.864 62.129 -0.265 1
1 318 . 6 1 1 A 35 35 PRO CB C 35 30.904 32.270 -1.366 1
1 321 . 6 1 1 A 36 36 SER H H 36 9.634 8.409 1.225 1
1 322 . 6 1 1 A 36 36 SER HA H 36 4.518 4.775 -0.257 1
1 325 . 6 1 1 A 36 36 SER C C 36 175.001 175.093 -0.092 1
1 326 . 6 1 1 A 36 36 SER CA C 36 57.129 56.483 0.646 1
1 327 . 6 1 1 A 36 36 SER CB C 36 65.374 65.455 -0.081 1
1 328 . 6 1 1 A 36 36 SER N N 36 119.984 116.657 3.327 1
1 329 . 6 1 1 A 37 37 GLU H H 37 9.091 9.067 0.024 1
1 330 . 6 1 1 A 37 37 GLU HA H 37 3.884 3.939 -0.055 1
1 335 . 6 1 1 A 37 37 GLU C C 37 179.347 178.122 1.225 1
1 336 . 6 1 1 A 37 37 GLU CA C 37 60.454 59.474 0.980 1
1 337 . 6 1 1 A 37 37 GLU CB C 37 28.623 29.482 -0.859 1
1 339 . 6 1 1 A 37 37 GLU N N 37 120.748 126.264 -5.516 1
1 340 . 6 1 1 A 38 38 GLU H H 38 8.760 8.054 0.706 1
1 341 . 6 1 1 A 38 38 GLU HA H 38 4.048 4.086 -0.038 1
1 346 . 6 1 1 A 38 38 GLU C C 38 179.975 178.759 1.216 1
1 347 . 6 1 1 A 38 38 GLU CA C 38 60.243 58.965 1.278 1
1 348 . 6 1 1 A 38 38 GLU CB C 38 29.117 29.853 -0.736 1
1 350 . 6 1 1 A 38 38 GLU N N 38 119.272 118.823 0.449 1
1 351 . 6 1 1 A 39 39 GLU H H 39 7.856 8.177 -0.321 1
1 352 . 6 1 1 A 39 39 GLU HA H 39 3.976 3.989 -0.013 1
1 357 . 6 1 1 A 39 39 GLU C C 39 178.912 178.790 0.122 1
1 358 . 6 1 1 A 39 39 GLU CA C 39 59.131 59.089 0.042 1
1 359 . 6 1 1 A 39 39 GLU CB C 39 29.612 28.964 0.648 1
1 361 . 6 1 1 A 39 39 GLU N N 39 121.658 120.568 1.090 1
1 362 . 6 1 1 A 40 40 LYS H H 40 8.653 7.790 0.863 1
1 363 . 6 1 1 A 40 40 LYS HA H 40 3.508 3.833 -0.325 1
1 372 . 6 1 1 A 40 40 LYS C C 40 177.974 179.121 -1.147 1
1 373 . 6 1 1 A 40 40 LYS CA C 40 60.948 59.465 1.483 1
1 374 . 6 1 1 A 40 40 LYS CB C 40 32.714 32.140 0.574 1
1 378 . 6 1 1 A 40 40 LYS N N 40 119.152 119.636 -0.484 1
1 379 . 6 1 1 A 41 41 GLN H H 41 7.876 7.859 0.017 1
1 380 . 6 1 1 A 41 41 GLN HA H 41 3.911 3.979 -0.068 1
1 387 . 6 1 1 A 41 41 GLN C C 41 178.352 178.081 0.271 1
1 388 . 6 1 1 A 41 41 GLN CA C 41 58.973 58.988 -0.015 1
1 389 . 6 1 1 A 41 41 GLN CB C 41 27.552 28.753 -1.201 1
1 391 . 6 1 1 A 41 41 GLN N N 41 118.910 119.563 -0.653 1
1 393 . 6 1 1 A 42 42 MET H H 42 7.771 7.872 -0.101 1
1 394 . 6 1 1 A 42 42 MET HA H 42 4.158 4.185 -0.027 1
1 402 . 6 1 1 A 42 42 MET C C 42 179.310 178.294 1.016 1
1 403 . 6 1 1 A 42 42 MET CA C 42 59.079 58.373 0.706 1
1 404 . 6 1 1 A 42 42 MET CB C 42 31.023 32.385 -1.362 1
1 407 . 6 1 1 A 42 42 MET N N 42 121.131 119.211 1.920 1
1 408 . 6 1 1 A 43 43 LEU H H 43 8.400 8.483 -0.083 1
1 409 . 6 1 1 A 43 43 LEU HA H 43 3.888 3.944 -0.056 1
1 419 . 6 1 1 A 43 43 LEU C C 43 180.721 179.183 1.538 1
1 420 . 6 1 1 A 43 43 LEU CA C 43 57.916 57.998 -0.082 1
1 421 . 6 1 1 A 43 43 LEU CB C 43 42.080 41.422 0.658 1
1 425 . 6 1 1 A 43 43 LEU N N 43 120.124 120.701 -0.577 1
1 426 . 6 1 1 A 44 44 SER H H 44 8.658 8.469 0.189 1
1 427 . 6 1 1 A 44 44 SER HA H 44 4.088 4.202 -0.114 1
1 430 . 6 1 1 A 44 44 SER C C 44 176.859 176.648 0.211 1
1 431 . 6 1 1 A 44 44 SER CA C 44 61.371 61.005 0.366 1
1 432 . 6 1 1 A 44 44 SER CB C 44 63.314 63.119 0.195 1
1 433 . 6 1 1 A 44 44 SER N N 44 119.795 113.892 5.903 1
1 434 . 6 1 1 A 45 45 GLU H H 45 7.905 7.612 0.293 1
1 435 . 6 1 1 A 45 45 GLU HA H 45 4.094 4.223 -0.129 1
1 440 . 6 1 1 A 45 45 GLU C C 45 179.095 179.038 0.057 1
1 441 . 6 1 1 A 45 45 GLU CA C 45 59.255 58.966 0.289 1
1 442 . 6 1 1 A 45 45 GLU CB C 45 29.200 29.706 -0.506 1
1 444 . 6 1 1 A 45 45 GLU N N 45 120.609 121.248 -0.639 1
1 445 . 6 1 1 A 46 46 LYS H H 46 7.837 7.697 0.140 1
1 446 . 6 1 1 A 46 46 LYS HA H 46 4.231 4.158 0.073 1
1 453 . 6 1 1 A 46 46 LYS C C 46 177.964 177.883 0.081 1
1 454 . 6 1 1 A 46 46 LYS CA C 46 58.278 58.619 -0.341 1
1 455 . 6 1 1 A 46 46 LYS CB C 46 34.110 32.445 1.665 1
1 459 . 6 1 1 A 46 46 LYS N N 46 115.471 118.982 -3.511 1
1 460 . 6 1 1 A 47 47 THR H H 47 7.763 7.946 -0.183 1
1 461 . 6 1 1 A 47 47 THR HA H 47 4.271 4.346 -0.075 1
1 466 . 6 1 1 A 47 47 THR C C 47 175.472 175.024 0.448 1
1 467 . 6 1 1 A 47 47 THR CA C 47 62.429 61.915 0.514 1
1 468 . 6 1 1 A 47 47 THR CB C 47 71.966 70.722 1.244 1
1 470 . 6 1 1 A 47 47 THR N N 47 104.286 107.895 -3.609 1
1 471 . 6 1 1 A 48 48 ASN H H 48 8.169 8.579 -0.410 1
1 472 . 6 1 1 A 48 48 ASN HA H 48 4.437 4.547 -0.110 1
1 477 . 6 1 1 A 48 48 ASN C C 48 173.874 173.923 -0.049 1
1 478 . 6 1 1 A 48 48 ASN CA C 48 55.377 54.261 1.116 1
1 479 . 6 1 1 A 48 48 ASN CB C 48 37.770 37.404 0.366 1
1 480 . 6 1 1 A 48 48 ASN N N 48 117.458 119.557 -2.099 1
1 482 . 6 1 1 A 49 49 LEU H H 49 7.532 7.278 0.254 1
1 483 . 6 1 1 A 49 49 LEU HA H 49 4.733 4.784 -0.051 1
1 493 . 6 1 1 A 49 49 LEU C C 49 176.625 175.630 0.995 1
1 494 . 6 1 1 A 49 49 LEU CA C 49 53.226 53.428 -0.202 1
1 495 . 6 1 1 A 49 49 LEU CB C 49 44.114 43.356 0.758 1
1 499 . 6 1 1 A 49 49 LEU N N 49 118.220 120.137 -1.917 1
1 500 . 6 1 1 A 50 50 SER H H 50 9.140 8.705 0.435 1
1 501 . 6 1 1 A 50 50 SER HA H 50 4.475 4.849 -0.374 1
1 504 . 6 1 1 A 50 50 SER C C 50 174.907 174.983 -0.076 1
1 505 . 6 1 1 A 50 50 SER CA C 50 56.964 57.686 -0.722 1
1 506 . 6 1 1 A 50 50 SER CB C 50 65.372 64.938 0.434 1
1 507 . 6 1 1 A 50 50 SER N N 50 117.569 117.622 -0.053 1
1 508 . 6 1 1 A 51 51 LEU H H 51 8.756 8.755 0.001 1
1 509 . 6 1 1 A 51 51 LEU HA H 51 3.874 3.927 -0.053 1
1 519 . 6 1 1 A 51 51 LEU C C 51 179.910 178.753 1.157 1
1 520 . 6 1 1 A 51 51 LEU CA C 51 58.916 58.134 0.782 1
1 521 . 6 1 1 A 51 51 LEU CB C 51 41.148 41.463 -0.315 1
1 525 . 6 1 1 A 51 51 LEU N N 51 120.905 125.880 -4.975 1
1 526 . 6 1 1 A 52 52 LEU H H 52 8.146 8.273 -0.127 1
1 527 . 6 1 1 A 52 52 LEU HA H 52 4.179 4.053 0.126 1
1 537 . 6 1 1 A 52 52 LEU C C 52 178.936 178.710 0.226 1
1 538 . 6 1 1 A 52 52 LEU CA C 52 58.162 58.454 -0.292 1
1 539 . 6 1 1 A 52 52 LEU CB C 52 42.137 41.719 0.418 1
1 543 . 6 1 1 A 52 52 LEU N N 52 120.685 120.120 0.565 1
1 544 . 6 1 1 A 53 53 GLN H H 53 7.924 8.244 -0.320 1
1 545 . 6 1 1 A 53 53 GLN HA H 53 4.102 4.140 -0.038 1
1 552 . 6 1 1 A 53 53 GLN C C 53 180.308 178.774 1.534 1
1 553 . 6 1 1 A 53 53 GLN CA C 53 59.326 58.557 0.769 1
1 554 . 6 1 1 A 53 53 GLN CB C 53 29.900 28.431 1.469 1
1 556 . 6 1 1 A 53 53 GLN N N 53 118.473 117.683 0.790 1
1 558 . 6 1 1 A 54 54 ILE H H 54 8.380 8.254 0.126 1
1 559 . 6 1 1 A 54 54 ILE HA H 54 3.677 3.682 -0.005 1
1 569 . 6 1 1 A 54 54 ILE C C 54 177.673 177.991 -0.318 1
1 570 . 6 1 1 A 54 54 ILE CA C 54 64.650 65.562 -0.912 1
1 571 . 6 1 1 A 54 54 ILE CB C 54 37.476 37.748 -0.272 1
1 575 . 6 1 1 A 54 54 ILE N N 54 120.113 121.452 -1.339 1
1 576 . 6 1 1 A 55 55 SER H H 55 8.854 8.079 0.775 1
1 577 . 6 1 1 A 55 55 SER HA H 55 4.267 4.290 -0.023 1
1 580 . 6 1 1 A 55 55 SER C C 55 177.127 176.797 0.330 1
1 581 . 6 1 1 A 55 55 SER CA C 55 62.852 62.136 0.716 1
1 582 . 6 1 1 A 55 55 SER CB C 55 62.727 62.972 -0.245 1
1 583 . 6 1 1 A 55 55 SER N N 55 116.646 116.233 0.413 1
1 584 . 6 1 1 A 56 56 ASN H H 56 8.634 8.296 0.338 1
1 585 . 6 1 1 A 56 56 ASN HA H 56 4.549 4.448 0.101 1
1 590 . 6 1 1 A 56 56 ASN C C 56 177.481 178.195 -0.714 1
1 591 . 6 1 1 A 56 56 ASN CA C 56 55.951 56.639 -0.688 1
1 592 . 6 1 1 A 56 56 ASN CB C 56 37.852 38.267 -0.415 1
1 593 . 6 1 1 A 56 56 ASN N N 56 119.048 119.737 -0.689 1
1 595 . 6 1 1 A 57 57 TRP H H 57 8.373 8.176 0.197 1
1 596 . 6 1 1 A 57 57 TRP HA H 57 4.065 4.460 -0.395 1
1 605 . 6 1 1 A 57 57 TRP C C 57 179.392 177.968 1.424 1
1 606 . 6 1 1 A 57 57 TRP CA C 57 63.204 61.202 2.002 1
1 607 . 6 1 1 A 57 57 TRP CB C 57 28.376 30.461 -2.085 1
1 613 . 6 1 1 A 57 57 TRP N N 57 122.950 122.933 0.017 1
1 615 . 6 1 1 A 58 58 PHE H H 58 8.428 8.546 -0.118 1
1 616 . 6 1 1 A 58 58 PHE HA H 58 3.922 3.856 0.066 1
1 624 . 6 1 1 A 58 58 PHE C C 58 178.237 177.808 0.429 1
1 625 . 6 1 1 A 58 58 PHE CA C 58 64.015 61.383 2.632 1
1 626 . 6 1 1 A 58 58 PHE CB C 58 39.602 38.606 0.996 1
1 632 . 6 1 1 A 58 58 PHE N N 58 116.774 117.579 -0.805 1
1 633 . 6 1 1 A 59 59 ILE H H 59 7.925 8.240 -0.315 1
1 634 . 6 1 1 A 59 59 ILE HA H 59 3.773 3.675 0.098 1
1 644 . 6 1 1 A 59 59 ILE C C 59 178.745 177.623 1.122 1
1 645 . 6 1 1 A 59 59 ILE CA C 59 65.531 65.260 0.271 1
1 646 . 6 1 1 A 59 59 ILE CB C 59 38.480 37.851 0.629 1
1 650 . 6 1 1 A 59 59 ILE N N 59 119.560 119.959 -0.399 1
1 651 . 6 1 1 A 60 60 ASN H H 60 7.506 7.853 -0.347 1
1 652 . 6 1 1 A 60 60 ASN HA H 60 4.407 4.382 0.025 1
1 657 . 6 1 1 A 60 60 ASN C C 60 177.163 177.824 -0.661 1
1 658 . 6 1 1 A 60 60 ASN CA C 60 55.871 56.346 -0.475 1
1 659 . 6 1 1 A 60 60 ASN CB C 60 38.878 37.917 0.961 1
1 660 . 6 1 1 A 60 60 ASN N N 60 116.868 117.968 -1.100 1
1 662 . 6 1 1 A 61 61 ALA H H 61 8.410 8.030 0.380 1
1 663 . 6 1 1 A 61 61 ALA HA H 61 3.667 3.679 -0.012 1
1 667 . 6 1 1 A 61 61 ALA C C 61 180.061 179.887 0.174 1
1 668 . 6 1 1 A 61 61 ALA CA C 61 54.601 54.112 0.489 1
1 669 . 6 1 1 A 61 61 ALA CB C 61 18.241 16.867 1.374 1
1 670 . 6 1 1 A 61 61 ALA N N 61 123.022 122.055 0.967 1
1 671 . 6 1 1 A 62 62 ARG H H 62 8.036 7.842 0.194 1
1 672 . 6 1 1 A 62 62 ARG HA H 62 4.092 4.033 0.059 1
1 679 . 6 1 1 A 62 62 ARG C C 62 176.756 177.393 -0.637 1
1 680 . 6 1 1 A 62 62 ARG CA C 62 58.762 58.272 0.490 1
1 681 . 6 1 1 A 62 62 ARG CB C 62 30.601 30.023 0.578 1
1 684 . 6 1 1 A 62 62 ARG N N 62 117.168 118.797 -1.629 1
1 685 . 6 1 1 A 63 63 ARG H H 63 7.214 7.953 -0.739 1
1 686 . 6 1 1 A 63 63 ARG HA H 63 4.249 4.373 -0.124 1
1 693 . 6 1 1 A 63 63 ARG C C 63 176.945 176.753 0.192 1
1 694 . 6 1 1 A 63 63 ARG CA C 63 57.669 56.213 1.456 1
1 695 . 6 1 1 A 63 63 ARG CB C 63 30.765 30.948 -0.183 1
1 698 . 6 1 1 A 63 63 ARG N N 63 116.514 117.722 -1.208 1
1 699 . 6 1 1 A 64 64 ARG H H 64 7.913 7.786 0.127 1
1 700 . 6 1 1 A 64 64 ARG HA H 64 4.351 4.383 -0.032 1
1 707 . 6 1 1 A 64 64 ARG C C 64 176.413 177.705 -1.292 1
1 708 . 6 1 1 A 64 64 ARG CA C 64 57.105 56.793 0.312 1
1 709 . 6 1 1 A 64 64 ARG CB C 64 31.672 32.355 -0.683 1
1 712 . 6 1 1 A 64 64 ARG N N 64 116.818 116.751 0.067 1
1 713 . 6 1 1 A 65 65 ILE H H 65 8.169 8.319 -0.150 1
1 714 . 6 1 1 A 65 65 ILE HA H 65 4.285 3.698 0.587 1
1 724 . 6 1 1 A 65 65 ILE C C 65 176.208 177.982 -1.774 1
1 725 . 6 1 1 A 65 65 ILE CA C 65 62.005 65.188 -3.183 1
1 726 . 6 1 1 A 65 65 ILE CB C 65 39.088 37.650 1.438 1
1 730 . 6 1 1 A 65 65 ILE N N 65 119.185 120.863 -1.678 1
1 731 . 6 1 1 A 66 66 LEU H H 66 7.962 7.864 0.098 1
1 732 . 6 1 1 A 66 66 LEU HA H 66 4.485 4.102 0.383 1
1 742 . 6 1 1 A 66 66 LEU C C 66 176.216 175.143 1.073 1
1 743 . 6 1 1 A 66 66 LEU CA C 66 56.153 59.931 -3.778 1
1 744 . 6 1 1 A 66 66 LEU CB C 66 40.792 40.179 0.613 1
1 748 . 6 1 1 A 66 66 LEU N N 66 124.389 121.650 2.739 1
1 749 . 6 1 1 A 67 67 PRO HA H 67 4.283 4.397 -0.114 1
1 756 . 6 1 1 A 67 67 PRO C C 67 178.294 178.409 -0.115 1
1 757 . 6 1 1 A 67 67 PRO CA C 67 65.390 65.257 0.133 1
1 758 . 6 1 1 A 67 67 PRO CB C 67 31.095 30.968 0.127 1
1 761 . 6 1 1 A 68 68 ASP H H 68 7.913 8.759 -0.846 1
1 762 . 6 1 1 A 68 68 ASP HA H 68 4.507 4.406 0.101 1
1 765 . 6 1 1 A 68 68 ASP C C 68 177.927 177.872 0.055 1
1 766 . 6 1 1 A 68 68 ASP CA C 68 55.906 56.818 -0.912 1
1 767 . 6 1 1 A 68 68 ASP CB C 68 40.736 40.629 0.107 1
1 768 . 6 1 1 A 68 68 ASP N N 68 117.231 117.274 -0.043 1
1 769 . 6 1 1 A 69 69 MET H H 69 8.083 8.591 -0.508 1
1 770 . 6 1 1 A 69 69 MET HA H 69 4.362 4.313 0.049 1
1 778 . 6 1 1 A 69 69 MET C C 69 177.374 178.878 -1.504 1
1 779 . 6 1 1 A 69 69 MET CA C 69 57.634 58.274 -0.640 1
1 780 . 6 1 1 A 69 69 MET CB C 69 32.816 32.703 0.113 1
1 783 . 6 1 1 A 69 69 MET N N 69 119.391 118.300 1.091 1
1 784 . 6 1 1 A 70 70 LEU H H 70 7.907 8.622 -0.715 1
1 785 . 6 1 1 A 70 70 LEU HA H 70 4.232 4.175 0.057 1
1 795 . 6 1 1 A 70 70 LEU C C 70 177.745 177.436 0.309 1
1 796 . 6 1 1 A 70 70 LEU CA C 70 55.835 57.635 -1.800 1
1 797 . 6 1 1 A 70 70 LEU CB C 70 42.174 41.640 0.534 1
1 801 . 6 1 1 A 70 70 LEU N N 70 119.266 123.392 -4.126 1
1 802 . 6 1 1 A 71 71 GLN H H 71 7.865 7.575 0.290 1
1 803 . 6 1 1 A 71 71 GLN HA H 71 4.287 4.373 -0.086 1
1 809 . 6 1 1 A 71 71 GLN C C 71 178.855 176.136 2.719 1
1 810 . 6 1 1 A 71 71 GLN CA C 71 56.383 56.349 0.034 1
1 811 . 6 1 1 A 71 71 GLN CB C 71 29.092 29.082 0.010 1
1 813 . 6 1 1 A 71 71 GLN N N 71 118.603 119.110 -0.507 1
1 815 . 6 1 1 A 72 72 GLN H H 72 8.189 8.441 -0.252 1
1 816 . 6 1 1 A 72 72 GLN HA H 72 4.302 4.183 0.119 1
1 821 . 6 1 1 A 72 72 GLN CA C 72 56.206 57.307 -1.101 1
1 822 . 6 1 1 A 72 72 GLN CB C 72 29.298 28.850 0.448 1
1 824 . 6 1 1 A 72 72 GLN N N 72 120.267 121.210 -0.943 1
1 825 . 6 1 1 A 73 73 ARG C C 73 176.105 175.635 0.470 1
1 826 . 6 1 1 A 74 74 ARG HA H 74 4.334 4.440 -0.106 1
1 833 . 6 1 1 A 74 74 ARG C C 74 176.188 176.318 -0.130 1
1 834 . 6 1 1 A 74 74 ARG CA C 74 56.300 56.453 -0.153 1
1 835 . 6 1 1 A 74 74 ARG CB C 74 30.668 30.910 -0.242 1
1 838 . 6 1 1 A 75 75 ASN C C 75 174.462 174.202 0.260 1
1 839 . 6 1 1 A 75 75 ASN CA C 75 53.148 54.050 -0.902 1
1 840 . 6 1 1 A 75 75 ASN CB C 75 39.046 38.721 0.325 1
1 841 . 6 1 1 A 76 76 ASP H H 76 8.257 8.718 -0.461 1
1 842 . 6 1 1 A 76 76 ASP HA H 76 4.877 5.089 -0.212 1
1 845 . 6 1 1 A 76 76 ASP C C 76 174.759 173.762 0.997 1
1 846 . 6 1 1 A 76 76 ASP CA C 76 52.380 50.530 1.850 1
1 847 . 6 1 1 A 76 76 ASP CB C 76 41.267 42.573 -1.306 1
1 848 . 6 1 1 A 76 76 ASP N N 76 122.030 126.295 -4.265 1
1 849 . 6 1 1 A 77 77 PRO HA H 77 4.466 4.579 -0.113 1
1 856 . 6 1 1 A 77 77 PRO C C 77 177.133 176.004 1.129 1
1 857 . 6 1 1 A 77 77 PRO CA C 77 63.733 62.465 1.268 1
1 858 . 6 1 1 A 77 77 PRO CB C 77 31.919 32.534 -0.615 1
1 861 . 6 1 1 A 78 78 SER H H 78 8.457 8.483 -0.026 1
1 862 . 6 1 1 A 78 78 SER HA H 78 4.479 4.767 -0.288 1
1 865 . 6 1 1 A 78 78 SER C C 78 174.731 174.285 0.446 1
1 866 . 6 1 1 A 78 78 SER CA C 78 58.691 57.313 1.378 1
1 867 . 6 1 1 A 78 78 SER CB C 78 63.973 63.569 0.404 1
1 868 . 6 1 1 A 78 78 SER N N 78 115.711 116.819 -1.108 1
1 869 . 6 1 1 A 79 79 GLY H H 79 8.090 9.110 -1.020 1
1 870 . 6 1 1 A 79 79 GLY HA2 H 79 4.179 4.221 -0.042 1
1 871 . 6 1 1 A 79 79 GLY HA3 H 79 4.065 4.222 -0.157 1
1 872 . 6 1 1 A 79 79 GLY CA C 79 44.746 44.061 0.685 1
1 873 . 6 1 1 A 79 79 GLY N N 79 110.429 114.588 -4.159 1
1 874 . 6 1 1 A 80 80 PRO HA H 80 4.464 4.761 -0.297 1
1 880 . 6 1 1 A 80 80 PRO C C 80 177.499 176.258 1.241 1
1 881 . 6 1 1 A 80 80 PRO CA C 80 63.275 62.914 0.361 1
1 882 . 6 1 1 A 80 80 PRO CB C 80 32.249 31.640 0.609 1
1 1 . 7 1 1 A 13 13 ASN HA H 13 4.787 5.506 -0.719 1
1 6 . 7 1 1 A 13 13 ASN CA C 13 53.148 52.204 0.944 1
1 7 . 7 1 1 A 13 13 ASN CB C 13 39.378 43.021 -3.643 1
1 9 . 7 1 1 A 14 14 LEU H H 14 8.418 8.669 -0.251 1
1 10 . 7 1 1 A 14 14 LEU HA H 14 4.654 4.525 0.129 1
1 20 . 7 1 1 A 14 14 LEU CA C 14 52.999 53.440 -0.441 1
1 21 . 7 1 1 A 14 14 LEU CB C 14 41.919 41.086 0.833 1
1 25 . 7 1 1 A 14 14 LEU N N 14 122.671 125.058 -2.387 1
1 26 . 7 1 1 A 15 15 PRO HA H 15 4.460 4.549 -0.089 1
1 33 . 7 1 1 A 15 15 PRO C C 15 178.156 177.487 0.669 1
1 34 . 7 1 1 A 15 15 PRO CA C 15 63.101 62.707 0.394 1
1 35 . 7 1 1 A 15 15 PRO CB C 15 32.304 32.786 -0.482 1
1 38 . 7 1 1 A 16 16 ALA H H 16 8.973 8.672 0.301 1
1 39 . 7 1 1 A 16 16 ALA HA H 16 4.021 3.973 0.048 1
1 43 . 7 1 1 A 16 16 ALA C C 16 180.695 179.514 1.181 1
1 44 . 7 1 1 A 16 16 ALA CA C 16 55.642 55.413 0.229 1
1 45 . 7 1 1 A 16 16 ALA CB C 16 18.552 18.590 -0.038 1
1 46 . 7 1 1 A 16 16 ALA N N 16 128.311 126.544 1.767 1
1 47 . 7 1 1 A 17 17 GLU H H 17 9.558 8.206 1.352 1
1 48 . 7 1 1 A 17 17 GLU HA H 17 4.065 4.075 -0.010 1
1 53 . 7 1 1 A 17 17 GLU C C 17 178.886 178.342 0.544 1
1 54 . 7 1 1 A 17 17 GLU CA C 17 59.400 59.350 0.050 1
1 55 . 7 1 1 A 17 17 GLU CB C 17 28.742 29.285 -0.543 1
1 57 . 7 1 1 A 17 17 GLU N N 17 117.113 117.244 -0.131 1
1 58 . 7 1 1 A 18 18 SER H H 18 7.263 8.288 -1.025 1
1 59 . 7 1 1 A 18 18 SER HA H 18 4.180 4.094 0.086 1
1 62 . 7 1 1 A 18 18 SER C C 18 174.951 176.559 -1.608 1
1 63 . 7 1 1 A 18 18 SER CA C 18 61.969 61.072 0.897 1
1 64 . 7 1 1 A 18 18 SER CB C 18 62.554 62.515 0.039 1
1 65 . 7 1 1 A 18 18 SER N N 18 114.932 115.458 -0.526 1
1 66 . 7 1 1 A 19 19 VAL H H 19 7.620 8.318 -0.698 1
1 67 . 7 1 1 A 19 19 VAL HA H 19 3.011 3.156 -0.145 1
1 75 . 7 1 1 A 19 19 VAL C C 19 176.953 177.641 -0.688 1
1 76 . 7 1 1 A 19 19 VAL CA C 19 66.479 66.872 -0.393 1
1 77 . 7 1 1 A 19 19 VAL CB C 19 31.569 31.448 0.121 1
1 80 . 7 1 1 A 19 19 VAL N N 19 121.086 121.924 -0.838 1
1 81 . 7 1 1 A 20 20 LYS H H 20 7.745 8.326 -0.581 1
1 82 . 7 1 1 A 20 20 LYS HA H 20 3.884 3.984 -0.100 1
1 91 . 7 1 1 A 20 20 LYS C C 20 178.150 178.809 -0.659 1
1 92 . 7 1 1 A 20 20 LYS CA C 20 59.984 59.792 0.192 1
1 93 . 7 1 1 A 20 20 LYS CB C 20 32.351 32.156 0.195 1
1 97 . 7 1 1 A 20 20 LYS N N 20 119.366 119.839 -0.473 1
1 98 . 7 1 1 A 21 21 ILE H H 21 6.943 7.828 -0.885 1
1 99 . 7 1 1 A 21 21 ILE HA H 21 3.783 3.647 0.136 1
1 109 . 7 1 1 A 21 21 ILE C C 21 178.996 178.703 0.293 1
1 110 . 7 1 1 A 21 21 ILE CA C 21 64.642 65.746 -1.104 1
1 111 . 7 1 1 A 21 21 ILE CB C 21 38.014 37.779 0.235 1
1 115 . 7 1 1 A 21 21 ILE N N 21 118.163 119.682 -1.519 1
1 116 . 7 1 1 A 22 22 LEU H H 22 7.267 7.940 -0.673 1
1 117 . 7 1 1 A 22 22 LEU HA H 22 3.748 3.844 -0.096 1
1 127 . 7 1 1 A 22 22 LEU C C 22 178.289 178.603 -0.314 1
1 128 . 7 1 1 A 22 22 LEU CA C 22 58.092 58.139 -0.047 1
1 129 . 7 1 1 A 22 22 LEU CB C 22 38.551 40.857 -2.306 1
1 133 . 7 1 1 A 22 22 LEU N N 22 120.609 119.775 0.834 1
1 134 . 7 1 1 A 23 23 ARG H H 23 8.676 8.779 -0.103 1
1 135 . 7 1 1 A 23 23 ARG HA H 23 4.030 4.159 -0.129 1
1 142 . 7 1 1 A 23 23 ARG C C 23 178.861 178.423 0.438 1
1 143 . 7 1 1 A 23 23 ARG CA C 23 60.404 60.151 0.253 1
1 144 . 7 1 1 A 23 23 ARG CB C 23 30.351 30.198 0.153 1
1 147 . 7 1 1 A 23 23 ARG N N 23 119.148 117.448 1.700 1
1 148 . 7 1 1 A 24 24 ASP H H 24 8.515 8.305 0.210 1
1 149 . 7 1 1 A 24 24 ASP HA H 24 4.519 4.381 0.138 1
1 152 . 7 1 1 A 24 24 ASP C C 24 178.759 178.541 0.218 1
1 153 . 7 1 1 A 24 24 ASP CA C 24 57.556 57.227 0.329 1
1 154 . 7 1 1 A 24 24 ASP CB C 24 40.569 40.898 -0.329 1
1 155 . 7 1 1 A 24 24 ASP N N 24 120.027 119.318 0.709 1
1 156 . 7 1 1 A 25 25 TRP H H 25 8.158 7.939 0.219 1
1 157 . 7 1 1 A 25 25 TRP HA H 25 4.181 4.459 -0.278 1
1 166 . 7 1 1 A 25 25 TRP C C 25 179.946 178.494 1.452 1
1 167 . 7 1 1 A 25 25 TRP CA C 25 63.346 60.922 2.424 1
1 168 . 7 1 1 A 25 25 TRP CB C 25 29.433 29.459 -0.026 1
1 174 . 7 1 1 A 25 25 TRP N N 25 121.350 121.875 -0.525 1
1 176 . 7 1 1 A 26 26 MET H H 26 8.977 8.728 0.249 1
1 177 . 7 1 1 A 26 26 MET HA H 26 4.076 4.569 -0.493 1
1 185 . 7 1 1 A 26 26 MET C C 26 177.371 178.174 -0.803 1
1 186 . 7 1 1 A 26 26 MET CA C 26 60.454 58.668 1.786 1
1 187 . 7 1 1 A 26 26 MET CB C 26 33.567 32.944 0.623 1
1 190 . 7 1 1 A 26 26 MET N N 26 119.977 118.769 1.208 1
1 191 . 7 1 1 A 27 27 TYR H H 27 8.604 8.228 0.376 1
1 192 . 7 1 1 A 27 27 TYR HA H 27 4.138 4.124 0.014 1
1 199 . 7 1 1 A 27 27 TYR C C 27 178.901 177.706 1.195 1
1 200 . 7 1 1 A 27 27 TYR CA C 27 61.846 61.328 0.518 1
1 201 . 7 1 1 A 27 27 TYR CB C 27 38.165 38.579 -0.414 1
1 206 . 7 1 1 A 27 27 TYR N N 27 117.797 121.313 -3.516 1
1 207 . 7 1 1 A 28 28 LYS H H 28 7.867 8.170 -0.303 1
1 208 . 7 1 1 A 28 28 LYS HA H 28 3.797 3.665 0.132 1
1 217 . 7 1 1 A 28 28 LYS C C 28 176.858 177.799 -0.941 1
1 218 . 7 1 1 A 28 28 LYS CA C 28 58.174 59.156 -0.982 1
1 219 . 7 1 1 A 28 28 LYS CB C 28 32.516 31.863 0.653 1
1 223 . 7 1 1 A 28 28 LYS N N 28 118.982 117.812 1.170 1
1 224 . 7 1 1 A 29 29 HIS H H 29 7.443 7.294 0.149 1
1 225 . 7 1 1 A 29 29 HIS HA H 29 4.386 4.339 0.047 1
1 230 . 7 1 1 A 29 29 HIS C C 29 176.085 175.933 0.152 1
1 231 . 7 1 1 A 29 29 HIS CA C 29 55.213 55.715 -0.502 1
1 232 . 7 1 1 A 29 29 HIS CB C 29 27.085 28.506 -1.421 1
1 235 . 7 1 1 A 29 29 HIS N N 29 117.138 115.662 1.476 1
1 236 . 7 1 1 A 30 30 ARG H H 30 6.921 8.074 -1.153 1
1 237 . 7 1 1 A 30 30 ARG HA H 30 3.898 4.293 -0.395 1
1 244 . 7 1 1 A 30 30 ARG C C 30 175.808 177.861 -2.053 1
1 245 . 7 1 1 A 30 30 ARG CA C 30 58.609 58.544 0.065 1
1 246 . 7 1 1 A 30 30 ARG CB C 30 28.739 29.582 -0.843 1
1 249 . 7 1 1 A 30 30 ARG N N 30 117.911 119.191 -1.280 1
1 250 . 7 1 1 A 31 31 PHE H H 31 7.819 7.680 0.139 1
1 251 . 7 1 1 A 31 31 PHE HA H 31 4.533 4.274 0.259 1
1 259 . 7 1 1 A 31 31 PHE C C 31 175.577 176.871 -1.294 1
1 260 . 7 1 1 A 31 31 PHE CA C 31 58.029 60.881 -2.852 1
1 261 . 7 1 1 A 31 31 PHE CB C 31 37.792 38.772 -0.980 1
1 267 . 7 1 1 A 31 31 PHE N N 31 115.408 118.551 -3.143 1
1 268 . 7 1 1 A 32 32 LYS H H 32 7.858 8.116 -0.258 1
1 269 . 7 1 1 A 32 32 LYS HA H 32 4.487 4.476 0.011 1
1 277 . 7 1 1 A 32 32 LYS C C 32 175.557 176.668 -1.111 1
1 278 . 7 1 1 A 32 32 LYS CA C 32 56.329 56.860 -0.531 1
1 279 . 7 1 1 A 32 32 LYS CB C 32 32.743 34.594 -1.851 1
1 283 . 7 1 1 A 32 32 LYS N N 32 122.453 114.118 8.335 1
1 284 . 7 1 1 A 33 33 ALA H H 33 8.643 8.204 0.439 1
1 285 . 7 1 1 A 33 33 ALA HA H 33 4.403 4.161 0.242 1
1 289 . 7 1 1 A 33 33 ALA C C 33 176.273 175.640 0.633 1
1 290 . 7 1 1 A 33 33 ALA CA C 33 53.579 53.328 0.251 1
1 291 . 7 1 1 A 33 33 ALA CB C 33 18.653 17.422 1.231 1
1 292 . 7 1 1 A 33 33 ALA N N 33 127.853 120.137 7.716 1
1 293 . 7 1 1 A 34 34 TYR H H 34 7.878 8.088 -0.210 1
1 294 . 7 1 1 A 34 34 TYR HA H 34 4.686 5.009 -0.323 1
1 301 . 7 1 1 A 34 34 TYR C C 34 173.133 172.939 0.194 1
1 302 . 7 1 1 A 34 34 TYR CA C 34 54.778 54.903 -0.125 1
1 303 . 7 1 1 A 34 34 TYR CB C 34 39.619 38.735 0.884 1
1 308 . 7 1 1 A 34 34 TYR N N 34 116.539 118.292 -1.753 1
1 309 . 7 1 1 A 35 35 PRO HA H 35 4.526 4.749 -0.223 1
1 316 . 7 1 1 A 35 35 PRO C C 35 176.837 175.658 1.179 1
1 317 . 7 1 1 A 35 35 PRO CA C 35 61.864 62.047 -0.183 1
1 318 . 7 1 1 A 35 35 PRO CB C 35 30.904 31.829 -0.925 1
1 321 . 7 1 1 A 36 36 SER H H 36 9.634 8.397 1.237 1
1 322 . 7 1 1 A 36 36 SER HA H 36 4.518 4.737 -0.219 1
1 325 . 7 1 1 A 36 36 SER C C 36 175.001 175.355 -0.354 1
1 326 . 7 1 1 A 36 36 SER CA C 36 57.129 56.681 0.448 1
1 327 . 7 1 1 A 36 36 SER CB C 36 65.374 65.128 0.246 1
1 328 . 7 1 1 A 36 36 SER N N 36 119.984 117.047 2.937 1
1 329 . 7 1 1 A 37 37 GLU H H 37 9.091 8.920 0.171 1
1 330 . 7 1 1 A 37 37 GLU HA H 37 3.884 3.905 -0.021 1
1 335 . 7 1 1 A 37 37 GLU C C 37 179.347 178.365 0.982 1
1 336 . 7 1 1 A 37 37 GLU CA C 37 60.454 59.430 1.024 1
1 337 . 7 1 1 A 37 37 GLU CB C 37 28.623 29.169 -0.546 1
1 339 . 7 1 1 A 37 37 GLU N N 37 120.748 126.451 -5.703 1
1 340 . 7 1 1 A 38 38 GLU H H 38 8.760 7.926 0.834 1
1 341 . 7 1 1 A 38 38 GLU HA H 38 4.048 4.097 -0.049 1
1 346 . 7 1 1 A 38 38 GLU C C 38 179.975 179.083 0.892 1
1 347 . 7 1 1 A 38 38 GLU CA C 38 60.243 59.204 1.039 1
1 348 . 7 1 1 A 38 38 GLU CB C 38 29.117 29.816 -0.699 1
1 350 . 7 1 1 A 38 38 GLU N N 38 119.272 120.302 -1.030 1
1 351 . 7 1 1 A 39 39 GLU H H 39 7.856 8.047 -0.191 1
1 352 . 7 1 1 A 39 39 GLU HA H 39 3.976 3.893 0.083 1
1 357 . 7 1 1 A 39 39 GLU C C 39 178.912 178.726 0.186 1
1 358 . 7 1 1 A 39 39 GLU CA C 39 59.131 59.029 0.102 1
1 359 . 7 1 1 A 39 39 GLU CB C 39 29.612 28.758 0.854 1
1 361 . 7 1 1 A 39 39 GLU N N 39 121.658 120.765 0.893 1
1 362 . 7 1 1 A 40 40 LYS H H 40 8.653 7.684 0.969 1
1 363 . 7 1 1 A 40 40 LYS HA H 40 3.508 3.790 -0.282 1
1 372 . 7 1 1 A 40 40 LYS C C 40 177.974 179.001 -1.027 1
1 373 . 7 1 1 A 40 40 LYS CA C 40 60.948 59.363 1.585 1
1 374 . 7 1 1 A 40 40 LYS CB C 40 32.714 32.055 0.659 1
1 378 . 7 1 1 A 40 40 LYS N N 40 119.152 119.752 -0.600 1
1 379 . 7 1 1 A 41 41 GLN H H 41 7.876 7.485 0.391 1
1 380 . 7 1 1 A 41 41 GLN HA H 41 3.911 3.995 -0.084 1
1 387 . 7 1 1 A 41 41 GLN C C 41 178.352 178.111 0.241 1
1 388 . 7 1 1 A 41 41 GLN CA C 41 58.973 58.903 0.070 1
1 389 . 7 1 1 A 41 41 GLN CB C 41 27.552 28.289 -0.737 1
1 391 . 7 1 1 A 41 41 GLN N N 41 118.910 119.366 -0.456 1
1 393 . 7 1 1 A 42 42 MET H H 42 7.771 7.821 -0.050 1
1 394 . 7 1 1 A 42 42 MET HA H 42 4.158 4.121 0.037 1
1 402 . 7 1 1 A 42 42 MET C C 42 179.310 178.342 0.968 1
1 403 . 7 1 1 A 42 42 MET CA C 42 59.079 58.389 0.690 1
1 404 . 7 1 1 A 42 42 MET CB C 42 31.023 32.191 -1.168 1
1 407 . 7 1 1 A 42 42 MET N N 42 121.131 118.857 2.274 1
1 408 . 7 1 1 A 43 43 LEU H H 43 8.400 8.173 0.227 1
1 409 . 7 1 1 A 43 43 LEU HA H 43 3.888 4.064 -0.176 1
1 419 . 7 1 1 A 43 43 LEU C C 43 180.721 178.985 1.736 1
1 420 . 7 1 1 A 43 43 LEU CA C 43 57.916 57.835 0.081 1
1 421 . 7 1 1 A 43 43 LEU CB C 43 42.080 41.048 1.032 1
1 425 . 7 1 1 A 43 43 LEU N N 43 120.124 120.458 -0.334 1
1 426 . 7 1 1 A 44 44 SER H H 44 8.658 8.527 0.131 1
1 427 . 7 1 1 A 44 44 SER HA H 44 4.088 4.165 -0.077 1
1 430 . 7 1 1 A 44 44 SER C C 44 176.859 176.642 0.217 1
1 431 . 7 1 1 A 44 44 SER CA C 44 61.371 61.158 0.213 1
1 432 . 7 1 1 A 44 44 SER CB C 44 63.314 63.056 0.258 1
1 433 . 7 1 1 A 44 44 SER N N 44 119.795 113.962 5.833 1
1 434 . 7 1 1 A 45 45 GLU H H 45 7.905 7.438 0.467 1
1 435 . 7 1 1 A 45 45 GLU HA H 45 4.094 4.169 -0.075 1
1 440 . 7 1 1 A 45 45 GLU C C 45 179.095 179.121 -0.026 1
1 441 . 7 1 1 A 45 45 GLU CA C 45 59.255 58.866 0.389 1
1 442 . 7 1 1 A 45 45 GLU CB C 45 29.200 29.326 -0.126 1
1 444 . 7 1 1 A 45 45 GLU N N 45 120.609 121.417 -0.808 1
1 445 . 7 1 1 A 46 46 LYS H H 46 7.837 7.871 -0.034 1
1 446 . 7 1 1 A 46 46 LYS HA H 46 4.231 4.153 0.078 1
1 453 . 7 1 1 A 46 46 LYS C C 46 177.964 178.332 -0.368 1
1 454 . 7 1 1 A 46 46 LYS CA C 46 58.278 58.556 -0.278 1
1 455 . 7 1 1 A 46 46 LYS CB C 46 34.110 32.667 1.443 1
1 459 . 7 1 1 A 46 46 LYS N N 46 115.471 118.905 -3.434 1
1 460 . 7 1 1 A 47 47 THR H H 47 7.763 8.099 -0.336 1
1 461 . 7 1 1 A 47 47 THR HA H 47 4.271 4.279 -0.008 1
1 466 . 7 1 1 A 47 47 THR C C 47 175.472 174.891 0.581 1
1 467 . 7 1 1 A 47 47 THR CA C 47 62.429 61.857 0.572 1
1 468 . 7 1 1 A 47 47 THR CB C 47 71.966 69.891 2.075 1
1 470 . 7 1 1 A 47 47 THR N N 47 104.286 108.036 -3.750 1
1 471 . 7 1 1 A 48 48 ASN H H 48 8.169 8.136 0.033 1
1 472 . 7 1 1 A 48 48 ASN HA H 48 4.437 4.269 0.168 1
1 477 . 7 1 1 A 48 48 ASN C C 48 173.874 173.907 -0.033 1
1 478 . 7 1 1 A 48 48 ASN CA C 48 55.377 54.358 1.019 1
1 479 . 7 1 1 A 48 48 ASN CB C 48 37.770 37.567 0.203 1
1 480 . 7 1 1 A 48 48 ASN N N 48 117.458 119.537 -2.079 1
1 482 . 7 1 1 A 49 49 LEU H H 49 7.532 7.351 0.181 1
1 483 . 7 1 1 A 49 49 LEU HA H 49 4.733 4.747 -0.014 1
1 493 . 7 1 1 A 49 49 LEU C C 49 176.625 175.611 1.014 1
1 494 . 7 1 1 A 49 49 LEU CA C 49 53.226 53.359 -0.133 1
1 495 . 7 1 1 A 49 49 LEU CB C 49 44.114 43.197 0.917 1
1 499 . 7 1 1 A 49 49 LEU N N 49 118.220 120.205 -1.985 1
1 500 . 7 1 1 A 50 50 SER H H 50 9.140 8.790 0.350 1
1 501 . 7 1 1 A 50 50 SER HA H 50 4.475 4.809 -0.334 1
1 504 . 7 1 1 A 50 50 SER C C 50 174.907 175.188 -0.281 1
1 505 . 7 1 1 A 50 50 SER CA C 50 56.964 57.979 -1.015 1
1 506 . 7 1 1 A 50 50 SER CB C 50 65.372 64.680 0.692 1
1 507 . 7 1 1 A 50 50 SER N N 50 117.569 117.458 0.111 1
1 508 . 7 1 1 A 51 51 LEU H H 51 8.756 8.709 0.047 1
1 509 . 7 1 1 A 51 51 LEU HA H 51 3.874 3.913 -0.039 1
1 519 . 7 1 1 A 51 51 LEU C C 51 179.910 178.795 1.115 1
1 520 . 7 1 1 A 51 51 LEU CA C 51 58.916 58.094 0.822 1
1 521 . 7 1 1 A 51 51 LEU CB C 51 41.148 41.341 -0.193 1
1 525 . 7 1 1 A 51 51 LEU N N 51 120.905 126.059 -5.154 1
1 526 . 7 1 1 A 52 52 LEU H H 52 8.146 8.313 -0.167 1
1 527 . 7 1 1 A 52 52 LEU HA H 52 4.179 4.033 0.146 1
1 537 . 7 1 1 A 52 52 LEU C C 52 178.936 178.702 0.234 1
1 538 . 7 1 1 A 52 52 LEU CA C 52 58.162 58.384 -0.222 1
1 539 . 7 1 1 A 52 52 LEU CB C 52 42.137 42.027 0.110 1
1 543 . 7 1 1 A 52 52 LEU N N 52 120.685 120.295 0.390 1
1 544 . 7 1 1 A 53 53 GLN H H 53 7.924 8.044 -0.120 1
1 545 . 7 1 1 A 53 53 GLN HA H 53 4.102 4.175 -0.073 1
1 552 . 7 1 1 A 53 53 GLN C C 53 180.308 178.757 1.551 1
1 553 . 7 1 1 A 53 53 GLN CA C 53 59.326 58.708 0.618 1
1 554 . 7 1 1 A 53 53 GLN CB C 53 29.900 28.357 1.543 1
1 556 . 7 1 1 A 53 53 GLN N N 53 118.473 117.236 1.237 1
1 558 . 7 1 1 A 54 54 ILE H H 54 8.380 8.012 0.368 1
1 559 . 7 1 1 A 54 54 ILE HA H 54 3.677 3.655 0.022 1
1 569 . 7 1 1 A 54 54 ILE C C 54 177.673 178.033 -0.360 1
1 570 . 7 1 1 A 54 54 ILE CA C 54 64.650 65.406 -0.756 1
1 571 . 7 1 1 A 54 54 ILE CB C 54 37.476 38.177 -0.701 1
1 575 . 7 1 1 A 54 54 ILE N N 54 120.113 121.396 -1.283 1
1 576 . 7 1 1 A 55 55 SER H H 55 8.854 8.403 0.451 1
1 577 . 7 1 1 A 55 55 SER HA H 55 4.267 4.293 -0.026 1
1 580 . 7 1 1 A 55 55 SER C C 55 177.127 176.978 0.149 1
1 581 . 7 1 1 A 55 55 SER CA C 55 62.852 61.349 1.503 1
1 582 . 7 1 1 A 55 55 SER CB C 55 62.727 62.476 0.251 1
1 583 . 7 1 1 A 55 55 SER N N 55 116.646 114.901 1.745 1
1 584 . 7 1 1 A 56 56 ASN H H 56 8.634 8.411 0.223 1
1 585 . 7 1 1 A 56 56 ASN HA H 56 4.549 4.500 0.049 1
1 590 . 7 1 1 A 56 56 ASN C C 56 177.481 178.072 -0.591 1
1 591 . 7 1 1 A 56 56 ASN CA C 56 55.951 56.604 -0.653 1
1 592 . 7 1 1 A 56 56 ASN CB C 56 37.852 38.112 -0.260 1
1 593 . 7 1 1 A 56 56 ASN N N 56 119.048 119.507 -0.459 1
1 595 . 7 1 1 A 57 57 TRP H H 57 8.373 8.220 0.153 1
1 596 . 7 1 1 A 57 57 TRP HA H 57 4.065 4.270 -0.205 1
1 605 . 7 1 1 A 57 57 TRP C C 57 179.392 178.332 1.060 1
1 606 . 7 1 1 A 57 57 TRP CA C 57 63.204 60.973 2.231 1
1 607 . 7 1 1 A 57 57 TRP CB C 57 28.376 29.654 -1.278 1
1 613 . 7 1 1 A 57 57 TRP N N 57 122.950 122.178 0.772 1
1 615 . 7 1 1 A 58 58 PHE H H 58 8.428 8.398 0.030 1
1 616 . 7 1 1 A 58 58 PHE HA H 58 3.922 3.632 0.290 1
1 624 . 7 1 1 A 58 58 PHE C C 58 178.237 177.832 0.405 1
1 625 . 7 1 1 A 58 58 PHE CA C 58 64.015 61.677 2.338 1
1 626 . 7 1 1 A 58 58 PHE CB C 58 39.602 38.602 1.000 1
1 632 . 7 1 1 A 58 58 PHE N N 58 116.774 117.434 -0.660 1
1 633 . 7 1 1 A 59 59 ILE H H 59 7.925 8.353 -0.428 1
1 634 . 7 1 1 A 59 59 ILE HA H 59 3.773 3.691 0.082 1
1 644 . 7 1 1 A 59 59 ILE C C 59 178.745 177.935 0.810 1
1 645 . 7 1 1 A 59 59 ILE CA C 59 65.531 65.358 0.173 1
1 646 . 7 1 1 A 59 59 ILE CB C 59 38.480 37.855 0.625 1
1 650 . 7 1 1 A 59 59 ILE N N 59 119.560 119.904 -0.344 1
1 651 . 7 1 1 A 60 60 ASN H H 60 7.506 7.884 -0.378 1
1 652 . 7 1 1 A 60 60 ASN HA H 60 4.407 4.422 -0.015 1
1 657 . 7 1 1 A 60 60 ASN C C 60 177.163 177.715 -0.552 1
1 658 . 7 1 1 A 60 60 ASN CA C 60 55.871 56.163 -0.292 1
1 659 . 7 1 1 A 60 60 ASN CB C 60 38.878 37.745 1.133 1
1 660 . 7 1 1 A 60 60 ASN N N 60 116.868 117.933 -1.065 1
1 662 . 7 1 1 A 61 61 ALA H H 61 8.410 8.124 0.286 1
1 663 . 7 1 1 A 61 61 ALA HA H 61 3.667 3.677 -0.010 1
1 667 . 7 1 1 A 61 61 ALA C C 61 180.061 179.892 0.169 1
1 668 . 7 1 1 A 61 61 ALA CA C 61 54.601 54.253 0.348 1
1 669 . 7 1 1 A 61 61 ALA CB C 61 18.241 16.968 1.273 1
1 670 . 7 1 1 A 61 61 ALA N N 61 123.022 122.227 0.795 1
1 671 . 7 1 1 A 62 62 ARG H H 62 8.036 8.170 -0.134 1
1 672 . 7 1 1 A 62 62 ARG HA H 62 4.092 3.987 0.105 1
1 679 . 7 1 1 A 62 62 ARG C C 62 176.756 177.481 -0.725 1
1 680 . 7 1 1 A 62 62 ARG CA C 62 58.762 58.357 0.405 1
1 681 . 7 1 1 A 62 62 ARG CB C 62 30.601 29.911 0.690 1
1 684 . 7 1 1 A 62 62 ARG N N 62 117.168 118.853 -1.685 1
1 685 . 7 1 1 A 63 63 ARG H H 63 7.214 7.800 -0.586 1
1 686 . 7 1 1 A 63 63 ARG HA H 63 4.249 4.325 -0.076 1
1 693 . 7 1 1 A 63 63 ARG C C 63 176.945 176.929 0.016 1
1 694 . 7 1 1 A 63 63 ARG CA C 63 57.669 57.017 0.652 1
1 695 . 7 1 1 A 63 63 ARG CB C 63 30.765 30.803 -0.038 1
1 698 . 7 1 1 A 63 63 ARG N N 63 116.514 116.626 -0.112 1
1 699 . 7 1 1 A 64 64 ARG H H 64 7.913 8.065 -0.152 1
1 700 . 7 1 1 A 64 64 ARG HA H 64 4.351 4.592 -0.241 1
1 707 . 7 1 1 A 64 64 ARG C C 64 176.413 178.209 -1.796 1
1 708 . 7 1 1 A 64 64 ARG CA C 64 57.105 57.191 -0.086 1
1 709 . 7 1 1 A 64 64 ARG CB C 64 31.672 33.019 -1.347 1
1 712 . 7 1 1 A 64 64 ARG N N 64 116.818 118.536 -1.718 1
1 713 . 7 1 1 A 65 65 ILE H H 65 8.169 8.312 -0.143 1
1 714 . 7 1 1 A 65 65 ILE HA H 65 4.285 3.762 0.523 1
1 724 . 7 1 1 A 65 65 ILE C C 65 176.208 178.020 -1.812 1
1 725 . 7 1 1 A 65 65 ILE CA C 65 62.005 64.703 -2.698 1
1 726 . 7 1 1 A 65 65 ILE CB C 65 39.088 37.601 1.487 1
1 730 . 7 1 1 A 65 65 ILE N N 65 119.185 119.718 -0.533 1
1 731 . 7 1 1 A 66 66 LEU H H 66 7.962 7.857 0.105 1
1 732 . 7 1 1 A 66 66 LEU HA H 66 4.485 4.048 0.437 1
1 742 . 7 1 1 A 66 66 LEU C C 66 176.216 175.242 0.974 1
1 743 . 7 1 1 A 66 66 LEU CA C 66 56.153 59.800 -3.647 1
1 744 . 7 1 1 A 66 66 LEU CB C 66 40.792 39.986 0.806 1
1 748 . 7 1 1 A 66 66 LEU N N 66 124.389 121.580 2.809 1
1 749 . 7 1 1 A 67 67 PRO HA H 67 4.283 4.381 -0.098 1
1 756 . 7 1 1 A 67 67 PRO C C 67 178.294 178.346 -0.052 1
1 757 . 7 1 1 A 67 67 PRO CA C 67 65.390 65.245 0.145 1
1 758 . 7 1 1 A 67 67 PRO CB C 67 31.095 31.241 -0.146 1
1 761 . 7 1 1 A 68 68 ASP H H 68 7.913 8.633 -0.720 1
1 762 . 7 1 1 A 68 68 ASP HA H 68 4.507 4.410 0.097 1
1 765 . 7 1 1 A 68 68 ASP C C 68 177.927 178.276 -0.349 1
1 766 . 7 1 1 A 68 68 ASP CA C 68 55.906 56.744 -0.838 1
1 767 . 7 1 1 A 68 68 ASP CB C 68 40.736 40.628 0.108 1
1 768 . 7 1 1 A 68 68 ASP N N 68 117.231 117.891 -0.660 1
1 769 . 7 1 1 A 69 69 MET H H 69 8.083 8.691 -0.608 1
1 770 . 7 1 1 A 69 69 MET HA H 69 4.362 4.174 0.188 1
1 778 . 7 1 1 A 69 69 MET C C 69 177.374 179.051 -1.677 1
1 779 . 7 1 1 A 69 69 MET CA C 69 57.634 58.761 -1.127 1
1 780 . 7 1 1 A 69 69 MET CB C 69 32.816 32.451 0.365 1
1 783 . 7 1 1 A 69 69 MET N N 69 119.391 118.453 0.938 1
1 784 . 7 1 1 A 70 70 LEU H H 70 7.907 7.615 0.292 1
1 785 . 7 1 1 A 70 70 LEU HA H 70 4.232 3.970 0.262 1
1 795 . 7 1 1 A 70 70 LEU C C 70 177.745 176.924 0.821 1
1 796 . 7 1 1 A 70 70 LEU CA C 70 55.835 58.108 -2.273 1
1 797 . 7 1 1 A 70 70 LEU CB C 70 42.174 41.517 0.657 1
1 801 . 7 1 1 A 70 70 LEU N N 70 119.266 121.400 -2.134 1
1 802 . 7 1 1 A 71 71 GLN H H 71 7.865 7.887 -0.022 1
1 803 . 7 1 1 A 71 71 GLN HA H 71 4.287 3.890 0.397 1
1 809 . 7 1 1 A 71 71 GLN C C 71 178.855 174.925 3.930 1
1 810 . 7 1 1 A 71 71 GLN CA C 71 56.383 56.951 -0.568 1
1 811 . 7 1 1 A 71 71 GLN CB C 71 29.092 26.402 2.690 1
1 813 . 7 1 1 A 71 71 GLN N N 71 118.603 115.737 2.866 1
1 815 . 7 1 1 A 72 72 GLN H H 72 8.189 7.785 0.404 1
1 816 . 7 1 1 A 72 72 GLN HA H 72 4.302 4.133 0.169 1
1 821 . 7 1 1 A 72 72 GLN CA C 72 56.206 56.531 -0.325 1
1 822 . 7 1 1 A 72 72 GLN CB C 72 29.298 30.566 -1.268 1
1 824 . 7 1 1 A 72 72 GLN N N 72 120.267 118.362 1.905 1
1 825 . 7 1 1 A 73 73 ARG C C 73 176.105 177.258 -1.153 1
1 826 . 7 1 1 A 74 74 ARG HA H 74 4.334 4.298 0.036 1
1 833 . 7 1 1 A 74 74 ARG C C 74 176.188 175.998 0.190 1
1 834 . 7 1 1 A 74 74 ARG CA C 74 56.300 57.308 -1.008 1
1 835 . 7 1 1 A 74 74 ARG CB C 74 30.668 30.254 0.414 1
1 838 . 7 1 1 A 75 75 ASN C C 75 174.462 175.135 -0.673 1
1 839 . 7 1 1 A 75 75 ASN CA C 75 53.148 53.944 -0.796 1
1 840 . 7 1 1 A 75 75 ASN CB C 75 39.046 38.466 0.580 1
1 841 . 7 1 1 A 76 76 ASP H H 76 8.257 8.503 -0.246 1
1 842 . 7 1 1 A 76 76 ASP HA H 76 4.877 5.258 -0.381 1
1 845 . 7 1 1 A 76 76 ASP C C 76 174.759 174.509 0.250 1
1 846 . 7 1 1 A 76 76 ASP CA C 76 52.380 51.197 1.183 1
1 847 . 7 1 1 A 76 76 ASP CB C 76 41.267 42.693 -1.426 1
1 848 . 7 1 1 A 76 76 ASP N N 76 122.030 122.934 -0.904 1
1 849 . 7 1 1 A 77 77 PRO HA H 77 4.466 4.604 -0.138 1
1 856 . 7 1 1 A 77 77 PRO C C 77 177.133 176.407 0.726 1
1 857 . 7 1 1 A 77 77 PRO CA C 77 63.733 62.304 1.429 1
1 858 . 7 1 1 A 77 77 PRO CB C 77 31.919 32.733 -0.814 1
1 861 . 7 1 1 A 78 78 SER H H 78 8.457 8.425 0.032 1
1 862 . 7 1 1 A 78 78 SER HA H 78 4.479 4.564 -0.085 1
1 865 . 7 1 1 A 78 78 SER C C 78 174.731 174.000 0.731 1
1 866 . 7 1 1 A 78 78 SER CA C 78 58.691 59.241 -0.550 1
1 867 . 7 1 1 A 78 78 SER CB C 78 63.973 63.252 0.721 1
1 868 . 7 1 1 A 78 78 SER N N 78 115.711 117.128 -1.417 1
1 869 . 7 1 1 A 79 79 GLY H H 79 8.090 8.208 -0.118 1
1 870 . 7 1 1 A 79 79 GLY HA2 H 79 4.179 4.163 0.016 1
1 871 . 7 1 1 A 79 79 GLY HA3 H 79 4.065 4.163 -0.098 1
1 872 . 7 1 1 A 79 79 GLY CA C 79 44.746 45.317 -0.571 1
1 873 . 7 1 1 A 79 79 GLY N N 79 110.429 112.537 -2.108 1
1 874 . 7 1 1 A 80 80 PRO HA H 80 4.464 4.699 -0.235 1
1 880 . 7 1 1 A 80 80 PRO C C 80 177.499 175.356 2.143 1
1 881 . 7 1 1 A 80 80 PRO CA C 80 63.275 62.803 0.472 1
1 882 . 7 1 1 A 80 80 PRO CB C 80 32.249 33.338 -1.089 1
1 1 . 8 1 1 A 13 13 ASN HA H 13 4.787 4.846 -0.059 1
1 6 . 8 1 1 A 13 13 ASN CA C 13 53.148 53.671 -0.523 1
1 7 . 8 1 1 A 13 13 ASN CB C 13 39.378 39.422 -0.044 1
1 9 . 8 1 1 A 14 14 LEU H H 14 8.418 8.630 -0.212 1
1 10 . 8 1 1 A 14 14 LEU HA H 14 4.654 4.650 0.004 1
1 20 . 8 1 1 A 14 14 LEU CA C 14 52.999 52.855 0.144 1
1 21 . 8 1 1 A 14 14 LEU CB C 14 41.919 40.785 1.134 1
1 25 . 8 1 1 A 14 14 LEU N N 14 122.671 121.894 0.777 1
1 26 . 8 1 1 A 15 15 PRO HA H 15 4.460 4.572 -0.112 1
1 33 . 8 1 1 A 15 15 PRO C C 15 178.156 177.594 0.562 1
1 34 . 8 1 1 A 15 15 PRO CA C 15 63.101 62.641 0.460 1
1 35 . 8 1 1 A 15 15 PRO CB C 15 32.304 32.529 -0.225 1
1 38 . 8 1 1 A 16 16 ALA H H 16 8.973 8.644 0.329 1
1 39 . 8 1 1 A 16 16 ALA HA H 16 4.021 3.956 0.065 1
1 43 . 8 1 1 A 16 16 ALA C C 16 180.695 179.681 1.014 1
1 44 . 8 1 1 A 16 16 ALA CA C 16 55.642 55.625 0.017 1
1 45 . 8 1 1 A 16 16 ALA CB C 16 18.552 18.669 -0.117 1
1 46 . 8 1 1 A 16 16 ALA N N 16 128.311 126.761 1.550 1
1 47 . 8 1 1 A 17 17 GLU H H 17 9.558 8.438 1.120 1
1 48 . 8 1 1 A 17 17 GLU HA H 17 4.065 4.015 0.050 1
1 53 . 8 1 1 A 17 17 GLU C C 17 178.886 178.605 0.281 1
1 54 . 8 1 1 A 17 17 GLU CA C 17 59.400 59.843 -0.443 1
1 55 . 8 1 1 A 17 17 GLU CB C 17 28.742 29.511 -0.769 1
1 57 . 8 1 1 A 17 17 GLU N N 17 117.113 118.797 -1.684 1
1 58 . 8 1 1 A 18 18 SER H H 18 7.263 7.630 -0.367 1
1 59 . 8 1 1 A 18 18 SER HA H 18 4.180 4.171 0.009 1
1 62 . 8 1 1 A 18 18 SER C C 18 174.951 177.257 -2.306 1
1 63 . 8 1 1 A 18 18 SER CA C 18 61.969 61.359 0.610 1
1 64 . 8 1 1 A 18 18 SER CB C 18 62.554 62.633 -0.079 1
1 65 . 8 1 1 A 18 18 SER N N 18 114.932 114.421 0.511 1
1 66 . 8 1 1 A 19 19 VAL H H 19 7.620 8.200 -0.580 1
1 67 . 8 1 1 A 19 19 VAL HA H 19 3.011 3.208 -0.197 1
1 75 . 8 1 1 A 19 19 VAL C C 19 176.953 177.738 -0.785 1
1 76 . 8 1 1 A 19 19 VAL CA C 19 66.479 66.647 -0.168 1
1 77 . 8 1 1 A 19 19 VAL CB C 19 31.569 31.453 0.116 1
1 80 . 8 1 1 A 19 19 VAL N N 19 121.086 121.470 -0.384 1
1 81 . 8 1 1 A 20 20 LYS H H 20 7.745 8.441 -0.696 1
1 82 . 8 1 1 A 20 20 LYS HA H 20 3.884 3.997 -0.113 1
1 91 . 8 1 1 A 20 20 LYS C C 20 178.150 178.888 -0.738 1
1 92 . 8 1 1 A 20 20 LYS CA C 20 59.984 59.745 0.239 1
1 93 . 8 1 1 A 20 20 LYS CB C 20 32.351 32.173 0.178 1
1 97 . 8 1 1 A 20 20 LYS N N 20 119.366 119.644 -0.278 1
1 98 . 8 1 1 A 21 21 ILE H H 21 6.943 7.491 -0.548 1
1 99 . 8 1 1 A 21 21 ILE HA H 21 3.783 3.674 0.109 1
1 109 . 8 1 1 A 21 21 ILE C C 21 178.996 178.734 0.262 1
1 110 . 8 1 1 A 21 21 ILE CA C 21 64.642 65.665 -1.023 1
1 111 . 8 1 1 A 21 21 ILE CB C 21 38.014 37.770 0.244 1
1 115 . 8 1 1 A 21 21 ILE N N 21 118.163 120.384 -2.221 1
1 116 . 8 1 1 A 22 22 LEU H H 22 7.267 8.010 -0.743 1
1 117 . 8 1 1 A 22 22 LEU HA H 22 3.748 3.918 -0.170 1
1 127 . 8 1 1 A 22 22 LEU C C 22 178.289 178.673 -0.384 1
1 128 . 8 1 1 A 22 22 LEU CA C 22 58.092 58.121 -0.029 1
1 129 . 8 1 1 A 22 22 LEU CB C 22 38.551 40.882 -2.331 1
1 133 . 8 1 1 A 22 22 LEU N N 22 120.609 119.285 1.324 1
1 134 . 8 1 1 A 23 23 ARG H H 23 8.676 8.755 -0.079 1
1 135 . 8 1 1 A 23 23 ARG HA H 23 4.030 4.170 -0.140 1
1 142 . 8 1 1 A 23 23 ARG C C 23 178.861 178.486 0.375 1
1 143 . 8 1 1 A 23 23 ARG CA C 23 60.404 60.148 0.256 1
1 144 . 8 1 1 A 23 23 ARG CB C 23 30.351 30.204 0.147 1
1 147 . 8 1 1 A 23 23 ARG N N 23 119.148 117.406 1.742 1
1 148 . 8 1 1 A 24 24 ASP H H 24 8.515 8.192 0.323 1
1 149 . 8 1 1 A 24 24 ASP HA H 24 4.519 4.386 0.133 1
1 152 . 8 1 1 A 24 24 ASP C C 24 178.759 178.611 0.148 1
1 153 . 8 1 1 A 24 24 ASP CA C 24 57.556 57.152 0.404 1
1 154 . 8 1 1 A 24 24 ASP CB C 24 40.569 41.067 -0.498 1
1 155 . 8 1 1 A 24 24 ASP N N 24 120.027 119.336 0.691 1
1 156 . 8 1 1 A 25 25 TRP H H 25 8.158 7.964 0.194 1
1 157 . 8 1 1 A 25 25 TRP HA H 25 4.181 4.489 -0.308 1
1 166 . 8 1 1 A 25 25 TRP C C 25 179.946 178.564 1.382 1
1 167 . 8 1 1 A 25 25 TRP CA C 25 63.346 61.193 2.153 1
1 168 . 8 1 1 A 25 25 TRP CB C 25 29.433 29.617 -0.184 1
1 174 . 8 1 1 A 25 25 TRP N N 25 121.350 121.647 -0.297 1
1 176 . 8 1 1 A 26 26 MET H H 26 8.977 8.748 0.229 1
1 177 . 8 1 1 A 26 26 MET HA H 26 4.076 4.660 -0.584 1
1 185 . 8 1 1 A 26 26 MET C C 26 177.371 178.074 -0.703 1
1 186 . 8 1 1 A 26 26 MET CA C 26 60.454 58.798 1.656 1
1 187 . 8 1 1 A 26 26 MET CB C 26 33.567 32.609 0.958 1
1 190 . 8 1 1 A 26 26 MET N N 26 119.977 118.827 1.150 1
1 191 . 8 1 1 A 27 27 TYR H H 27 8.604 8.383 0.221 1
1 192 . 8 1 1 A 27 27 TYR HA H 27 4.138 4.290 -0.152 1
1 199 . 8 1 1 A 27 27 TYR C C 27 178.901 177.764 1.137 1
1 200 . 8 1 1 A 27 27 TYR CA C 27 61.846 61.403 0.443 1
1 201 . 8 1 1 A 27 27 TYR CB C 27 38.165 38.613 -0.448 1
1 206 . 8 1 1 A 27 27 TYR N N 27 117.797 121.066 -3.269 1
1 207 . 8 1 1 A 28 28 LYS H H 28 7.867 7.813 0.054 1
1 208 . 8 1 1 A 28 28 LYS HA H 28 3.797 3.728 0.069 1
1 217 . 8 1 1 A 28 28 LYS C C 28 176.858 177.527 -0.669 1
1 218 . 8 1 1 A 28 28 LYS CA C 28 58.174 58.925 -0.751 1
1 219 . 8 1 1 A 28 28 LYS CB C 28 32.516 31.790 0.726 1
1 223 . 8 1 1 A 28 28 LYS N N 28 118.982 118.020 0.962 1
1 224 . 8 1 1 A 29 29 HIS H H 29 7.443 7.305 0.138 1
1 225 . 8 1 1 A 29 29 HIS HA H 29 4.386 4.354 0.032 1
1 230 . 8 1 1 A 29 29 HIS C C 29 176.085 175.792 0.293 1
1 231 . 8 1 1 A 29 29 HIS CA C 29 55.213 54.951 0.262 1
1 232 . 8 1 1 A 29 29 HIS CB C 29 27.085 28.903 -1.818 1
1 235 . 8 1 1 A 29 29 HIS N N 29 117.138 115.319 1.819 1
1 236 . 8 1 1 A 30 30 ARG H H 30 6.921 8.210 -1.289 1
1 237 . 8 1 1 A 30 30 ARG HA H 30 3.898 4.363 -0.465 1
1 244 . 8 1 1 A 30 30 ARG C C 30 175.808 177.956 -2.148 1
1 245 . 8 1 1 A 30 30 ARG CA C 30 58.609 58.653 -0.044 1
1 246 . 8 1 1 A 30 30 ARG CB C 30 28.739 29.651 -0.912 1
1 249 . 8 1 1 A 30 30 ARG N N 30 117.911 119.461 -1.550 1
1 250 . 8 1 1 A 31 31 PHE H H 31 7.819 8.175 -0.356 1
1 251 . 8 1 1 A 31 31 PHE HA H 31 4.533 4.236 0.297 1
1 259 . 8 1 1 A 31 31 PHE C C 31 175.577 177.261 -1.684 1
1 260 . 8 1 1 A 31 31 PHE CA C 31 58.029 60.848 -2.819 1
1 261 . 8 1 1 A 31 31 PHE CB C 31 37.792 39.024 -1.232 1
1 267 . 8 1 1 A 31 31 PHE N N 31 115.408 118.803 -3.395 1
1 268 . 8 1 1 A 32 32 LYS H H 32 7.858 7.786 0.072 1
1 269 . 8 1 1 A 32 32 LYS HA H 32 4.487 4.388 0.099 1
1 277 . 8 1 1 A 32 32 LYS C C 32 175.557 176.536 -0.979 1
1 278 . 8 1 1 A 32 32 LYS CA C 32 56.329 57.536 -1.207 1
1 279 . 8 1 1 A 32 32 LYS CB C 32 32.743 34.214 -1.471 1
1 283 . 8 1 1 A 32 32 LYS N N 32 122.453 114.367 8.086 1
1 284 . 8 1 1 A 33 33 ALA H H 33 8.643 8.000 0.643 1
1 285 . 8 1 1 A 33 33 ALA HA H 33 4.403 4.092 0.311 1
1 289 . 8 1 1 A 33 33 ALA C C 33 176.273 175.194 1.079 1
1 290 . 8 1 1 A 33 33 ALA CA C 33 53.579 53.316 0.263 1
1 291 . 8 1 1 A 33 33 ALA CB C 33 18.653 17.170 1.483 1
1 292 . 8 1 1 A 33 33 ALA N N 33 127.853 120.369 7.484 1
1 293 . 8 1 1 A 34 34 TYR H H 34 7.878 8.051 -0.173 1
1 294 . 8 1 1 A 34 34 TYR HA H 34 4.686 4.837 -0.151 1
1 301 . 8 1 1 A 34 34 TYR C C 34 173.133 173.172 -0.039 1
1 302 . 8 1 1 A 34 34 TYR CA C 34 54.778 54.878 -0.100 1
1 303 . 8 1 1 A 34 34 TYR CB C 34 39.619 40.725 -1.106 1
1 308 . 8 1 1 A 34 34 TYR N N 34 116.539 116.792 -0.253 1
1 309 . 8 1 1 A 35 35 PRO HA H 35 4.526 4.539 -0.013 1
1 316 . 8 1 1 A 35 35 PRO C C 35 176.837 175.726 1.111 1
1 317 . 8 1 1 A 35 35 PRO CA C 35 61.864 61.998 -0.134 1
1 318 . 8 1 1 A 35 35 PRO CB C 35 30.904 31.878 -0.974 1
1 321 . 8 1 1 A 36 36 SER H H 36 9.634 8.418 1.216 1
1 322 . 8 1 1 A 36 36 SER HA H 36 4.518 4.772 -0.254 1
1 325 . 8 1 1 A 36 36 SER C C 36 175.001 174.998 0.003 1
1 326 . 8 1 1 A 36 36 SER CA C 36 57.129 56.735 0.394 1
1 327 . 8 1 1 A 36 36 SER CB C 36 65.374 65.099 0.275 1
1 328 . 8 1 1 A 36 36 SER N N 36 119.984 117.063 2.921 1
1 329 . 8 1 1 A 37 37 GLU H H 37 9.091 9.079 0.012 1
1 330 . 8 1 1 A 37 37 GLU HA H 37 3.884 3.923 -0.039 1
1 335 . 8 1 1 A 37 37 GLU C C 37 179.347 178.102 1.245 1
1 336 . 8 1 1 A 37 37 GLU CA C 37 60.454 59.474 0.980 1
1 337 . 8 1 1 A 37 37 GLU CB C 37 28.623 29.555 -0.932 1
1 339 . 8 1 1 A 37 37 GLU N N 37 120.748 126.574 -5.826 1
1 340 . 8 1 1 A 38 38 GLU H H 38 8.760 8.001 0.759 1
1 341 . 8 1 1 A 38 38 GLU HA H 38 4.048 4.077 -0.029 1
1 346 . 8 1 1 A 38 38 GLU C C 38 179.975 178.747 1.228 1
1 347 . 8 1 1 A 38 38 GLU CA C 38 60.243 58.853 1.390 1
1 348 . 8 1 1 A 38 38 GLU CB C 38 29.117 29.913 -0.796 1
1 350 . 8 1 1 A 38 38 GLU N N 38 119.272 119.259 0.013 1
1 351 . 8 1 1 A 39 39 GLU H H 39 7.856 7.996 -0.140 1
1 352 . 8 1 1 A 39 39 GLU HA H 39 3.976 3.912 0.064 1
1 357 . 8 1 1 A 39 39 GLU C C 39 178.912 178.633 0.279 1
1 358 . 8 1 1 A 39 39 GLU CA C 39 59.131 59.192 -0.061 1
1 359 . 8 1 1 A 39 39 GLU CB C 39 29.612 28.886 0.726 1
1 361 . 8 1 1 A 39 39 GLU N N 39 121.658 120.826 0.832 1
1 362 . 8 1 1 A 40 40 LYS H H 40 8.653 7.783 0.870 1
1 363 . 8 1 1 A 40 40 LYS HA H 40 3.508 3.831 -0.323 1
1 372 . 8 1 1 A 40 40 LYS C C 40 177.974 179.004 -1.030 1
1 373 . 8 1 1 A 40 40 LYS CA C 40 60.948 59.395 1.553 1
1 374 . 8 1 1 A 40 40 LYS CB C 40 32.714 32.088 0.626 1
1 378 . 8 1 1 A 40 40 LYS N N 40 119.152 119.444 -0.292 1
1 379 . 8 1 1 A 41 41 GLN H H 41 7.876 7.451 0.425 1
1 380 . 8 1 1 A 41 41 GLN HA H 41 3.911 3.974 -0.063 1
1 387 . 8 1 1 A 41 41 GLN C C 41 178.352 178.087 0.265 1
1 388 . 8 1 1 A 41 41 GLN CA C 41 58.973 59.105 -0.132 1
1 389 . 8 1 1 A 41 41 GLN CB C 41 27.552 28.270 -0.718 1
1 391 . 8 1 1 A 41 41 GLN N N 41 118.910 119.589 -0.679 1
1 393 . 8 1 1 A 42 42 MET H H 42 7.771 7.840 -0.069 1
1 394 . 8 1 1 A 42 42 MET HA H 42 4.158 4.191 -0.033 1
1 402 . 8 1 1 A 42 42 MET C C 42 179.310 178.235 1.075 1
1 403 . 8 1 1 A 42 42 MET CA C 42 59.079 58.356 0.723 1
1 404 . 8 1 1 A 42 42 MET CB C 42 31.023 32.383 -1.360 1
1 407 . 8 1 1 A 42 42 MET N N 42 121.131 119.191 1.940 1
1 408 . 8 1 1 A 43 43 LEU H H 43 8.400 8.183 0.217 1
1 409 . 8 1 1 A 43 43 LEU HA H 43 3.888 3.981 -0.093 1
1 419 . 8 1 1 A 43 43 LEU C C 43 180.721 179.099 1.622 1
1 420 . 8 1 1 A 43 43 LEU CA C 43 57.916 58.074 -0.158 1
1 421 . 8 1 1 A 43 43 LEU CB C 43 42.080 41.329 0.751 1
1 425 . 8 1 1 A 43 43 LEU N N 43 120.124 120.743 -0.619 1
1 426 . 8 1 1 A 44 44 SER H H 44 8.658 8.508 0.150 1
1 427 . 8 1 1 A 44 44 SER HA H 44 4.088 4.248 -0.160 1
1 430 . 8 1 1 A 44 44 SER C C 44 176.859 176.569 0.290 1
1 431 . 8 1 1 A 44 44 SER CA C 44 61.371 60.998 0.373 1
1 432 . 8 1 1 A 44 44 SER CB C 44 63.314 62.851 0.463 1
1 433 . 8 1 1 A 44 44 SER N N 44 119.795 113.656 6.139 1
1 434 . 8 1 1 A 45 45 GLU H H 45 7.905 7.510 0.395 1
1 435 . 8 1 1 A 45 45 GLU HA H 45 4.094 4.212 -0.118 1
1 440 . 8 1 1 A 45 45 GLU C C 45 179.095 178.965 0.130 1
1 441 . 8 1 1 A 45 45 GLU CA C 45 59.255 59.017 0.238 1
1 442 . 8 1 1 A 45 45 GLU CB C 45 29.200 29.797 -0.597 1
1 444 . 8 1 1 A 45 45 GLU N N 45 120.609 121.033 -0.424 1
1 445 . 8 1 1 A 46 46 LYS H H 46 7.837 8.019 -0.182 1
1 446 . 8 1 1 A 46 46 LYS HA H 46 4.231 4.142 0.089 1
1 453 . 8 1 1 A 46 46 LYS C C 46 177.964 177.996 -0.032 1
1 454 . 8 1 1 A 46 46 LYS CA C 46 58.278 58.747 -0.469 1
1 455 . 8 1 1 A 46 46 LYS CB C 46 34.110 32.373 1.737 1
1 459 . 8 1 1 A 46 46 LYS N N 46 115.471 118.844 -3.373 1
1 460 . 8 1 1 A 47 47 THR H H 47 7.763 7.939 -0.176 1
1 461 . 8 1 1 A 47 47 THR HA H 47 4.271 4.319 -0.048 1
1 466 . 8 1 1 A 47 47 THR C C 47 175.472 175.304 0.168 1
1 467 . 8 1 1 A 47 47 THR CA C 47 62.429 62.345 0.084 1
1 468 . 8 1 1 A 47 47 THR CB C 47 71.966 70.438 1.528 1
1 470 . 8 1 1 A 47 47 THR N N 47 104.286 108.754 -4.468 1
1 471 . 8 1 1 A 48 48 ASN H H 48 8.169 8.505 -0.336 1
1 472 . 8 1 1 A 48 48 ASN HA H 48 4.437 4.579 -0.142 1
1 477 . 8 1 1 A 48 48 ASN C C 48 173.874 173.924 -0.050 1
1 478 . 8 1 1 A 48 48 ASN CA C 48 55.377 54.252 1.125 1
1 479 . 8 1 1 A 48 48 ASN CB C 48 37.770 37.385 0.385 1
1 480 . 8 1 1 A 48 48 ASN N N 48 117.458 119.849 -2.391 1
1 482 . 8 1 1 A 49 49 LEU H H 49 7.532 7.057 0.475 1
1 483 . 8 1 1 A 49 49 LEU HA H 49 4.733 4.805 -0.072 1
1 493 . 8 1 1 A 49 49 LEU C C 49 176.625 175.577 1.048 1
1 494 . 8 1 1 A 49 49 LEU CA C 49 53.226 53.353 -0.127 1
1 495 . 8 1 1 A 49 49 LEU CB C 49 44.114 43.667 0.447 1
1 499 . 8 1 1 A 49 49 LEU N N 49 118.220 120.120 -1.900 1
1 500 . 8 1 1 A 50 50 SER H H 50 9.140 8.757 0.383 1
1 501 . 8 1 1 A 50 50 SER HA H 50 4.475 4.828 -0.353 1
1 504 . 8 1 1 A 50 50 SER C C 50 174.907 174.994 -0.087 1
1 505 . 8 1 1 A 50 50 SER CA C 50 56.964 57.834 -0.870 1
1 506 . 8 1 1 A 50 50 SER CB C 50 65.372 64.990 0.382 1
1 507 . 8 1 1 A 50 50 SER N N 50 117.569 117.751 -0.182 1
1 508 . 8 1 1 A 51 51 LEU H H 51 8.756 8.741 0.015 1
1 509 . 8 1 1 A 51 51 LEU HA H 51 3.874 3.913 -0.039 1
1 519 . 8 1 1 A 51 51 LEU C C 51 179.910 178.871 1.039 1
1 520 . 8 1 1 A 51 51 LEU CA C 51 58.916 58.078 0.838 1
1 521 . 8 1 1 A 51 51 LEU CB C 51 41.148 41.307 -0.159 1
1 525 . 8 1 1 A 51 51 LEU N N 51 120.905 125.898 -4.993 1
1 526 . 8 1 1 A 52 52 LEU H H 52 8.146 8.296 -0.150 1
1 527 . 8 1 1 A 52 52 LEU HA H 52 4.179 4.061 0.118 1
1 537 . 8 1 1 A 52 52 LEU C C 52 178.936 178.834 0.102 1
1 538 . 8 1 1 A 52 52 LEU CA C 52 58.162 58.372 -0.210 1
1 539 . 8 1 1 A 52 52 LEU CB C 52 42.137 41.592 0.545 1
1 543 . 8 1 1 A 52 52 LEU N N 52 120.685 120.200 0.485 1
1 544 . 8 1 1 A 53 53 GLN H H 53 7.924 8.245 -0.321 1
1 545 . 8 1 1 A 53 53 GLN HA H 53 4.102 4.160 -0.058 1
1 552 . 8 1 1 A 53 53 GLN C C 53 180.308 178.630 1.678 1
1 553 . 8 1 1 A 53 53 GLN CA C 53 59.326 58.604 0.722 1
1 554 . 8 1 1 A 53 53 GLN CB C 53 29.900 28.355 1.545 1
1 556 . 8 1 1 A 53 53 GLN N N 53 118.473 117.664 0.809 1
1 558 . 8 1 1 A 54 54 ILE H H 54 8.380 8.250 0.130 1
1 559 . 8 1 1 A 54 54 ILE HA H 54 3.677 3.712 -0.035 1
1 569 . 8 1 1 A 54 54 ILE C C 54 177.673 178.089 -0.416 1
1 570 . 8 1 1 A 54 54 ILE CA C 54 64.650 65.461 -0.811 1
1 571 . 8 1 1 A 54 54 ILE CB C 54 37.476 37.880 -0.404 1
1 575 . 8 1 1 A 54 54 ILE N N 54 120.113 121.653 -1.540 1
1 576 . 8 1 1 A 55 55 SER H H 55 8.854 7.930 0.924 1
1 577 . 8 1 1 A 55 55 SER HA H 55 4.267 4.343 -0.076 1
1 580 . 8 1 1 A 55 55 SER C C 55 177.127 177.663 -0.536 1
1 581 . 8 1 1 A 55 55 SER CA C 55 62.852 61.805 1.047 1
1 582 . 8 1 1 A 55 55 SER CB C 55 62.727 62.924 -0.197 1
1 583 . 8 1 1 A 55 55 SER N N 55 116.646 115.908 0.738 1
1 584 . 8 1 1 A 56 56 ASN H H 56 8.634 8.250 0.384 1
1 585 . 8 1 1 A 56 56 ASN HA H 56 4.549 4.480 0.069 1
1 590 . 8 1 1 A 56 56 ASN C C 56 177.481 178.339 -0.858 1
1 591 . 8 1 1 A 56 56 ASN CA C 56 55.951 56.402 -0.451 1
1 592 . 8 1 1 A 56 56 ASN CB C 56 37.852 38.291 -0.439 1
1 593 . 8 1 1 A 56 56 ASN N N 56 119.048 119.807 -0.759 1
1 595 . 8 1 1 A 57 57 TRP H H 57 8.373 8.331 0.042 1
1 596 . 8 1 1 A 57 57 TRP HA H 57 4.065 4.331 -0.266 1
1 605 . 8 1 1 A 57 57 TRP C C 57 179.392 178.326 1.066 1
1 606 . 8 1 1 A 57 57 TRP CA C 57 63.204 61.366 1.838 1
1 607 . 8 1 1 A 57 57 TRP CB C 57 28.376 29.676 -1.300 1
1 613 . 8 1 1 A 57 57 TRP N N 57 122.950 122.789 0.161 1
1 615 . 8 1 1 A 58 58 PHE H H 58 8.428 8.431 -0.003 1
1 616 . 8 1 1 A 58 58 PHE HA H 58 3.922 3.688 0.234 1
1 624 . 8 1 1 A 58 58 PHE C C 58 178.237 177.824 0.413 1
1 625 . 8 1 1 A 58 58 PHE CA C 58 64.015 61.620 2.395 1
1 626 . 8 1 1 A 58 58 PHE CB C 58 39.602 38.413 1.189 1
1 632 . 8 1 1 A 58 58 PHE N N 58 116.774 118.033 -1.259 1
1 633 . 8 1 1 A 59 59 ILE H H 59 7.925 8.116 -0.191 1
1 634 . 8 1 1 A 59 59 ILE HA H 59 3.773 3.709 0.064 1
1 644 . 8 1 1 A 59 59 ILE C C 59 178.745 177.938 0.807 1
1 645 . 8 1 1 A 59 59 ILE CA C 59 65.531 65.266 0.265 1
1 646 . 8 1 1 A 59 59 ILE CB C 59 38.480 37.981 0.499 1
1 650 . 8 1 1 A 59 59 ILE N N 59 119.560 119.982 -0.422 1
1 651 . 8 1 1 A 60 60 ASN H H 60 7.506 8.153 -0.647 1
1 652 . 8 1 1 A 60 60 ASN HA H 60 4.407 4.366 0.041 1
1 657 . 8 1 1 A 60 60 ASN C C 60 177.163 177.185 -0.022 1
1 658 . 8 1 1 A 60 60 ASN CA C 60 55.871 55.480 0.391 1
1 659 . 8 1 1 A 60 60 ASN CB C 60 38.878 37.337 1.541 1
1 660 . 8 1 1 A 60 60 ASN N N 60 116.868 117.247 -0.379 1
1 662 . 8 1 1 A 61 61 ALA H H 61 8.410 8.041 0.369 1
1 663 . 8 1 1 A 61 61 ALA HA H 61 3.667 3.731 -0.064 1
1 667 . 8 1 1 A 61 61 ALA C C 61 180.061 179.953 0.108 1
1 668 . 8 1 1 A 61 61 ALA CA C 61 54.601 53.871 0.730 1
1 669 . 8 1 1 A 61 61 ALA CB C 61 18.241 17.276 0.965 1
1 670 . 8 1 1 A 61 61 ALA N N 61 123.022 120.675 2.347 1
1 671 . 8 1 1 A 62 62 ARG H H 62 8.036 8.155 -0.119 1
1 672 . 8 1 1 A 62 62 ARG HA H 62 4.092 4.011 0.081 1
1 679 . 8 1 1 A 62 62 ARG C C 62 176.756 177.424 -0.668 1
1 680 . 8 1 1 A 62 62 ARG CA C 62 58.762 58.373 0.389 1
1 681 . 8 1 1 A 62 62 ARG CB C 62 30.601 29.896 0.705 1
1 684 . 8 1 1 A 62 62 ARG N N 62 117.168 118.934 -1.766 1
1 685 . 8 1 1 A 63 63 ARG H H 63 7.214 7.822 -0.608 1
1 686 . 8 1 1 A 63 63 ARG HA H 63 4.249 4.331 -0.082 1
1 693 . 8 1 1 A 63 63 ARG C C 63 176.945 176.940 0.005 1
1 694 . 8 1 1 A 63 63 ARG CA C 63 57.669 57.024 0.645 1
1 695 . 8 1 1 A 63 63 ARG CB C 63 30.765 30.814 -0.049 1
1 698 . 8 1 1 A 63 63 ARG N N 63 116.514 116.630 -0.116 1
1 699 . 8 1 1 A 64 64 ARG H H 64 7.913 8.080 -0.167 1
1 700 . 8 1 1 A 64 64 ARG HA H 64 4.351 4.598 -0.247 1
1 707 . 8 1 1 A 64 64 ARG C C 64 176.413 178.278 -1.865 1
1 708 . 8 1 1 A 64 64 ARG CA C 64 57.105 57.213 -0.108 1
1 709 . 8 1 1 A 64 64 ARG CB C 64 31.672 32.989 -1.317 1
1 712 . 8 1 1 A 64 64 ARG N N 64 116.818 118.486 -1.668 1
1 713 . 8 1 1 A 65 65 ILE H H 65 8.169 8.501 -0.332 1
1 714 . 8 1 1 A 65 65 ILE HA H 65 4.285 3.846 0.439 1
1 724 . 8 1 1 A 65 65 ILE C C 65 176.208 177.959 -1.751 1
1 725 . 8 1 1 A 65 65 ILE CA C 65 62.005 64.567 -2.562 1
1 726 . 8 1 1 A 65 65 ILE CB C 65 39.088 37.599 1.489 1
1 730 . 8 1 1 A 65 65 ILE N N 65 119.185 119.628 -0.443 1
1 731 . 8 1 1 A 66 66 LEU H H 66 7.962 7.946 0.016 1
1 732 . 8 1 1 A 66 66 LEU HA H 66 4.485 4.101 0.384 1
1 742 . 8 1 1 A 66 66 LEU C C 66 176.216 175.078 1.138 1
1 743 . 8 1 1 A 66 66 LEU CA C 66 56.153 59.801 -3.648 1
1 744 . 8 1 1 A 66 66 LEU CB C 66 40.792 40.602 0.190 1
1 748 . 8 1 1 A 66 66 LEU N N 66 124.389 122.033 2.356 1
1 749 . 8 1 1 A 67 67 PRO HA H 67 4.283 4.356 -0.073 1
1 756 . 8 1 1 A 67 67 PRO C C 67 178.294 178.411 -0.117 1
1 757 . 8 1 1 A 67 67 PRO CA C 67 65.390 65.432 -0.042 1
1 758 . 8 1 1 A 67 67 PRO CB C 67 31.095 30.734 0.361 1
1 761 . 8 1 1 A 68 68 ASP H H 68 7.913 8.626 -0.713 1
1 762 . 8 1 1 A 68 68 ASP HA H 68 4.507 4.435 0.072 1
1 765 . 8 1 1 A 68 68 ASP C C 68 177.927 177.891 0.036 1
1 766 . 8 1 1 A 68 68 ASP CA C 68 55.906 56.727 -0.821 1
1 767 . 8 1 1 A 68 68 ASP CB C 68 40.736 40.547 0.189 1
1 768 . 8 1 1 A 68 68 ASP N N 68 117.231 117.482 -0.251 1
1 769 . 8 1 1 A 69 69 MET H H 69 8.083 8.603 -0.520 1
1 770 . 8 1 1 A 69 69 MET HA H 69 4.362 4.343 0.019 1
1 778 . 8 1 1 A 69 69 MET C C 69 177.374 178.830 -1.456 1
1 779 . 8 1 1 A 69 69 MET CA C 69 57.634 58.394 -0.760 1
1 780 . 8 1 1 A 69 69 MET CB C 69 32.816 32.795 0.021 1
1 783 . 8 1 1 A 69 69 MET N N 69 119.391 117.418 1.973 1
1 784 . 8 1 1 A 70 70 LEU H H 70 7.907 8.418 -0.511 1
1 785 . 8 1 1 A 70 70 LEU HA H 70 4.232 3.997 0.235 1
1 795 . 8 1 1 A 70 70 LEU C C 70 177.745 177.138 0.607 1
1 796 . 8 1 1 A 70 70 LEU CA C 70 55.835 57.928 -2.093 1
1 797 . 8 1 1 A 70 70 LEU CB C 70 42.174 41.405 0.769 1
1 801 . 8 1 1 A 70 70 LEU N N 70 119.266 121.128 -1.862 1
1 802 . 8 1 1 A 71 71 GLN H H 71 7.865 7.506 0.359 1
1 803 . 8 1 1 A 71 71 GLN HA H 71 4.287 4.314 -0.027 1
1 809 . 8 1 1 A 71 71 GLN C C 71 178.855 175.874 2.981 1
1 810 . 8 1 1 A 71 71 GLN CA C 71 56.383 55.624 0.759 1
1 811 . 8 1 1 A 71 71 GLN CB C 71 29.092 29.301 -0.209 1
1 813 . 8 1 1 A 71 71 GLN N N 71 118.603 118.194 0.409 1
1 815 . 8 1 1 A 72 72 GLN H H 72 8.189 8.751 -0.562 1
1 816 . 8 1 1 A 72 72 GLN HA H 72 4.302 4.503 -0.201 1
1 821 . 8 1 1 A 72 72 GLN CA C 72 56.206 55.559 0.647 1
1 822 . 8 1 1 A 72 72 GLN CB C 72 29.298 27.435 1.863 1
1 824 . 8 1 1 A 72 72 GLN N N 72 120.267 118.926 1.341 1
1 825 . 8 1 1 A 73 73 ARG C C 73 176.105 175.601 0.504 1
1 826 . 8 1 1 A 74 74 ARG HA H 74 4.334 4.860 -0.526 1
1 833 . 8 1 1 A 74 74 ARG C C 74 176.188 175.241 0.947 1
1 834 . 8 1 1 A 74 74 ARG CA C 74 56.300 53.983 2.317 1
1 835 . 8 1 1 A 74 74 ARG CB C 74 30.668 33.632 -2.964 1
1 838 . 8 1 1 A 75 75 ASN C C 75 174.462 174.794 -0.332 1
1 839 . 8 1 1 A 75 75 ASN CA C 75 53.148 53.932 -0.784 1
1 840 . 8 1 1 A 75 75 ASN CB C 75 39.046 38.916 0.130 1
1 841 . 8 1 1 A 76 76 ASP H H 76 8.257 8.798 -0.541 1
1 842 . 8 1 1 A 76 76 ASP HA H 76 4.877 5.237 -0.360 1
1 845 . 8 1 1 A 76 76 ASP C C 76 174.759 173.776 0.983 1
1 846 . 8 1 1 A 76 76 ASP CA C 76 52.380 51.475 0.905 1
1 847 . 8 1 1 A 76 76 ASP CB C 76 41.267 42.501 -1.234 1
1 848 . 8 1 1 A 76 76 ASP N N 76 122.030 124.297 -2.267 1
1 849 . 8 1 1 A 77 77 PRO HA H 77 4.466 4.674 -0.208 1
1 856 . 8 1 1 A 77 77 PRO C C 77 177.133 177.088 0.045 1
1 857 . 8 1 1 A 77 77 PRO CA C 77 63.733 62.716 1.017 1
1 858 . 8 1 1 A 77 77 PRO CB C 77 31.919 31.729 0.190 1
1 861 . 8 1 1 A 78 78 SER H H 78 8.457 8.486 -0.029 1
1 862 . 8 1 1 A 78 78 SER HA H 78 4.479 4.557 -0.078 1
1 865 . 8 1 1 A 78 78 SER C C 78 174.731 174.216 0.515 1
1 866 . 8 1 1 A 78 78 SER CA C 78 58.691 58.086 0.605 1
1 867 . 8 1 1 A 78 78 SER CB C 78 63.973 64.376 -0.403 1
1 868 . 8 1 1 A 78 78 SER N N 78 115.711 115.122 0.589 1
1 869 . 8 1 1 A 79 79 GLY H H 79 8.090 8.317 -0.227 1
1 870 . 8 1 1 A 79 79 GLY HA2 H 79 4.179 4.203 -0.024 1
1 871 . 8 1 1 A 79 79 GLY HA3 H 79 4.065 4.208 -0.143 1
1 872 . 8 1 1 A 79 79 GLY CA C 79 44.746 44.870 -0.124 1
1 873 . 8 1 1 A 79 79 GLY N N 79 110.429 107.905 2.524 1
1 874 . 8 1 1 A 80 80 PRO HA H 80 4.464 4.650 -0.186 1
1 880 . 8 1 1 A 80 80 PRO C C 80 177.499 175.281 2.218 1
1 881 . 8 1 1 A 80 80 PRO CA C 80 63.275 62.681 0.594 1
1 882 . 8 1 1 A 80 80 PRO CB C 80 32.249 32.332 -0.083 1
1 1 . 9 1 1 A 13 13 ASN HA H 13 4.787 5.540 -0.753 1
1 6 . 9 1 1 A 13 13 ASN CA C 13 53.148 51.391 1.757 1
1 7 . 9 1 1 A 13 13 ASN CB C 13 39.378 43.135 -3.757 1
1 9 . 9 1 1 A 14 14 LEU H H 14 8.418 8.639 -0.221 1
1 10 . 9 1 1 A 14 14 LEU HA H 14 4.654 4.443 0.211 1
1 20 . 9 1 1 A 14 14 LEU CA C 14 52.999 53.517 -0.518 1
1 21 . 9 1 1 A 14 14 LEU CB C 14 41.919 41.258 0.661 1
1 25 . 9 1 1 A 14 14 LEU N N 14 122.671 122.437 0.234 1
1 26 . 9 1 1 A 15 15 PRO HA H 15 4.460 4.582 -0.122 1
1 33 . 9 1 1 A 15 15 PRO C C 15 178.156 177.542 0.614 1
1 34 . 9 1 1 A 15 15 PRO CA C 15 63.101 62.665 0.436 1
1 35 . 9 1 1 A 15 15 PRO CB C 15 32.304 32.178 0.126 1
1 38 . 9 1 1 A 16 16 ALA H H 16 8.973 8.621 0.352 1
1 39 . 9 1 1 A 16 16 ALA HA H 16 4.021 3.958 0.063 1
1 43 . 9 1 1 A 16 16 ALA C C 16 180.695 179.380 1.315 1
1 44 . 9 1 1 A 16 16 ALA CA C 16 55.642 55.461 0.181 1
1 45 . 9 1 1 A 16 16 ALA CB C 16 18.552 18.571 -0.019 1
1 46 . 9 1 1 A 16 16 ALA N N 16 128.311 127.101 1.210 1
1 47 . 9 1 1 A 17 17 GLU H H 17 9.558 8.292 1.266 1
1 48 . 9 1 1 A 17 17 GLU HA H 17 4.065 4.057 0.008 1
1 53 . 9 1 1 A 17 17 GLU C C 17 178.886 178.169 0.717 1
1 54 . 9 1 1 A 17 17 GLU CA C 17 59.400 59.359 0.041 1
1 55 . 9 1 1 A 17 17 GLU CB C 17 28.742 29.345 -0.603 1
1 57 . 9 1 1 A 17 17 GLU N N 17 117.113 117.141 -0.028 1
1 58 . 9 1 1 A 18 18 SER H H 18 7.263 8.586 -1.323 1
1 59 . 9 1 1 A 18 18 SER HA H 18 4.180 4.149 0.031 1
1 62 . 9 1 1 A 18 18 SER C C 18 174.951 176.432 -1.481 1
1 63 . 9 1 1 A 18 18 SER CA C 18 61.969 61.338 0.631 1
1 64 . 9 1 1 A 18 18 SER CB C 18 62.554 62.611 -0.057 1
1 65 . 9 1 1 A 18 18 SER N N 18 114.932 115.692 -0.760 1
1 66 . 9 1 1 A 19 19 VAL H H 19 7.620 8.344 -0.724 1
1 67 . 9 1 1 A 19 19 VAL HA H 19 3.011 3.027 -0.016 1
1 75 . 9 1 1 A 19 19 VAL C C 19 176.953 177.520 -0.567 1
1 76 . 9 1 1 A 19 19 VAL CA C 19 66.479 66.906 -0.427 1
1 77 . 9 1 1 A 19 19 VAL CB C 19 31.569 31.409 0.160 1
1 80 . 9 1 1 A 19 19 VAL N N 19 121.086 122.379 -1.293 1
1 81 . 9 1 1 A 20 20 LYS H H 20 7.745 8.474 -0.729 1
1 82 . 9 1 1 A 20 20 LYS HA H 20 3.884 3.954 -0.070 1
1 91 . 9 1 1 A 20 20 LYS C C 20 178.150 178.482 -0.332 1
1 92 . 9 1 1 A 20 20 LYS CA C 20 59.984 59.781 0.203 1
1 93 . 9 1 1 A 20 20 LYS CB C 20 32.351 32.163 0.188 1
1 97 . 9 1 1 A 20 20 LYS N N 20 119.366 119.648 -0.282 1
1 98 . 9 1 1 A 21 21 ILE H H 21 6.943 7.681 -0.738 1
1 99 . 9 1 1 A 21 21 ILE HA H 21 3.783 3.613 0.170 1
1 109 . 9 1 1 A 21 21 ILE C C 21 178.996 178.726 0.270 1
1 110 . 9 1 1 A 21 21 ILE CA C 21 64.642 65.806 -1.164 1
1 111 . 9 1 1 A 21 21 ILE CB C 21 38.014 37.989 0.025 1
1 115 . 9 1 1 A 21 21 ILE N N 21 118.163 119.546 -1.383 1
1 116 . 9 1 1 A 22 22 LEU H H 22 7.267 7.983 -0.716 1
1 117 . 9 1 1 A 22 22 LEU HA H 22 3.748 3.859 -0.111 1
1 127 . 9 1 1 A 22 22 LEU C C 22 178.289 178.823 -0.534 1
1 128 . 9 1 1 A 22 22 LEU CA C 22 58.092 58.022 0.070 1
1 129 . 9 1 1 A 22 22 LEU CB C 22 38.551 40.748 -2.197 1
1 133 . 9 1 1 A 22 22 LEU N N 22 120.609 119.134 1.475 1
1 134 . 9 1 1 A 23 23 ARG H H 23 8.676 8.752 -0.076 1
1 135 . 9 1 1 A 23 23 ARG HA H 23 4.030 4.243 -0.213 1
1 142 . 9 1 1 A 23 23 ARG C C 23 178.861 178.283 0.578 1
1 143 . 9 1 1 A 23 23 ARG CA C 23 60.404 59.951 0.453 1
1 144 . 9 1 1 A 23 23 ARG CB C 23 30.351 30.139 0.212 1
1 147 . 9 1 1 A 23 23 ARG N N 23 119.148 117.773 1.375 1
1 148 . 9 1 1 A 24 24 ASP H H 24 8.515 8.383 0.132 1
1 149 . 9 1 1 A 24 24 ASP HA H 24 4.519 4.377 0.142 1
1 152 . 9 1 1 A 24 24 ASP C C 24 178.759 178.411 0.348 1
1 153 . 9 1 1 A 24 24 ASP CA C 24 57.556 57.140 0.416 1
1 154 . 9 1 1 A 24 24 ASP CB C 24 40.569 40.723 -0.154 1
1 155 . 9 1 1 A 24 24 ASP N N 24 120.027 119.356 0.671 1
1 156 . 9 1 1 A 25 25 TRP H H 25 8.158 7.790 0.368 1
1 157 . 9 1 1 A 25 25 TRP HA H 25 4.181 4.468 -0.287 1
1 166 . 9 1 1 A 25 25 TRP C C 25 179.946 178.439 1.507 1
1 167 . 9 1 1 A 25 25 TRP CA C 25 63.346 61.131 2.215 1
1 168 . 9 1 1 A 25 25 TRP CB C 25 29.433 29.619 -0.186 1
1 174 . 9 1 1 A 25 25 TRP N N 25 121.350 121.444 -0.094 1
1 176 . 9 1 1 A 26 26 MET H H 26 8.977 8.913 0.064 1
1 177 . 9 1 1 A 26 26 MET HA H 26 4.076 4.372 -0.296 1
1 185 . 9 1 1 A 26 26 MET C C 26 177.371 178.068 -0.697 1
1 186 . 9 1 1 A 26 26 MET CA C 26 60.454 58.648 1.806 1
1 187 . 9 1 1 A 26 26 MET CB C 26 33.567 32.740 0.827 1
1 190 . 9 1 1 A 26 26 MET N N 26 119.977 118.733 1.244 1
1 191 . 9 1 1 A 27 27 TYR H H 27 8.604 8.334 0.270 1
1 192 . 9 1 1 A 27 27 TYR HA H 27 4.138 4.142 -0.004 1
1 199 . 9 1 1 A 27 27 TYR C C 27 178.901 177.751 1.150 1
1 200 . 9 1 1 A 27 27 TYR CA C 27 61.846 61.251 0.595 1
1 201 . 9 1 1 A 27 27 TYR CB C 27 38.165 38.727 -0.562 1
1 206 . 9 1 1 A 27 27 TYR N N 27 117.797 121.239 -3.442 1
1 207 . 9 1 1 A 28 28 LYS H H 28 7.867 8.166 -0.299 1
1 208 . 9 1 1 A 28 28 LYS HA H 28 3.797 3.758 0.039 1
1 217 . 9 1 1 A 28 28 LYS C C 28 176.858 177.652 -0.794 1
1 218 . 9 1 1 A 28 28 LYS CA C 28 58.174 58.990 -0.816 1
1 219 . 9 1 1 A 28 28 LYS CB C 28 32.516 31.986 0.530 1
1 223 . 9 1 1 A 28 28 LYS N N 28 118.982 118.000 0.982 1
1 224 . 9 1 1 A 29 29 HIS H H 29 7.443 7.181 0.262 1
1 225 . 9 1 1 A 29 29 HIS HA H 29 4.386 4.486 -0.100 1
1 230 . 9 1 1 A 29 29 HIS C C 29 176.085 175.659 0.426 1
1 231 . 9 1 1 A 29 29 HIS CA C 29 55.213 55.202 0.011 1
1 232 . 9 1 1 A 29 29 HIS CB C 29 27.085 29.104 -2.019 1
1 235 . 9 1 1 A 29 29 HIS N N 29 117.138 115.320 1.818 1
1 236 . 9 1 1 A 30 30 ARG H H 30 6.921 8.115 -1.194 1
1 237 . 9 1 1 A 30 30 ARG HA H 30 3.898 4.165 -0.267 1
1 244 . 9 1 1 A 30 30 ARG C C 30 175.808 177.863 -2.055 1
1 245 . 9 1 1 A 30 30 ARG CA C 30 58.609 58.438 0.171 1
1 246 . 9 1 1 A 30 30 ARG CB C 30 28.739 29.625 -0.886 1
1 249 . 9 1 1 A 30 30 ARG N N 30 117.911 119.300 -1.389 1
1 250 . 9 1 1 A 31 31 PHE H H 31 7.819 7.610 0.209 1
1 251 . 9 1 1 A 31 31 PHE HA H 31 4.533 4.230 0.303 1
1 259 . 9 1 1 A 31 31 PHE C C 31 175.577 177.798 -2.221 1
1 260 . 9 1 1 A 31 31 PHE CA C 31 58.029 60.988 -2.959 1
1 261 . 9 1 1 A 31 31 PHE CB C 31 37.792 39.085 -1.293 1
1 267 . 9 1 1 A 31 31 PHE N N 31 115.408 118.970 -3.562 1
1 268 . 9 1 1 A 32 32 LYS H H 32 7.858 7.992 -0.134 1
1 269 . 9 1 1 A 32 32 LYS HA H 32 4.487 4.383 0.104 1
1 277 . 9 1 1 A 32 32 LYS C C 32 175.557 176.669 -1.112 1
1 278 . 9 1 1 A 32 32 LYS CA C 32 56.329 58.387 -2.058 1
1 279 . 9 1 1 A 32 32 LYS CB C 32 32.743 34.140 -1.397 1
1 283 . 9 1 1 A 32 32 LYS N N 32 122.453 114.847 7.606 1
1 284 . 9 1 1 A 33 33 ALA H H 33 8.643 8.330 0.313 1
1 285 . 9 1 1 A 33 33 ALA HA H 33 4.403 4.024 0.379 1
1 289 . 9 1 1 A 33 33 ALA C C 33 176.273 175.236 1.037 1
1 290 . 9 1 1 A 33 33 ALA CA C 33 53.579 53.275 0.304 1
1 291 . 9 1 1 A 33 33 ALA CB C 33 18.653 17.094 1.559 1
1 292 . 9 1 1 A 33 33 ALA N N 33 127.853 119.951 7.902 1
1 293 . 9 1 1 A 34 34 TYR H H 34 7.878 7.995 -0.117 1
1 294 . 9 1 1 A 34 34 TYR HA H 34 4.686 4.882 -0.196 1
1 301 . 9 1 1 A 34 34 TYR C C 34 173.133 173.324 -0.191 1
1 302 . 9 1 1 A 34 34 TYR CA C 34 54.778 54.901 -0.123 1
1 303 . 9 1 1 A 34 34 TYR CB C 34 39.619 40.571 -0.952 1
1 308 . 9 1 1 A 34 34 TYR N N 34 116.539 116.800 -0.261 1
1 309 . 9 1 1 A 35 35 PRO HA H 35 4.526 4.615 -0.089 1
1 316 . 9 1 1 A 35 35 PRO C C 35 176.837 175.385 1.452 1
1 317 . 9 1 1 A 35 35 PRO CA C 35 61.864 62.042 -0.178 1
1 318 . 9 1 1 A 35 35 PRO CB C 35 30.904 31.936 -1.032 1
1 321 . 9 1 1 A 36 36 SER H H 36 9.634 8.295 1.339 1
1 322 . 9 1 1 A 36 36 SER HA H 36 4.518 4.862 -0.344 1
1 325 . 9 1 1 A 36 36 SER C C 36 175.001 175.578 -0.577 1
1 326 . 9 1 1 A 36 36 SER CA C 36 57.129 58.158 -1.029 1
1 327 . 9 1 1 A 36 36 SER CB C 36 65.374 64.946 0.428 1
1 328 . 9 1 1 A 36 36 SER N N 36 119.984 116.698 3.286 1
1 329 . 9 1 1 A 37 37 GLU H H 37 9.091 9.111 -0.020 1
1 330 . 9 1 1 A 37 37 GLU HA H 37 3.884 3.910 -0.026 1
1 335 . 9 1 1 A 37 37 GLU C C 37 179.347 178.222 1.125 1
1 336 . 9 1 1 A 37 37 GLU CA C 37 60.454 59.568 0.886 1
1 337 . 9 1 1 A 37 37 GLU CB C 37 28.623 29.474 -0.851 1
1 339 . 9 1 1 A 37 37 GLU N N 37 120.748 124.627 -3.879 1
1 340 . 9 1 1 A 38 38 GLU H H 38 8.760 7.995 0.765 1
1 341 . 9 1 1 A 38 38 GLU HA H 38 4.048 4.115 -0.067 1
1 346 . 9 1 1 A 38 38 GLU C C 38 179.975 179.105 0.870 1
1 347 . 9 1 1 A 38 38 GLU CA C 38 60.243 59.145 1.098 1
1 348 . 9 1 1 A 38 38 GLU CB C 38 29.117 29.826 -0.709 1
1 350 . 9 1 1 A 38 38 GLU N N 38 119.272 119.601 -0.329 1
1 351 . 9 1 1 A 39 39 GLU H H 39 7.856 7.979 -0.123 1
1 352 . 9 1 1 A 39 39 GLU HA H 39 3.976 3.878 0.098 1
1 357 . 9 1 1 A 39 39 GLU C C 39 178.912 178.883 0.029 1
1 358 . 9 1 1 A 39 39 GLU CA C 39 59.131 59.195 -0.064 1
1 359 . 9 1 1 A 39 39 GLU CB C 39 29.612 28.848 0.764 1
1 361 . 9 1 1 A 39 39 GLU N N 39 121.658 120.687 0.971 1
1 362 . 9 1 1 A 40 40 LYS H H 40 8.653 7.764 0.889 1
1 363 . 9 1 1 A 40 40 LYS HA H 40 3.508 3.835 -0.327 1
1 372 . 9 1 1 A 40 40 LYS C C 40 177.974 178.928 -0.954 1
1 373 . 9 1 1 A 40 40 LYS CA C 40 60.948 59.544 1.404 1
1 374 . 9 1 1 A 40 40 LYS CB C 40 32.714 32.093 0.621 1
1 378 . 9 1 1 A 40 40 LYS N N 40 119.152 119.726 -0.574 1
1 379 . 9 1 1 A 41 41 GLN H H 41 7.876 7.503 0.373 1
1 380 . 9 1 1 A 41 41 GLN HA H 41 3.911 4.007 -0.096 1
1 387 . 9 1 1 A 41 41 GLN C C 41 178.352 178.155 0.197 1
1 388 . 9 1 1 A 41 41 GLN CA C 41 58.973 58.721 0.252 1
1 389 . 9 1 1 A 41 41 GLN CB C 41 27.552 28.652 -1.100 1
1 391 . 9 1 1 A 41 41 GLN N N 41 118.910 119.350 -0.440 1
1 393 . 9 1 1 A 42 42 MET H H 42 7.771 7.840 -0.069 1
1 394 . 9 1 1 A 42 42 MET HA H 42 4.158 4.241 -0.083 1
1 402 . 9 1 1 A 42 42 MET C C 42 179.310 178.260 1.050 1
1 403 . 9 1 1 A 42 42 MET CA C 42 59.079 58.093 0.986 1
1 404 . 9 1 1 A 42 42 MET CB C 42 31.023 32.345 -1.322 1
1 407 . 9 1 1 A 42 42 MET N N 42 121.131 119.583 1.548 1
1 408 . 9 1 1 A 43 43 LEU H H 43 8.400 8.436 -0.036 1
1 409 . 9 1 1 A 43 43 LEU HA H 43 3.888 3.960 -0.072 1
1 419 . 9 1 1 A 43 43 LEU C C 43 180.721 178.972 1.749 1
1 420 . 9 1 1 A 43 43 LEU CA C 43 57.916 58.068 -0.152 1
1 421 . 9 1 1 A 43 43 LEU CB C 43 42.080 41.334 0.746 1
1 425 . 9 1 1 A 43 43 LEU N N 43 120.124 120.794 -0.670 1
1 426 . 9 1 1 A 44 44 SER H H 44 8.658 8.676 -0.018 1
1 427 . 9 1 1 A 44 44 SER HA H 44 4.088 4.357 -0.269 1
1 430 . 9 1 1 A 44 44 SER C C 44 176.859 177.387 -0.528 1
1 431 . 9 1 1 A 44 44 SER CA C 44 61.371 61.563 -0.192 1
1 432 . 9 1 1 A 44 44 SER CB C 44 63.314 62.533 0.781 1
1 433 . 9 1 1 A 44 44 SER N N 44 119.795 113.225 6.570 1
1 434 . 9 1 1 A 45 45 GLU H H 45 7.905 7.492 0.413 1
1 435 . 9 1 1 A 45 45 GLU HA H 45 4.094 4.249 -0.155 1
1 440 . 9 1 1 A 45 45 GLU C C 45 179.095 179.293 -0.198 1
1 441 . 9 1 1 A 45 45 GLU CA C 45 59.255 59.011 0.244 1
1 442 . 9 1 1 A 45 45 GLU CB C 45 29.200 29.829 -0.629 1
1 444 . 9 1 1 A 45 45 GLU N N 45 120.609 123.260 -2.651 1
1 445 . 9 1 1 A 46 46 LYS H H 46 7.837 7.959 -0.122 1
1 446 . 9 1 1 A 46 46 LYS HA H 46 4.231 4.125 0.106 1
1 453 . 9 1 1 A 46 46 LYS C C 46 177.964 178.962 -0.998 1
1 454 . 9 1 1 A 46 46 LYS CA C 46 58.278 59.136 -0.858 1
1 455 . 9 1 1 A 46 46 LYS CB C 46 34.110 32.571 1.539 1
1 459 . 9 1 1 A 46 46 LYS N N 46 115.471 119.240 -3.769 1
1 460 . 9 1 1 A 47 47 THR H H 47 7.763 8.159 -0.396 1
1 461 . 9 1 1 A 47 47 THR HA H 47 4.271 4.207 0.064 1
1 466 . 9 1 1 A 47 47 THR C C 47 175.472 174.737 0.735 1
1 467 . 9 1 1 A 47 47 THR CA C 47 62.429 62.551 -0.122 1
1 468 . 9 1 1 A 47 47 THR CB C 47 71.966 70.012 1.954 1
1 470 . 9 1 1 A 47 47 THR N N 47 104.286 108.897 -4.611 1
1 471 . 9 1 1 A 48 48 ASN H H 48 8.169 8.002 0.167 1
1 472 . 9 1 1 A 48 48 ASN HA H 48 4.437 4.477 -0.040 1
1 477 . 9 1 1 A 48 48 ASN C C 48 173.874 173.896 -0.022 1
1 478 . 9 1 1 A 48 48 ASN CA C 48 55.377 54.404 0.973 1
1 479 . 9 1 1 A 48 48 ASN CB C 48 37.770 36.642 1.128 1
1 480 . 9 1 1 A 48 48 ASN N N 48 117.458 116.039 1.419 1
1 482 . 9 1 1 A 49 49 LEU H H 49 7.532 7.276 0.256 1
1 483 . 9 1 1 A 49 49 LEU HA H 49 4.733 4.855 -0.122 1
1 493 . 9 1 1 A 49 49 LEU C C 49 176.625 176.105 0.520 1
1 494 . 9 1 1 A 49 49 LEU CA C 49 53.226 53.121 0.105 1
1 495 . 9 1 1 A 49 49 LEU CB C 49 44.114 44.253 -0.139 1
1 499 . 9 1 1 A 49 49 LEU N N 49 118.220 119.002 -0.782 1
1 500 . 9 1 1 A 50 50 SER H H 50 9.140 8.397 0.743 1
1 501 . 9 1 1 A 50 50 SER HA H 50 4.475 5.007 -0.532 1
1 504 . 9 1 1 A 50 50 SER C C 50 174.907 175.923 -1.016 1
1 505 . 9 1 1 A 50 50 SER CA C 50 56.964 55.539 1.425 1
1 506 . 9 1 1 A 50 50 SER CB C 50 65.372 65.707 -0.335 1
1 507 . 9 1 1 A 50 50 SER N N 50 117.569 113.004 4.565 1
1 508 . 9 1 1 A 51 51 LEU H H 51 8.756 8.981 -0.225 1
1 509 . 9 1 1 A 51 51 LEU HA H 51 3.874 3.932 -0.058 1
1 519 . 9 1 1 A 51 51 LEU C C 51 179.910 178.920 0.990 1
1 520 . 9 1 1 A 51 51 LEU CA C 51 58.916 58.184 0.732 1
1 521 . 9 1 1 A 51 51 LEU CB C 51 41.148 41.246 -0.098 1
1 525 . 9 1 1 A 51 51 LEU N N 51 120.905 123.195 -2.290 1
1 526 . 9 1 1 A 52 52 LEU H H 52 8.146 8.231 -0.085 1
1 527 . 9 1 1 A 52 52 LEU HA H 52 4.179 4.014 0.165 1
1 537 . 9 1 1 A 52 52 LEU C C 52 178.936 178.697 0.239 1
1 538 . 9 1 1 A 52 52 LEU CA C 52 58.162 58.399 -0.237 1
1 539 . 9 1 1 A 52 52 LEU CB C 52 42.137 41.589 0.548 1
1 543 . 9 1 1 A 52 52 LEU N N 52 120.685 120.163 0.522 1
1 544 . 9 1 1 A 53 53 GLN H H 53 7.924 7.815 0.109 1
1 545 . 9 1 1 A 53 53 GLN HA H 53 4.102 4.146 -0.044 1
1 552 . 9 1 1 A 53 53 GLN C C 53 180.308 178.603 1.705 1
1 553 . 9 1 1 A 53 53 GLN CA C 53 59.326 58.550 0.776 1
1 554 . 9 1 1 A 53 53 GLN CB C 53 29.900 28.303 1.597 1
1 556 . 9 1 1 A 53 53 GLN N N 53 118.473 117.502 0.971 1
1 558 . 9 1 1 A 54 54 ILE H H 54 8.380 8.408 -0.028 1
1 559 . 9 1 1 A 54 54 ILE HA H 54 3.677 3.725 -0.048 1
1 569 . 9 1 1 A 54 54 ILE C C 54 177.673 178.169 -0.496 1
1 570 . 9 1 1 A 54 54 ILE CA C 54 64.650 65.399 -0.749 1
1 571 . 9 1 1 A 54 54 ILE CB C 54 37.476 37.761 -0.285 1
1 575 . 9 1 1 A 54 54 ILE N N 54 120.113 121.488 -1.375 1
1 576 . 9 1 1 A 55 55 SER H H 55 8.854 8.131 0.723 1
1 577 . 9 1 1 A 55 55 SER HA H 55 4.267 4.382 -0.115 1
1 580 . 9 1 1 A 55 55 SER C C 55 177.127 176.864 0.263 1
1 581 . 9 1 1 A 55 55 SER CA C 55 62.852 62.471 0.381 1
1 582 . 9 1 1 A 55 55 SER CB C 55 62.727 62.803 -0.076 1
1 583 . 9 1 1 A 55 55 SER N N 55 116.646 116.170 0.476 1
1 584 . 9 1 1 A 56 56 ASN H H 56 8.634 8.301 0.333 1
1 585 . 9 1 1 A 56 56 ASN HA H 56 4.549 4.479 0.070 1
1 590 . 9 1 1 A 56 56 ASN C C 56 177.481 178.401 -0.920 1
1 591 . 9 1 1 A 56 56 ASN CA C 56 55.951 56.483 -0.532 1
1 592 . 9 1 1 A 56 56 ASN CB C 56 37.852 38.254 -0.402 1
1 593 . 9 1 1 A 56 56 ASN N N 56 119.048 120.125 -1.077 1
1 595 . 9 1 1 A 57 57 TRP H H 57 8.373 8.218 0.155 1
1 596 . 9 1 1 A 57 57 TRP HA H 57 4.065 4.334 -0.269 1
1 605 . 9 1 1 A 57 57 TRP C C 57 179.392 178.325 1.067 1
1 606 . 9 1 1 A 57 57 TRP CA C 57 63.204 61.281 1.923 1
1 607 . 9 1 1 A 57 57 TRP CB C 57 28.376 29.241 -0.865 1
1 613 . 9 1 1 A 57 57 TRP N N 57 122.950 123.186 -0.236 1
1 615 . 9 1 1 A 58 58 PHE H H 58 8.428 8.170 0.258 1
1 616 . 9 1 1 A 58 58 PHE HA H 58 3.922 3.814 0.108 1
1 624 . 9 1 1 A 58 58 PHE C C 58 178.237 177.999 0.238 1
1 625 . 9 1 1 A 58 58 PHE CA C 58 64.015 60.977 3.038 1
1 626 . 9 1 1 A 58 58 PHE CB C 58 39.602 38.118 1.484 1
1 632 . 9 1 1 A 58 58 PHE N N 58 116.774 117.393 -0.619 1
1 633 . 9 1 1 A 59 59 ILE H H 59 7.925 7.761 0.164 1
1 634 . 9 1 1 A 59 59 ILE HA H 59 3.773 3.611 0.162 1
1 644 . 9 1 1 A 59 59 ILE C C 59 178.745 177.648 1.097 1
1 645 . 9 1 1 A 59 59 ILE CA C 59 65.531 65.268 0.263 1
1 646 . 9 1 1 A 59 59 ILE CB C 59 38.480 37.785 0.695 1
1 650 . 9 1 1 A 59 59 ILE N N 59 119.560 120.476 -0.916 1
1 651 . 9 1 1 A 60 60 ASN H H 60 7.506 8.275 -0.769 1
1 652 . 9 1 1 A 60 60 ASN HA H 60 4.407 4.406 0.001 1
1 657 . 9 1 1 A 60 60 ASN C C 60 177.163 177.913 -0.750 1
1 658 . 9 1 1 A 60 60 ASN CA C 60 55.871 55.931 -0.060 1
1 659 . 9 1 1 A 60 60 ASN CB C 60 38.878 37.676 1.202 1
1 660 . 9 1 1 A 60 60 ASN N N 60 116.868 117.451 -0.583 1
1 662 . 9 1 1 A 61 61 ALA H H 61 8.410 7.888 0.522 1
1 663 . 9 1 1 A 61 61 ALA HA H 61 3.667 3.634 0.033 1
1 667 . 9 1 1 A 61 61 ALA C C 61 180.061 179.055 1.006 1
1 668 . 9 1 1 A 61 61 ALA CA C 61 54.601 55.008 -0.407 1
1 669 . 9 1 1 A 61 61 ALA CB C 61 18.241 17.294 0.947 1
1 670 . 9 1 1 A 61 61 ALA N N 61 123.022 122.749 0.273 1
1 671 . 9 1 1 A 62 62 ARG H H 62 8.036 7.846 0.190 1
1 672 . 9 1 1 A 62 62 ARG HA H 62 4.092 3.947 0.145 1
1 679 . 9 1 1 A 62 62 ARG C C 62 176.756 177.829 -1.073 1
1 680 . 9 1 1 A 62 62 ARG CA C 62 58.762 58.309 0.453 1
1 681 . 9 1 1 A 62 62 ARG CB C 62 30.601 29.860 0.741 1
1 684 . 9 1 1 A 62 62 ARG N N 62 117.168 118.515 -1.347 1
1 685 . 9 1 1 A 63 63 ARG H H 63 7.214 7.836 -0.622 1
1 686 . 9 1 1 A 63 63 ARG HA H 63 4.249 4.176 0.073 1
1 693 . 9 1 1 A 63 63 ARG C C 63 176.945 176.787 0.158 1
1 694 . 9 1 1 A 63 63 ARG CA C 63 57.669 58.260 -0.591 1
1 695 . 9 1 1 A 63 63 ARG CB C 63 30.765 31.020 -0.255 1
1 698 . 9 1 1 A 63 63 ARG N N 63 116.514 118.074 -1.560 1
1 699 . 9 1 1 A 64 64 ARG H H 64 7.913 7.883 0.030 1
1 700 . 9 1 1 A 64 64 ARG HA H 64 4.351 4.594 -0.243 1
1 707 . 9 1 1 A 64 64 ARG C C 64 176.413 178.414 -2.001 1
1 708 . 9 1 1 A 64 64 ARG CA C 64 57.105 57.175 -0.070 1
1 709 . 9 1 1 A 64 64 ARG CB C 64 31.672 32.533 -0.861 1
1 712 . 9 1 1 A 64 64 ARG N N 64 116.818 118.550 -1.732 1
1 713 . 9 1 1 A 65 65 ILE H H 65 8.169 8.255 -0.086 1
1 714 . 9 1 1 A 65 65 ILE HA H 65 4.285 3.633 0.652 1
1 724 . 9 1 1 A 65 65 ILE C C 65 176.208 177.921 -1.713 1
1 725 . 9 1 1 A 65 65 ILE CA C 65 62.005 65.476 -3.471 1
1 726 . 9 1 1 A 65 65 ILE CB C 65 39.088 37.871 1.217 1
1 730 . 9 1 1 A 65 65 ILE N N 65 119.185 119.420 -0.235 1
1 731 . 9 1 1 A 66 66 LEU H H 66 7.962 7.832 0.130 1
1 732 . 9 1 1 A 66 66 LEU HA H 66 4.485 4.048 0.437 1
1 742 . 9 1 1 A 66 66 LEU C C 66 176.216 175.344 0.872 1
1 743 . 9 1 1 A 66 66 LEU CA C 66 56.153 59.807 -3.654 1
1 744 . 9 1 1 A 66 66 LEU CB C 66 40.792 40.081 0.711 1
1 748 . 9 1 1 A 66 66 LEU N N 66 124.389 121.606 2.783 1
1 749 . 9 1 1 A 67 67 PRO HA H 67 4.283 4.401 -0.118 1
1 756 . 9 1 1 A 67 67 PRO C C 67 178.294 177.948 0.346 1
1 757 . 9 1 1 A 67 67 PRO CA C 67 65.390 64.794 0.596 1
1 758 . 9 1 1 A 67 67 PRO CB C 67 31.095 31.346 -0.251 1
1 761 . 9 1 1 A 68 68 ASP H H 68 7.913 8.629 -0.716 1
1 762 . 9 1 1 A 68 68 ASP HA H 68 4.507 4.635 -0.128 1
1 765 . 9 1 1 A 68 68 ASP C C 68 177.927 177.984 -0.057 1
1 766 . 9 1 1 A 68 68 ASP CA C 68 55.906 56.709 -0.803 1
1 767 . 9 1 1 A 68 68 ASP CB C 68 40.736 41.486 -0.750 1
1 768 . 9 1 1 A 68 68 ASP N N 68 117.231 118.574 -1.343 1
1 769 . 9 1 1 A 69 69 MET H H 69 8.083 8.323 -0.240 1
1 770 . 9 1 1 A 69 69 MET HA H 69 4.362 4.209 0.153 1
1 778 . 9 1 1 A 69 69 MET C C 69 177.374 179.145 -1.771 1
1 779 . 9 1 1 A 69 69 MET CA C 69 57.634 58.503 -0.869 1
1 780 . 9 1 1 A 69 69 MET CB C 69 32.816 32.668 0.148 1
1 783 . 9 1 1 A 69 69 MET N N 69 119.391 118.226 1.165 1
1 784 . 9 1 1 A 70 70 LEU H H 70 7.907 7.388 0.519 1
1 785 . 9 1 1 A 70 70 LEU HA H 70 4.232 4.048 0.184 1
1 795 . 9 1 1 A 70 70 LEU C C 70 177.745 176.551 1.194 1
1 796 . 9 1 1 A 70 70 LEU CA C 70 55.835 57.389 -1.554 1
1 797 . 9 1 1 A 70 70 LEU CB C 70 42.174 42.119 0.055 1
1 801 . 9 1 1 A 70 70 LEU N N 70 119.266 121.049 -1.783 1
1 802 . 9 1 1 A 71 71 GLN H H 71 7.865 7.867 -0.002 1
1 803 . 9 1 1 A 71 71 GLN HA H 71 4.287 3.859 0.428 1
1 809 . 9 1 1 A 71 71 GLN C C 71 178.855 174.848 4.007 1
1 810 . 9 1 1 A 71 71 GLN CA C 71 56.383 57.000 -0.617 1
1 811 . 9 1 1 A 71 71 GLN CB C 71 29.092 26.524 2.568 1
1 813 . 9 1 1 A 71 71 GLN N N 71 118.603 116.199 2.404 1
1 815 . 9 1 1 A 72 72 GLN H H 72 8.189 7.789 0.400 1
1 816 . 9 1 1 A 72 72 GLN HA H 72 4.302 4.266 0.036 1
1 821 . 9 1 1 A 72 72 GLN CA C 72 56.206 55.652 0.554 1
1 822 . 9 1 1 A 72 72 GLN CB C 72 29.298 30.205 -0.907 1
1 824 . 9 1 1 A 72 72 GLN N N 72 120.267 117.736 2.531 1
1 825 . 9 1 1 A 73 73 ARG C C 73 176.105 176.058 0.047 1
1 826 . 9 1 1 A 74 74 ARG HA H 74 4.334 4.736 -0.402 1
1 833 . 9 1 1 A 74 74 ARG C C 74 176.188 174.237 1.951 1
1 834 . 9 1 1 A 74 74 ARG CA C 74 56.300 55.172 1.128 1
1 835 . 9 1 1 A 74 74 ARG CB C 74 30.668 33.867 -3.199 1
1 838 . 9 1 1 A 75 75 ASN C C 75 174.462 174.217 0.245 1
1 839 . 9 1 1 A 75 75 ASN CA C 75 53.148 52.892 0.256 1
1 840 . 9 1 1 A 75 75 ASN CB C 75 39.046 36.996 2.050 1
1 841 . 9 1 1 A 76 76 ASP H H 76 8.257 8.199 0.058 1
1 842 . 9 1 1 A 76 76 ASP HA H 76 4.877 5.328 -0.451 1
1 845 . 9 1 1 A 76 76 ASP C C 76 174.759 173.885 0.874 1
1 846 . 9 1 1 A 76 76 ASP CA C 76 52.380 51.098 1.282 1
1 847 . 9 1 1 A 76 76 ASP CB C 76 41.267 43.285 -2.018 1
1 848 . 9 1 1 A 76 76 ASP N N 76 122.030 121.695 0.335 1
1 849 . 9 1 1 A 77 77 PRO HA H 77 4.466 4.543 -0.077 1
1 856 . 9 1 1 A 77 77 PRO C C 77 177.133 176.053 1.080 1
1 857 . 9 1 1 A 77 77 PRO CA C 77 63.733 62.505 1.228 1
1 858 . 9 1 1 A 77 77 PRO CB C 77 31.919 32.331 -0.412 1
1 861 . 9 1 1 A 78 78 SER H H 78 8.457 8.525 -0.068 1
1 862 . 9 1 1 A 78 78 SER HA H 78 4.479 4.974 -0.495 1
1 865 . 9 1 1 A 78 78 SER C C 78 174.731 174.315 0.416 1
1 866 . 9 1 1 A 78 78 SER CA C 78 58.691 58.314 0.377 1
1 867 . 9 1 1 A 78 78 SER CB C 78 63.973 64.595 -0.622 1
1 868 . 9 1 1 A 78 78 SER N N 78 115.711 117.511 -1.800 1
1 869 . 9 1 1 A 79 79 GLY H H 79 8.090 8.482 -0.392 1
1 870 . 9 1 1 A 79 79 GLY HA2 H 79 4.179 4.025 0.154 1
1 871 . 9 1 1 A 79 79 GLY HA3 H 79 4.065 4.025 0.040 1
1 872 . 9 1 1 A 79 79 GLY CA C 79 44.746 46.014 -1.268 1
1 873 . 9 1 1 A 79 79 GLY N N 79 110.429 110.579 -0.150 1
1 874 . 9 1 1 A 80 80 PRO HA H 80 4.464 4.601 -0.137 1
1 880 . 9 1 1 A 80 80 PRO C C 80 177.499 175.409 2.090 1
1 881 . 9 1 1 A 80 80 PRO CA C 80 63.275 62.785 0.490 1
1 882 . 9 1 1 A 80 80 PRO CB C 80 32.249 33.450 -1.201 1
1 1 . 10 1 1 A 13 13 ASN HA H 13 4.787 5.789 -1.002 1
1 6 . 10 1 1 A 13 13 ASN CA C 13 53.148 51.906 1.242 1
1 7 . 10 1 1 A 13 13 ASN CB C 13 39.378 42.033 -2.655 1
1 9 . 10 1 1 A 14 14 LEU H H 14 8.418 8.992 -0.574 1
1 10 . 10 1 1 A 14 14 LEU HA H 14 4.654 4.757 -0.103 1
1 20 . 10 1 1 A 14 14 LEU CA C 14 52.999 52.299 0.700 1
1 21 . 10 1 1 A 14 14 LEU CB C 14 41.919 42.147 -0.228 1
1 25 . 10 1 1 A 14 14 LEU N N 14 122.671 122.152 0.519 1
1 26 . 10 1 1 A 15 15 PRO HA H 15 4.460 4.627 -0.167 1
1 33 . 10 1 1 A 15 15 PRO C C 15 178.156 177.558 0.598 1
1 34 . 10 1 1 A 15 15 PRO CA C 15 63.101 62.669 0.432 1
1 35 . 10 1 1 A 15 15 PRO CB C 15 32.304 32.430 -0.126 1
1 38 . 10 1 1 A 16 16 ALA H H 16 8.973 8.648 0.325 1
1 39 . 10 1 1 A 16 16 ALA HA H 16 4.021 3.960 0.061 1
1 43 . 10 1 1 A 16 16 ALA C C 16 180.695 179.731 0.964 1
1 44 . 10 1 1 A 16 16 ALA CA C 16 55.642 55.630 0.012 1
1 45 . 10 1 1 A 16 16 ALA CB C 16 18.552 18.672 -0.120 1
1 46 . 10 1 1 A 16 16 ALA N N 16 128.311 127.010 1.301 1
1 47 . 10 1 1 A 17 17 GLU H H 17 9.558 8.433 1.125 1
1 48 . 10 1 1 A 17 17 GLU HA H 17 4.065 4.015 0.050 1
1 53 . 10 1 1 A 17 17 GLU C C 17 178.886 178.516 0.370 1
1 54 . 10 1 1 A 17 17 GLU CA C 17 59.400 59.866 -0.466 1
1 55 . 10 1 1 A 17 17 GLU CB C 17 28.742 29.458 -0.716 1
1 57 . 10 1 1 A 17 17 GLU N N 17 117.113 118.772 -1.659 1
1 58 . 10 1 1 A 18 18 SER H H 18 7.263 7.682 -0.419 1
1 59 . 10 1 1 A 18 18 SER HA H 18 4.180 4.178 0.002 1
1 62 . 10 1 1 A 18 18 SER C C 18 174.951 177.133 -2.182 1
1 63 . 10 1 1 A 18 18 SER CA C 18 61.969 61.345 0.624 1
1 64 . 10 1 1 A 18 18 SER CB C 18 62.554 62.851 -0.297 1
1 65 . 10 1 1 A 18 18 SER N N 18 114.932 114.721 0.211 1
1 66 . 10 1 1 A 19 19 VAL H H 19 7.620 8.316 -0.696 1
1 67 . 10 1 1 A 19 19 VAL HA H 19 3.011 3.127 -0.116 1
1 75 . 10 1 1 A 19 19 VAL C C 19 176.953 177.654 -0.701 1
1 76 . 10 1 1 A 19 19 VAL CA C 19 66.479 66.900 -0.421 1
1 77 . 10 1 1 A 19 19 VAL CB C 19 31.569 31.455 0.114 1
1 80 . 10 1 1 A 19 19 VAL N N 19 121.086 120.863 0.223 1
1 81 . 10 1 1 A 20 20 LYS H H 20 7.745 8.401 -0.656 1
1 82 . 10 1 1 A 20 20 LYS HA H 20 3.884 3.988 -0.104 1
1 91 . 10 1 1 A 20 20 LYS C C 20 178.150 178.837 -0.687 1
1 92 . 10 1 1 A 20 20 LYS CA C 20 59.984 59.797 0.187 1
1 93 . 10 1 1 A 20 20 LYS CB C 20 32.351 32.158 0.193 1
1 97 . 10 1 1 A 20 20 LYS N N 20 119.366 119.654 -0.288 1
1 98 . 10 1 1 A 21 21 ILE H H 21 6.943 7.889 -0.946 1
1 99 . 10 1 1 A 21 21 ILE HA H 21 3.783 3.652 0.131 1
1 109 . 10 1 1 A 21 21 ILE C C 21 178.996 178.623 0.373 1
1 110 . 10 1 1 A 21 21 ILE CA C 21 64.642 65.859 -1.217 1
1 111 . 10 1 1 A 21 21 ILE CB C 21 38.014 37.789 0.225 1
1 115 . 10 1 1 A 21 21 ILE N N 21 118.163 120.076 -1.913 1
1 116 . 10 1 1 A 22 22 LEU H H 22 7.267 7.903 -0.636 1
1 117 . 10 1 1 A 22 22 LEU HA H 22 3.748 3.883 -0.135 1
1 127 . 10 1 1 A 22 22 LEU C C 22 178.289 178.600 -0.311 1
1 128 . 10 1 1 A 22 22 LEU CA C 22 58.092 58.196 -0.104 1
1 129 . 10 1 1 A 22 22 LEU CB C 22 38.551 40.924 -2.373 1
1 133 . 10 1 1 A 22 22 LEU N N 22 120.609 119.132 1.477 1
1 134 . 10 1 1 A 23 23 ARG H H 23 8.676 8.726 -0.050 1
1 135 . 10 1 1 A 23 23 ARG HA H 23 4.030 4.170 -0.140 1
1 142 . 10 1 1 A 23 23 ARG C C 23 178.861 178.466 0.395 1
1 143 . 10 1 1 A 23 23 ARG CA C 23 60.404 60.149 0.255 1
1 144 . 10 1 1 A 23 23 ARG CB C 23 30.351 30.195 0.156 1
1 147 . 10 1 1 A 23 23 ARG N N 23 119.148 117.635 1.513 1
1 148 . 10 1 1 A 24 24 ASP H H 24 8.515 8.272 0.243 1
1 149 . 10 1 1 A 24 24 ASP HA H 24 4.519 4.383 0.136 1
1 152 . 10 1 1 A 24 24 ASP C C 24 178.759 178.534 0.225 1
1 153 . 10 1 1 A 24 24 ASP CA C 24 57.556 57.165 0.391 1
1 154 . 10 1 1 A 24 24 ASP CB C 24 40.569 40.970 -0.401 1
1 155 . 10 1 1 A 24 24 ASP N N 24 120.027 119.346 0.681 1
1 156 . 10 1 1 A 25 25 TRP H H 25 8.158 7.834 0.324 1
1 157 . 10 1 1 A 25 25 TRP HA H 25 4.181 4.496 -0.315 1
1 166 . 10 1 1 A 25 25 TRP C C 25 179.946 178.508 1.438 1
1 167 . 10 1 1 A 25 25 TRP CA C 25 63.346 61.329 2.017 1
1 168 . 10 1 1 A 25 25 TRP CB C 25 29.433 29.719 -0.286 1
1 174 . 10 1 1 A 25 25 TRP N N 25 121.350 121.638 -0.288 1
1 176 . 10 1 1 A 26 26 MET H H 26 8.977 8.802 0.175 1
1 177 . 10 1 1 A 26 26 MET HA H 26 4.076 4.629 -0.553 1
1 185 . 10 1 1 A 26 26 MET C C 26 177.371 178.083 -0.712 1
1 186 . 10 1 1 A 26 26 MET CA C 26 60.454 58.727 1.727 1
1 187 . 10 1 1 A 26 26 MET CB C 26 33.567 32.740 0.827 1
1 190 . 10 1 1 A 26 26 MET N N 26 119.977 118.821 1.156 1
1 191 . 10 1 1 A 27 27 TYR H H 27 8.604 8.408 0.196 1
1 192 . 10 1 1 A 27 27 TYR HA H 27 4.138 4.178 -0.040 1
1 199 . 10 1 1 A 27 27 TYR C C 27 178.901 177.823 1.078 1
1 200 . 10 1 1 A 27 27 TYR CA C 27 61.846 61.327 0.519 1
1 201 . 10 1 1 A 27 27 TYR CB C 27 38.165 38.771 -0.606 1
1 206 . 10 1 1 A 27 27 TYR N N 27 117.797 121.555 -3.758 1
1 207 . 10 1 1 A 28 28 LYS H H 28 7.867 7.787 0.080 1
1 208 . 10 1 1 A 28 28 LYS HA H 28 3.797 3.800 -0.003 1
1 217 . 10 1 1 A 28 28 LYS C C 28 176.858 177.924 -1.066 1
1 218 . 10 1 1 A 28 28 LYS CA C 28 58.174 59.304 -1.130 1
1 219 . 10 1 1 A 28 28 LYS CB C 28 32.516 31.852 0.664 1
1 223 . 10 1 1 A 28 28 LYS N N 28 118.982 117.961 1.021 1
1 224 . 10 1 1 A 29 29 HIS H H 29 7.443 7.266 0.177 1
1 225 . 10 1 1 A 29 29 HIS HA H 29 4.386 4.415 -0.029 1
1 230 . 10 1 1 A 29 29 HIS C C 29 176.085 175.969 0.116 1
1 231 . 10 1 1 A 29 29 HIS CA C 29 55.213 55.884 -0.671 1
1 232 . 10 1 1 A 29 29 HIS CB C 29 27.085 28.608 -1.523 1
1 235 . 10 1 1 A 29 29 HIS N N 29 117.138 115.724 1.414 1
1 236 . 10 1 1 A 30 30 ARG H H 30 6.921 8.268 -1.347 1
1 237 . 10 1 1 A 30 30 ARG HA H 30 3.898 4.368 -0.470 1
1 244 . 10 1 1 A 30 30 ARG C C 30 175.808 178.121 -2.313 1
1 245 . 10 1 1 A 30 30 ARG CA C 30 58.609 58.624 -0.015 1
1 246 . 10 1 1 A 30 30 ARG CB C 30 28.739 29.849 -1.110 1
1 249 . 10 1 1 A 30 30 ARG N N 30 117.911 119.336 -1.425 1
1 250 . 10 1 1 A 31 31 PHE H H 31 7.819 8.230 -0.411 1
1 251 . 10 1 1 A 31 31 PHE HA H 31 4.533 4.036 0.497 1
1 259 . 10 1 1 A 31 31 PHE C C 31 175.577 177.453 -1.876 1
1 260 . 10 1 1 A 31 31 PHE CA C 31 58.029 61.626 -3.597 1
1 261 . 10 1 1 A 31 31 PHE CB C 31 37.792 39.244 -1.452 1
1 267 . 10 1 1 A 31 31 PHE N N 31 115.408 121.248 -5.840 1
1 268 . 10 1 1 A 32 32 LYS H H 32 7.858 7.995 -0.137 1
1 269 . 10 1 1 A 32 32 LYS HA H 32 4.487 4.276 0.211 1
1 277 . 10 1 1 A 32 32 LYS C C 32 175.557 175.995 -0.438 1
1 278 . 10 1 1 A 32 32 LYS CA C 32 56.329 56.543 -0.214 1
1 279 . 10 1 1 A 32 32 LYS CB C 32 32.743 33.383 -0.640 1
1 283 . 10 1 1 A 32 32 LYS N N 32 122.453 115.731 6.722 1
1 284 . 10 1 1 A 33 33 ALA H H 33 8.643 8.158 0.485 1
1 285 . 10 1 1 A 33 33 ALA HA H 33 4.403 4.145 0.258 1
1 289 . 10 1 1 A 33 33 ALA C C 33 176.273 175.580 0.693 1
1 290 . 10 1 1 A 33 33 ALA CA C 33 53.579 53.274 0.305 1
1 291 . 10 1 1 A 33 33 ALA CB C 33 18.653 17.307 1.346 1
1 292 . 10 1 1 A 33 33 ALA N N 33 127.853 121.123 6.730 1
1 293 . 10 1 1 A 34 34 TYR H H 34 7.878 8.051 -0.173 1
1 294 . 10 1 1 A 34 34 TYR HA H 34 4.686 5.058 -0.372 1
1 301 . 10 1 1 A 34 34 TYR C C 34 173.133 172.972 0.161 1
1 302 . 10 1 1 A 34 34 TYR CA C 34 54.778 54.953 -0.175 1
1 303 . 10 1 1 A 34 34 TYR CB C 34 39.619 38.981 0.638 1
1 308 . 10 1 1 A 34 34 TYR N N 34 116.539 118.338 -1.799 1
1 309 . 10 1 1 A 35 35 PRO HA H 35 4.526 4.665 -0.139 1
1 316 . 10 1 1 A 35 35 PRO C C 35 176.837 175.606 1.231 1
1 317 . 10 1 1 A 35 35 PRO CA C 35 61.864 62.167 -0.303 1
1 318 . 10 1 1 A 35 35 PRO CB C 35 30.904 31.875 -0.971 1
1 321 . 10 1 1 A 36 36 SER H H 36 9.634 8.411 1.223 1
1 322 . 10 1 1 A 36 36 SER HA H 36 4.518 4.735 -0.217 1
1 325 . 10 1 1 A 36 36 SER C C 36 175.001 174.945 0.056 1
1 326 . 10 1 1 A 36 36 SER CA C 36 57.129 56.605 0.524 1
1 327 . 10 1 1 A 36 36 SER CB C 36 65.374 65.141 0.233 1
1 328 . 10 1 1 A 36 36 SER N N 36 119.984 117.043 2.941 1
1 329 . 10 1 1 A 37 37 GLU H H 37 9.091 9.037 0.054 1
1 330 . 10 1 1 A 37 37 GLU HA H 37 3.884 3.894 -0.010 1
1 335 . 10 1 1 A 37 37 GLU C C 37 179.347 178.209 1.138 1
1 336 . 10 1 1 A 37 37 GLU CA C 37 60.454 59.736 0.718 1
1 337 . 10 1 1 A 37 37 GLU CB C 37 28.623 29.456 -0.833 1
1 339 . 10 1 1 A 37 37 GLU N N 37 120.748 126.471 -5.723 1
1 340 . 10 1 1 A 38 38 GLU H H 38 8.760 7.968 0.792 1
1 341 . 10 1 1 A 38 38 GLU HA H 38 4.048 4.079 -0.031 1
1 346 . 10 1 1 A 38 38 GLU C C 38 179.975 179.191 0.784 1
1 347 . 10 1 1 A 38 38 GLU CA C 38 60.243 59.301 0.942 1
1 348 . 10 1 1 A 38 38 GLU CB C 38 29.117 29.312 -0.195 1
1 350 . 10 1 1 A 38 38 GLU N N 38 119.272 119.154 0.118 1
1 351 . 10 1 1 A 39 39 GLU H H 39 7.856 8.046 -0.190 1
1 352 . 10 1 1 A 39 39 GLU HA H 39 3.976 3.814 0.162 1
1 357 . 10 1 1 A 39 39 GLU C C 39 178.912 178.920 -0.008 1
1 358 . 10 1 1 A 39 39 GLU CA C 39 59.131 59.097 0.034 1
1 359 . 10 1 1 A 39 39 GLU CB C 39 29.612 28.952 0.660 1
1 361 . 10 1 1 A 39 39 GLU N N 39 121.658 120.598 1.060 1
1 362 . 10 1 1 A 40 40 LYS H H 40 8.653 7.546 1.107 1
1 363 . 10 1 1 A 40 40 LYS HA H 40 3.508 3.774 -0.266 1
1 372 . 10 1 1 A 40 40 LYS C C 40 177.974 179.192 -1.218 1
1 373 . 10 1 1 A 40 40 LYS CA C 40 60.948 59.399 1.549 1
1 374 . 10 1 1 A 40 40 LYS CB C 40 32.714 32.059 0.655 1
1 378 . 10 1 1 A 40 40 LYS N N 40 119.152 119.691 -0.539 1
1 379 . 10 1 1 A 41 41 GLN H H 41 7.876 7.586 0.290 1
1 380 . 10 1 1 A 41 41 GLN HA H 41 3.911 4.010 -0.099 1
1 387 . 10 1 1 A 41 41 GLN C C 41 178.352 177.899 0.453 1
1 388 . 10 1 1 A 41 41 GLN CA C 41 58.973 58.865 0.108 1
1 389 . 10 1 1 A 41 41 GLN CB C 41 27.552 28.291 -0.739 1
1 391 . 10 1 1 A 41 41 GLN N N 41 118.910 119.795 -0.885 1
1 393 . 10 1 1 A 42 42 MET H H 42 7.771 7.941 -0.170 1
1 394 . 10 1 1 A 42 42 MET HA H 42 4.158 4.050 0.108 1
1 402 . 10 1 1 A 42 42 MET C C 42 179.310 178.367 0.943 1
1 403 . 10 1 1 A 42 42 MET CA C 42 59.079 58.585 0.494 1
1 404 . 10 1 1 A 42 42 MET CB C 42 31.023 32.095 -1.072 1
1 407 . 10 1 1 A 42 42 MET N N 42 121.131 119.032 2.099 1
1 408 . 10 1 1 A 43 43 LEU H H 43 8.400 8.361 0.039 1
1 409 . 10 1 1 A 43 43 LEU HA H 43 3.888 3.944 -0.056 1
1 419 . 10 1 1 A 43 43 LEU C C 43 180.721 179.051 1.670 1
1 420 . 10 1 1 A 43 43 LEU CA C 43 57.916 58.000 -0.084 1
1 421 . 10 1 1 A 43 43 LEU CB C 43 42.080 41.434 0.646 1
1 425 . 10 1 1 A 43 43 LEU N N 43 120.124 120.787 -0.663 1
1 426 . 10 1 1 A 44 44 SER H H 44 8.658 8.489 0.169 1
1 427 . 10 1 1 A 44 44 SER HA H 44 4.088 4.221 -0.133 1
1 430 . 10 1 1 A 44 44 SER C C 44 176.859 176.675 0.184 1
1 431 . 10 1 1 A 44 44 SER CA C 44 61.371 60.976 0.395 1
1 432 . 10 1 1 A 44 44 SER CB C 44 63.314 62.799 0.515 1
1 433 . 10 1 1 A 44 44 SER N N 44 119.795 113.945 5.850 1
1 434 . 10 1 1 A 45 45 GLU H H 45 7.905 7.687 0.218 1
1 435 . 10 1 1 A 45 45 GLU HA H 45 4.094 4.230 -0.136 1
1 440 . 10 1 1 A 45 45 GLU C C 45 179.095 179.145 -0.050 1
1 441 . 10 1 1 A 45 45 GLU CA C 45 59.255 59.006 0.249 1
1 442 . 10 1 1 A 45 45 GLU CB C 45 29.200 29.692 -0.492 1
1 444 . 10 1 1 A 45 45 GLU N N 45 120.609 121.067 -0.458 1
1 445 . 10 1 1 A 46 46 LYS H H 46 7.837 7.901 -0.064 1
1 446 . 10 1 1 A 46 46 LYS HA H 46 4.231 4.147 0.084 1
1 453 . 10 1 1 A 46 46 LYS C C 46 177.964 178.814 -0.850 1
1 454 . 10 1 1 A 46 46 LYS CA C 46 58.278 58.873 -0.595 1
1 455 . 10 1 1 A 46 46 LYS CB C 46 34.110 32.615 1.495 1
1 459 . 10 1 1 A 46 46 LYS N N 46 115.471 119.372 -3.901 1
1 460 . 10 1 1 A 47 47 THR H H 47 7.763 8.070 -0.307 1
1 461 . 10 1 1 A 47 47 THR HA H 47 4.271 4.256 0.015 1
1 466 . 10 1 1 A 47 47 THR C C 47 175.472 174.597 0.875 1
1 467 . 10 1 1 A 47 47 THR CA C 47 62.429 62.236 0.193 1
1 468 . 10 1 1 A 47 47 THR CB C 47 71.966 69.805 2.161 1
1 470 . 10 1 1 A 47 47 THR N N 47 104.286 108.856 -4.570 1
1 471 . 10 1 1 A 48 48 ASN H H 48 8.169 7.777 0.392 1
1 472 . 10 1 1 A 48 48 ASN HA H 48 4.437 4.505 -0.068 1
1 477 . 10 1 1 A 48 48 ASN C C 48 173.874 174.026 -0.152 1
1 478 . 10 1 1 A 48 48 ASN CA C 48 55.377 54.429 0.948 1
1 479 . 10 1 1 A 48 48 ASN CB C 48 37.770 36.896 0.874 1
1 480 . 10 1 1 A 48 48 ASN N N 48 117.458 116.268 1.190 1
1 482 . 10 1 1 A 49 49 LEU H H 49 7.532 7.216 0.316 1
1 483 . 10 1 1 A 49 49 LEU HA H 49 4.733 4.685 0.048 1
1 493 . 10 1 1 A 49 49 LEU C C 49 176.625 176.719 -0.094 1
1 494 . 10 1 1 A 49 49 LEU CA C 49 53.226 53.537 -0.311 1
1 495 . 10 1 1 A 49 49 LEU CB C 49 44.114 42.936 1.178 1
1 499 . 10 1 1 A 49 49 LEU N N 49 118.220 119.155 -0.935 1
1 500 . 10 1 1 A 50 50 SER H H 50 9.140 8.474 0.666 1
1 501 . 10 1 1 A 50 50 SER HA H 50 4.475 5.025 -0.550 1
1 504 . 10 1 1 A 50 50 SER C C 50 174.907 175.833 -0.926 1
1 505 . 10 1 1 A 50 50 SER CA C 50 56.964 55.970 0.994 1
1 506 . 10 1 1 A 50 50 SER CB C 50 65.372 64.908 0.464 1
1 507 . 10 1 1 A 50 50 SER N N 50 117.569 113.137 4.432 1
1 508 . 10 1 1 A 51 51 LEU H H 51 8.756 8.657 0.099 1
1 509 . 10 1 1 A 51 51 LEU HA H 51 3.874 3.945 -0.071 1
1 519 . 10 1 1 A 51 51 LEU C C 51 179.910 178.979 0.931 1
1 520 . 10 1 1 A 51 51 LEU CA C 51 58.916 57.786 1.130 1
1 521 . 10 1 1 A 51 51 LEU CB C 51 41.148 41.470 -0.322 1
1 525 . 10 1 1 A 51 51 LEU N N 51 120.905 124.155 -3.250 1
1 526 . 10 1 1 A 52 52 LEU H H 52 8.146 8.095 0.051 1
1 527 . 10 1 1 A 52 52 LEU HA H 52 4.179 4.107 0.072 1
1 537 . 10 1 1 A 52 52 LEU C C 52 178.936 178.804 0.132 1
1 538 . 10 1 1 A 52 52 LEU CA C 52 58.162 58.226 -0.064 1
1 539 . 10 1 1 A 52 52 LEU CB C 52 42.137 41.645 0.492 1
1 543 . 10 1 1 A 52 52 LEU N N 52 120.685 120.135 0.550 1
1 544 . 10 1 1 A 53 53 GLN H H 53 7.924 8.340 -0.416 1
1 545 . 10 1 1 A 53 53 GLN HA H 53 4.102 4.155 -0.053 1
1 552 . 10 1 1 A 53 53 GLN C C 53 180.308 178.682 1.626 1
1 553 . 10 1 1 A 53 53 GLN CA C 53 59.326 58.610 0.716 1
1 554 . 10 1 1 A 53 53 GLN CB C 53 29.900 28.334 1.566 1
1 556 . 10 1 1 A 53 53 GLN N N 53 118.473 117.693 0.780 1
1 558 . 10 1 1 A 54 54 ILE H H 54 8.380 8.168 0.212 1
1 559 . 10 1 1 A 54 54 ILE HA H 54 3.677 3.747 -0.070 1
1 569 . 10 1 1 A 54 54 ILE C C 54 177.673 178.015 -0.342 1
1 570 . 10 1 1 A 54 54 ILE CA C 54 64.650 65.548 -0.898 1
1 571 . 10 1 1 A 54 54 ILE CB C 54 37.476 37.836 -0.360 1
1 575 . 10 1 1 A 54 54 ILE N N 54 120.113 121.596 -1.483 1
1 576 . 10 1 1 A 55 55 SER H H 55 8.854 7.792 1.062 1
1 577 . 10 1 1 A 55 55 SER HA H 55 4.267 4.252 0.015 1
1 580 . 10 1 1 A 55 55 SER C C 55 177.127 177.639 -0.512 1
1 581 . 10 1 1 A 55 55 SER CA C 55 62.852 61.787 1.065 1
1 582 . 10 1 1 A 55 55 SER CB C 55 62.727 63.069 -0.342 1
1 583 . 10 1 1 A 55 55 SER N N 55 116.646 115.612 1.034 1
1 584 . 10 1 1 A 56 56 ASN H H 56 8.634 8.025 0.609 1
1 585 . 10 1 1 A 56 56 ASN HA H 56 4.549 4.447 0.102 1
1 590 . 10 1 1 A 56 56 ASN C C 56 177.481 178.290 -0.809 1
1 591 . 10 1 1 A 56 56 ASN CA C 56 55.951 56.516 -0.565 1
1 592 . 10 1 1 A 56 56 ASN CB C 56 37.852 38.192 -0.340 1
1 593 . 10 1 1 A 56 56 ASN N N 56 119.048 119.543 -0.495 1
1 595 . 10 1 1 A 57 57 TRP H H 57 8.373 8.208 0.165 1
1 596 . 10 1 1 A 57 57 TRP HA H 57 4.065 4.400 -0.335 1
1 605 . 10 1 1 A 57 57 TRP C C 57 179.392 178.315 1.077 1
1 606 . 10 1 1 A 57 57 TRP CA C 57 63.204 61.200 2.004 1
1 607 . 10 1 1 A 57 57 TRP CB C 57 28.376 29.648 -1.272 1
1 613 . 10 1 1 A 57 57 TRP N N 57 122.950 122.971 -0.021 1
1 615 . 10 1 1 A 58 58 PHE H H 58 8.428 8.442 -0.014 1
1 616 . 10 1 1 A 58 58 PHE HA H 58 3.922 3.995 -0.073 1
1 624 . 10 1 1 A 58 58 PHE C C 58 178.237 177.872 0.365 1
1 625 . 10 1 1 A 58 58 PHE CA C 58 64.015 61.935 2.080 1
1 626 . 10 1 1 A 58 58 PHE CB C 58 39.602 38.778 0.824 1
1 632 . 10 1 1 A 58 58 PHE N N 58 116.774 117.791 -1.017 1
1 633 . 10 1 1 A 59 59 ILE H H 59 7.925 8.679 -0.754 1
1 634 . 10 1 1 A 59 59 ILE HA H 59 3.773 3.745 0.028 1
1 644 . 10 1 1 A 59 59 ILE C C 59 178.745 178.232 0.513 1
1 645 . 10 1 1 A 59 59 ILE CA C 59 65.531 65.415 0.116 1
1 646 . 10 1 1 A 59 59 ILE CB C 59 38.480 37.846 0.634 1
1 650 . 10 1 1 A 59 59 ILE N N 59 119.560 119.965 -0.405 1
1 651 . 10 1 1 A 60 60 ASN H H 60 7.506 7.972 -0.466 1
1 652 . 10 1 1 A 60 60 ASN HA H 60 4.407 4.297 0.110 1
1 657 . 10 1 1 A 60 60 ASN C C 60 177.163 177.238 -0.075 1
1 658 . 10 1 1 A 60 60 ASN CA C 60 55.871 56.756 -0.885 1
1 659 . 10 1 1 A 60 60 ASN CB C 60 38.878 39.092 -0.214 1
1 660 . 10 1 1 A 60 60 ASN N N 60 116.868 119.287 -2.419 1
1 662 . 10 1 1 A 61 61 ALA H H 61 8.410 8.072 0.338 1
1 663 . 10 1 1 A 61 61 ALA HA H 61 3.667 3.673 -0.006 1
1 667 . 10 1 1 A 61 61 ALA C C 61 180.061 179.745 0.316 1
1 668 . 10 1 1 A 61 61 ALA CA C 61 54.601 54.078 0.523 1
1 669 . 10 1 1 A 61 61 ALA CB C 61 18.241 16.994 1.247 1
1 670 . 10 1 1 A 61 61 ALA N N 61 123.022 121.028 1.994 1
1 671 . 10 1 1 A 62 62 ARG H H 62 8.036 7.894 0.142 1
1 672 . 10 1 1 A 62 62 ARG HA H 62 4.092 3.984 0.108 1
1 679 . 10 1 1 A 62 62 ARG C C 62 176.756 177.526 -0.770 1
1 680 . 10 1 1 A 62 62 ARG CA C 62 58.762 58.452 0.310 1
1 681 . 10 1 1 A 62 62 ARG CB C 62 30.601 29.854 0.747 1
1 684 . 10 1 1 A 62 62 ARG N N 62 117.168 118.867 -1.699 1
1 685 . 10 1 1 A 63 63 ARG H H 63 7.214 8.029 -0.815 1
1 686 . 10 1 1 A 63 63 ARG HA H 63 4.249 4.307 -0.058 1
1 693 . 10 1 1 A 63 63 ARG C C 63 176.945 176.894 0.051 1
1 694 . 10 1 1 A 63 63 ARG CA C 63 57.669 57.128 0.541 1
1 695 . 10 1 1 A 63 63 ARG CB C 63 30.765 30.793 -0.028 1
1 698 . 10 1 1 A 63 63 ARG N N 63 116.514 116.423 0.091 1
1 699 . 10 1 1 A 64 64 ARG H H 64 7.913 8.017 -0.104 1
1 700 . 10 1 1 A 64 64 ARG HA H 64 4.351 4.587 -0.236 1
1 707 . 10 1 1 A 64 64 ARG C C 64 176.413 178.220 -1.807 1
1 708 . 10 1 1 A 64 64 ARG CA C 64 57.105 57.183 -0.078 1
1 709 . 10 1 1 A 64 64 ARG CB C 64 31.672 33.082 -1.410 1
1 712 . 10 1 1 A 64 64 ARG N N 64 116.818 118.484 -1.666 1
1 713 . 10 1 1 A 65 65 ILE H H 65 8.169 8.362 -0.193 1
1 714 . 10 1 1 A 65 65 ILE HA H 65 4.285 3.820 0.465 1
1 724 . 10 1 1 A 65 65 ILE C C 65 176.208 177.942 -1.734 1
1 725 . 10 1 1 A 65 65 ILE CA C 65 62.005 64.660 -2.655 1
1 726 . 10 1 1 A 65 65 ILE CB C 65 39.088 37.501 1.587 1
1 730 . 10 1 1 A 65 65 ILE N N 65 119.185 119.589 -0.404 1
1 731 . 10 1 1 A 66 66 LEU H H 66 7.962 7.806 0.156 1
1 732 . 10 1 1 A 66 66 LEU HA H 66 4.485 4.087 0.398 1
1 742 . 10 1 1 A 66 66 LEU C C 66 176.216 175.074 1.142 1
1 743 . 10 1 1 A 66 66 LEU CA C 66 56.153 59.794 -3.641 1
1 744 . 10 1 1 A 66 66 LEU CB C 66 40.792 40.564 0.228 1
1 748 . 10 1 1 A 66 66 LEU N N 66 124.389 121.935 2.454 1
1 749 . 10 1 1 A 67 67 PRO HA H 67 4.283 4.350 -0.067 1
1 756 . 10 1 1 A 67 67 PRO C C 67 178.294 178.313 -0.019 1
1 757 . 10 1 1 A 67 67 PRO CA C 67 65.390 65.410 -0.020 1
1 758 . 10 1 1 A 67 67 PRO CB C 67 31.095 30.782 0.313 1
1 761 . 10 1 1 A 68 68 ASP H H 68 7.913 8.588 -0.675 1
1 762 . 10 1 1 A 68 68 ASP HA H 68 4.507 4.459 0.048 1
1 765 . 10 1 1 A 68 68 ASP C C 68 177.927 177.966 -0.039 1
1 766 . 10 1 1 A 68 68 ASP CA C 68 55.906 56.512 -0.606 1
1 767 . 10 1 1 A 68 68 ASP CB C 68 40.736 40.445 0.291 1
1 768 . 10 1 1 A 68 68 ASP N N 68 117.231 117.401 -0.170 1
1 769 . 10 1 1 A 69 69 MET H H 69 8.083 8.614 -0.531 1
1 770 . 10 1 1 A 69 69 MET HA H 69 4.362 4.363 -0.001 1
1 778 . 10 1 1 A 69 69 MET C C 69 177.374 178.414 -1.040 1
1 779 . 10 1 1 A 69 69 MET CA C 69 57.634 58.518 -0.884 1
1 780 . 10 1 1 A 69 69 MET CB C 69 32.816 32.981 -0.165 1
1 783 . 10 1 1 A 69 69 MET N N 69 119.391 117.355 2.036 1
1 784 . 10 1 1 A 70 70 LEU H H 70 7.907 8.301 -0.394 1
1 785 . 10 1 1 A 70 70 LEU HA H 70 4.232 4.022 0.210 1
1 795 . 10 1 1 A 70 70 LEU C C 70 177.745 177.767 -0.022 1
1 796 . 10 1 1 A 70 70 LEU CA C 70 55.835 57.919 -2.084 1
1 797 . 10 1 1 A 70 70 LEU CB C 70 42.174 41.780 0.394 1
1 801 . 10 1 1 A 70 70 LEU N N 70 119.266 121.058 -1.792 1
1 802 . 10 1 1 A 71 71 GLN H H 71 7.865 7.732 0.133 1
1 803 . 10 1 1 A 71 71 GLN HA H 71 4.287 4.282 0.005 1
1 809 . 10 1 1 A 71 71 GLN C C 71 178.855 175.440 3.415 1
1 810 . 10 1 1 A 71 71 GLN CA C 71 56.383 55.945 0.438 1
1 811 . 10 1 1 A 71 71 GLN CB C 71 29.092 29.298 -0.206 1
1 813 . 10 1 1 A 71 71 GLN N N 71 118.603 118.124 0.479 1
1 815 . 10 1 1 A 72 72 GLN H H 72 8.189 8.770 -0.581 1
1 816 . 10 1 1 A 72 72 GLN HA H 72 4.302 4.792 -0.490 1
1 821 . 10 1 1 A 72 72 GLN CA C 72 56.206 55.688 0.518 1
1 822 . 10 1 1 A 72 72 GLN CB C 72 29.298 29.813 -0.515 1
1 824 . 10 1 1 A 72 72 GLN N N 72 120.267 125.986 -5.719 1
1 825 . 10 1 1 A 73 73 ARG C C 73 176.105 175.244 0.861 1
1 826 . 10 1 1 A 74 74 ARG HA H 74 4.334 4.796 -0.462 1
1 833 . 10 1 1 A 74 74 ARG C C 74 176.188 175.940 0.248 1
1 834 . 10 1 1 A 74 74 ARG CA C 74 56.300 55.720 0.580 1
1 835 . 10 1 1 A 74 74 ARG CB C 74 30.668 31.046 -0.378 1
1 838 . 10 1 1 A 75 75 ASN C C 75 174.462 173.959 0.503 1
1 839 . 10 1 1 A 75 75 ASN CA C 75 53.148 52.576 0.572 1
1 840 . 10 1 1 A 75 75 ASN CB C 75 39.046 42.206 -3.160 1
1 841 . 10 1 1 A 76 76 ASP H H 76 8.257 9.085 -0.828 1
1 842 . 10 1 1 A 76 76 ASP HA H 76 4.877 5.281 -0.404 1
1 845 . 10 1 1 A 76 76 ASP C C 76 174.759 173.352 1.407 1
1 846 . 10 1 1 A 76 76 ASP CA C 76 52.380 51.493 0.887 1
1 847 . 10 1 1 A 76 76 ASP CB C 76 41.267 41.535 -0.268 1
1 848 . 10 1 1 A 76 76 ASP N N 76 122.030 123.603 -1.573 1
1 849 . 10 1 1 A 77 77 PRO HA H 77 4.466 4.577 -0.111 1
1 856 . 10 1 1 A 77 77 PRO C C 77 177.133 175.981 1.152 1
1 857 . 10 1 1 A 77 77 PRO CA C 77 63.733 62.457 1.276 1
1 858 . 10 1 1 A 77 77 PRO CB C 77 31.919 32.519 -0.600 1
1 861 . 10 1 1 A 78 78 SER H H 78 8.457 8.404 0.053 1
1 862 . 10 1 1 A 78 78 SER HA H 78 4.479 4.944 -0.465 1
1 865 . 10 1 1 A 78 78 SER C C 78 174.731 174.238 0.493 1
1 866 . 10 1 1 A 78 78 SER CA C 78 58.691 57.713 0.978 1
1 867 . 10 1 1 A 78 78 SER CB C 78 63.973 64.451 -0.478 1
1 868 . 10 1 1 A 78 78 SER N N 78 115.711 116.532 -0.821 1
1 869 . 10 1 1 A 79 79 GLY H H 79 8.090 8.506 -0.416 1
1 870 . 10 1 1 A 79 79 GLY HA2 H 79 4.179 4.202 -0.023 1
1 871 . 10 1 1 A 79 79 GLY HA3 H 79 4.065 4.202 -0.137 1
1 872 . 10 1 1 A 79 79 GLY CA C 79 44.746 44.547 0.199 1
1 873 . 10 1 1 A 79 79 GLY N N 79 110.429 112.648 -2.219 1
1 874 . 10 1 1 A 80 80 PRO HA H 80 4.464 4.666 -0.202 1
1 880 . 10 1 1 A 80 80 PRO C C 80 177.499 177.471 0.028 1
1 881 . 10 1 1 A 80 80 PRO CA C 80 63.275 62.556 0.719 1
1 882 . 10 1 1 A 80 80 PRO CB C 80 32.249 31.499 0.750 1
1 1 . 11 1 1 A 13 13 ASN HA H 13 4.787 5.483 -0.696 1
1 6 . 11 1 1 A 13 13 ASN CA C 13 53.148 51.750 1.398 1
1 7 . 11 1 1 A 13 13 ASN CB C 13 39.378 41.016 -1.638 1
1 9 . 11 1 1 A 14 14 LEU H H 14 8.418 8.671 -0.253 1
1 10 . 11 1 1 A 14 14 LEU HA H 14 4.654 4.670 -0.016 1
1 20 . 11 1 1 A 14 14 LEU CA C 14 52.999 52.852 0.147 1
1 21 . 11 1 1 A 14 14 LEU CB C 14 41.919 40.765 1.154 1
1 25 . 11 1 1 A 14 14 LEU N N 14 122.671 124.256 -1.585 1
1 26 . 11 1 1 A 15 15 PRO HA H 15 4.460 4.576 -0.116 1
1 33 . 11 1 1 A 15 15 PRO C C 15 178.156 177.517 0.639 1
1 34 . 11 1 1 A 15 15 PRO CA C 15 63.101 62.731 0.370 1
1 35 . 11 1 1 A 15 15 PRO CB C 15 32.304 32.710 -0.406 1
1 38 . 11 1 1 A 16 16 ALA H H 16 8.973 8.657 0.316 1
1 39 . 11 1 1 A 16 16 ALA HA H 16 4.021 3.959 0.062 1
1 43 . 11 1 1 A 16 16 ALA C C 16 180.695 179.565 1.130 1
1 44 . 11 1 1 A 16 16 ALA CA C 16 55.642 55.401 0.241 1
1 45 . 11 1 1 A 16 16 ALA CB C 16 18.552 18.594 -0.042 1
1 46 . 11 1 1 A 16 16 ALA N N 16 128.311 126.666 1.645 1
1 47 . 11 1 1 A 17 17 GLU H H 17 9.558 8.277 1.281 1
1 48 . 11 1 1 A 17 17 GLU HA H 17 4.065 4.082 -0.017 1
1 53 . 11 1 1 A 17 17 GLU C C 17 178.886 178.079 0.807 1
1 54 . 11 1 1 A 17 17 GLU CA C 17 59.400 59.345 0.055 1
1 55 . 11 1 1 A 17 17 GLU CB C 17 28.742 29.345 -0.603 1
1 57 . 11 1 1 A 17 17 GLU N N 17 117.113 117.086 0.027 1
1 58 . 11 1 1 A 18 18 SER H H 18 7.263 8.200 -0.937 1
1 59 . 11 1 1 A 18 18 SER HA H 18 4.180 4.155 0.025 1
1 62 . 11 1 1 A 18 18 SER C C 18 174.951 176.826 -1.875 1
1 63 . 11 1 1 A 18 18 SER CA C 18 61.969 61.339 0.630 1
1 64 . 11 1 1 A 18 18 SER CB C 18 62.554 62.554 0.000 1
1 65 . 11 1 1 A 18 18 SER N N 18 114.932 115.582 -0.650 1
1 66 . 11 1 1 A 19 19 VAL H H 19 7.620 8.031 -0.411 1
1 67 . 11 1 1 A 19 19 VAL HA H 19 3.011 3.140 -0.129 1
1 75 . 11 1 1 A 19 19 VAL C C 19 176.953 177.697 -0.744 1
1 76 . 11 1 1 A 19 19 VAL CA C 19 66.479 66.862 -0.383 1
1 77 . 11 1 1 A 19 19 VAL CB C 19 31.569 31.367 0.202 1
1 80 . 11 1 1 A 19 19 VAL N N 19 121.086 122.113 -1.027 1
1 81 . 11 1 1 A 20 20 LYS H H 20 7.745 8.234 -0.489 1
1 82 . 11 1 1 A 20 20 LYS HA H 20 3.884 3.970 -0.086 1
1 91 . 11 1 1 A 20 20 LYS C C 20 178.150 178.739 -0.589 1
1 92 . 11 1 1 A 20 20 LYS CA C 20 59.984 59.566 0.418 1
1 93 . 11 1 1 A 20 20 LYS CB C 20 32.351 32.215 0.136 1
1 97 . 11 1 1 A 20 20 LYS N N 20 119.366 119.588 -0.222 1
1 98 . 11 1 1 A 21 21 ILE H H 21 6.943 7.534 -0.591 1
1 99 . 11 1 1 A 21 21 ILE HA H 21 3.783 3.708 0.075 1
1 109 . 11 1 1 A 21 21 ILE C C 21 178.996 178.563 0.433 1
1 110 . 11 1 1 A 21 21 ILE CA C 21 64.642 65.599 -0.957 1
1 111 . 11 1 1 A 21 21 ILE CB C 21 38.014 37.963 0.051 1
1 115 . 11 1 1 A 21 21 ILE N N 21 118.163 120.409 -2.246 1
1 116 . 11 1 1 A 22 22 LEU H H 22 7.267 8.257 -0.990 1
1 117 . 11 1 1 A 22 22 LEU HA H 22 3.748 3.939 -0.191 1
1 127 . 11 1 1 A 22 22 LEU C C 22 178.289 178.804 -0.515 1
1 128 . 11 1 1 A 22 22 LEU CA C 22 58.092 57.935 0.157 1
1 129 . 11 1 1 A 22 22 LEU CB C 22 38.551 40.763 -2.212 1
1 133 . 11 1 1 A 22 22 LEU N N 22 120.609 119.190 1.419 1
1 134 . 11 1 1 A 23 23 ARG H H 23 8.676 8.729 -0.053 1
1 135 . 11 1 1 A 23 23 ARG HA H 23 4.030 4.216 -0.186 1
1 142 . 11 1 1 A 23 23 ARG C C 23 178.861 178.211 0.650 1
1 143 . 11 1 1 A 23 23 ARG CA C 23 60.404 59.856 0.548 1
1 144 . 11 1 1 A 23 23 ARG CB C 23 30.351 30.101 0.250 1
1 147 . 11 1 1 A 23 23 ARG N N 23 119.148 117.686 1.462 1
1 148 . 11 1 1 A 24 24 ASP H H 24 8.515 8.198 0.317 1
1 149 . 11 1 1 A 24 24 ASP HA H 24 4.519 4.383 0.136 1
1 152 . 11 1 1 A 24 24 ASP C C 24 178.759 178.479 0.280 1
1 153 . 11 1 1 A 24 24 ASP CA C 24 57.556 57.145 0.411 1
1 154 . 11 1 1 A 24 24 ASP CB C 24 40.569 40.837 -0.268 1
1 155 . 11 1 1 A 24 24 ASP N N 24 120.027 119.489 0.538 1
1 156 . 11 1 1 A 25 25 TRP H H 25 8.158 8.060 0.098 1
1 157 . 11 1 1 A 25 25 TRP HA H 25 4.181 4.435 -0.254 1
1 166 . 11 1 1 A 25 25 TRP C C 25 179.946 178.456 1.490 1
1 167 . 11 1 1 A 25 25 TRP CA C 25 63.346 61.365 1.981 1
1 168 . 11 1 1 A 25 25 TRP CB C 25 29.433 29.707 -0.274 1
1 174 . 11 1 1 A 25 25 TRP N N 25 121.350 121.668 -0.318 1
1 176 . 11 1 1 A 26 26 MET H H 26 8.977 8.676 0.301 1
1 177 . 11 1 1 A 26 26 MET HA H 26 4.076 4.405 -0.329 1
1 185 . 11 1 1 A 26 26 MET C C 26 177.371 178.013 -0.642 1
1 186 . 11 1 1 A 26 26 MET CA C 26 60.454 58.929 1.525 1
1 187 . 11 1 1 A 26 26 MET CB C 26 33.567 32.387 1.180 1
1 190 . 11 1 1 A 26 26 MET N N 26 119.977 118.765 1.212 1
1 191 . 11 1 1 A 27 27 TYR H H 27 8.604 8.274 0.330 1
1 192 . 11 1 1 A 27 27 TYR HA H 27 4.138 4.129 0.009 1
1 199 . 11 1 1 A 27 27 TYR C C 27 178.901 177.561 1.340 1
1 200 . 11 1 1 A 27 27 TYR CA C 27 61.846 61.210 0.636 1
1 201 . 11 1 1 A 27 27 TYR CB C 27 38.165 38.592 -0.427 1
1 206 . 11 1 1 A 27 27 TYR N N 27 117.797 121.223 -3.426 1
1 207 . 11 1 1 A 28 28 LYS H H 28 7.867 7.673 0.194 1
1 208 . 11 1 1 A 28 28 LYS HA H 28 3.797 3.616 0.181 1
1 217 . 11 1 1 A 28 28 LYS C C 28 176.858 177.591 -0.733 1
1 218 . 11 1 1 A 28 28 LYS CA C 28 58.174 59.033 -0.859 1
1 219 . 11 1 1 A 28 28 LYS CB C 28 32.516 32.127 0.389 1
1 223 . 11 1 1 A 28 28 LYS N N 28 118.982 117.681 1.301 1
1 224 . 11 1 1 A 29 29 HIS H H 29 7.443 7.194 0.249 1
1 225 . 11 1 1 A 29 29 HIS HA H 29 4.386 4.418 -0.032 1
1 230 . 11 1 1 A 29 29 HIS C C 29 176.085 175.804 0.281 1
1 231 . 11 1 1 A 29 29 HIS CA C 29 55.213 55.046 0.167 1
1 232 . 11 1 1 A 29 29 HIS CB C 29 27.085 28.814 -1.729 1
1 235 . 11 1 1 A 29 29 HIS N N 29 117.138 115.631 1.507 1
1 236 . 11 1 1 A 30 30 ARG H H 30 6.921 7.907 -0.986 1
1 237 . 11 1 1 A 30 30 ARG HA H 30 3.898 4.258 -0.360 1
1 244 . 11 1 1 A 30 30 ARG C C 30 175.808 177.838 -2.030 1
1 245 . 11 1 1 A 30 30 ARG CA C 30 58.609 58.439 0.170 1
1 246 . 11 1 1 A 30 30 ARG CB C 30 28.739 29.520 -0.781 1
1 249 . 11 1 1 A 30 30 ARG N N 30 117.911 119.401 -1.490 1
1 250 . 11 1 1 A 31 31 PHE H H 31 7.819 7.717 0.102 1
1 251 . 11 1 1 A 31 31 PHE HA H 31 4.533 4.252 0.281 1
1 259 . 11 1 1 A 31 31 PHE C C 31 175.577 176.934 -1.357 1
1 260 . 11 1 1 A 31 31 PHE CA C 31 58.029 60.833 -2.804 1
1 261 . 11 1 1 A 31 31 PHE CB C 31 37.792 38.793 -1.001 1
1 267 . 11 1 1 A 31 31 PHE N N 31 115.408 118.782 -3.374 1
1 268 . 11 1 1 A 32 32 LYS H H 32 7.858 7.939 -0.081 1
1 269 . 11 1 1 A 32 32 LYS HA H 32 4.487 4.469 0.018 1
1 277 . 11 1 1 A 32 32 LYS C C 32 175.557 176.078 -0.521 1
1 278 . 11 1 1 A 32 32 LYS CA C 32 56.329 56.774 -0.445 1
1 279 . 11 1 1 A 32 32 LYS CB C 32 32.743 34.445 -1.702 1
1 283 . 11 1 1 A 32 32 LYS N N 32 122.453 113.227 9.226 1
1 284 . 11 1 1 A 33 33 ALA H H 33 8.643 7.971 0.672 1
1 285 . 11 1 1 A 33 33 ALA HA H 33 4.403 4.069 0.334 1
1 289 . 11 1 1 A 33 33 ALA C C 33 176.273 175.292 0.981 1
1 290 . 11 1 1 A 33 33 ALA CA C 33 53.579 53.182 0.397 1
1 291 . 11 1 1 A 33 33 ALA CB C 33 18.653 17.123 1.530 1
1 292 . 11 1 1 A 33 33 ALA N N 33 127.853 120.561 7.292 1
1 293 . 11 1 1 A 34 34 TYR H H 34 7.878 8.049 -0.171 1
1 294 . 11 1 1 A 34 34 TYR HA H 34 4.686 4.896 -0.210 1
1 301 . 11 1 1 A 34 34 TYR C C 34 173.133 173.235 -0.102 1
1 302 . 11 1 1 A 34 34 TYR CA C 34 54.778 54.923 -0.145 1
1 303 . 11 1 1 A 34 34 TYR CB C 34 39.619 40.639 -1.020 1
1 308 . 11 1 1 A 34 34 TYR N N 34 116.539 116.602 -0.063 1
1 309 . 11 1 1 A 35 35 PRO HA H 35 4.526 4.559 -0.033 1
1 316 . 11 1 1 A 35 35 PRO C C 35 176.837 175.887 0.950 1
1 317 . 11 1 1 A 35 35 PRO CA C 35 61.864 62.330 -0.466 1
1 318 . 11 1 1 A 35 35 PRO CB C 35 30.904 31.815 -0.911 1
1 321 . 11 1 1 A 36 36 SER H H 36 9.634 8.405 1.229 1
1 322 . 11 1 1 A 36 36 SER HA H 36 4.518 4.730 -0.212 1
1 325 . 11 1 1 A 36 36 SER C C 36 175.001 175.360 -0.359 1
1 326 . 11 1 1 A 36 36 SER CA C 36 57.129 57.014 0.115 1
1 327 . 11 1 1 A 36 36 SER CB C 36 65.374 65.123 0.251 1
1 328 . 11 1 1 A 36 36 SER N N 36 119.984 117.284 2.700 1
1 329 . 11 1 1 A 37 37 GLU H H 37 9.091 8.979 0.112 1
1 330 . 11 1 1 A 37 37 GLU HA H 37 3.884 3.914 -0.030 1
1 335 . 11 1 1 A 37 37 GLU C C 37 179.347 178.374 0.973 1
1 336 . 11 1 1 A 37 37 GLU CA C 37 60.454 59.586 0.868 1
1 337 . 11 1 1 A 37 37 GLU CB C 37 28.623 29.177 -0.554 1
1 339 . 11 1 1 A 37 37 GLU N N 37 120.748 126.304 -5.556 1
1 340 . 11 1 1 A 38 38 GLU H H 38 8.760 7.992 0.768 1
1 341 . 11 1 1 A 38 38 GLU HA H 38 4.048 4.089 -0.041 1
1 346 . 11 1 1 A 38 38 GLU C C 38 179.975 178.999 0.976 1
1 347 . 11 1 1 A 38 38 GLU CA C 38 60.243 59.148 1.095 1
1 348 . 11 1 1 A 38 38 GLU CB C 38 29.117 29.840 -0.723 1
1 350 . 11 1 1 A 38 38 GLU N N 38 119.272 120.161 -0.889 1
1 351 . 11 1 1 A 39 39 GLU H H 39 7.856 7.961 -0.105 1
1 352 . 11 1 1 A 39 39 GLU HA H 39 3.976 3.873 0.103 1
1 357 . 11 1 1 A 39 39 GLU C C 39 178.912 178.837 0.075 1
1 358 . 11 1 1 A 39 39 GLU CA C 39 59.131 59.227 -0.096 1
1 359 . 11 1 1 A 39 39 GLU CB C 39 29.612 28.848 0.764 1
1 361 . 11 1 1 A 39 39 GLU N N 39 121.658 120.671 0.987 1
1 362 . 11 1 1 A 40 40 LYS H H 40 8.653 7.695 0.958 1
1 363 . 11 1 1 A 40 40 LYS HA H 40 3.508 3.835 -0.327 1
1 372 . 11 1 1 A 40 40 LYS C C 40 177.974 178.960 -0.986 1
1 373 . 11 1 1 A 40 40 LYS CA C 40 60.948 59.602 1.346 1
1 374 . 11 1 1 A 40 40 LYS CB C 40 32.714 32.082 0.632 1
1 378 . 11 1 1 A 40 40 LYS N N 40 119.152 119.580 -0.428 1
1 379 . 11 1 1 A 41 41 GLN H H 41 7.876 7.570 0.306 1
1 380 . 11 1 1 A 41 41 GLN HA H 41 3.911 3.997 -0.086 1
1 387 . 11 1 1 A 41 41 GLN C C 41 178.352 178.133 0.219 1
1 388 . 11 1 1 A 41 41 GLN CA C 41 58.973 58.457 0.516 1
1 389 . 11 1 1 A 41 41 GLN CB C 41 27.552 28.679 -1.127 1
1 391 . 11 1 1 A 41 41 GLN N N 41 118.910 119.347 -0.437 1
1 393 . 11 1 1 A 42 42 MET H H 42 7.771 7.609 0.162 1
1 394 . 11 1 1 A 42 42 MET HA H 42 4.158 4.263 -0.105 1
1 402 . 11 1 1 A 42 42 MET C C 42 179.310 178.246 1.064 1
1 403 . 11 1 1 A 42 42 MET CA C 42 59.079 57.888 1.191 1
1 404 . 11 1 1 A 42 42 MET CB C 42 31.023 32.647 -1.624 1
1 407 . 11 1 1 A 42 42 MET N N 42 121.131 119.791 1.340 1
1 408 . 11 1 1 A 43 43 LEU H H 43 8.400 8.386 0.014 1
1 409 . 11 1 1 A 43 43 LEU HA H 43 3.888 3.945 -0.057 1
1 419 . 11 1 1 A 43 43 LEU C C 43 180.721 179.155 1.566 1
1 420 . 11 1 1 A 43 43 LEU CA C 43 57.916 58.021 -0.105 1
1 421 . 11 1 1 A 43 43 LEU CB C 43 42.080 41.566 0.514 1
1 425 . 11 1 1 A 43 43 LEU N N 43 120.124 120.685 -0.561 1
1 426 . 11 1 1 A 44 44 SER H H 44 8.658 8.719 -0.061 1
1 427 . 11 1 1 A 44 44 SER HA H 44 4.088 4.348 -0.260 1
1 430 . 11 1 1 A 44 44 SER C C 44 176.859 177.405 -0.546 1
1 431 . 11 1 1 A 44 44 SER CA C 44 61.371 61.362 0.009 1
1 432 . 11 1 1 A 44 44 SER CB C 44 63.314 62.675 0.639 1
1 433 . 11 1 1 A 44 44 SER N N 44 119.795 113.938 5.857 1
1 434 . 11 1 1 A 45 45 GLU H H 45 7.905 7.557 0.348 1
1 435 . 11 1 1 A 45 45 GLU HA H 45 4.094 4.236 -0.142 1
1 440 . 11 1 1 A 45 45 GLU C C 45 179.095 179.335 -0.240 1
1 441 . 11 1 1 A 45 45 GLU CA C 45 59.255 58.990 0.265 1
1 442 . 11 1 1 A 45 45 GLU CB C 45 29.200 29.830 -0.630 1
1 444 . 11 1 1 A 45 45 GLU N N 45 120.609 123.889 -3.280 1
1 445 . 11 1 1 A 46 46 LYS H H 46 7.837 7.675 0.162 1
1 446 . 11 1 1 A 46 46 LYS HA H 46 4.231 4.141 0.090 1
1 453 . 11 1 1 A 46 46 LYS C C 46 177.964 178.912 -0.948 1
1 454 . 11 1 1 A 46 46 LYS CA C 46 58.278 59.096 -0.818 1
1 455 . 11 1 1 A 46 46 LYS CB C 46 34.110 32.450 1.660 1
1 459 . 11 1 1 A 46 46 LYS N N 46 115.471 119.441 -3.970 1
1 460 . 11 1 1 A 47 47 THR H H 47 7.763 8.212 -0.449 1
1 461 . 11 1 1 A 47 47 THR HA H 47 4.271 4.200 0.071 1
1 466 . 11 1 1 A 47 47 THR C C 47 175.472 175.164 0.308 1
1 467 . 11 1 1 A 47 47 THR CA C 47 62.429 62.587 -0.158 1
1 468 . 11 1 1 A 47 47 THR CB C 47 71.966 70.049 1.917 1
1 470 . 11 1 1 A 47 47 THR N N 47 104.286 108.913 -4.627 1
1 471 . 11 1 1 A 48 48 ASN H H 48 8.169 8.174 -0.005 1
1 472 . 11 1 1 A 48 48 ASN HA H 48 4.437 4.259 0.178 1
1 477 . 11 1 1 A 48 48 ASN C C 48 173.874 173.911 -0.037 1
1 478 . 11 1 1 A 48 48 ASN CA C 48 55.377 54.428 0.949 1
1 479 . 11 1 1 A 48 48 ASN CB C 48 37.770 37.593 0.177 1
1 480 . 11 1 1 A 48 48 ASN N N 48 117.458 119.554 -2.096 1
1 482 . 11 1 1 A 49 49 LEU H H 49 7.532 7.301 0.231 1
1 483 . 11 1 1 A 49 49 LEU HA H 49 4.733 4.809 -0.076 1
1 493 . 11 1 1 A 49 49 LEU C C 49 176.625 175.496 1.129 1
1 494 . 11 1 1 A 49 49 LEU CA C 49 53.226 53.360 -0.134 1
1 495 . 11 1 1 A 49 49 LEU CB C 49 44.114 43.669 0.445 1
1 499 . 11 1 1 A 49 49 LEU N N 49 118.220 120.185 -1.965 1
1 500 . 11 1 1 A 50 50 SER H H 50 9.140 8.752 0.388 1
1 501 . 11 1 1 A 50 50 SER HA H 50 4.475 5.017 -0.542 1
1 504 . 11 1 1 A 50 50 SER C C 50 174.907 174.762 0.145 1
1 505 . 11 1 1 A 50 50 SER CA C 50 56.964 57.601 -0.637 1
1 506 . 11 1 1 A 50 50 SER CB C 50 65.372 65.017 0.355 1
1 507 . 11 1 1 A 50 50 SER N N 50 117.569 117.097 0.472 1
1 508 . 11 1 1 A 51 51 LEU H H 51 8.756 8.803 -0.047 1
1 509 . 11 1 1 A 51 51 LEU HA H 51 3.874 3.924 -0.050 1
1 519 . 11 1 1 A 51 51 LEU C C 51 179.910 178.891 1.019 1
1 520 . 11 1 1 A 51 51 LEU CA C 51 58.916 58.180 0.736 1
1 521 . 11 1 1 A 51 51 LEU CB C 51 41.148 41.456 -0.308 1
1 525 . 11 1 1 A 51 51 LEU N N 51 120.905 125.725 -4.820 1
1 526 . 11 1 1 A 52 52 LEU H H 52 8.146 8.259 -0.113 1
1 527 . 11 1 1 A 52 52 LEU HA H 52 4.179 4.016 0.163 1
1 537 . 11 1 1 A 52 52 LEU C C 52 178.936 178.509 0.427 1
1 538 . 11 1 1 A 52 52 LEU CA C 52 58.162 58.385 -0.223 1
1 539 . 11 1 1 A 52 52 LEU CB C 52 42.137 41.350 0.787 1
1 543 . 11 1 1 A 52 52 LEU N N 52 120.685 120.012 0.673 1
1 544 . 11 1 1 A 53 53 GLN H H 53 7.924 8.244 -0.320 1
1 545 . 11 1 1 A 53 53 GLN HA H 53 4.102 4.166 -0.064 1
1 552 . 11 1 1 A 53 53 GLN C C 53 180.308 178.642 1.666 1
1 553 . 11 1 1 A 53 53 GLN CA C 53 59.326 58.584 0.742 1
1 554 . 11 1 1 A 53 53 GLN CB C 53 29.900 28.580 1.320 1
1 556 . 11 1 1 A 53 53 GLN N N 53 118.473 117.545 0.928 1
1 558 . 11 1 1 A 54 54 ILE H H 54 8.380 8.368 0.012 1
1 559 . 11 1 1 A 54 54 ILE HA H 54 3.677 3.732 -0.055 1
1 569 . 11 1 1 A 54 54 ILE C C 54 177.673 178.084 -0.411 1
1 570 . 11 1 1 A 54 54 ILE CA C 54 64.650 65.523 -0.873 1
1 571 . 11 1 1 A 54 54 ILE CB C 54 37.476 37.870 -0.394 1
1 575 . 11 1 1 A 54 54 ILE N N 54 120.113 121.622 -1.509 1
1 576 . 11 1 1 A 55 55 SER H H 55 8.854 8.198 0.656 1
1 577 . 11 1 1 A 55 55 SER HA H 55 4.267 4.326 -0.059 1
1 580 . 11 1 1 A 55 55 SER C C 55 177.127 177.167 -0.040 1
1 581 . 11 1 1 A 55 55 SER CA C 55 62.852 62.161 0.691 1
1 582 . 11 1 1 A 55 55 SER CB C 55 62.727 62.922 -0.195 1
1 583 . 11 1 1 A 55 55 SER N N 55 116.646 116.095 0.551 1
1 584 . 11 1 1 A 56 56 ASN H H 56 8.634 8.103 0.531 1
1 585 . 11 1 1 A 56 56 ASN HA H 56 4.549 4.460 0.089 1
1 590 . 11 1 1 A 56 56 ASN C C 56 177.481 178.334 -0.853 1
1 591 . 11 1 1 A 56 56 ASN CA C 56 55.951 56.507 -0.556 1
1 592 . 11 1 1 A 56 56 ASN CB C 56 37.852 38.148 -0.296 1
1 593 . 11 1 1 A 56 56 ASN N N 56 119.048 119.716 -0.668 1
1 595 . 11 1 1 A 57 57 TRP H H 57 8.373 8.087 0.286 1
1 596 . 11 1 1 A 57 57 TRP HA H 57 4.065 4.339 -0.274 1
1 605 . 11 1 1 A 57 57 TRP C C 57 179.392 178.203 1.189 1
1 606 . 11 1 1 A 57 57 TRP CA C 57 63.204 61.231 1.973 1
1 607 . 11 1 1 A 57 57 TRP CB C 57 28.376 29.482 -1.106 1
1 613 . 11 1 1 A 57 57 TRP N N 57 122.950 122.749 0.201 1
1 615 . 11 1 1 A 58 58 PHE H H 58 8.428 8.333 0.095 1
1 616 . 11 1 1 A 58 58 PHE HA H 58 3.922 3.797 0.125 1
1 624 . 11 1 1 A 58 58 PHE C C 58 178.237 177.840 0.397 1
1 625 . 11 1 1 A 58 58 PHE CA C 58 64.015 61.539 2.476 1
1 626 . 11 1 1 A 58 58 PHE CB C 58 39.602 38.363 1.239 1
1 632 . 11 1 1 A 58 58 PHE N N 58 116.774 117.519 -0.745 1
1 633 . 11 1 1 A 59 59 ILE H H 59 7.925 8.264 -0.339 1
1 634 . 11 1 1 A 59 59 ILE HA H 59 3.773 3.710 0.063 1
1 644 . 11 1 1 A 59 59 ILE C C 59 178.745 177.767 0.978 1
1 645 . 11 1 1 A 59 59 ILE CA C 59 65.531 65.303 0.228 1
1 646 . 11 1 1 A 59 59 ILE CB C 59 38.480 37.856 0.624 1
1 650 . 11 1 1 A 59 59 ILE N N 59 119.560 120.144 -0.584 1
1 651 . 11 1 1 A 60 60 ASN H H 60 7.506 8.168 -0.662 1
1 652 . 11 1 1 A 60 60 ASN HA H 60 4.407 4.430 -0.023 1
1 657 . 11 1 1 A 60 60 ASN C C 60 177.163 177.699 -0.536 1
1 658 . 11 1 1 A 60 60 ASN CA C 60 55.871 56.194 -0.323 1
1 659 . 11 1 1 A 60 60 ASN CB C 60 38.878 37.709 1.169 1
1 660 . 11 1 1 A 60 60 ASN N N 60 116.868 117.943 -1.075 1
1 662 . 11 1 1 A 61 61 ALA H H 61 8.410 8.287 0.123 1
1 663 . 11 1 1 A 61 61 ALA HA H 61 3.667 3.689 -0.022 1
1 667 . 11 1 1 A 61 61 ALA C C 61 180.061 179.166 0.895 1
1 668 . 11 1 1 A 61 61 ALA CA C 61 54.601 54.864 -0.263 1
1 669 . 11 1 1 A 61 61 ALA CB C 61 18.241 17.023 1.218 1
1 670 . 11 1 1 A 61 61 ALA N N 61 123.022 122.583 0.439 1
1 671 . 11 1 1 A 62 62 ARG H H 62 8.036 8.020 0.016 1
1 672 . 11 1 1 A 62 62 ARG HA H 62 4.092 3.999 0.093 1
1 679 . 11 1 1 A 62 62 ARG C C 62 176.756 177.167 -0.411 1
1 680 . 11 1 1 A 62 62 ARG CA C 62 58.762 58.104 0.658 1
1 681 . 11 1 1 A 62 62 ARG CB C 62 30.601 29.847 0.754 1
1 684 . 11 1 1 A 62 62 ARG N N 62 117.168 118.396 -1.228 1
1 685 . 11 1 1 A 63 63 ARG H H 63 7.214 7.898 -0.684 1
1 686 . 11 1 1 A 63 63 ARG HA H 63 4.249 4.401 -0.152 1
1 693 . 11 1 1 A 63 63 ARG C C 63 176.945 176.204 0.741 1
1 694 . 11 1 1 A 63 63 ARG CA C 63 57.669 56.361 1.308 1
1 695 . 11 1 1 A 63 63 ARG CB C 63 30.765 31.091 -0.326 1
1 698 . 11 1 1 A 63 63 ARG N N 63 116.514 117.341 -0.827 1
1 699 . 11 1 1 A 64 64 ARG H H 64 7.913 7.932 -0.019 1
1 700 . 11 1 1 A 64 64 ARG HA H 64 4.351 4.516 -0.165 1
1 707 . 11 1 1 A 64 64 ARG C C 64 176.413 177.177 -0.764 1
1 708 . 11 1 1 A 64 64 ARG CA C 64 57.105 55.461 1.644 1
1 709 . 11 1 1 A 64 64 ARG CB C 64 31.672 31.108 0.564 1
1 712 . 11 1 1 A 64 64 ARG N N 64 116.818 119.185 -2.367 1
1 713 . 11 1 1 A 65 65 ILE H H 65 8.169 7.791 0.378 1
1 714 . 11 1 1 A 65 65 ILE HA H 65 4.285 4.257 0.028 1
1 724 . 11 1 1 A 65 65 ILE C C 65 176.208 176.774 -0.566 1
1 725 . 11 1 1 A 65 65 ILE CA C 65 62.005 62.706 -0.701 1
1 726 . 11 1 1 A 65 65 ILE CB C 65 39.088 39.201 -0.113 1
1 730 . 11 1 1 A 65 65 ILE N N 65 119.185 119.714 -0.529 1
1 731 . 11 1 1 A 66 66 LEU H H 66 7.962 8.031 -0.069 1
1 732 . 11 1 1 A 66 66 LEU HA H 66 4.485 4.062 0.423 1
1 742 . 11 1 1 A 66 66 LEU C C 66 176.216 175.157 1.059 1
1 743 . 11 1 1 A 66 66 LEU CA C 66 56.153 59.855 -3.702 1
1 744 . 11 1 1 A 66 66 LEU CB C 66 40.792 40.014 0.778 1
1 748 . 11 1 1 A 66 66 LEU N N 66 124.389 121.518 2.871 1
1 749 . 11 1 1 A 67 67 PRO HA H 67 4.283 4.397 -0.114 1
1 756 . 11 1 1 A 67 67 PRO C C 67 178.294 178.040 0.254 1
1 757 . 11 1 1 A 67 67 PRO CA C 67 65.390 64.936 0.454 1
1 758 . 11 1 1 A 67 67 PRO CB C 67 31.095 31.293 -0.198 1
1 761 . 11 1 1 A 68 68 ASP H H 68 7.913 8.751 -0.838 1
1 762 . 11 1 1 A 68 68 ASP HA H 68 4.507 4.518 -0.011 1
1 765 . 11 1 1 A 68 68 ASP C C 68 177.927 177.402 0.525 1
1 766 . 11 1 1 A 68 68 ASP CA C 68 55.906 56.429 -0.523 1
1 767 . 11 1 1 A 68 68 ASP CB C 68 40.736 41.246 -0.510 1
1 768 . 11 1 1 A 68 68 ASP N N 68 117.231 118.085 -0.854 1
1 769 . 11 1 1 A 69 69 MET H H 69 8.083 8.212 -0.129 1
1 770 . 11 1 1 A 69 69 MET HA H 69 4.362 4.419 -0.057 1
1 778 . 11 1 1 A 69 69 MET C C 69 177.374 178.440 -1.066 1
1 779 . 11 1 1 A 69 69 MET CA C 69 57.634 58.200 -0.566 1
1 780 . 11 1 1 A 69 69 MET CB C 69 32.816 33.263 -0.447 1
1 783 . 11 1 1 A 69 69 MET N N 69 119.391 116.445 2.946 1
1 784 . 11 1 1 A 70 70 LEU H H 70 7.907 8.601 -0.694 1
1 785 . 11 1 1 A 70 70 LEU HA H 70 4.232 4.062 0.170 1
1 795 . 11 1 1 A 70 70 LEU C C 70 177.745 177.403 0.342 1
1 796 . 11 1 1 A 70 70 LEU CA C 70 55.835 57.557 -1.722 1
1 797 . 11 1 1 A 70 70 LEU CB C 70 42.174 41.330 0.844 1
1 801 . 11 1 1 A 70 70 LEU N N 70 119.266 122.865 -3.599 1
1 802 . 11 1 1 A 71 71 GLN H H 71 7.865 7.598 0.267 1
1 803 . 11 1 1 A 71 71 GLN HA H 71 4.287 4.364 -0.077 1
1 809 . 11 1 1 A 71 71 GLN C C 71 178.855 176.095 2.760 1
1 810 . 11 1 1 A 71 71 GLN CA C 71 56.383 56.604 -0.221 1
1 811 . 11 1 1 A 71 71 GLN CB C 71 29.092 29.221 -0.129 1
1 813 . 11 1 1 A 71 71 GLN N N 71 118.603 119.177 -0.574 1
1 815 . 11 1 1 A 72 72 GLN H H 72 8.189 8.193 -0.004 1
1 816 . 11 1 1 A 72 72 GLN HA H 72 4.302 4.323 -0.021 1
1 821 . 11 1 1 A 72 72 GLN CA C 72 56.206 57.017 -0.811 1
1 822 . 11 1 1 A 72 72 GLN CB C 72 29.298 29.671 -0.373 1
1 824 . 11 1 1 A 72 72 GLN N N 72 120.267 122.173 -1.906 1
1 825 . 11 1 1 A 73 73 ARG C C 73 176.105 174.770 1.335 1
1 826 . 11 1 1 A 74 74 ARG HA H 74 4.334 4.875 -0.541 1
1 833 . 11 1 1 A 74 74 ARG C C 74 176.188 174.740 1.448 1
1 834 . 11 1 1 A 74 74 ARG CA C 74 56.300 55.087 1.213 1
1 835 . 11 1 1 A 74 74 ARG CB C 74 30.668 30.530 0.138 1
1 838 . 11 1 1 A 75 75 ASN C C 75 174.462 172.585 1.877 1
1 839 . 11 1 1 A 75 75 ASN CA C 75 53.148 52.374 0.774 1
1 840 . 11 1 1 A 75 75 ASN CB C 75 39.046 42.507 -3.461 1
1 841 . 11 1 1 A 76 76 ASP H H 76 8.257 8.793 -0.536 1
1 842 . 11 1 1 A 76 76 ASP HA H 76 4.877 5.251 -0.374 1
1 845 . 11 1 1 A 76 76 ASP C C 76 174.759 175.130 -0.371 1
1 846 . 11 1 1 A 76 76 ASP CA C 76 52.380 51.736 0.644 1
1 847 . 11 1 1 A 76 76 ASP CB C 76 41.267 41.545 -0.278 1
1 848 . 11 1 1 A 76 76 ASP N N 76 122.030 121.056 0.974 1
1 849 . 11 1 1 A 77 77 PRO HA H 77 4.466 4.515 -0.049 1
1 856 . 11 1 1 A 77 77 PRO C C 77 177.133 176.241 0.892 1
1 857 . 11 1 1 A 77 77 PRO CA C 77 63.733 62.762 0.971 1
1 858 . 11 1 1 A 77 77 PRO CB C 77 31.919 31.529 0.390 1
1 861 . 11 1 1 A 78 78 SER H H 78 8.457 8.559 -0.102 1
1 862 . 11 1 1 A 78 78 SER HA H 78 4.479 4.738 -0.259 1
1 865 . 11 1 1 A 78 78 SER C C 78 174.731 173.685 1.046 1
1 866 . 11 1 1 A 78 78 SER CA C 78 58.691 57.328 1.363 1
1 867 . 11 1 1 A 78 78 SER CB C 78 63.973 63.652 0.321 1
1 868 . 11 1 1 A 78 78 SER N N 78 115.711 117.703 -1.992 1
1 869 . 11 1 1 A 79 79 GLY H H 79 8.090 8.176 -0.086 1
1 870 . 11 1 1 A 79 79 GLY HA2 H 79 4.179 4.263 -0.084 1
1 871 . 11 1 1 A 79 79 GLY HA3 H 79 4.065 4.365 -0.300 1
1 872 . 11 1 1 A 79 79 GLY CA C 79 44.746 45.925 -1.179 1
1 873 . 11 1 1 A 79 79 GLY N N 79 110.429 113.756 -3.327 1
1 874 . 11 1 1 A 80 80 PRO HA H 80 4.464 4.295 0.169 1
1 880 . 11 1 1 A 80 80 PRO C C 80 177.499 177.702 -0.203 1
1 881 . 11 1 1 A 80 80 PRO CA C 80 63.275 64.877 -1.602 1
1 882 . 11 1 1 A 80 80 PRO CB C 80 32.249 31.856 0.393 1
1 1 . 12 1 1 A 13 13 ASN HA H 13 4.787 5.526 -0.739 1
1 6 . 12 1 1 A 13 13 ASN CA C 13 53.148 51.887 1.261 1
1 7 . 12 1 1 A 13 13 ASN CB C 13 39.378 43.260 -3.882 1
1 9 . 12 1 1 A 14 14 LEU H H 14 8.418 8.940 -0.522 1
1 10 . 12 1 1 A 14 14 LEU HA H 14 4.654 4.720 -0.066 1
1 20 . 12 1 1 A 14 14 LEU CA C 14 52.999 51.524 1.475 1
1 21 . 12 1 1 A 14 14 LEU CB C 14 41.919 43.853 -1.934 1
1 25 . 12 1 1 A 14 14 LEU N N 14 122.671 122.154 0.517 1
1 26 . 12 1 1 A 15 15 PRO HA H 15 4.460 4.629 -0.169 1
1 33 . 12 1 1 A 15 15 PRO C C 15 178.156 177.685 0.471 1
1 34 . 12 1 1 A 15 15 PRO CA C 15 63.101 62.650 0.451 1
1 35 . 12 1 1 A 15 15 PRO CB C 15 32.304 32.085 0.219 1
1 38 . 12 1 1 A 16 16 ALA H H 16 8.973 8.628 0.345 1
1 39 . 12 1 1 A 16 16 ALA HA H 16 4.021 3.957 0.064 1
1 43 . 12 1 1 A 16 16 ALA C C 16 180.695 179.589 1.106 1
1 44 . 12 1 1 A 16 16 ALA CA C 16 55.642 55.633 0.009 1
1 45 . 12 1 1 A 16 16 ALA CB C 16 18.552 18.644 -0.092 1
1 46 . 12 1 1 A 16 16 ALA N N 16 128.311 127.173 1.138 1
1 47 . 12 1 1 A 17 17 GLU H H 17 9.558 8.441 1.117 1
1 48 . 12 1 1 A 17 17 GLU HA H 17 4.065 4.014 0.051 1
1 53 . 12 1 1 A 17 17 GLU C C 17 178.886 179.056 -0.170 1
1 54 . 12 1 1 A 17 17 GLU CA C 17 59.400 59.780 -0.380 1
1 55 . 12 1 1 A 17 17 GLU CB C 17 28.742 29.456 -0.714 1
1 57 . 12 1 1 A 17 17 GLU N N 17 117.113 118.796 -1.683 1
1 58 . 12 1 1 A 18 18 SER H H 18 7.263 7.997 -0.734 1
1 59 . 12 1 1 A 18 18 SER HA H 18 4.180 4.096 0.084 1
1 62 . 12 1 1 A 18 18 SER C C 18 174.951 175.785 -0.834 1
1 63 . 12 1 1 A 18 18 SER CA C 18 61.969 62.583 -0.614 1
1 64 . 12 1 1 A 18 18 SER CB C 18 62.554 62.915 -0.361 1
1 65 . 12 1 1 A 18 18 SER N N 18 114.932 117.488 -2.556 1
1 66 . 12 1 1 A 19 19 VAL H H 19 7.620 8.425 -0.805 1
1 67 . 12 1 1 A 19 19 VAL HA H 19 3.011 3.143 -0.132 1
1 75 . 12 1 1 A 19 19 VAL C C 19 176.953 177.680 -0.727 1
1 76 . 12 1 1 A 19 19 VAL CA C 19 66.479 66.793 -0.314 1
1 77 . 12 1 1 A 19 19 VAL CB C 19 31.569 31.445 0.124 1
1 80 . 12 1 1 A 19 19 VAL N N 19 121.086 121.708 -0.622 1
1 81 . 12 1 1 A 20 20 LYS H H 20 7.745 8.410 -0.665 1
1 82 . 12 1 1 A 20 20 LYS HA H 20 3.884 3.992 -0.108 1
1 91 . 12 1 1 A 20 20 LYS C C 20 178.150 178.990 -0.840 1
1 92 . 12 1 1 A 20 20 LYS CA C 20 59.984 59.548 0.436 1
1 93 . 12 1 1 A 20 20 LYS CB C 20 32.351 32.217 0.134 1
1 97 . 12 1 1 A 20 20 LYS N N 20 119.366 119.620 -0.254 1
1 98 . 12 1 1 A 21 21 ILE H H 21 6.943 7.769 -0.826 1
1 99 . 12 1 1 A 21 21 ILE HA H 21 3.783 3.679 0.104 1
1 109 . 12 1 1 A 21 21 ILE C C 21 178.996 178.643 0.353 1
1 110 . 12 1 1 A 21 21 ILE CA C 21 64.642 65.726 -1.084 1
1 111 . 12 1 1 A 21 21 ILE CB C 21 38.014 37.712 0.302 1
1 115 . 12 1 1 A 21 21 ILE N N 21 118.163 119.840 -1.677 1
1 116 . 12 1 1 A 22 22 LEU H H 22 7.267 8.036 -0.769 1
1 117 . 12 1 1 A 22 22 LEU HA H 22 3.748 3.869 -0.121 1
1 127 . 12 1 1 A 22 22 LEU C C 22 178.289 178.733 -0.444 1
1 128 . 12 1 1 A 22 22 LEU CA C 22 58.092 58.100 -0.008 1
1 129 . 12 1 1 A 22 22 LEU CB C 22 38.551 40.900 -2.349 1
1 133 . 12 1 1 A 22 22 LEU N N 22 120.609 119.086 1.523 1
1 134 . 12 1 1 A 23 23 ARG H H 23 8.676 8.774 -0.098 1
1 135 . 12 1 1 A 23 23 ARG HA H 23 4.030 4.233 -0.203 1
1 142 . 12 1 1 A 23 23 ARG C C 23 178.861 178.376 0.485 1
1 143 . 12 1 1 A 23 23 ARG CA C 23 60.404 60.023 0.381 1
1 144 . 12 1 1 A 23 23 ARG CB C 23 30.351 30.221 0.130 1
1 147 . 12 1 1 A 23 23 ARG N N 23 119.148 117.710 1.438 1
1 148 . 12 1 1 A 24 24 ASP H H 24 8.515 8.267 0.248 1
1 149 . 12 1 1 A 24 24 ASP HA H 24 4.519 4.437 0.082 1
1 152 . 12 1 1 A 24 24 ASP C C 24 178.759 178.493 0.266 1
1 153 . 12 1 1 A 24 24 ASP CA C 24 57.556 57.237 0.319 1
1 154 . 12 1 1 A 24 24 ASP CB C 24 40.569 40.864 -0.295 1
1 155 . 12 1 1 A 24 24 ASP N N 24 120.027 119.301 0.726 1
1 156 . 12 1 1 A 25 25 TRP H H 25 8.158 7.764 0.394 1
1 157 . 12 1 1 A 25 25 TRP HA H 25 4.181 4.463 -0.282 1
1 166 . 12 1 1 A 25 25 TRP C C 25 179.946 178.425 1.521 1
1 167 . 12 1 1 A 25 25 TRP CA C 25 63.346 61.345 2.001 1
1 168 . 12 1 1 A 25 25 TRP CB C 25 29.433 29.911 -0.478 1
1 174 . 12 1 1 A 25 25 TRP N N 25 121.350 121.426 -0.076 1
1 176 . 12 1 1 A 26 26 MET H H 26 8.977 8.824 0.153 1
1 177 . 12 1 1 A 26 26 MET HA H 26 4.076 4.647 -0.571 1
1 185 . 12 1 1 A 26 26 MET C C 26 177.371 178.299 -0.928 1
1 186 . 12 1 1 A 26 26 MET CA C 26 60.454 58.793 1.661 1
1 187 . 12 1 1 A 26 26 MET CB C 26 33.567 32.708 0.859 1
1 190 . 12 1 1 A 26 26 MET N N 26 119.977 118.827 1.150 1
1 191 . 12 1 1 A 27 27 TYR H H 27 8.604 8.185 0.419 1
1 192 . 12 1 1 A 27 27 TYR HA H 27 4.138 4.257 -0.119 1
1 199 . 12 1 1 A 27 27 TYR C C 27 178.901 177.450 1.451 1
1 200 . 12 1 1 A 27 27 TYR CA C 27 61.846 61.530 0.316 1
1 201 . 12 1 1 A 27 27 TYR CB C 27 38.165 38.714 -0.549 1
1 206 . 12 1 1 A 27 27 TYR N N 27 117.797 121.298 -3.501 1
1 207 . 12 1 1 A 28 28 LYS H H 28 7.867 7.863 0.004 1
1 208 . 12 1 1 A 28 28 LYS HA H 28 3.797 3.916 -0.119 1
1 217 . 12 1 1 A 28 28 LYS C C 28 176.858 177.725 -0.867 1
1 218 . 12 1 1 A 28 28 LYS CA C 28 58.174 58.981 -0.807 1
1 219 . 12 1 1 A 28 28 LYS CB C 28 32.516 32.319 0.197 1
1 223 . 12 1 1 A 28 28 LYS N N 28 118.982 118.108 0.874 1
1 224 . 12 1 1 A 29 29 HIS H H 29 7.443 7.233 0.210 1
1 225 . 12 1 1 A 29 29 HIS HA H 29 4.386 4.443 -0.057 1
1 230 . 12 1 1 A 29 29 HIS C C 29 176.085 175.925 0.160 1
1 231 . 12 1 1 A 29 29 HIS CA C 29 55.213 55.037 0.176 1
1 232 . 12 1 1 A 29 29 HIS CB C 29 27.085 29.034 -1.949 1
1 235 . 12 1 1 A 29 29 HIS N N 29 117.138 115.407 1.731 1
1 236 . 12 1 1 A 30 30 ARG H H 30 6.921 8.507 -1.586 1
1 237 . 12 1 1 A 30 30 ARG HA H 30 3.898 4.361 -0.463 1
1 244 . 12 1 1 A 30 30 ARG C C 30 175.808 178.111 -2.303 1
1 245 . 12 1 1 A 30 30 ARG CA C 30 58.609 58.592 0.017 1
1 246 . 12 1 1 A 30 30 ARG CB C 30 28.739 29.678 -0.939 1
1 249 . 12 1 1 A 30 30 ARG N N 30 117.911 119.644 -1.733 1
1 250 . 12 1 1 A 31 31 PHE H H 31 7.819 8.366 -0.547 1
1 251 . 12 1 1 A 31 31 PHE HA H 31 4.533 4.283 0.250 1
1 259 . 12 1 1 A 31 31 PHE C C 31 175.577 176.862 -1.285 1
1 260 . 12 1 1 A 31 31 PHE CA C 31 58.029 60.851 -2.822 1
1 261 . 12 1 1 A 31 31 PHE CB C 31 37.792 38.716 -0.924 1
1 267 . 12 1 1 A 31 31 PHE N N 31 115.408 118.551 -3.143 1
1 268 . 12 1 1 A 32 32 LYS H H 32 7.858 7.980 -0.122 1
1 269 . 12 1 1 A 32 32 LYS HA H 32 4.487 4.461 0.026 1
1 277 . 12 1 1 A 32 32 LYS C C 32 175.557 176.286 -0.729 1
1 278 . 12 1 1 A 32 32 LYS CA C 32 56.329 56.713 -0.384 1
1 279 . 12 1 1 A 32 32 LYS CB C 32 32.743 34.544 -1.801 1
1 283 . 12 1 1 A 32 32 LYS N N 32 122.453 113.279 9.174 1
1 284 . 12 1 1 A 33 33 ALA H H 33 8.643 8.191 0.452 1
1 285 . 12 1 1 A 33 33 ALA HA H 33 4.403 4.060 0.343 1
1 289 . 12 1 1 A 33 33 ALA C C 33 176.273 175.217 1.056 1
1 290 . 12 1 1 A 33 33 ALA CA C 33 53.579 53.227 0.352 1
1 291 . 12 1 1 A 33 33 ALA CB C 33 18.653 17.202 1.451 1
1 292 . 12 1 1 A 33 33 ALA N N 33 127.853 120.501 7.352 1
1 293 . 12 1 1 A 34 34 TYR H H 34 7.878 7.973 -0.095 1
1 294 . 12 1 1 A 34 34 TYR HA H 34 4.686 4.813 -0.127 1
1 301 . 12 1 1 A 34 34 TYR C C 34 173.133 173.206 -0.073 1
1 302 . 12 1 1 A 34 34 TYR CA C 34 54.778 54.865 -0.087 1
1 303 . 12 1 1 A 34 34 TYR CB C 34 39.619 40.566 -0.947 1
1 308 . 12 1 1 A 34 34 TYR N N 34 116.539 116.754 -0.215 1
1 309 . 12 1 1 A 35 35 PRO HA H 35 4.526 5.075 -0.549 1
1 316 . 12 1 1 A 35 35 PRO C C 35 176.837 175.583 1.254 1
1 317 . 12 1 1 A 35 35 PRO CA C 35 61.864 62.147 -0.283 1
1 318 . 12 1 1 A 35 35 PRO CB C 35 30.904 32.252 -1.348 1
1 321 . 12 1 1 A 36 36 SER H H 36 9.634 8.808 0.826 1
1 322 . 12 1 1 A 36 36 SER HA H 36 4.518 4.786 -0.268 1
1 325 . 12 1 1 A 36 36 SER C C 36 175.001 174.975 0.026 1
1 326 . 12 1 1 A 36 36 SER CA C 36 57.129 56.653 0.476 1
1 327 . 12 1 1 A 36 36 SER CB C 36 65.374 65.282 0.092 1
1 328 . 12 1 1 A 36 36 SER N N 36 119.984 116.772 3.212 1
1 329 . 12 1 1 A 37 37 GLU H H 37 9.091 9.125 -0.034 1
1 330 . 12 1 1 A 37 37 GLU HA H 37 3.884 3.931 -0.047 1
1 335 . 12 1 1 A 37 37 GLU C C 37 179.347 178.117 1.230 1
1 336 . 12 1 1 A 37 37 GLU CA C 37 60.454 59.476 0.978 1
1 337 . 12 1 1 A 37 37 GLU CB C 37 28.623 29.481 -0.858 1
1 339 . 12 1 1 A 37 37 GLU N N 37 120.748 126.445 -5.697 1
1 340 . 12 1 1 A 38 38 GLU H H 38 8.760 7.974 0.786 1
1 341 . 12 1 1 A 38 38 GLU HA H 38 4.048 4.087 -0.039 1
1 346 . 12 1 1 A 38 38 GLU C C 38 179.975 178.783 1.192 1
1 347 . 12 1 1 A 38 38 GLU CA C 38 60.243 59.062 1.181 1
1 348 . 12 1 1 A 38 38 GLU CB C 38 29.117 29.885 -0.768 1
1 350 . 12 1 1 A 38 38 GLU N N 38 119.272 119.074 0.198 1
1 351 . 12 1 1 A 39 39 GLU H H 39 7.856 8.030 -0.174 1
1 352 . 12 1 1 A 39 39 GLU HA H 39 3.976 3.942 0.034 1
1 357 . 12 1 1 A 39 39 GLU C C 39 178.912 178.905 0.007 1
1 358 . 12 1 1 A 39 39 GLU CA C 39 59.131 59.092 0.039 1
1 359 . 12 1 1 A 39 39 GLU CB C 39 29.612 28.823 0.789 1
1 361 . 12 1 1 A 39 39 GLU N N 39 121.658 120.859 0.799 1
1 362 . 12 1 1 A 40 40 LYS H H 40 8.653 7.837 0.816 1
1 363 . 12 1 1 A 40 40 LYS HA H 40 3.508 3.831 -0.323 1
1 372 . 12 1 1 A 40 40 LYS C C 40 177.974 179.059 -1.085 1
1 373 . 12 1 1 A 40 40 LYS CA C 40 60.948 59.667 1.281 1
1 374 . 12 1 1 A 40 40 LYS CB C 40 32.714 32.155 0.559 1
1 378 . 12 1 1 A 40 40 LYS N N 40 119.152 119.444 -0.292 1
1 379 . 12 1 1 A 41 41 GLN H H 41 7.876 7.407 0.469 1
1 380 . 12 1 1 A 41 41 GLN HA H 41 3.911 3.959 -0.048 1
1 387 . 12 1 1 A 41 41 GLN C C 41 178.352 178.224 0.128 1
1 388 . 12 1 1 A 41 41 GLN CA C 41 58.973 58.966 0.007 1
1 389 . 12 1 1 A 41 41 GLN CB C 41 27.552 28.597 -1.045 1
1 391 . 12 1 1 A 41 41 GLN N N 41 118.910 119.697 -0.787 1
1 393 . 12 1 1 A 42 42 MET H H 42 7.771 7.736 0.035 1
1 394 . 12 1 1 A 42 42 MET HA H 42 4.158 4.210 -0.052 1
1 402 . 12 1 1 A 42 42 MET C C 42 179.310 178.249 1.061 1
1 403 . 12 1 1 A 42 42 MET CA C 42 59.079 58.359 0.720 1
1 404 . 12 1 1 A 42 42 MET CB C 42 31.023 32.402 -1.379 1
1 407 . 12 1 1 A 42 42 MET N N 42 121.131 119.152 1.979 1
1 408 . 12 1 1 A 43 43 LEU H H 43 8.400 8.441 -0.041 1
1 409 . 12 1 1 A 43 43 LEU HA H 43 3.888 3.910 -0.022 1
1 419 . 12 1 1 A 43 43 LEU C C 43 180.721 178.790 1.931 1
1 420 . 12 1 1 A 43 43 LEU CA C 43 57.916 58.102 -0.186 1
1 421 . 12 1 1 A 43 43 LEU CB C 43 42.080 41.167 0.913 1
1 425 . 12 1 1 A 43 43 LEU N N 43 120.124 120.875 -0.751 1
1 426 . 12 1 1 A 44 44 SER H H 44 8.658 8.478 0.180 1
1 427 . 12 1 1 A 44 44 SER HA H 44 4.088 4.145 -0.057 1
1 430 . 12 1 1 A 44 44 SER C C 44 176.859 176.645 0.214 1
1 431 . 12 1 1 A 44 44 SER CA C 44 61.371 61.078 0.293 1
1 432 . 12 1 1 A 44 44 SER CB C 44 63.314 62.815 0.499 1
1 433 . 12 1 1 A 44 44 SER N N 44 119.795 113.525 6.270 1
1 434 . 12 1 1 A 45 45 GLU H H 45 7.905 7.675 0.230 1
1 435 . 12 1 1 A 45 45 GLU HA H 45 4.094 4.211 -0.117 1
1 440 . 12 1 1 A 45 45 GLU C C 45 179.095 179.464 -0.369 1
1 441 . 12 1 1 A 45 45 GLU CA C 45 59.255 58.968 0.287 1
1 442 . 12 1 1 A 45 45 GLU CB C 45 29.200 29.845 -0.645 1
1 444 . 12 1 1 A 45 45 GLU N N 45 120.609 121.371 -0.762 1
1 445 . 12 1 1 A 46 46 LYS H H 46 7.837 8.197 -0.360 1
1 446 . 12 1 1 A 46 46 LYS HA H 46 4.231 4.144 0.087 1
1 453 . 12 1 1 A 46 46 LYS C C 46 177.964 178.705 -0.741 1
1 454 . 12 1 1 A 46 46 LYS CA C 46 58.278 58.843 -0.565 1
1 455 . 12 1 1 A 46 46 LYS CB C 46 34.110 32.730 1.380 1
1 459 . 12 1 1 A 46 46 LYS N N 46 115.471 118.992 -3.521 1
1 460 . 12 1 1 A 47 47 THR H H 47 7.763 8.184 -0.421 1
1 461 . 12 1 1 A 47 47 THR HA H 47 4.271 4.233 0.038 1
1 466 . 12 1 1 A 47 47 THR C C 47 175.472 174.697 0.775 1
1 467 . 12 1 1 A 47 47 THR CA C 47 62.429 62.350 0.079 1
1 468 . 12 1 1 A 47 47 THR CB C 47 71.966 70.108 1.858 1
1 470 . 12 1 1 A 47 47 THR N N 47 104.286 108.364 -4.078 1
1 471 . 12 1 1 A 48 48 ASN H H 48 8.169 8.141 0.028 1
1 472 . 12 1 1 A 48 48 ASN HA H 48 4.437 4.629 -0.192 1
1 477 . 12 1 1 A 48 48 ASN C C 48 173.874 173.899 -0.025 1
1 478 . 12 1 1 A 48 48 ASN CA C 48 55.377 54.404 0.973 1
1 479 . 12 1 1 A 48 48 ASN CB C 48 37.770 36.651 1.119 1
1 480 . 12 1 1 A 48 48 ASN N N 48 117.458 116.003 1.455 1
1 482 . 12 1 1 A 49 49 LEU H H 49 7.532 7.551 -0.019 1
1 483 . 12 1 1 A 49 49 LEU HA H 49 4.733 4.819 -0.086 1
1 493 . 12 1 1 A 49 49 LEU C C 49 176.625 175.589 1.036 1
1 494 . 12 1 1 A 49 49 LEU CA C 49 53.226 53.139 0.087 1
1 495 . 12 1 1 A 49 49 LEU CB C 49 44.114 43.813 0.301 1
1 499 . 12 1 1 A 49 49 LEU N N 49 118.220 119.166 -0.946 1
1 500 . 12 1 1 A 50 50 SER H H 50 9.140 8.759 0.381 1
1 501 . 12 1 1 A 50 50 SER HA H 50 4.475 4.828 -0.353 1
1 504 . 12 1 1 A 50 50 SER C C 50 174.907 175.073 -0.166 1
1 505 . 12 1 1 A 50 50 SER CA C 50 56.964 57.844 -0.880 1
1 506 . 12 1 1 A 50 50 SER CB C 50 65.372 64.832 0.540 1
1 507 . 12 1 1 A 50 50 SER N N 50 117.569 117.738 -0.169 1
1 508 . 12 1 1 A 51 51 LEU H H 51 8.756 8.740 0.016 1
1 509 . 12 1 1 A 51 51 LEU HA H 51 3.874 3.924 -0.050 1
1 519 . 12 1 1 A 51 51 LEU C C 51 179.910 178.746 1.164 1
1 520 . 12 1 1 A 51 51 LEU CA C 51 58.916 58.162 0.754 1
1 521 . 12 1 1 A 51 51 LEU CB C 51 41.148 41.420 -0.272 1
1 525 . 12 1 1 A 51 51 LEU N N 51 120.905 125.872 -4.967 1
1 526 . 12 1 1 A 52 52 LEU H H 52 8.146 8.306 -0.160 1
1 527 . 12 1 1 A 52 52 LEU HA H 52 4.179 4.032 0.147 1
1 537 . 12 1 1 A 52 52 LEU C C 52 178.936 178.734 0.202 1
1 538 . 12 1 1 A 52 52 LEU CA C 52 58.162 58.415 -0.253 1
1 539 . 12 1 1 A 52 52 LEU CB C 52 42.137 41.558 0.579 1
1 543 . 12 1 1 A 52 52 LEU N N 52 120.685 120.120 0.565 1
1 544 . 12 1 1 A 53 53 GLN H H 53 7.924 8.174 -0.250 1
1 545 . 12 1 1 A 53 53 GLN HA H 53 4.102 4.146 -0.044 1
1 552 . 12 1 1 A 53 53 GLN C C 53 180.308 178.680 1.628 1
1 553 . 12 1 1 A 53 53 GLN CA C 53 59.326 58.552 0.774 1
1 554 . 12 1 1 A 53 53 GLN CB C 53 29.900 28.246 1.654 1
1 556 . 12 1 1 A 53 53 GLN N N 53 118.473 117.635 0.838 1
1 558 . 12 1 1 A 54 54 ILE H H 54 8.380 8.258 0.122 1
1 559 . 12 1 1 A 54 54 ILE HA H 54 3.677 3.724 -0.047 1
1 569 . 12 1 1 A 54 54 ILE C C 54 177.673 178.161 -0.488 1
1 570 . 12 1 1 A 54 54 ILE CA C 54 64.650 65.609 -0.959 1
1 571 . 12 1 1 A 54 54 ILE CB C 54 37.476 37.758 -0.282 1
1 575 . 12 1 1 A 54 54 ILE N N 54 120.113 121.480 -1.367 1
1 576 . 12 1 1 A 55 55 SER H H 55 8.854 7.905 0.949 1
1 577 . 12 1 1 A 55 55 SER HA H 55 4.267 4.313 -0.046 1
1 580 . 12 1 1 A 55 55 SER C C 55 177.127 177.671 -0.544 1
1 581 . 12 1 1 A 55 55 SER CA C 55 62.852 61.842 1.010 1
1 582 . 12 1 1 A 55 55 SER CB C 55 62.727 63.074 -0.347 1
1 583 . 12 1 1 A 55 55 SER N N 55 116.646 115.881 0.765 1
1 584 . 12 1 1 A 56 56 ASN H H 56 8.634 8.243 0.391 1
1 585 . 12 1 1 A 56 56 ASN HA H 56 4.549 4.469 0.080 1
1 590 . 12 1 1 A 56 56 ASN C C 56 177.481 178.072 -0.591 1
1 591 . 12 1 1 A 56 56 ASN CA C 56 55.951 56.605 -0.654 1
1 592 . 12 1 1 A 56 56 ASN CB C 56 37.852 38.184 -0.332 1
1 593 . 12 1 1 A 56 56 ASN N N 56 119.048 119.560 -0.512 1
1 595 . 12 1 1 A 57 57 TRP H H 57 8.373 8.468 -0.095 1
1 596 . 12 1 1 A 57 57 TRP HA H 57 4.065 4.419 -0.354 1
1 605 . 12 1 1 A 57 57 TRP C C 57 179.392 178.298 1.094 1
1 606 . 12 1 1 A 57 57 TRP CA C 57 63.204 61.039 2.165 1
1 607 . 12 1 1 A 57 57 TRP CB C 57 28.376 29.401 -1.025 1
1 613 . 12 1 1 A 57 57 TRP N N 57 122.950 122.602 0.348 1
1 615 . 12 1 1 A 58 58 PHE H H 58 8.428 8.257 0.171 1
1 616 . 12 1 1 A 58 58 PHE HA H 58 3.922 3.810 0.112 1
1 624 . 12 1 1 A 58 58 PHE C C 58 178.237 177.820 0.417 1
1 625 . 12 1 1 A 58 58 PHE CA C 58 64.015 61.697 2.318 1
1 626 . 12 1 1 A 58 58 PHE CB C 58 39.602 38.503 1.099 1
1 632 . 12 1 1 A 58 58 PHE N N 58 116.774 117.590 -0.816 1
1 633 . 12 1 1 A 59 59 ILE H H 59 7.925 8.269 -0.344 1
1 634 . 12 1 1 A 59 59 ILE HA H 59 3.773 3.708 0.065 1
1 644 . 12 1 1 A 59 59 ILE C C 59 178.745 177.628 1.117 1
1 645 . 12 1 1 A 59 59 ILE CA C 59 65.531 65.284 0.247 1
1 646 . 12 1 1 A 59 59 ILE CB C 59 38.480 37.815 0.665 1
1 650 . 12 1 1 A 59 59 ILE N N 59 119.560 120.089 -0.529 1
1 651 . 12 1 1 A 60 60 ASN H H 60 7.506 7.735 -0.229 1
1 652 . 12 1 1 A 60 60 ASN HA H 60 4.407 4.386 0.021 1
1 657 . 12 1 1 A 60 60 ASN C C 60 177.163 177.592 -0.429 1
1 658 . 12 1 1 A 60 60 ASN CA C 60 55.871 56.380 -0.509 1
1 659 . 12 1 1 A 60 60 ASN CB C 60 38.878 37.982 0.896 1
1 660 . 12 1 1 A 60 60 ASN N N 60 116.868 117.993 -1.125 1
1 662 . 12 1 1 A 61 61 ALA H H 61 8.410 8.001 0.409 1
1 663 . 12 1 1 A 61 61 ALA HA H 61 3.667 3.704 -0.037 1
1 667 . 12 1 1 A 61 61 ALA C C 61 180.061 179.795 0.266 1
1 668 . 12 1 1 A 61 61 ALA CA C 61 54.601 54.804 -0.203 1
1 669 . 12 1 1 A 61 61 ALA CB C 61 18.241 17.533 0.708 1
1 670 . 12 1 1 A 61 61 ALA N N 61 123.022 122.746 0.276 1
1 671 . 12 1 1 A 62 62 ARG H H 62 8.036 7.987 0.049 1
1 672 . 12 1 1 A 62 62 ARG HA H 62 4.092 4.023 0.069 1
1 679 . 12 1 1 A 62 62 ARG C C 62 176.756 177.414 -0.658 1
1 680 . 12 1 1 A 62 62 ARG CA C 62 58.762 58.046 0.716 1
1 681 . 12 1 1 A 62 62 ARG CB C 62 30.601 29.929 0.672 1
1 684 . 12 1 1 A 62 62 ARG N N 62 117.168 118.658 -1.490 1
1 685 . 12 1 1 A 63 63 ARG H H 63 7.214 8.194 -0.980 1
1 686 . 12 1 1 A 63 63 ARG HA H 63 4.249 4.407 -0.158 1
1 693 . 12 1 1 A 63 63 ARG C C 63 176.945 176.573 0.372 1
1 694 . 12 1 1 A 63 63 ARG CA C 63 57.669 56.733 0.936 1
1 695 . 12 1 1 A 63 63 ARG CB C 63 30.765 31.065 -0.300 1
1 698 . 12 1 1 A 63 63 ARG N N 63 116.514 118.020 -1.506 1
1 699 . 12 1 1 A 64 64 ARG H H 64 7.913 7.754 0.159 1
1 700 . 12 1 1 A 64 64 ARG HA H 64 4.351 4.587 -0.236 1
1 707 . 12 1 1 A 64 64 ARG C C 64 176.413 178.520 -2.107 1
1 708 . 12 1 1 A 64 64 ARG CA C 64 57.105 57.238 -0.133 1
1 709 . 12 1 1 A 64 64 ARG CB C 64 31.672 32.872 -1.200 1
1 712 . 12 1 1 A 64 64 ARG N N 64 116.818 118.993 -2.175 1
1 713 . 12 1 1 A 65 65 ILE H H 65 8.169 8.120 0.049 1
1 714 . 12 1 1 A 65 65 ILE HA H 65 4.285 3.603 0.682 1
1 724 . 12 1 1 A 65 65 ILE C C 65 176.208 177.869 -1.661 1
1 725 . 12 1 1 A 65 65 ILE CA C 65 62.005 65.592 -3.587 1
1 726 . 12 1 1 A 65 65 ILE CB C 65 39.088 37.873 1.215 1
1 730 . 12 1 1 A 65 65 ILE N N 65 119.185 119.805 -0.620 1
1 731 . 12 1 1 A 66 66 LEU H H 66 7.962 8.195 -0.233 1
1 732 . 12 1 1 A 66 66 LEU HA H 66 4.485 3.991 0.494 1
1 742 . 12 1 1 A 66 66 LEU C C 66 176.216 175.222 0.994 1
1 743 . 12 1 1 A 66 66 LEU CA C 66 56.153 59.785 -3.632 1
1 744 . 12 1 1 A 66 66 LEU CB C 66 40.792 39.983 0.809 1
1 748 . 12 1 1 A 66 66 LEU N N 66 124.389 121.553 2.836 1
1 749 . 12 1 1 A 67 67 PRO HA H 67 4.283 4.341 -0.058 1
1 756 . 12 1 1 A 67 67 PRO C C 67 178.294 178.425 -0.131 1
1 757 . 12 1 1 A 67 67 PRO CA C 67 65.390 64.831 0.559 1
1 758 . 12 1 1 A 67 67 PRO CB C 67 31.095 31.337 -0.242 1
1 761 . 12 1 1 A 68 68 ASP H H 68 7.913 8.546 -0.633 1
1 762 . 12 1 1 A 68 68 ASP HA H 68 4.507 4.436 0.071 1
1 765 . 12 1 1 A 68 68 ASP C C 68 177.927 178.085 -0.158 1
1 766 . 12 1 1 A 68 68 ASP CA C 68 55.906 56.787 -0.881 1
1 767 . 12 1 1 A 68 68 ASP CB C 68 40.736 41.296 -0.560 1
1 768 . 12 1 1 A 68 68 ASP N N 68 117.231 118.214 -0.983 1
1 769 . 12 1 1 A 69 69 MET H H 69 8.083 8.434 -0.351 1
1 770 . 12 1 1 A 69 69 MET HA H 69 4.362 4.597 -0.235 1
1 778 . 12 1 1 A 69 69 MET C C 69 177.374 178.524 -1.150 1
1 779 . 12 1 1 A 69 69 MET CA C 69 57.634 58.454 -0.820 1
1 780 . 12 1 1 A 69 69 MET CB C 69 32.816 32.599 0.217 1
1 783 . 12 1 1 A 69 69 MET N N 69 119.391 118.554 0.837 1
1 784 . 12 1 1 A 70 70 LEU H H 70 7.907 7.771 0.136 1
1 785 . 12 1 1 A 70 70 LEU HA H 70 4.232 3.714 0.518 1
1 795 . 12 1 1 A 70 70 LEU C C 70 177.745 177.959 -0.214 1
1 796 . 12 1 1 A 70 70 LEU CA C 70 55.835 57.756 -1.921 1
1 797 . 12 1 1 A 70 70 LEU CB C 70 42.174 41.733 0.441 1
1 801 . 12 1 1 A 70 70 LEU N N 70 119.266 123.402 -4.136 1
1 802 . 12 1 1 A 71 71 GLN H H 71 7.865 8.104 -0.239 1
1 803 . 12 1 1 A 71 71 GLN HA H 71 4.287 4.396 -0.109 1
1 809 . 12 1 1 A 71 71 GLN C C 71 178.855 175.329 3.526 1
1 810 . 12 1 1 A 71 71 GLN CA C 71 56.383 55.124 1.259 1
1 811 . 12 1 1 A 71 71 GLN CB C 71 29.092 27.930 1.162 1
1 813 . 12 1 1 A 71 71 GLN N N 71 118.603 115.043 3.560 1
1 815 . 12 1 1 A 72 72 GLN H H 72 8.189 7.756 0.433 1
1 816 . 12 1 1 A 72 72 GLN HA H 72 4.302 4.526 -0.224 1
1 821 . 12 1 1 A 72 72 GLN CA C 72 56.206 54.399 1.807 1
1 822 . 12 1 1 A 72 72 GLN CB C 72 29.298 31.017 -1.719 1
1 824 . 12 1 1 A 72 72 GLN N N 72 120.267 121.348 -1.081 1
1 825 . 12 1 1 A 73 73 ARG C C 73 176.105 175.485 0.620 1
1 826 . 12 1 1 A 74 74 ARG HA H 74 4.334 4.275 0.059 1
1 833 . 12 1 1 A 74 74 ARG C C 74 176.188 177.189 -1.001 1
1 834 . 12 1 1 A 74 74 ARG CA C 74 56.300 56.846 -0.546 1
1 835 . 12 1 1 A 74 74 ARG CB C 74 30.668 30.439 0.229 1
1 838 . 12 1 1 A 75 75 ASN C C 75 174.462 174.418 0.044 1
1 839 . 12 1 1 A 75 75 ASN CA C 75 53.148 54.038 -0.890 1
1 840 . 12 1 1 A 75 75 ASN CB C 75 39.046 37.389 1.657 1
1 841 . 12 1 1 A 76 76 ASP H H 76 8.257 7.674 0.583 1
1 842 . 12 1 1 A 76 76 ASP HA H 76 4.877 4.956 -0.079 1
1 845 . 12 1 1 A 76 76 ASP C C 76 174.759 174.621 0.138 1
1 846 . 12 1 1 A 76 76 ASP CA C 76 52.380 51.378 1.002 1
1 847 . 12 1 1 A 76 76 ASP CB C 76 41.267 42.315 -1.048 1
1 848 . 12 1 1 A 76 76 ASP N N 76 122.030 119.053 2.977 1
1 849 . 12 1 1 A 77 77 PRO HA H 77 4.466 4.450 0.016 1
1 856 . 12 1 1 A 77 77 PRO C C 77 177.133 176.708 0.425 1
1 857 . 12 1 1 A 77 77 PRO CA C 77 63.733 62.446 1.287 1
1 858 . 12 1 1 A 77 77 PRO CB C 77 31.919 32.418 -0.499 1
1 861 . 12 1 1 A 78 78 SER H H 78 8.457 8.502 -0.045 1
1 862 . 12 1 1 A 78 78 SER HA H 78 4.479 4.252 0.227 1
1 865 . 12 1 1 A 78 78 SER C C 78 174.731 174.769 -0.038 1
1 866 . 12 1 1 A 78 78 SER CA C 78 58.691 59.304 -0.613 1
1 867 . 12 1 1 A 78 78 SER CB C 78 63.973 63.655 0.318 1
1 868 . 12 1 1 A 78 78 SER N N 78 115.711 117.463 -1.752 1
1 869 . 12 1 1 A 79 79 GLY H H 79 8.090 8.471 -0.381 1
1 870 . 12 1 1 A 79 79 GLY HA2 H 79 4.179 3.999 0.180 1
1 871 . 12 1 1 A 79 79 GLY HA3 H 79 4.065 4.001 0.064 1
1 872 . 12 1 1 A 79 79 GLY CA C 79 44.746 45.237 -0.491 1
1 873 . 12 1 1 A 79 79 GLY N N 79 110.429 113.263 -2.834 1
1 874 . 12 1 1 A 80 80 PRO HA H 80 4.464 4.374 0.090 1
1 880 . 12 1 1 A 80 80 PRO C C 80 177.499 178.155 -0.656 1
1 881 . 12 1 1 A 80 80 PRO CA C 80 63.275 64.789 -1.514 1
1 882 . 12 1 1 A 80 80 PRO CB C 80 32.249 31.902 0.347 1
1 1 . 13 1 1 A 13 13 ASN HA H 13 4.787 4.760 0.027 1
1 6 . 13 1 1 A 13 13 ASN CA C 13 53.148 53.679 -0.531 1
1 7 . 13 1 1 A 13 13 ASN CB C 13 39.378 39.485 -0.107 1
1 9 . 13 1 1 A 14 14 LEU H H 14 8.418 8.456 -0.038 1
1 10 . 13 1 1 A 14 14 LEU HA H 14 4.654 4.729 -0.075 1
1 20 . 13 1 1 A 14 14 LEU CA C 14 52.999 52.611 0.388 1
1 21 . 13 1 1 A 14 14 LEU CB C 14 41.919 41.124 0.795 1
1 25 . 13 1 1 A 14 14 LEU N N 14 122.671 121.545 1.126 1
1 26 . 13 1 1 A 15 15 PRO HA H 15 4.460 4.591 -0.131 1
1 33 . 13 1 1 A 15 15 PRO C C 15 178.156 177.609 0.547 1
1 34 . 13 1 1 A 15 15 PRO CA C 15 63.101 62.740 0.361 1
1 35 . 13 1 1 A 15 15 PRO CB C 15 32.304 32.703 -0.399 1
1 38 . 13 1 1 A 16 16 ALA H H 16 8.973 8.648 0.325 1
1 39 . 13 1 1 A 16 16 ALA HA H 16 4.021 3.980 0.041 1
1 43 . 13 1 1 A 16 16 ALA C C 16 180.695 179.442 1.253 1
1 44 . 13 1 1 A 16 16 ALA CA C 16 55.642 55.415 0.227 1
1 45 . 13 1 1 A 16 16 ALA CB C 16 18.552 18.619 -0.067 1
1 46 . 13 1 1 A 16 16 ALA N N 16 128.311 126.693 1.618 1
1 47 . 13 1 1 A 17 17 GLU H H 17 9.558 8.216 1.342 1
1 48 . 13 1 1 A 17 17 GLU HA H 17 4.065 4.087 -0.022 1
1 53 . 13 1 1 A 17 17 GLU C C 17 178.886 178.410 0.476 1
1 54 . 13 1 1 A 17 17 GLU CA C 17 59.400 59.333 0.067 1
1 55 . 13 1 1 A 17 17 GLU CB C 17 28.742 29.446 -0.704 1
1 57 . 13 1 1 A 17 17 GLU N N 17 117.113 117.139 -0.026 1
1 58 . 13 1 1 A 18 18 SER H H 18 7.263 7.782 -0.519 1
1 59 . 13 1 1 A 18 18 SER HA H 18 4.180 4.169 0.011 1
1 62 . 13 1 1 A 18 18 SER C C 18 174.951 177.078 -2.127 1
1 63 . 13 1 1 A 18 18 SER CA C 18 61.969 61.164 0.805 1
1 64 . 13 1 1 A 18 18 SER CB C 18 62.554 62.607 -0.053 1
1 65 . 13 1 1 A 18 18 SER N N 18 114.932 115.192 -0.260 1
1 66 . 13 1 1 A 19 19 VAL H H 19 7.620 8.179 -0.559 1
1 67 . 13 1 1 A 19 19 VAL HA H 19 3.011 3.152 -0.141 1
1 75 . 13 1 1 A 19 19 VAL C C 19 176.953 177.575 -0.622 1
1 76 . 13 1 1 A 19 19 VAL CA C 19 66.479 66.798 -0.319 1
1 77 . 13 1 1 A 19 19 VAL CB C 19 31.569 31.423 0.146 1
1 80 . 13 1 1 A 19 19 VAL N N 19 121.086 121.481 -0.395 1
1 81 . 13 1 1 A 20 20 LYS H H 20 7.745 8.234 -0.489 1
1 82 . 13 1 1 A 20 20 LYS HA H 20 3.884 3.997 -0.113 1
1 91 . 13 1 1 A 20 20 LYS C C 20 178.150 178.721 -0.571 1
1 92 . 13 1 1 A 20 20 LYS CA C 20 59.984 59.797 0.187 1
1 93 . 13 1 1 A 20 20 LYS CB C 20 32.351 32.171 0.180 1
1 97 . 13 1 1 A 20 20 LYS N N 20 119.366 119.646 -0.280 1
1 98 . 13 1 1 A 21 21 ILE H H 21 6.943 7.914 -0.971 1
1 99 . 13 1 1 A 21 21 ILE HA H 21 3.783 3.636 0.147 1
1 109 . 13 1 1 A 21 21 ILE C C 21 178.996 178.637 0.359 1
1 110 . 13 1 1 A 21 21 ILE CA C 21 64.642 65.808 -1.166 1
1 111 . 13 1 1 A 21 21 ILE CB C 21 38.014 38.049 -0.035 1
1 115 . 13 1 1 A 21 21 ILE N N 21 118.163 119.553 -1.390 1
1 116 . 13 1 1 A 22 22 LEU H H 22 7.267 7.913 -0.646 1
1 117 . 13 1 1 A 22 22 LEU HA H 22 3.748 3.808 -0.060 1
1 127 . 13 1 1 A 22 22 LEU C C 22 178.289 178.707 -0.418 1
1 128 . 13 1 1 A 22 22 LEU CA C 22 58.092 58.104 -0.012 1
1 129 . 13 1 1 A 22 22 LEU CB C 22 38.551 40.852 -2.301 1
1 133 . 13 1 1 A 22 22 LEU N N 22 120.609 119.150 1.459 1
1 134 . 13 1 1 A 23 23 ARG H H 23 8.676 8.655 0.021 1
1 135 . 13 1 1 A 23 23 ARG HA H 23 4.030 4.133 -0.103 1
1 142 . 13 1 1 A 23 23 ARG C C 23 178.861 178.313 0.548 1
1 143 . 13 1 1 A 23 23 ARG CA C 23 60.404 60.116 0.288 1
1 144 . 13 1 1 A 23 23 ARG CB C 23 30.351 30.174 0.177 1
1 147 . 13 1 1 A 23 23 ARG N N 23 119.148 117.547 1.601 1
1 148 . 13 1 1 A 24 24 ASP H H 24 8.515 8.313 0.202 1
1 149 . 13 1 1 A 24 24 ASP HA H 24 4.519 4.398 0.121 1
1 152 . 13 1 1 A 24 24 ASP C C 24 178.759 178.347 0.412 1
1 153 . 13 1 1 A 24 24 ASP CA C 24 57.556 57.215 0.341 1
1 154 . 13 1 1 A 24 24 ASP CB C 24 40.569 40.795 -0.226 1
1 155 . 13 1 1 A 24 24 ASP N N 24 120.027 119.332 0.695 1
1 156 . 13 1 1 A 25 25 TRP H H 25 8.158 8.034 0.124 1
1 157 . 13 1 1 A 25 25 TRP HA H 25 4.181 4.500 -0.319 1
1 166 . 13 1 1 A 25 25 TRP C C 25 179.946 178.607 1.339 1
1 167 . 13 1 1 A 25 25 TRP CA C 25 63.346 61.377 1.969 1
1 168 . 13 1 1 A 25 25 TRP CB C 25 29.433 29.733 -0.300 1
1 174 . 13 1 1 A 25 25 TRP N N 25 121.350 121.632 -0.282 1
1 176 . 13 1 1 A 26 26 MET H H 26 8.977 8.772 0.205 1
1 177 . 13 1 1 A 26 26 MET HA H 26 4.076 4.505 -0.429 1
1 185 . 13 1 1 A 26 26 MET C C 26 177.371 178.334 -0.963 1
1 186 . 13 1 1 A 26 26 MET CA C 26 60.454 58.888 1.566 1
1 187 . 13 1 1 A 26 26 MET CB C 26 33.567 33.375 0.192 1
1 190 . 13 1 1 A 26 26 MET N N 26 119.977 118.539 1.438 1
1 191 . 13 1 1 A 27 27 TYR H H 27 8.604 8.323 0.281 1
1 192 . 13 1 1 A 27 27 TYR HA H 27 4.138 4.269 -0.131 1
1 199 . 13 1 1 A 27 27 TYR C C 27 178.901 177.868 1.033 1
1 200 . 13 1 1 A 27 27 TYR CA C 27 61.846 61.398 0.448 1
1 201 . 13 1 1 A 27 27 TYR CB C 27 38.165 38.480 -0.315 1
1 206 . 13 1 1 A 27 27 TYR N N 27 117.797 121.379 -3.582 1
1 207 . 13 1 1 A 28 28 LYS H H 28 7.867 8.149 -0.282 1
1 208 . 13 1 1 A 28 28 LYS HA H 28 3.797 3.895 -0.098 1
1 217 . 13 1 1 A 28 28 LYS C C 28 176.858 177.772 -0.914 1
1 218 . 13 1 1 A 28 28 LYS CA C 28 58.174 59.184 -1.010 1
1 219 . 13 1 1 A 28 28 LYS CB C 28 32.516 32.261 0.255 1
1 223 . 13 1 1 A 28 28 LYS N N 28 118.982 118.519 0.463 1
1 224 . 13 1 1 A 29 29 HIS H H 29 7.443 7.411 0.032 1
1 225 . 13 1 1 A 29 29 HIS HA H 29 4.386 4.506 -0.120 1
1 230 . 13 1 1 A 29 29 HIS C C 29 176.085 175.827 0.258 1
1 231 . 13 1 1 A 29 29 HIS CA C 29 55.213 55.193 0.020 1
1 232 . 13 1 1 A 29 29 HIS CB C 29 27.085 29.105 -2.020 1
1 235 . 13 1 1 A 29 29 HIS N N 29 117.138 115.339 1.799 1
1 236 . 13 1 1 A 30 30 ARG H H 30 6.921 8.244 -1.323 1
1 237 . 13 1 1 A 30 30 ARG HA H 30 3.898 4.392 -0.494 1
1 244 . 13 1 1 A 30 30 ARG C C 30 175.808 178.150 -2.342 1
1 245 . 13 1 1 A 30 30 ARG CA C 30 58.609 58.691 -0.082 1
1 246 . 13 1 1 A 30 30 ARG CB C 30 28.739 29.720 -0.981 1
1 249 . 13 1 1 A 30 30 ARG N N 30 117.911 119.626 -1.715 1
1 250 . 13 1 1 A 31 31 PHE H H 31 7.819 7.988 -0.169 1
1 251 . 13 1 1 A 31 31 PHE HA H 31 4.533 4.132 0.401 1
1 259 . 13 1 1 A 31 31 PHE C C 31 175.577 177.563 -1.986 1
1 260 . 13 1 1 A 31 31 PHE CA C 31 58.029 61.477 -3.448 1
1 261 . 13 1 1 A 31 31 PHE CB C 31 37.792 39.389 -1.597 1
1 267 . 13 1 1 A 31 31 PHE N N 31 115.408 121.310 -5.902 1
1 268 . 13 1 1 A 32 32 LYS H H 32 7.858 8.156 -0.298 1
1 269 . 13 1 1 A 32 32 LYS HA H 32 4.487 4.195 0.292 1
1 277 . 13 1 1 A 32 32 LYS C C 32 175.557 176.406 -0.849 1
1 278 . 13 1 1 A 32 32 LYS CA C 32 56.329 57.761 -1.432 1
1 279 . 13 1 1 A 32 32 LYS CB C 32 32.743 34.217 -1.474 1
1 283 . 13 1 1 A 32 32 LYS N N 32 122.453 115.527 6.926 1
1 284 . 13 1 1 A 33 33 ALA H H 33 8.643 8.418 0.225 1
1 285 . 13 1 1 A 33 33 ALA HA H 33 4.403 4.183 0.220 1
1 289 . 13 1 1 A 33 33 ALA C C 33 176.273 175.589 0.684 1
1 290 . 13 1 1 A 33 33 ALA CA C 33 53.579 53.283 0.296 1
1 291 . 13 1 1 A 33 33 ALA CB C 33 18.653 17.096 1.557 1
1 292 . 13 1 1 A 33 33 ALA N N 33 127.853 119.849 8.004 1
1 293 . 13 1 1 A 34 34 TYR H H 34 7.878 8.037 -0.159 1
1 294 . 13 1 1 A 34 34 TYR HA H 34 4.686 5.016 -0.330 1
1 301 . 13 1 1 A 34 34 TYR C C 34 173.133 173.037 0.096 1
1 302 . 13 1 1 A 34 34 TYR CA C 34 54.778 54.922 -0.144 1
1 303 . 13 1 1 A 34 34 TYR CB C 34 39.619 38.693 0.926 1
1 308 . 13 1 1 A 34 34 TYR N N 34 116.539 117.879 -1.340 1
1 309 . 13 1 1 A 35 35 PRO HA H 35 4.526 4.396 0.130 1
1 316 . 13 1 1 A 35 35 PRO C C 35 176.837 176.201 0.636 1
1 317 . 13 1 1 A 35 35 PRO CA C 35 61.864 62.718 -0.854 1
1 318 . 13 1 1 A 35 35 PRO CB C 35 30.904 31.234 -0.330 1
1 321 . 13 1 1 A 36 36 SER H H 36 9.634 8.452 1.182 1
1 322 . 13 1 1 A 36 36 SER HA H 36 4.518 4.647 -0.129 1
1 325 . 13 1 1 A 36 36 SER C C 36 175.001 175.487 -0.486 1
1 326 . 13 1 1 A 36 36 SER CA C 36 57.129 57.473 -0.344 1
1 327 . 13 1 1 A 36 36 SER CB C 36 65.374 64.539 0.835 1
1 328 . 13 1 1 A 36 36 SER N N 36 119.984 117.561 2.423 1
1 329 . 13 1 1 A 37 37 GLU H H 37 9.091 8.873 0.218 1
1 330 . 13 1 1 A 37 37 GLU HA H 37 3.884 3.905 -0.021 1
1 335 . 13 1 1 A 37 37 GLU C C 37 179.347 178.695 0.652 1
1 336 . 13 1 1 A 37 37 GLU CA C 37 60.454 59.794 0.660 1
1 337 . 13 1 1 A 37 37 GLU CB C 37 28.623 29.375 -0.752 1
1 339 . 13 1 1 A 37 37 GLU N N 37 120.748 126.140 -5.392 1
1 340 . 13 1 1 A 38 38 GLU H H 38 8.760 8.382 0.378 1
1 341 . 13 1 1 A 38 38 GLU HA H 38 4.048 4.016 0.032 1
1 346 . 13 1 1 A 38 38 GLU C C 38 179.975 178.621 1.354 1
1 347 . 13 1 1 A 38 38 GLU CA C 38 60.243 59.505 0.738 1
1 348 . 13 1 1 A 38 38 GLU CB C 38 29.117 29.049 0.068 1
1 350 . 13 1 1 A 38 38 GLU N N 38 119.272 119.474 -0.202 1
1 351 . 13 1 1 A 39 39 GLU H H 39 7.856 8.165 -0.309 1
1 352 . 13 1 1 A 39 39 GLU HA H 39 3.976 3.875 0.101 1
1 357 . 13 1 1 A 39 39 GLU C C 39 178.912 178.836 0.076 1
1 358 . 13 1 1 A 39 39 GLU CA C 39 59.131 59.196 -0.065 1
1 359 . 13 1 1 A 39 39 GLU CB C 39 29.612 28.787 0.825 1
1 361 . 13 1 1 A 39 39 GLU N N 39 121.658 118.420 3.238 1
1 362 . 13 1 1 A 40 40 LYS H H 40 8.653 7.791 0.862 1
1 363 . 13 1 1 A 40 40 LYS HA H 40 3.508 3.806 -0.298 1
1 372 . 13 1 1 A 40 40 LYS C C 40 177.974 178.918 -0.944 1
1 373 . 13 1 1 A 40 40 LYS CA C 40 60.948 59.617 1.331 1
1 374 . 13 1 1 A 40 40 LYS CB C 40 32.714 32.152 0.562 1
1 378 . 13 1 1 A 40 40 LYS N N 40 119.152 119.711 -0.559 1
1 379 . 13 1 1 A 41 41 GLN H H 41 7.876 7.832 0.044 1
1 380 . 13 1 1 A 41 41 GLN HA H 41 3.911 3.952 -0.041 1
1 387 . 13 1 1 A 41 41 GLN C C 41 178.352 178.223 0.129 1
1 388 . 13 1 1 A 41 41 GLN CA C 41 58.973 58.982 -0.009 1
1 389 . 13 1 1 A 41 41 GLN CB C 41 27.552 28.680 -1.128 1
1 391 . 13 1 1 A 41 41 GLN N N 41 118.910 119.493 -0.583 1
1 393 . 13 1 1 A 42 42 MET H H 42 7.771 8.133 -0.362 1
1 394 . 13 1 1 A 42 42 MET HA H 42 4.158 4.194 -0.036 1
1 402 . 13 1 1 A 42 42 MET C C 42 179.310 178.232 1.078 1
1 403 . 13 1 1 A 42 42 MET CA C 42 59.079 58.359 0.720 1
1 404 . 13 1 1 A 42 42 MET CB C 42 31.023 32.382 -1.359 1
1 407 . 13 1 1 A 42 42 MET N N 42 121.131 119.169 1.962 1
1 408 . 13 1 1 A 43 43 LEU H H 43 8.400 8.483 -0.083 1
1 409 . 13 1 1 A 43 43 LEU HA H 43 3.888 3.963 -0.075 1
1 419 . 13 1 1 A 43 43 LEU C C 43 180.721 178.982 1.739 1
1 420 . 13 1 1 A 43 43 LEU CA C 43 57.916 58.128 -0.212 1
1 421 . 13 1 1 A 43 43 LEU CB C 43 42.080 41.266 0.814 1
1 425 . 13 1 1 A 43 43 LEU N N 43 120.124 120.778 -0.654 1
1 426 . 13 1 1 A 44 44 SER H H 44 8.658 8.521 0.137 1
1 427 . 13 1 1 A 44 44 SER HA H 44 4.088 4.369 -0.281 1
1 430 . 13 1 1 A 44 44 SER C C 44 176.859 176.686 0.173 1
1 431 . 13 1 1 A 44 44 SER CA C 44 61.371 61.043 0.328 1
1 432 . 13 1 1 A 44 44 SER CB C 44 63.314 63.039 0.275 1
1 433 . 13 1 1 A 44 44 SER N N 44 119.795 113.660 6.135 1
1 434 . 13 1 1 A 45 45 GLU H H 45 7.905 7.904 0.001 1
1 435 . 13 1 1 A 45 45 GLU HA H 45 4.094 4.149 -0.055 1
1 440 . 13 1 1 A 45 45 GLU C C 45 179.095 178.896 0.199 1
1 441 . 13 1 1 A 45 45 GLU CA C 45 59.255 58.907 0.348 1
1 442 . 13 1 1 A 45 45 GLU CB C 45 29.200 29.323 -0.123 1
1 444 . 13 1 1 A 45 45 GLU N N 45 120.609 121.010 -0.401 1
1 445 . 13 1 1 A 46 46 LYS H H 46 7.837 8.228 -0.391 1
1 446 . 13 1 1 A 46 46 LYS HA H 46 4.231 4.201 0.030 1
1 453 . 13 1 1 A 46 46 LYS C C 46 177.964 178.335 -0.371 1
1 454 . 13 1 1 A 46 46 LYS CA C 46 58.278 58.456 -0.178 1
1 455 . 13 1 1 A 46 46 LYS CB C 46 34.110 32.973 1.137 1
1 459 . 13 1 1 A 46 46 LYS N N 46 115.471 118.776 -3.305 1
1 460 . 13 1 1 A 47 47 THR H H 47 7.763 8.059 -0.296 1
1 461 . 13 1 1 A 47 47 THR HA H 47 4.271 4.236 0.035 1
1 466 . 13 1 1 A 47 47 THR C C 47 175.472 175.185 0.287 1
1 467 . 13 1 1 A 47 47 THR CA C 47 62.429 62.394 0.035 1
1 468 . 13 1 1 A 47 47 THR CB C 47 71.966 70.181 1.785 1
1 470 . 13 1 1 A 47 47 THR N N 47 104.286 108.313 -4.027 1
1 471 . 13 1 1 A 48 48 ASN H H 48 8.169 8.644 -0.475 1
1 472 . 13 1 1 A 48 48 ASN HA H 48 4.437 4.521 -0.084 1
1 477 . 13 1 1 A 48 48 ASN C C 48 173.874 173.938 -0.064 1
1 478 . 13 1 1 A 48 48 ASN CA C 48 55.377 54.343 1.034 1
1 479 . 13 1 1 A 48 48 ASN CB C 48 37.770 37.485 0.285 1
1 480 . 13 1 1 A 48 48 ASN N N 48 117.458 119.662 -2.204 1
1 482 . 13 1 1 A 49 49 LEU H H 49 7.532 7.177 0.355 1
1 483 . 13 1 1 A 49 49 LEU HA H 49 4.733 4.714 0.019 1
1 493 . 13 1 1 A 49 49 LEU C C 49 176.625 175.667 0.958 1
1 494 . 13 1 1 A 49 49 LEU CA C 49 53.226 53.502 -0.276 1
1 495 . 13 1 1 A 49 49 LEU CB C 49 44.114 43.064 1.050 1
1 499 . 13 1 1 A 49 49 LEU N N 49 118.220 120.249 -2.029 1
1 500 . 13 1 1 A 50 50 SER H H 50 9.140 8.798 0.342 1
1 501 . 13 1 1 A 50 50 SER HA H 50 4.475 4.774 -0.299 1
1 504 . 13 1 1 A 50 50 SER C C 50 174.907 175.052 -0.145 1
1 505 . 13 1 1 A 50 50 SER CA C 50 56.964 58.127 -1.163 1
1 506 . 13 1 1 A 50 50 SER CB C 50 65.372 64.825 0.547 1
1 507 . 13 1 1 A 50 50 SER N N 50 117.569 117.550 0.019 1
1 508 . 13 1 1 A 51 51 LEU H H 51 8.756 8.755 0.001 1
1 509 . 13 1 1 A 51 51 LEU HA H 51 3.874 3.905 -0.031 1
1 519 . 13 1 1 A 51 51 LEU C C 51 179.910 178.863 1.047 1
1 520 . 13 1 1 A 51 51 LEU CA C 51 58.916 58.095 0.821 1
1 521 . 13 1 1 A 51 51 LEU CB C 51 41.148 41.278 -0.130 1
1 525 . 13 1 1 A 51 51 LEU N N 51 120.905 125.499 -4.594 1
1 526 . 13 1 1 A 52 52 LEU H H 52 8.146 8.328 -0.182 1
1 527 . 13 1 1 A 52 52 LEU HA H 52 4.179 4.049 0.130 1
1 537 . 13 1 1 A 52 52 LEU C C 52 178.936 178.756 0.180 1
1 538 . 13 1 1 A 52 52 LEU CA C 52 58.162 58.382 -0.220 1
1 539 . 13 1 1 A 52 52 LEU CB C 52 42.137 41.785 0.352 1
1 543 . 13 1 1 A 52 52 LEU N N 52 120.685 120.259 0.426 1
1 544 . 13 1 1 A 53 53 GLN H H 53 7.924 8.041 -0.117 1
1 545 . 13 1 1 A 53 53 GLN HA H 53 4.102 4.143 -0.041 1
1 552 . 13 1 1 A 53 53 GLN C C 53 180.308 178.489 1.819 1
1 553 . 13 1 1 A 53 53 GLN CA C 53 59.326 58.352 0.974 1
1 554 . 13 1 1 A 53 53 GLN CB C 53 29.900 28.474 1.426 1
1 556 . 13 1 1 A 53 53 GLN N N 53 118.473 117.503 0.970 1
1 558 . 13 1 1 A 54 54 ILE H H 54 8.380 8.405 -0.025 1
1 559 . 13 1 1 A 54 54 ILE HA H 54 3.677 3.785 -0.108 1
1 569 . 13 1 1 A 54 54 ILE C C 54 177.673 178.112 -0.439 1
1 570 . 13 1 1 A 54 54 ILE CA C 54 64.650 65.264 -0.614 1
1 571 . 13 1 1 A 54 54 ILE CB C 54 37.476 37.818 -0.342 1
1 575 . 13 1 1 A 54 54 ILE N N 54 120.113 121.462 -1.349 1
1 576 . 13 1 1 A 55 55 SER H H 55 8.854 7.986 0.868 1
1 577 . 13 1 1 A 55 55 SER HA H 55 4.267 4.258 0.009 1
1 580 . 13 1 1 A 55 55 SER C C 55 177.127 177.025 0.102 1
1 581 . 13 1 1 A 55 55 SER CA C 55 62.852 62.301 0.551 1
1 582 . 13 1 1 A 55 55 SER CB C 55 62.727 62.976 -0.249 1
1 583 . 13 1 1 A 55 55 SER N N 55 116.646 116.055 0.591 1
1 584 . 13 1 1 A 56 56 ASN H H 56 8.634 8.288 0.346 1
1 585 . 13 1 1 A 56 56 ASN HA H 56 4.549 4.447 0.102 1
1 590 . 13 1 1 A 56 56 ASN C C 56 177.481 178.297 -0.816 1
1 591 . 13 1 1 A 56 56 ASN CA C 56 55.951 56.540 -0.589 1
1 592 . 13 1 1 A 56 56 ASN CB C 56 37.852 38.434 -0.582 1
1 593 . 13 1 1 A 56 56 ASN N N 56 119.048 119.806 -0.758 1
1 595 . 13 1 1 A 57 57 TRP H H 57 8.373 8.281 0.092 1
1 596 . 13 1 1 A 57 57 TRP HA H 57 4.065 4.358 -0.293 1
1 605 . 13 1 1 A 57 57 TRP C C 57 179.392 178.242 1.150 1
1 606 . 13 1 1 A 57 57 TRP CA C 57 63.204 61.396 1.808 1
1 607 . 13 1 1 A 57 57 TRP CB C 57 28.376 29.334 -0.958 1
1 613 . 13 1 1 A 57 57 TRP N N 57 122.950 123.292 -0.342 1
1 615 . 13 1 1 A 58 58 PHE H H 58 8.428 8.480 -0.052 1
1 616 . 13 1 1 A 58 58 PHE HA H 58 3.922 4.081 -0.159 1
1 624 . 13 1 1 A 58 58 PHE C C 58 178.237 178.004 0.233 1
1 625 . 13 1 1 A 58 58 PHE CA C 58 64.015 61.828 2.187 1
1 626 . 13 1 1 A 58 58 PHE CB C 58 39.602 38.664 0.938 1
1 632 . 13 1 1 A 58 58 PHE N N 58 116.774 118.114 -1.340 1
1 633 . 13 1 1 A 59 59 ILE H H 59 7.925 8.151 -0.226 1
1 634 . 13 1 1 A 59 59 ILE HA H 59 3.773 3.648 0.125 1
1 644 . 13 1 1 A 59 59 ILE C C 59 178.745 177.561 1.184 1
1 645 . 13 1 1 A 59 59 ILE CA C 59 65.531 65.105 0.426 1
1 646 . 13 1 1 A 59 59 ILE CB C 59 38.480 37.631 0.849 1
1 650 . 13 1 1 A 59 59 ILE N N 59 119.560 120.332 -0.772 1
1 651 . 13 1 1 A 60 60 ASN H H 60 7.506 8.054 -0.548 1
1 652 . 13 1 1 A 60 60 ASN HA H 60 4.407 4.358 0.049 1
1 657 . 13 1 1 A 60 60 ASN C C 60 177.163 177.820 -0.657 1
1 658 . 13 1 1 A 60 60 ASN CA C 60 55.871 56.186 -0.315 1
1 659 . 13 1 1 A 60 60 ASN CB C 60 38.878 37.945 0.933 1
1 660 . 13 1 1 A 60 60 ASN N N 60 116.868 117.859 -0.991 1
1 662 . 13 1 1 A 61 61 ALA H H 61 8.410 7.778 0.632 1
1 663 . 13 1 1 A 61 61 ALA HA H 61 3.667 3.786 -0.119 1
1 667 . 13 1 1 A 61 61 ALA C C 61 180.061 179.817 0.244 1
1 668 . 13 1 1 A 61 61 ALA CA C 61 54.601 54.607 -0.006 1
1 669 . 13 1 1 A 61 61 ALA CB C 61 18.241 17.272 0.969 1
1 670 . 13 1 1 A 61 61 ALA N N 61 123.022 121.921 1.101 1
1 671 . 13 1 1 A 62 62 ARG H H 62 8.036 8.196 -0.160 1
1 672 . 13 1 1 A 62 62 ARG HA H 62 4.092 4.091 0.001 1
1 679 . 13 1 1 A 62 62 ARG C C 62 176.756 177.378 -0.622 1
1 680 . 13 1 1 A 62 62 ARG CA C 62 58.762 58.060 0.702 1
1 681 . 13 1 1 A 62 62 ARG CB C 62 30.601 30.109 0.492 1
1 684 . 13 1 1 A 62 62 ARG N N 62 117.168 118.874 -1.706 1
1 685 . 13 1 1 A 63 63 ARG H H 63 7.214 7.833 -0.619 1
1 686 . 13 1 1 A 63 63 ARG HA H 63 4.249 4.422 -0.173 1
1 693 . 13 1 1 A 63 63 ARG C C 63 176.945 176.633 0.312 1
1 694 . 13 1 1 A 63 63 ARG CA C 63 57.669 56.562 1.107 1
1 695 . 13 1 1 A 63 63 ARG CB C 63 30.765 31.122 -0.357 1
1 698 . 13 1 1 A 63 63 ARG N N 63 116.514 118.450 -1.936 1
1 699 . 13 1 1 A 64 64 ARG H H 64 7.913 7.826 0.087 1
1 700 . 13 1 1 A 64 64 ARG HA H 64 4.351 4.599 -0.248 1
1 707 . 13 1 1 A 64 64 ARG C C 64 176.413 178.539 -2.126 1
1 708 . 13 1 1 A 64 64 ARG CA C 64 57.105 57.252 -0.147 1
1 709 . 13 1 1 A 64 64 ARG CB C 64 31.672 32.879 -1.207 1
1 712 . 13 1 1 A 64 64 ARG N N 64 116.818 119.105 -2.287 1
1 713 . 13 1 1 A 65 65 ILE H H 65 8.169 8.152 0.017 1
1 714 . 13 1 1 A 65 65 ILE HA H 65 4.285 3.596 0.689 1
1 724 . 13 1 1 A 65 65 ILE C C 65 176.208 177.870 -1.662 1
1 725 . 13 1 1 A 65 65 ILE CA C 65 62.005 65.583 -3.578 1
1 726 . 13 1 1 A 65 65 ILE CB C 65 39.088 37.901 1.187 1
1 730 . 13 1 1 A 65 65 ILE N N 65 119.185 119.752 -0.567 1
1 731 . 13 1 1 A 66 66 LEU H H 66 7.962 7.999 -0.037 1
1 732 . 13 1 1 A 66 66 LEU HA H 66 4.485 4.076 0.409 1
1 742 . 13 1 1 A 66 66 LEU C C 66 176.216 175.300 0.916 1
1 743 . 13 1 1 A 66 66 LEU CA C 66 56.153 59.860 -3.707 1
1 744 . 13 1 1 A 66 66 LEU CB C 66 40.792 40.043 0.749 1
1 748 . 13 1 1 A 66 66 LEU N N 66 124.389 121.700 2.689 1
1 749 . 13 1 1 A 67 67 PRO HA H 67 4.283 4.393 -0.110 1
1 756 . 13 1 1 A 67 67 PRO C C 67 178.294 178.224 0.070 1
1 757 . 13 1 1 A 67 67 PRO CA C 67 65.390 64.897 0.493 1
1 758 . 13 1 1 A 67 67 PRO CB C 67 31.095 31.345 -0.250 1
1 761 . 13 1 1 A 68 68 ASP H H 68 7.913 8.662 -0.749 1
1 762 . 13 1 1 A 68 68 ASP HA H 68 4.507 4.464 0.043 1
1 765 . 13 1 1 A 68 68 ASP C C 68 177.927 178.193 -0.266 1
1 766 . 13 1 1 A 68 68 ASP CA C 68 55.906 56.718 -0.812 1
1 767 . 13 1 1 A 68 68 ASP CB C 68 40.736 40.999 -0.263 1
1 768 . 13 1 1 A 68 68 ASP N N 68 117.231 118.281 -1.050 1
1 769 . 13 1 1 A 69 69 MET H H 69 8.083 8.488 -0.405 1
1 770 . 13 1 1 A 69 69 MET HA H 69 4.362 4.246 0.116 1
1 778 . 13 1 1 A 69 69 MET C C 69 177.374 178.807 -1.433 1
1 779 . 13 1 1 A 69 69 MET CA C 69 57.634 58.768 -1.134 1
1 780 . 13 1 1 A 69 69 MET CB C 69 32.816 32.486 0.330 1
1 783 . 13 1 1 A 69 69 MET N N 69 119.391 118.727 0.664 1
1 784 . 13 1 1 A 70 70 LEU H H 70 7.907 8.161 -0.254 1
1 785 . 13 1 1 A 70 70 LEU HA H 70 4.232 3.829 0.403 1
1 795 . 13 1 1 A 70 70 LEU C C 70 177.745 177.779 -0.034 1
1 796 . 13 1 1 A 70 70 LEU CA C 70 55.835 58.226 -2.391 1
1 797 . 13 1 1 A 70 70 LEU CB C 70 42.174 41.495 0.679 1
1 801 . 13 1 1 A 70 70 LEU N N 70 119.266 121.241 -1.975 1
1 802 . 13 1 1 A 71 71 GLN H H 71 7.865 7.715 0.150 1
1 803 . 13 1 1 A 71 71 GLN HA H 71 4.287 4.330 -0.043 1
1 809 . 13 1 1 A 71 71 GLN C C 71 178.855 176.168 2.687 1
1 810 . 13 1 1 A 71 71 GLN CA C 71 56.383 55.828 0.555 1
1 811 . 13 1 1 A 71 71 GLN CB C 71 29.092 29.635 -0.543 1
1 813 . 13 1 1 A 71 71 GLN N N 71 118.603 118.745 -0.142 1
1 815 . 13 1 1 A 72 72 GLN H H 72 8.189 8.851 -0.662 1
1 816 . 13 1 1 A 72 72 GLN HA H 72 4.302 3.898 0.404 1
1 821 . 13 1 1 A 72 72 GLN CA C 72 56.206 56.881 -0.675 1
1 822 . 13 1 1 A 72 72 GLN CB C 72 29.298 27.020 2.278 1
1 824 . 13 1 1 A 72 72 GLN N N 72 120.267 117.174 3.093 1
1 825 . 13 1 1 A 73 73 ARG C C 73 176.105 175.267 0.838 1
1 826 . 13 1 1 A 74 74 ARG HA H 74 4.334 4.548 -0.214 1
1 833 . 13 1 1 A 74 74 ARG C C 74 176.188 176.398 -0.210 1
1 834 . 13 1 1 A 74 74 ARG CA C 74 56.300 55.612 0.688 1
1 835 . 13 1 1 A 74 74 ARG CB C 74 30.668 29.583 1.085 1
1 838 . 13 1 1 A 75 75 ASN C C 75 174.462 174.314 0.148 1
1 839 . 13 1 1 A 75 75 ASN CA C 75 53.148 53.423 -0.275 1
1 840 . 13 1 1 A 75 75 ASN CB C 75 39.046 39.141 -0.095 1
1 841 . 13 1 1 A 76 76 ASP H H 76 8.257 8.738 -0.481 1
1 842 . 13 1 1 A 76 76 ASP HA H 76 4.877 5.098 -0.221 1
1 845 . 13 1 1 A 76 76 ASP C C 76 174.759 174.004 0.755 1
1 846 . 13 1 1 A 76 76 ASP CA C 76 52.380 50.565 1.815 1
1 847 . 13 1 1 A 76 76 ASP CB C 76 41.267 42.432 -1.165 1
1 848 . 13 1 1 A 76 76 ASP N N 76 122.030 124.470 -2.440 1
1 849 . 13 1 1 A 77 77 PRO HA H 77 4.466 4.640 -0.174 1
1 856 . 13 1 1 A 77 77 PRO C C 77 177.133 176.307 0.826 1
1 857 . 13 1 1 A 77 77 PRO CA C 77 63.733 62.411 1.322 1
1 858 . 13 1 1 A 77 77 PRO CB C 77 31.919 32.604 -0.685 1
1 861 . 13 1 1 A 78 78 SER H H 78 8.457 8.453 0.004 1
1 862 . 13 1 1 A 78 78 SER HA H 78 4.479 4.787 -0.308 1
1 865 . 13 1 1 A 78 78 SER C C 78 174.731 175.123 -0.392 1
1 866 . 13 1 1 A 78 78 SER CA C 78 58.691 56.684 2.007 1
1 867 . 13 1 1 A 78 78 SER CB C 78 63.973 65.713 -1.740 1
1 868 . 13 1 1 A 78 78 SER N N 78 115.711 114.720 0.991 1
1 869 . 13 1 1 A 79 79 GLY H H 79 8.090 8.450 -0.360 1
1 870 . 13 1 1 A 79 79 GLY HA2 H 79 4.179 4.043 0.136 1
1 871 . 13 1 1 A 79 79 GLY HA3 H 79 4.065 4.043 0.022 1
1 872 . 13 1 1 A 79 79 GLY CA C 79 44.746 44.919 -0.173 1
1 873 . 13 1 1 A 79 79 GLY N N 79 110.429 108.398 2.031 1
1 874 . 13 1 1 A 80 80 PRO HA H 80 4.464 4.532 -0.068 1
1 880 . 13 1 1 A 80 80 PRO C C 80 177.499 176.724 0.775 1
1 881 . 13 1 1 A 80 80 PRO CA C 80 63.275 63.589 -0.314 1
1 882 . 13 1 1 A 80 80 PRO CB C 80 32.249 32.281 -0.032 1
1 1 . 14 1 1 A 13 13 ASN HA H 13 4.787 5.531 -0.744 1
1 6 . 14 1 1 A 13 13 ASN CA C 13 53.148 51.827 1.321 1
1 7 . 14 1 1 A 13 13 ASN CB C 13 39.378 41.925 -2.547 1
1 9 . 14 1 1 A 14 14 LEU H H 14 8.418 8.879 -0.461 1
1 10 . 14 1 1 A 14 14 LEU HA H 14 4.654 4.740 -0.086 1
1 20 . 14 1 1 A 14 14 LEU CA C 14 52.999 52.027 0.972 1
1 21 . 14 1 1 A 14 14 LEU CB C 14 41.919 42.167 -0.248 1
1 25 . 14 1 1 A 14 14 LEU N N 14 122.671 122.340 0.331 1
1 26 . 14 1 1 A 15 15 PRO HA H 15 4.460 4.558 -0.098 1
1 33 . 14 1 1 A 15 15 PRO C C 15 178.156 177.510 0.646 1
1 34 . 14 1 1 A 15 15 PRO CA C 15 63.101 62.676 0.425 1
1 35 . 14 1 1 A 15 15 PRO CB C 15 32.304 32.675 -0.371 1
1 38 . 14 1 1 A 16 16 ALA H H 16 8.973 8.634 0.339 1
1 39 . 14 1 1 A 16 16 ALA HA H 16 4.021 3.950 0.071 1
1 43 . 14 1 1 A 16 16 ALA C C 16 180.695 179.740 0.955 1
1 44 . 14 1 1 A 16 16 ALA CA C 16 55.642 55.572 0.070 1
1 45 . 14 1 1 A 16 16 ALA CB C 16 18.552 18.761 -0.209 1
1 46 . 14 1 1 A 16 16 ALA N N 16 128.311 126.484 1.827 1
1 47 . 14 1 1 A 17 17 GLU H H 17 9.558 8.437 1.121 1
1 48 . 14 1 1 A 17 17 GLU HA H 17 4.065 3.997 0.068 1
1 53 . 14 1 1 A 17 17 GLU C C 17 178.886 178.524 0.362 1
1 54 . 14 1 1 A 17 17 GLU CA C 17 59.400 59.913 -0.513 1
1 55 . 14 1 1 A 17 17 GLU CB C 17 28.742 29.514 -0.772 1
1 57 . 14 1 1 A 17 17 GLU N N 17 117.113 118.736 -1.623 1
1 58 . 14 1 1 A 18 18 SER H H 18 7.263 7.535 -0.272 1
1 59 . 14 1 1 A 18 18 SER HA H 18 4.180 4.127 0.053 1
1 62 . 14 1 1 A 18 18 SER C C 18 174.951 177.020 -2.069 1
1 63 . 14 1 1 A 18 18 SER CA C 18 61.969 61.589 0.380 1
1 64 . 14 1 1 A 18 18 SER CB C 18 62.554 63.063 -0.509 1
1 65 . 14 1 1 A 18 18 SER N N 18 114.932 114.055 0.877 1
1 66 . 14 1 1 A 19 19 VAL H H 19 7.620 8.247 -0.627 1
1 67 . 14 1 1 A 19 19 VAL HA H 19 3.011 3.148 -0.137 1
1 75 . 14 1 1 A 19 19 VAL C C 19 176.953 177.704 -0.751 1
1 76 . 14 1 1 A 19 19 VAL CA C 19 66.479 66.813 -0.334 1
1 77 . 14 1 1 A 19 19 VAL CB C 19 31.569 31.469 0.100 1
1 80 . 14 1 1 A 19 19 VAL N N 19 121.086 120.948 0.138 1
1 81 . 14 1 1 A 20 20 LYS H H 20 7.745 8.367 -0.622 1
1 82 . 14 1 1 A 20 20 LYS HA H 20 3.884 3.986 -0.102 1
1 91 . 14 1 1 A 20 20 LYS C C 20 178.150 178.841 -0.691 1
1 92 . 14 1 1 A 20 20 LYS CA C 20 59.984 59.736 0.248 1
1 93 . 14 1 1 A 20 20 LYS CB C 20 32.351 32.174 0.177 1
1 97 . 14 1 1 A 20 20 LYS N N 20 119.366 119.632 -0.266 1
1 98 . 14 1 1 A 21 21 ILE H H 21 6.943 7.610 -0.667 1
1 99 . 14 1 1 A 21 21 ILE HA H 21 3.783 3.661 0.122 1
1 109 . 14 1 1 A 21 21 ILE C C 21 178.996 178.660 0.336 1
1 110 . 14 1 1 A 21 21 ILE CA C 21 64.642 65.822 -1.180 1
1 111 . 14 1 1 A 21 21 ILE CB C 21 38.014 38.013 0.001 1
1 115 . 14 1 1 A 21 21 ILE N N 21 118.163 119.957 -1.794 1
1 116 . 14 1 1 A 22 22 LEU H H 22 7.267 7.899 -0.632 1
1 117 . 14 1 1 A 22 22 LEU HA H 22 3.748 3.858 -0.110 1
1 127 . 14 1 1 A 22 22 LEU C C 22 178.289 178.723 -0.434 1
1 128 . 14 1 1 A 22 22 LEU CA C 22 58.092 58.145 -0.053 1
1 129 . 14 1 1 A 22 22 LEU CB C 22 38.551 40.779 -2.228 1
1 133 . 14 1 1 A 22 22 LEU N N 22 120.609 119.116 1.493 1
1 134 . 14 1 1 A 23 23 ARG H H 23 8.676 8.699 -0.023 1
1 135 . 14 1 1 A 23 23 ARG HA H 23 4.030 4.144 -0.114 1
1 142 . 14 1 1 A 23 23 ARG C C 23 178.861 178.311 0.550 1
1 143 . 14 1 1 A 23 23 ARG CA C 23 60.404 60.065 0.339 1
1 144 . 14 1 1 A 23 23 ARG CB C 23 30.351 30.164 0.187 1
1 147 . 14 1 1 A 23 23 ARG N N 23 119.148 117.643 1.505 1
1 148 . 14 1 1 A 24 24 ASP H H 24 8.515 8.249 0.266 1
1 149 . 14 1 1 A 24 24 ASP HA H 24 4.519 4.408 0.111 1
1 152 . 14 1 1 A 24 24 ASP C C 24 178.759 178.528 0.231 1
1 153 . 14 1 1 A 24 24 ASP CA C 24 57.556 57.220 0.336 1
1 154 . 14 1 1 A 24 24 ASP CB C 24 40.569 40.892 -0.323 1
1 155 . 14 1 1 A 24 24 ASP N N 24 120.027 119.283 0.744 1
1 156 . 14 1 1 A 25 25 TRP H H 25 8.158 7.914 0.244 1
1 157 . 14 1 1 A 25 25 TRP HA H 25 4.181 4.470 -0.289 1
1 166 . 14 1 1 A 25 25 TRP C C 25 179.946 178.590 1.356 1
1 167 . 14 1 1 A 25 25 TRP CA C 25 63.346 61.380 1.966 1
1 168 . 14 1 1 A 25 25 TRP CB C 25 29.433 29.687 -0.254 1
1 174 . 14 1 1 A 25 25 TRP N N 25 121.350 121.743 -0.393 1
1 176 . 14 1 1 A 26 26 MET H H 26 8.977 8.739 0.238 1
1 177 . 14 1 1 A 26 26 MET HA H 26 4.076 4.566 -0.490 1
1 185 . 14 1 1 A 26 26 MET C C 26 177.371 178.171 -0.800 1
1 186 . 14 1 1 A 26 26 MET CA C 26 60.454 58.964 1.490 1
1 187 . 14 1 1 A 26 26 MET CB C 26 33.567 32.555 1.012 1
1 190 . 14 1 1 A 26 26 MET N N 26 119.977 118.796 1.181 1
1 191 . 14 1 1 A 27 27 TYR H H 27 8.604 8.296 0.308 1
1 192 . 14 1 1 A 27 27 TYR HA H 27 4.138 4.168 -0.030 1
1 199 . 14 1 1 A 27 27 TYR C C 27 178.901 177.557 1.344 1
1 200 . 14 1 1 A 27 27 TYR CA C 27 61.846 61.287 0.559 1
1 201 . 14 1 1 A 27 27 TYR CB C 27 38.165 38.513 -0.348 1
1 206 . 14 1 1 A 27 27 TYR N N 27 117.797 121.475 -3.678 1
1 207 . 14 1 1 A 28 28 LYS H H 28 7.867 8.258 -0.391 1
1 208 . 14 1 1 A 28 28 LYS HA H 28 3.797 3.676 0.121 1
1 217 . 14 1 1 A 28 28 LYS C C 28 176.858 178.170 -1.312 1
1 218 . 14 1 1 A 28 28 LYS CA C 28 58.174 59.436 -1.262 1
1 219 . 14 1 1 A 28 28 LYS CB C 28 32.516 32.136 0.380 1
1 223 . 14 1 1 A 28 28 LYS N N 28 118.982 117.735 1.247 1
1 224 . 14 1 1 A 29 29 HIS H H 29 7.443 7.291 0.152 1
1 225 . 14 1 1 A 29 29 HIS HA H 29 4.386 4.470 -0.084 1
1 230 . 14 1 1 A 29 29 HIS C C 29 176.085 175.979 0.106 1
1 231 . 14 1 1 A 29 29 HIS CA C 29 55.213 56.282 -1.069 1
1 232 . 14 1 1 A 29 29 HIS CB C 29 27.085 28.509 -1.424 1
1 235 . 14 1 1 A 29 29 HIS N N 29 117.138 115.875 1.263 1
1 236 . 14 1 1 A 30 30 ARG H H 30 6.921 8.074 -1.153 1
1 237 . 14 1 1 A 30 30 ARG HA H 30 3.898 4.275 -0.377 1
1 244 . 14 1 1 A 30 30 ARG C C 30 175.808 177.942 -2.134 1
1 245 . 14 1 1 A 30 30 ARG CA C 30 58.609 58.534 0.075 1
1 246 . 14 1 1 A 30 30 ARG CB C 30 28.739 29.724 -0.985 1
1 249 . 14 1 1 A 30 30 ARG N N 30 117.911 119.302 -1.391 1
1 250 . 14 1 1 A 31 31 PHE H H 31 7.819 7.926 -0.107 1
1 251 . 14 1 1 A 31 31 PHE HA H 31 4.533 4.257 0.276 1
1 259 . 14 1 1 A 31 31 PHE C C 31 175.577 177.742 -2.165 1
1 260 . 14 1 1 A 31 31 PHE CA C 31 58.029 60.875 -2.846 1
1 261 . 14 1 1 A 31 31 PHE CB C 31 37.792 38.952 -1.160 1
1 267 . 14 1 1 A 31 31 PHE N N 31 115.408 118.852 -3.444 1
1 268 . 14 1 1 A 32 32 LYS H H 32 7.858 8.234 -0.376 1
1 269 . 14 1 1 A 32 32 LYS HA H 32 4.487 4.495 -0.008 1
1 277 . 14 1 1 A 32 32 LYS C C 32 175.557 176.581 -1.024 1
1 278 . 14 1 1 A 32 32 LYS CA C 32 56.329 58.687 -2.358 1
1 279 . 14 1 1 A 32 32 LYS CB C 32 32.743 33.888 -1.145 1
1 283 . 14 1 1 A 32 32 LYS N N 32 122.453 115.178 7.275 1
1 284 . 14 1 1 A 33 33 ALA H H 33 8.643 8.458 0.185 1
1 285 . 14 1 1 A 33 33 ALA HA H 33 4.403 4.107 0.296 1
1 289 . 14 1 1 A 33 33 ALA C C 33 176.273 175.280 0.993 1
1 290 . 14 1 1 A 33 33 ALA CA C 33 53.579 53.411 0.168 1
1 291 . 14 1 1 A 33 33 ALA CB C 33 18.653 17.282 1.371 1
1 292 . 14 1 1 A 33 33 ALA N N 33 127.853 119.801 8.052 1
1 293 . 14 1 1 A 34 34 TYR H H 34 7.878 8.029 -0.151 1
1 294 . 14 1 1 A 34 34 TYR HA H 34 4.686 4.902 -0.216 1
1 301 . 14 1 1 A 34 34 TYR C C 34 173.133 173.316 -0.183 1
1 302 . 14 1 1 A 34 34 TYR CA C 34 54.778 54.916 -0.138 1
1 303 . 14 1 1 A 34 34 TYR CB C 34 39.619 40.845 -1.226 1
1 308 . 14 1 1 A 34 34 TYR N N 34 116.539 116.803 -0.264 1
1 309 . 14 1 1 A 35 35 PRO HA H 35 4.526 4.572 -0.046 1
1 316 . 14 1 1 A 35 35 PRO C C 35 176.837 175.580 1.257 1
1 317 . 14 1 1 A 35 35 PRO CA C 35 61.864 62.026 -0.162 1
1 318 . 14 1 1 A 35 35 PRO CB C 35 30.904 31.825 -0.921 1
1 321 . 14 1 1 A 36 36 SER H H 36 9.634 8.411 1.223 1
1 322 . 14 1 1 A 36 36 SER HA H 36 4.518 4.839 -0.321 1
1 325 . 14 1 1 A 36 36 SER C C 36 175.001 175.674 -0.673 1
1 326 . 14 1 1 A 36 36 SER CA C 36 57.129 58.455 -1.326 1
1 327 . 14 1 1 A 36 36 SER CB C 36 65.374 64.826 0.548 1
1 328 . 14 1 1 A 36 36 SER N N 36 119.984 117.135 2.849 1
1 329 . 14 1 1 A 37 37 GLU H H 37 9.091 9.124 -0.033 1
1 330 . 14 1 1 A 37 37 GLU HA H 37 3.884 3.963 -0.079 1
1 335 . 14 1 1 A 37 37 GLU C C 37 179.347 178.041 1.306 1
1 336 . 14 1 1 A 37 37 GLU CA C 37 60.454 59.463 0.991 1
1 337 . 14 1 1 A 37 37 GLU CB C 37 28.623 29.517 -0.894 1
1 339 . 14 1 1 A 37 37 GLU N N 37 120.748 124.379 -3.631 1
1 340 . 14 1 1 A 38 38 GLU H H 38 8.760 7.980 0.780 1
1 341 . 14 1 1 A 38 38 GLU HA H 38 4.048 4.099 -0.051 1
1 346 . 14 1 1 A 38 38 GLU C C 38 179.975 178.767 1.208 1
1 347 . 14 1 1 A 38 38 GLU CA C 38 60.243 58.656 1.587 1
1 348 . 14 1 1 A 38 38 GLU CB C 38 29.117 29.931 -0.814 1
1 350 . 14 1 1 A 38 38 GLU N N 38 119.272 119.037 0.235 1
1 351 . 14 1 1 A 39 39 GLU H H 39 7.856 7.823 0.033 1
1 352 . 14 1 1 A 39 39 GLU HA H 39 3.976 3.888 0.088 1
1 357 . 14 1 1 A 39 39 GLU C C 39 178.912 178.625 0.287 1
1 358 . 14 1 1 A 39 39 GLU CA C 39 59.131 59.268 -0.137 1
1 359 . 14 1 1 A 39 39 GLU CB C 39 29.612 28.814 0.798 1
1 361 . 14 1 1 A 39 39 GLU N N 39 121.658 120.658 1.000 1
1 362 . 14 1 1 A 40 40 LYS H H 40 8.653 7.660 0.993 1
1 363 . 14 1 1 A 40 40 LYS HA H 40 3.508 3.838 -0.330 1
1 372 . 14 1 1 A 40 40 LYS C C 40 177.974 178.856 -0.882 1
1 373 . 14 1 1 A 40 40 LYS CA C 40 60.948 59.471 1.477 1
1 374 . 14 1 1 A 40 40 LYS CB C 40 32.714 32.038 0.676 1
1 378 . 14 1 1 A 40 40 LYS N N 40 119.152 119.435 -0.283 1
1 379 . 14 1 1 A 41 41 GLN H H 41 7.876 7.937 -0.061 1
1 380 . 14 1 1 A 41 41 GLN HA H 41 3.911 3.956 -0.045 1
1 387 . 14 1 1 A 41 41 GLN C C 41 178.352 178.179 0.173 1
1 388 . 14 1 1 A 41 41 GLN CA C 41 58.973 58.826 0.147 1
1 389 . 14 1 1 A 41 41 GLN CB C 41 27.552 28.563 -1.011 1
1 391 . 14 1 1 A 41 41 GLN N N 41 118.910 119.730 -0.820 1
1 393 . 14 1 1 A 42 42 MET H H 42 7.771 7.710 0.061 1
1 394 . 14 1 1 A 42 42 MET HA H 42 4.158 4.250 -0.092 1
1 402 . 14 1 1 A 42 42 MET C C 42 179.310 178.284 1.026 1
1 403 . 14 1 1 A 42 42 MET CA C 42 59.079 58.020 1.059 1
1 404 . 14 1 1 A 42 42 MET CB C 42 31.023 32.410 -1.387 1
1 407 . 14 1 1 A 42 42 MET N N 42 121.131 119.538 1.593 1
1 408 . 14 1 1 A 43 43 LEU H H 43 8.400 8.198 0.202 1
1 409 . 14 1 1 A 43 43 LEU HA H 43 3.888 3.989 -0.101 1
1 419 . 14 1 1 A 43 43 LEU C C 43 180.721 179.122 1.599 1
1 420 . 14 1 1 A 43 43 LEU CA C 43 57.916 57.994 -0.078 1
1 421 . 14 1 1 A 43 43 LEU CB C 43 42.080 41.398 0.682 1
1 425 . 14 1 1 A 43 43 LEU N N 43 120.124 120.794 -0.670 1
1 426 . 14 1 1 A 44 44 SER H H 44 8.658 8.695 -0.037 1
1 427 . 14 1 1 A 44 44 SER HA H 44 4.088 4.330 -0.242 1
1 430 . 14 1 1 A 44 44 SER C C 44 176.859 177.351 -0.492 1
1 431 . 14 1 1 A 44 44 SER CA C 44 61.371 61.580 -0.209 1
1 432 . 14 1 1 A 44 44 SER CB C 44 63.314 62.605 0.709 1
1 433 . 14 1 1 A 44 44 SER N N 44 119.795 113.318 6.477 1
1 434 . 14 1 1 A 45 45 GLU H H 45 7.905 7.491 0.414 1
1 435 . 14 1 1 A 45 45 GLU HA H 45 4.094 4.263 -0.169 1
1 440 . 14 1 1 A 45 45 GLU C C 45 179.095 179.011 0.084 1
1 441 . 14 1 1 A 45 45 GLU CA C 45 59.255 58.979 0.276 1
1 442 . 14 1 1 A 45 45 GLU CB C 45 29.200 29.894 -0.694 1
1 444 . 14 1 1 A 45 45 GLU N N 45 120.609 123.473 -2.864 1
1 445 . 14 1 1 A 46 46 LYS H H 46 7.837 7.793 0.044 1
1 446 . 14 1 1 A 46 46 LYS HA H 46 4.231 4.101 0.130 1
1 453 . 14 1 1 A 46 46 LYS C C 46 177.964 178.876 -0.912 1
1 454 . 14 1 1 A 46 46 LYS CA C 46 58.278 59.129 -0.851 1
1 455 . 14 1 1 A 46 46 LYS CB C 46 34.110 32.414 1.696 1
1 459 . 14 1 1 A 46 46 LYS N N 46 115.471 119.093 -3.622 1
1 460 . 14 1 1 A 47 47 THR H H 47 7.763 8.254 -0.491 1
1 461 . 14 1 1 A 47 47 THR HA H 47 4.271 4.187 0.084 1
1 466 . 14 1 1 A 47 47 THR C C 47 175.472 175.248 0.224 1
1 467 . 14 1 1 A 47 47 THR CA C 47 62.429 62.724 -0.295 1
1 468 . 14 1 1 A 47 47 THR CB C 47 71.966 69.981 1.985 1
1 470 . 14 1 1 A 47 47 THR N N 47 104.286 108.945 -4.659 1
1 471 . 14 1 1 A 48 48 ASN H H 48 8.169 8.228 -0.059 1
1 472 . 14 1 1 A 48 48 ASN HA H 48 4.437 4.447 -0.010 1
1 477 . 14 1 1 A 48 48 ASN C C 48 173.874 173.919 -0.045 1
1 478 . 14 1 1 A 48 48 ASN CA C 48 55.377 54.412 0.965 1
1 479 . 14 1 1 A 48 48 ASN CB C 48 37.770 37.605 0.165 1
1 480 . 14 1 1 A 48 48 ASN N N 48 117.458 119.634 -2.176 1
1 482 . 14 1 1 A 49 49 LEU H H 49 7.532 7.253 0.279 1
1 483 . 14 1 1 A 49 49 LEU HA H 49 4.733 4.777 -0.044 1
1 493 . 14 1 1 A 49 49 LEU C C 49 176.625 175.685 0.940 1
1 494 . 14 1 1 A 49 49 LEU CA C 49 53.226 53.404 -0.178 1
1 495 . 14 1 1 A 49 49 LEU CB C 49 44.114 43.466 0.648 1
1 499 . 14 1 1 A 49 49 LEU N N 49 118.220 120.207 -1.987 1
1 500 . 14 1 1 A 50 50 SER H H 50 9.140 8.779 0.361 1
1 501 . 14 1 1 A 50 50 SER HA H 50 4.475 4.952 -0.477 1
1 504 . 14 1 1 A 50 50 SER C C 50 174.907 174.832 0.075 1
1 505 . 14 1 1 A 50 50 SER CA C 50 56.964 57.726 -0.762 1
1 506 . 14 1 1 A 50 50 SER CB C 50 65.372 65.099 0.273 1
1 507 . 14 1 1 A 50 50 SER N N 50 117.569 117.291 0.278 1
1 508 . 14 1 1 A 51 51 LEU H H 51 8.756 8.770 -0.014 1
1 509 . 14 1 1 A 51 51 LEU HA H 51 3.874 3.917 -0.043 1
1 519 . 14 1 1 A 51 51 LEU C C 51 179.910 178.789 1.121 1
1 520 . 14 1 1 A 51 51 LEU CA C 51 58.916 58.191 0.725 1
1 521 . 14 1 1 A 51 51 LEU CB C 51 41.148 41.391 -0.243 1
1 525 . 14 1 1 A 51 51 LEU N N 51 120.905 125.759 -4.854 1
1 526 . 14 1 1 A 52 52 LEU H H 52 8.146 8.214 -0.068 1
1 527 . 14 1 1 A 52 52 LEU HA H 52 4.179 3.999 0.180 1
1 537 . 14 1 1 A 52 52 LEU C C 52 178.936 178.659 0.277 1
1 538 . 14 1 1 A 52 52 LEU CA C 52 58.162 58.426 -0.264 1
1 539 . 14 1 1 A 52 52 LEU CB C 52 42.137 41.301 0.836 1
1 543 . 14 1 1 A 52 52 LEU N N 52 120.685 120.098 0.587 1
1 544 . 14 1 1 A 53 53 GLN H H 53 7.924 8.249 -0.325 1
1 545 . 14 1 1 A 53 53 GLN HA H 53 4.102 4.192 -0.090 1
1 552 . 14 1 1 A 53 53 GLN C C 53 180.308 178.651 1.657 1
1 553 . 14 1 1 A 53 53 GLN CA C 53 59.326 58.630 0.696 1
1 554 . 14 1 1 A 53 53 GLN CB C 53 29.900 28.467 1.433 1
1 556 . 14 1 1 A 53 53 GLN N N 53 118.473 117.551 0.922 1
1 558 . 14 1 1 A 54 54 ILE H H 54 8.380 8.272 0.108 1
1 559 . 14 1 1 A 54 54 ILE HA H 54 3.677 3.728 -0.051 1
1 569 . 14 1 1 A 54 54 ILE C C 54 177.673 178.168 -0.495 1
1 570 . 14 1 1 A 54 54 ILE CA C 54 64.650 65.520 -0.870 1
1 571 . 14 1 1 A 54 54 ILE CB C 54 37.476 37.844 -0.368 1
1 575 . 14 1 1 A 54 54 ILE N N 54 120.113 121.677 -1.564 1
1 576 . 14 1 1 A 55 55 SER H H 55 8.854 8.020 0.834 1
1 577 . 14 1 1 A 55 55 SER HA H 55 4.267 4.270 -0.003 1
1 580 . 14 1 1 A 55 55 SER C C 55 177.127 177.752 -0.625 1
1 581 . 14 1 1 A 55 55 SER CA C 55 62.852 61.780 1.072 1
1 582 . 14 1 1 A 55 55 SER CB C 55 62.727 63.057 -0.330 1
1 583 . 14 1 1 A 55 55 SER N N 55 116.646 115.869 0.777 1
1 584 . 14 1 1 A 56 56 ASN H H 56 8.634 8.096 0.538 1
1 585 . 14 1 1 A 56 56 ASN HA H 56 4.549 4.457 0.092 1
1 590 . 14 1 1 A 56 56 ASN C C 56 177.481 178.307 -0.826 1
1 591 . 14 1 1 A 56 56 ASN CA C 56 55.951 56.542 -0.591 1
1 592 . 14 1 1 A 56 56 ASN CB C 56 37.852 38.358 -0.506 1
1 593 . 14 1 1 A 56 56 ASN N N 56 119.048 119.307 -0.259 1
1 595 . 14 1 1 A 57 57 TRP H H 57 8.373 8.189 0.184 1
1 596 . 14 1 1 A 57 57 TRP HA H 57 4.065 4.355 -0.290 1
1 605 . 14 1 1 A 57 57 TRP C C 57 179.392 178.272 1.120 1
1 606 . 14 1 1 A 57 57 TRP CA C 57 63.204 61.255 1.949 1
1 607 . 14 1 1 A 57 57 TRP CB C 57 28.376 29.693 -1.317 1
1 613 . 14 1 1 A 57 57 TRP N N 57 122.950 122.652 0.298 1
1 615 . 14 1 1 A 58 58 PHE H H 58 8.428 8.298 0.130 1
1 616 . 14 1 1 A 58 58 PHE HA H 58 3.922 3.687 0.235 1
1 624 . 14 1 1 A 58 58 PHE C C 58 178.237 177.769 0.468 1
1 625 . 14 1 1 A 58 58 PHE CA C 58 64.015 61.733 2.282 1
1 626 . 14 1 1 A 58 58 PHE CB C 58 39.602 38.382 1.220 1
1 632 . 14 1 1 A 58 58 PHE N N 58 116.774 117.614 -0.840 1
1 633 . 14 1 1 A 59 59 ILE H H 59 7.925 8.215 -0.290 1
1 634 . 14 1 1 A 59 59 ILE HA H 59 3.773 3.672 0.101 1
1 644 . 14 1 1 A 59 59 ILE C C 59 178.745 177.879 0.866 1
1 645 . 14 1 1 A 59 59 ILE CA C 59 65.531 65.255 0.276 1
1 646 . 14 1 1 A 59 59 ILE CB C 59 38.480 37.867 0.613 1
1 650 . 14 1 1 A 59 59 ILE N N 59 119.560 120.028 -0.468 1
1 651 . 14 1 1 A 60 60 ASN H H 60 7.506 7.701 -0.195 1
1 652 . 14 1 1 A 60 60 ASN HA H 60 4.407 4.394 0.013 1
1 657 . 14 1 1 A 60 60 ASN C C 60 177.163 177.629 -0.466 1
1 658 . 14 1 1 A 60 60 ASN CA C 60 55.871 55.869 0.002 1
1 659 . 14 1 1 A 60 60 ASN CB C 60 38.878 37.926 0.952 1
1 660 . 14 1 1 A 60 60 ASN N N 60 116.868 117.700 -0.832 1
1 662 . 14 1 1 A 61 61 ALA H H 61 8.410 7.983 0.427 1
1 663 . 14 1 1 A 61 61 ALA HA H 61 3.667 3.633 0.034 1
1 667 . 14 1 1 A 61 61 ALA C C 61 180.061 179.253 0.808 1
1 668 . 14 1 1 A 61 61 ALA CA C 61 54.601 54.509 0.092 1
1 669 . 14 1 1 A 61 61 ALA CB C 61 18.241 17.046 1.195 1
1 670 . 14 1 1 A 61 61 ALA N N 61 123.022 121.925 1.097 1
1 671 . 14 1 1 A 62 62 ARG H H 62 8.036 8.133 -0.097 1
1 672 . 14 1 1 A 62 62 ARG HA H 62 4.092 4.090 0.002 1
1 679 . 14 1 1 A 62 62 ARG C C 62 176.756 177.099 -0.343 1
1 680 . 14 1 1 A 62 62 ARG CA C 62 58.762 58.051 0.711 1
1 681 . 14 1 1 A 62 62 ARG CB C 62 30.601 29.641 0.960 1
1 684 . 14 1 1 A 62 62 ARG N N 62 117.168 116.832 0.336 1
1 685 . 14 1 1 A 63 63 ARG H H 63 7.214 7.620 -0.406 1
1 686 . 14 1 1 A 63 63 ARG HA H 63 4.249 4.416 -0.167 1
1 693 . 14 1 1 A 63 63 ARG C C 63 176.945 176.616 0.329 1
1 694 . 14 1 1 A 63 63 ARG CA C 63 57.669 56.605 1.064 1
1 695 . 14 1 1 A 63 63 ARG CB C 63 30.765 31.183 -0.418 1
1 698 . 14 1 1 A 63 63 ARG N N 63 116.514 117.713 -1.199 1
1 699 . 14 1 1 A 64 64 ARG H H 64 7.913 7.790 0.123 1
1 700 . 14 1 1 A 64 64 ARG HA H 64 4.351 4.591 -0.240 1
1 707 . 14 1 1 A 64 64 ARG C C 64 176.413 178.346 -1.933 1
1 708 . 14 1 1 A 64 64 ARG CA C 64 57.105 57.240 -0.135 1
1 709 . 14 1 1 A 64 64 ARG CB C 64 31.672 32.895 -1.223 1
1 712 . 14 1 1 A 64 64 ARG N N 64 116.818 119.177 -2.359 1
1 713 . 14 1 1 A 65 65 ILE H H 65 8.169 8.347 -0.178 1
1 714 . 14 1 1 A 65 65 ILE HA H 65 4.285 3.634 0.651 1
1 724 . 14 1 1 A 65 65 ILE C C 65 176.208 177.948 -1.740 1
1 725 . 14 1 1 A 65 65 ILE CA C 65 62.005 65.354 -3.349 1
1 726 . 14 1 1 A 65 65 ILE CB C 65 39.088 37.655 1.433 1
1 730 . 14 1 1 A 65 65 ILE N N 65 119.185 119.948 -0.763 1
1 731 . 14 1 1 A 66 66 LEU H H 66 7.962 8.028 -0.066 1
1 732 . 14 1 1 A 66 66 LEU HA H 66 4.485 4.042 0.443 1
1 742 . 14 1 1 A 66 66 LEU C C 66 176.216 175.119 1.097 1
1 743 . 14 1 1 A 66 66 LEU CA C 66 56.153 59.832 -3.679 1
1 744 . 14 1 1 A 66 66 LEU CB C 66 40.792 40.078 0.714 1
1 748 . 14 1 1 A 66 66 LEU N N 66 124.389 121.605 2.784 1
1 749 . 14 1 1 A 67 67 PRO HA H 67 4.283 4.375 -0.092 1
1 756 . 14 1 1 A 67 67 PRO C C 67 178.294 178.205 0.089 1
1 757 . 14 1 1 A 67 67 PRO CA C 67 65.390 65.236 0.154 1
1 758 . 14 1 1 A 67 67 PRO CB C 67 31.095 31.073 0.022 1
1 761 . 14 1 1 A 68 68 ASP H H 68 7.913 8.730 -0.817 1
1 762 . 14 1 1 A 68 68 ASP HA H 68 4.507 4.402 0.105 1
1 765 . 14 1 1 A 68 68 ASP C C 68 177.927 177.725 0.202 1
1 766 . 14 1 1 A 68 68 ASP CA C 68 55.906 56.330 -0.424 1
1 767 . 14 1 1 A 68 68 ASP CB C 68 40.736 40.792 -0.056 1
1 768 . 14 1 1 A 68 68 ASP N N 68 117.231 117.121 0.110 1
1 769 . 14 1 1 A 69 69 MET H H 69 8.083 8.442 -0.359 1
1 770 . 14 1 1 A 69 69 MET HA H 69 4.362 4.275 0.087 1
1 778 . 14 1 1 A 69 69 MET C C 69 177.374 178.453 -1.079 1
1 779 . 14 1 1 A 69 69 MET CA C 69 57.634 58.190 -0.556 1
1 780 . 14 1 1 A 69 69 MET CB C 69 32.816 32.879 -0.063 1
1 783 . 14 1 1 A 69 69 MET N N 69 119.391 118.072 1.319 1
1 784 . 14 1 1 A 70 70 LEU H H 70 7.907 8.739 -0.832 1
1 785 . 14 1 1 A 70 70 LEU HA H 70 4.232 4.068 0.164 1
1 795 . 14 1 1 A 70 70 LEU C C 70 177.745 177.380 0.365 1
1 796 . 14 1 1 A 70 70 LEU CA C 70 55.835 58.077 -2.242 1
1 797 . 14 1 1 A 70 70 LEU CB C 70 42.174 41.627 0.547 1
1 801 . 14 1 1 A 70 70 LEU N N 70 119.266 123.329 -4.063 1
1 802 . 14 1 1 A 71 71 GLN H H 71 7.865 7.486 0.379 1
1 803 . 14 1 1 A 71 71 GLN HA H 71 4.287 4.236 0.051 1
1 809 . 14 1 1 A 71 71 GLN C C 71 178.855 175.407 3.448 1
1 810 . 14 1 1 A 71 71 GLN CA C 71 56.383 56.694 -0.311 1
1 811 . 14 1 1 A 71 71 GLN CB C 71 29.092 29.311 -0.219 1
1 813 . 14 1 1 A 71 71 GLN N N 71 118.603 117.963 0.640 1
1 815 . 14 1 1 A 72 72 GLN H H 72 8.189 8.549 -0.360 1
1 816 . 14 1 1 A 72 72 GLN HA H 72 4.302 4.658 -0.356 1
1 821 . 14 1 1 A 72 72 GLN CA C 72 56.206 54.299 1.907 1
1 822 . 14 1 1 A 72 72 GLN CB C 72 29.298 29.992 -0.694 1
1 824 . 14 1 1 A 72 72 GLN N N 72 120.267 125.511 -5.244 1
1 825 . 14 1 1 A 73 73 ARG C C 73 176.105 176.955 -0.850 1
1 826 . 14 1 1 A 74 74 ARG HA H 74 4.334 4.356 -0.022 1
1 833 . 14 1 1 A 74 74 ARG C C 74 176.188 175.673 0.515 1
1 834 . 14 1 1 A 74 74 ARG CA C 74 56.300 57.125 -0.825 1
1 835 . 14 1 1 A 74 74 ARG CB C 74 30.668 30.946 -0.278 1
1 838 . 14 1 1 A 75 75 ASN C C 75 174.462 173.251 1.211 1
1 839 . 14 1 1 A 75 75 ASN CA C 75 53.148 52.074 1.074 1
1 840 . 14 1 1 A 75 75 ASN CB C 75 39.046 40.385 -1.339 1
1 841 . 14 1 1 A 76 76 ASP H H 76 8.257 8.941 -0.684 1
1 842 . 14 1 1 A 76 76 ASP HA H 76 4.877 5.225 -0.348 1
1 845 . 14 1 1 A 76 76 ASP C C 76 174.759 174.433 0.326 1
1 846 . 14 1 1 A 76 76 ASP CA C 76 52.380 50.820 1.560 1
1 847 . 14 1 1 A 76 76 ASP CB C 76 41.267 43.388 -2.121 1
1 848 . 14 1 1 A 76 76 ASP N N 76 122.030 127.178 -5.148 1
1 849 . 14 1 1 A 77 77 PRO HA H 77 4.466 4.725 -0.259 1
1 856 . 14 1 1 A 77 77 PRO C C 77 177.133 175.759 1.374 1
1 857 . 14 1 1 A 77 77 PRO CA C 77 63.733 62.295 1.438 1
1 858 . 14 1 1 A 77 77 PRO CB C 77 31.919 29.613 2.306 1
1 861 . 14 1 1 A 78 78 SER H H 78 8.457 8.310 0.147 1
1 862 . 14 1 1 A 78 78 SER HA H 78 4.479 4.861 -0.382 1
1 865 . 14 1 1 A 78 78 SER C C 78 174.731 174.417 0.314 1
1 866 . 14 1 1 A 78 78 SER CA C 78 58.691 57.792 0.899 1
1 867 . 14 1 1 A 78 78 SER CB C 78 63.973 64.311 -0.338 1
1 868 . 14 1 1 A 78 78 SER N N 78 115.711 118.559 -2.848 1
1 869 . 14 1 1 A 79 79 GLY H H 79 8.090 8.622 -0.532 1
1 870 . 14 1 1 A 79 79 GLY HA2 H 79 4.179 4.486 -0.307 1
1 871 . 14 1 1 A 79 79 GLY HA3 H 79 4.065 4.490 -0.425 1
1 872 . 14 1 1 A 79 79 GLY CA C 79 44.746 46.400 -1.654 1
1 873 . 14 1 1 A 79 79 GLY N N 79 110.429 112.804 -2.375 1
1 874 . 14 1 1 A 80 80 PRO HA H 80 4.464 4.665 -0.201 1
1 880 . 14 1 1 A 80 80 PRO C C 80 177.499 176.040 1.459 1
1 881 . 14 1 1 A 80 80 PRO CA C 80 63.275 62.714 0.561 1
1 882 . 14 1 1 A 80 80 PRO CB C 80 32.249 33.425 -1.176 1
1 1 . 15 1 1 A 13 13 ASN HA H 13 4.787 5.559 -0.772 1
1 6 . 15 1 1 A 13 13 ASN CA C 13 53.148 51.993 1.155 1
1 7 . 15 1 1 A 13 13 ASN CB C 13 39.378 41.038 -1.660 1
1 9 . 15 1 1 A 14 14 LEU H H 14 8.418 8.849 -0.431 1
1 10 . 15 1 1 A 14 14 LEU HA H 14 4.654 4.644 0.010 1
1 20 . 15 1 1 A 14 14 LEU CA C 14 52.999 53.144 -0.145 1
1 21 . 15 1 1 A 14 14 LEU CB C 14 41.919 41.135 0.784 1
1 25 . 15 1 1 A 14 14 LEU N N 14 122.671 125.180 -2.509 1
1 26 . 15 1 1 A 15 15 PRO HA H 15 4.460 4.603 -0.143 1
1 33 . 15 1 1 A 15 15 PRO C C 15 178.156 177.616 0.540 1
1 34 . 15 1 1 A 15 15 PRO CA C 15 63.101 62.651 0.450 1
1 35 . 15 1 1 A 15 15 PRO CB C 15 32.304 32.169 0.135 1
1 38 . 15 1 1 A 16 16 ALA H H 16 8.973 8.639 0.334 1
1 39 . 15 1 1 A 16 16 ALA HA H 16 4.021 3.987 0.034 1
1 43 . 15 1 1 A 16 16 ALA C C 16 180.695 179.532 1.163 1
1 44 . 15 1 1 A 16 16 ALA CA C 16 55.642 55.626 0.016 1
1 45 . 15 1 1 A 16 16 ALA CB C 16 18.552 18.607 -0.055 1
1 46 . 15 1 1 A 16 16 ALA N N 16 128.311 127.134 1.177 1
1 47 . 15 1 1 A 17 17 GLU H H 17 9.558 8.476 1.082 1
1 48 . 15 1 1 A 17 17 GLU HA H 17 4.065 4.029 0.036 1
1 53 . 15 1 1 A 17 17 GLU C C 17 178.886 179.209 -0.323 1
1 54 . 15 1 1 A 17 17 GLU CA C 17 59.400 59.764 -0.364 1
1 55 . 15 1 1 A 17 17 GLU CB C 17 28.742 29.505 -0.763 1
1 57 . 15 1 1 A 17 17 GLU N N 17 117.113 119.028 -1.915 1
1 58 . 15 1 1 A 18 18 SER H H 18 7.263 7.992 -0.729 1
1 59 . 15 1 1 A 18 18 SER HA H 18 4.180 4.159 0.021 1
1 62 . 15 1 1 A 18 18 SER C C 18 174.951 176.312 -1.361 1
1 63 . 15 1 1 A 18 18 SER CA C 18 61.969 62.397 -0.428 1
1 64 . 15 1 1 A 18 18 SER CB C 18 62.554 62.865 -0.311 1
1 65 . 15 1 1 A 18 18 SER N N 18 114.932 117.120 -2.188 1
1 66 . 15 1 1 A 19 19 VAL H H 19 7.620 8.266 -0.646 1
1 67 . 15 1 1 A 19 19 VAL HA H 19 3.011 3.271 -0.260 1
1 75 . 15 1 1 A 19 19 VAL C C 19 176.953 177.781 -0.828 1
1 76 . 15 1 1 A 19 19 VAL CA C 19 66.479 66.699 -0.220 1
1 77 . 15 1 1 A 19 19 VAL CB C 19 31.569 31.557 0.012 1
1 80 . 15 1 1 A 19 19 VAL N N 19 121.086 121.352 -0.266 1
1 81 . 15 1 1 A 20 20 LYS H H 20 7.745 8.506 -0.761 1
1 82 . 15 1 1 A 20 20 LYS HA H 20 3.884 3.958 -0.074 1
1 91 . 15 1 1 A 20 20 LYS C C 20 178.150 178.492 -0.342 1
1 92 . 15 1 1 A 20 20 LYS CA C 20 59.984 59.849 0.135 1
1 93 . 15 1 1 A 20 20 LYS CB C 20 32.351 32.185 0.166 1
1 97 . 15 1 1 A 20 20 LYS N N 20 119.366 119.659 -0.293 1
1 98 . 15 1 1 A 21 21 ILE H H 21 6.943 7.967 -1.024 1
1 99 . 15 1 1 A 21 21 ILE HA H 21 3.783 3.612 0.171 1
1 109 . 15 1 1 A 21 21 ILE C C 21 178.996 178.773 0.223 1
1 110 . 15 1 1 A 21 21 ILE CA C 21 64.642 65.776 -1.134 1
1 111 . 15 1 1 A 21 21 ILE CB C 21 38.014 37.912 0.102 1
1 115 . 15 1 1 A 21 21 ILE N N 21 118.163 119.626 -1.463 1
1 116 . 15 1 1 A 22 22 LEU H H 22 7.267 7.947 -0.680 1
1 117 . 15 1 1 A 22 22 LEU HA H 22 3.748 3.766 -0.018 1
1 127 . 15 1 1 A 22 22 LEU C C 22 178.289 178.539 -0.250 1
1 128 . 15 1 1 A 22 22 LEU CA C 22 58.092 57.938 0.154 1
1 129 . 15 1 1 A 22 22 LEU CB C 22 38.551 40.610 -2.059 1
1 133 . 15 1 1 A 22 22 LEU N N 22 120.609 119.111 1.498 1
1 134 . 15 1 1 A 23 23 ARG H H 23 8.676 8.705 -0.029 1
1 135 . 15 1 1 A 23 23 ARG HA H 23 4.030 4.163 -0.133 1
1 142 . 15 1 1 A 23 23 ARG C C 23 178.861 178.333 0.528 1
1 143 . 15 1 1 A 23 23 ARG CA C 23 60.404 60.034 0.370 1
1 144 . 15 1 1 A 23 23 ARG CB C 23 30.351 30.133 0.218 1
1 147 . 15 1 1 A 23 23 ARG N N 23 119.148 117.657 1.491 1
1 148 . 15 1 1 A 24 24 ASP H H 24 8.515 8.395 0.120 1
1 149 . 15 1 1 A 24 24 ASP HA H 24 4.519 4.393 0.126 1
1 152 . 15 1 1 A 24 24 ASP C C 24 178.759 178.326 0.433 1
1 153 . 15 1 1 A 24 24 ASP CA C 24 57.556 57.208 0.348 1
1 154 . 15 1 1 A 24 24 ASP CB C 24 40.569 40.831 -0.262 1
1 155 . 15 1 1 A 24 24 ASP N N 24 120.027 119.272 0.755 1
1 156 . 15 1 1 A 25 25 TRP H H 25 8.158 7.940 0.218 1
1 157 . 15 1 1 A 25 25 TRP HA H 25 4.181 4.423 -0.242 1
1 166 . 15 1 1 A 25 25 TRP C C 25 179.946 178.562 1.384 1
1 167 . 15 1 1 A 25 25 TRP CA C 25 63.346 61.195 2.151 1
1 168 . 15 1 1 A 25 25 TRP CB C 25 29.433 29.654 -0.221 1
1 174 . 15 1 1 A 25 25 TRP N N 25 121.350 121.599 -0.249 1
1 176 . 15 1 1 A 26 26 MET H H 26 8.977 8.957 0.020 1
1 177 . 15 1 1 A 26 26 MET HA H 26 4.076 4.426 -0.350 1
1 185 . 15 1 1 A 26 26 MET C C 26 177.371 178.175 -0.804 1
1 186 . 15 1 1 A 26 26 MET CA C 26 60.454 58.976 1.478 1
1 187 . 15 1 1 A 26 26 MET CB C 26 33.567 32.916 0.651 1
1 190 . 15 1 1 A 26 26 MET N N 26 119.977 118.627 1.350 1
1 191 . 15 1 1 A 27 27 TYR H H 27 8.604 8.169 0.435 1
1 192 . 15 1 1 A 27 27 TYR HA H 27 4.138 4.254 -0.116 1
1 199 . 15 1 1 A 27 27 TYR C C 27 178.901 177.716 1.185 1
1 200 . 15 1 1 A 27 27 TYR CA C 27 61.846 61.376 0.470 1
1 201 . 15 1 1 A 27 27 TYR CB C 27 38.165 38.611 -0.446 1
1 206 . 15 1 1 A 27 27 TYR N N 27 117.797 121.297 -3.500 1
1 207 . 15 1 1 A 28 28 LYS H H 28 7.867 8.149 -0.282 1
1 208 . 15 1 1 A 28 28 LYS HA H 28 3.797 3.737 0.060 1
1 217 . 15 1 1 A 28 28 LYS C C 28 176.858 177.732 -0.874 1
1 218 . 15 1 1 A 28 28 LYS CA C 28 58.174 59.209 -1.035 1
1 219 . 15 1 1 A 28 28 LYS CB C 28 32.516 32.120 0.396 1
1 223 . 15 1 1 A 28 28 LYS N N 28 118.982 118.239 0.743 1
1 224 . 15 1 1 A 29 29 HIS H H 29 7.443 7.220 0.223 1
1 225 . 15 1 1 A 29 29 HIS HA H 29 4.386 4.482 -0.096 1
1 230 . 15 1 1 A 29 29 HIS C C 29 176.085 175.880 0.205 1
1 231 . 15 1 1 A 29 29 HIS CA C 29 55.213 55.232 -0.019 1
1 232 . 15 1 1 A 29 29 HIS CB C 29 27.085 29.233 -2.148 1
1 235 . 15 1 1 A 29 29 HIS N N 29 117.138 115.312 1.826 1
1 236 . 15 1 1 A 30 30 ARG H H 30 6.921 8.098 -1.177 1
1 237 . 15 1 1 A 30 30 ARG HA H 30 3.898 4.309 -0.411 1
1 244 . 15 1 1 A 30 30 ARG C C 30 175.808 178.001 -2.193 1
1 245 . 15 1 1 A 30 30 ARG CA C 30 58.609 58.672 -0.063 1
1 246 . 15 1 1 A 30 30 ARG CB C 30 28.739 29.890 -1.151 1
1 249 . 15 1 1 A 30 30 ARG N N 30 117.911 119.668 -1.757 1
1 250 . 15 1 1 A 31 31 PHE H H 31 7.819 8.159 -0.340 1
1 251 . 15 1 1 A 31 31 PHE HA H 31 4.533 4.268 0.265 1
1 259 . 15 1 1 A 31 31 PHE C C 31 175.577 177.806 -2.229 1
1 260 . 15 1 1 A 31 31 PHE CA C 31 58.029 61.009 -2.980 1
1 261 . 15 1 1 A 31 31 PHE CB C 31 37.792 38.482 -0.690 1
1 267 . 15 1 1 A 31 31 PHE N N 31 115.408 118.664 -3.256 1
1 268 . 15 1 1 A 32 32 LYS H H 32 7.858 8.302 -0.444 1
1 269 . 15 1 1 A 32 32 LYS HA H 32 4.487 4.457 0.030 1
1 277 . 15 1 1 A 32 32 LYS C C 32 175.557 176.765 -1.208 1
1 278 . 15 1 1 A 32 32 LYS CA C 32 56.329 58.990 -2.661 1
1 279 . 15 1 1 A 32 32 LYS CB C 32 32.743 33.821 -1.078 1
1 283 . 15 1 1 A 32 32 LYS N N 32 122.453 115.284 7.169 1
1 284 . 15 1 1 A 33 33 ALA H H 33 8.643 8.440 0.203 1
1 285 . 15 1 1 A 33 33 ALA HA H 33 4.403 4.070 0.333 1
1 289 . 15 1 1 A 33 33 ALA C C 33 176.273 175.204 1.069 1
1 290 . 15 1 1 A 33 33 ALA CA C 33 53.579 53.387 0.192 1
1 291 . 15 1 1 A 33 33 ALA CB C 33 18.653 17.208 1.445 1
1 292 . 15 1 1 A 33 33 ALA N N 33 127.853 119.800 8.053 1
1 293 . 15 1 1 A 34 34 TYR H H 34 7.878 8.009 -0.131 1
1 294 . 15 1 1 A 34 34 TYR HA H 34 4.686 4.927 -0.241 1
1 301 . 15 1 1 A 34 34 TYR C C 34 173.133 173.206 -0.073 1
1 302 . 15 1 1 A 34 34 TYR CA C 34 54.778 54.927 -0.149 1
1 303 . 15 1 1 A 34 34 TYR CB C 34 39.619 40.857 -1.238 1
1 308 . 15 1 1 A 34 34 TYR N N 34 116.539 116.793 -0.254 1
1 309 . 15 1 1 A 35 35 PRO HA H 35 4.526 4.545 -0.019 1
1 316 . 15 1 1 A 35 35 PRO C C 35 176.837 175.402 1.435 1
1 317 . 15 1 1 A 35 35 PRO CA C 35 61.864 61.987 -0.123 1
1 318 . 15 1 1 A 35 35 PRO CB C 35 30.904 31.788 -0.884 1
1 321 . 15 1 1 A 36 36 SER H H 36 9.634 8.304 1.330 1
1 322 . 15 1 1 A 36 36 SER HA H 36 4.518 4.874 -0.356 1
1 325 . 15 1 1 A 36 36 SER C C 36 175.001 175.328 -0.327 1
1 326 . 15 1 1 A 36 36 SER CA C 36 57.129 58.052 -0.923 1
1 327 . 15 1 1 A 36 36 SER CB C 36 65.374 64.992 0.382 1
1 328 . 15 1 1 A 36 36 SER N N 36 119.984 116.895 3.089 1
1 329 . 15 1 1 A 37 37 GLU H H 37 9.091 9.001 0.090 1
1 330 . 15 1 1 A 37 37 GLU HA H 37 3.884 3.918 -0.034 1
1 335 . 15 1 1 A 37 37 GLU C C 37 179.347 178.357 0.990 1
1 336 . 15 1 1 A 37 37 GLU CA C 37 60.454 59.421 1.033 1
1 337 . 15 1 1 A 37 37 GLU CB C 37 28.623 29.296 -0.673 1
1 339 . 15 1 1 A 37 37 GLU N N 37 120.748 124.211 -3.463 1
1 340 . 15 1 1 A 38 38 GLU H H 38 8.760 7.975 0.785 1
1 341 . 15 1 1 A 38 38 GLU HA H 38 4.048 4.060 -0.012 1
1 346 . 15 1 1 A 38 38 GLU C C 38 179.975 178.983 0.992 1
1 347 . 15 1 1 A 38 38 GLU CA C 38 60.243 59.148 1.095 1
1 348 . 15 1 1 A 38 38 GLU CB C 38 29.117 29.815 -0.698 1
1 350 . 15 1 1 A 38 38 GLU N N 38 119.272 120.150 -0.878 1
1 351 . 15 1 1 A 39 39 GLU H H 39 7.856 8.011 -0.155 1
1 352 . 15 1 1 A 39 39 GLU HA H 39 3.976 3.891 0.085 1
1 357 . 15 1 1 A 39 39 GLU C C 39 178.912 178.893 0.019 1
1 358 . 15 1 1 A 39 39 GLU CA C 39 59.131 59.159 -0.028 1
1 359 . 15 1 1 A 39 39 GLU CB C 39 29.612 28.769 0.843 1
1 361 . 15 1 1 A 39 39 GLU N N 39 121.658 120.773 0.885 1
1 362 . 15 1 1 A 40 40 LYS H H 40 8.653 7.765 0.888 1
1 363 . 15 1 1 A 40 40 LYS HA H 40 3.508 3.798 -0.290 1
1 372 . 15 1 1 A 40 40 LYS C C 40 177.974 178.910 -0.936 1
1 373 . 15 1 1 A 40 40 LYS CA C 40 60.948 59.421 1.527 1
1 374 . 15 1 1 A 40 40 LYS CB C 40 32.714 32.057 0.657 1
1 378 . 15 1 1 A 40 40 LYS N N 40 119.152 119.760 -0.608 1
1 379 . 15 1 1 A 41 41 GLN H H 41 7.876 7.398 0.478 1
1 380 . 15 1 1 A 41 41 GLN HA H 41 3.911 3.940 -0.029 1
1 387 . 15 1 1 A 41 41 GLN C C 41 178.352 178.171 0.181 1
1 388 . 15 1 1 A 41 41 GLN CA C 41 58.973 58.829 0.144 1
1 389 . 15 1 1 A 41 41 GLN CB C 41 27.552 28.973 -1.421 1
1 391 . 15 1 1 A 41 41 GLN N N 41 118.910 119.486 -0.576 1
1 393 . 15 1 1 A 42 42 MET H H 42 7.771 7.866 -0.095 1
1 394 . 15 1 1 A 42 42 MET HA H 42 4.158 4.203 -0.045 1
1 402 . 15 1 1 A 42 42 MET C C 42 179.310 178.235 1.075 1
1 403 . 15 1 1 A 42 42 MET CA C 42 59.079 58.287 0.792 1
1 404 . 15 1 1 A 42 42 MET CB C 42 31.023 32.473 -1.450 1
1 407 . 15 1 1 A 42 42 MET N N 42 121.131 119.222 1.909 1
1 408 . 15 1 1 A 43 43 LEU H H 43 8.400 8.415 -0.015 1
1 409 . 15 1 1 A 43 43 LEU HA H 43 3.888 3.964 -0.076 1
1 419 . 15 1 1 A 43 43 LEU C C 43 180.721 178.944 1.777 1
1 420 . 15 1 1 A 43 43 LEU CA C 43 57.916 58.050 -0.134 1
1 421 . 15 1 1 A 43 43 LEU CB C 43 42.080 41.563 0.517 1
1 425 . 15 1 1 A 43 43 LEU N N 43 120.124 120.723 -0.599 1
1 426 . 15 1 1 A 44 44 SER H H 44 8.658 8.504 0.154 1
1 427 . 15 1 1 A 44 44 SER HA H 44 4.088 4.210 -0.122 1
1 430 . 15 1 1 A 44 44 SER C C 44 176.859 176.650 0.209 1
1 431 . 15 1 1 A 44 44 SER CA C 44 61.371 60.974 0.397 1
1 432 . 15 1 1 A 44 44 SER CB C 44 63.314 62.954 0.360 1
1 433 . 15 1 1 A 44 44 SER N N 44 119.795 113.901 5.894 1
1 434 . 15 1 1 A 45 45 GLU H H 45 7.905 7.606 0.299 1
1 435 . 15 1 1 A 45 45 GLU HA H 45 4.094 4.222 -0.128 1
1 440 . 15 1 1 A 45 45 GLU C C 45 179.095 179.010 0.085 1
1 441 . 15 1 1 A 45 45 GLU CA C 45 59.255 58.984 0.271 1
1 442 . 15 1 1 A 45 45 GLU CB C 45 29.200 29.829 -0.629 1
1 444 . 15 1 1 A 45 45 GLU N N 45 120.609 121.041 -0.432 1
1 445 . 15 1 1 A 46 46 LYS H H 46 7.837 7.942 -0.105 1
1 446 . 15 1 1 A 46 46 LYS HA H 46 4.231 4.147 0.084 1
1 453 . 15 1 1 A 46 46 LYS C C 46 177.964 178.236 -0.272 1
1 454 . 15 1 1 A 46 46 LYS CA C 46 58.278 58.794 -0.516 1
1 455 . 15 1 1 A 46 46 LYS CB C 46 34.110 32.553 1.557 1
1 459 . 15 1 1 A 46 46 LYS N N 46 115.471 118.814 -3.343 1
1 460 . 15 1 1 A 47 47 THR H H 47 7.763 8.097 -0.334 1
1 461 . 15 1 1 A 47 47 THR HA H 47 4.271 4.259 0.012 1
1 466 . 15 1 1 A 47 47 THR C C 47 175.472 174.827 0.645 1
1 467 . 15 1 1 A 47 47 THR CA C 47 62.429 62.237 0.192 1
1 468 . 15 1 1 A 47 47 THR CB C 47 71.966 70.256 1.710 1
1 470 . 15 1 1 A 47 47 THR N N 47 104.286 108.107 -3.821 1
1 471 . 15 1 1 A 48 48 ASN H H 48 8.169 8.025 0.144 1
1 472 . 15 1 1 A 48 48 ASN HA H 48 4.437 4.642 -0.205 1
1 477 . 15 1 1 A 48 48 ASN C C 48 173.874 173.946 -0.072 1
1 478 . 15 1 1 A 48 48 ASN CA C 48 55.377 54.419 0.958 1
1 479 . 15 1 1 A 48 48 ASN CB C 48 37.770 36.660 1.110 1
1 480 . 15 1 1 A 48 48 ASN N N 48 117.458 115.952 1.506 1
1 482 . 15 1 1 A 49 49 LEU H H 49 7.532 7.055 0.477 1
1 483 . 15 1 1 A 49 49 LEU HA H 49 4.733 4.797 -0.064 1
1 493 . 15 1 1 A 49 49 LEU C C 49 176.625 175.598 1.027 1
1 494 . 15 1 1 A 49 49 LEU CA C 49 53.226 53.287 -0.061 1
1 495 . 15 1 1 A 49 49 LEU CB C 49 44.114 43.613 0.501 1
1 499 . 15 1 1 A 49 49 LEU N N 49 118.220 119.178 -0.958 1
1 500 . 15 1 1 A 50 50 SER H H 50 9.140 8.819 0.321 1
1 501 . 15 1 1 A 50 50 SER HA H 50 4.475 4.819 -0.344 1
1 504 . 15 1 1 A 50 50 SER C C 50 174.907 175.189 -0.282 1
1 505 . 15 1 1 A 50 50 SER CA C 50 56.964 57.978 -1.014 1
1 506 . 15 1 1 A 50 50 SER CB C 50 65.372 64.688 0.684 1
1 507 . 15 1 1 A 50 50 SER N N 50 117.569 117.687 -0.118 1
1 508 . 15 1 1 A 51 51 LEU H H 51 8.756 8.709 0.047 1
1 509 . 15 1 1 A 51 51 LEU HA H 51 3.874 3.912 -0.038 1
1 519 . 15 1 1 A 51 51 LEU C C 51 179.910 178.769 1.141 1
1 520 . 15 1 1 A 51 51 LEU CA C 51 58.916 58.160 0.756 1
1 521 . 15 1 1 A 51 51 LEU CB C 51 41.148 41.368 -0.220 1
1 525 . 15 1 1 A 51 51 LEU N N 51 120.905 125.866 -4.961 1
1 526 . 15 1 1 A 52 52 LEU H H 52 8.146 8.268 -0.122 1
1 527 . 15 1 1 A 52 52 LEU HA H 52 4.179 4.020 0.159 1
1 537 . 15 1 1 A 52 52 LEU C C 52 178.936 178.741 0.195 1
1 538 . 15 1 1 A 52 52 LEU CA C 52 58.162 58.404 -0.242 1
1 539 . 15 1 1 A 52 52 LEU CB C 52 42.137 41.652 0.485 1
1 543 . 15 1 1 A 52 52 LEU N N 52 120.685 120.223 0.462 1
1 544 . 15 1 1 A 53 53 GLN H H 53 7.924 8.136 -0.212 1
1 545 . 15 1 1 A 53 53 GLN HA H 53 4.102 4.132 -0.030 1
1 552 . 15 1 1 A 53 53 GLN C C 53 180.308 178.482 1.826 1
1 553 . 15 1 1 A 53 53 GLN CA C 53 59.326 58.388 0.938 1
1 554 . 15 1 1 A 53 53 GLN CB C 53 29.900 28.386 1.514 1
1 556 . 15 1 1 A 53 53 GLN N N 53 118.473 117.451 1.022 1
1 558 . 15 1 1 A 54 54 ILE H H 54 8.380 8.274 0.106 1
1 559 . 15 1 1 A 54 54 ILE HA H 54 3.677 3.729 -0.052 1
1 569 . 15 1 1 A 54 54 ILE C C 54 177.673 178.096 -0.423 1
1 570 . 15 1 1 A 54 54 ILE CA C 54 64.650 65.290 -0.640 1
1 571 . 15 1 1 A 54 54 ILE CB C 54 37.476 37.799 -0.323 1
1 575 . 15 1 1 A 54 54 ILE N N 54 120.113 121.452 -1.339 1
1 576 . 15 1 1 A 55 55 SER H H 55 8.854 8.059 0.795 1
1 577 . 15 1 1 A 55 55 SER HA H 55 4.267 4.266 0.001 1
1 580 . 15 1 1 A 55 55 SER C C 55 177.127 176.821 0.306 1
1 581 . 15 1 1 A 55 55 SER CA C 55 62.852 62.443 0.409 1
1 582 . 15 1 1 A 55 55 SER CB C 55 62.727 62.921 -0.194 1
1 583 . 15 1 1 A 55 55 SER N N 55 116.646 116.046 0.600 1
1 584 . 15 1 1 A 56 56 ASN H H 56 8.634 8.218 0.416 1
1 585 . 15 1 1 A 56 56 ASN HA H 56 4.549 4.483 0.066 1
1 590 . 15 1 1 A 56 56 ASN C C 56 177.481 178.421 -0.940 1
1 591 . 15 1 1 A 56 56 ASN CA C 56 55.951 56.481 -0.530 1
1 592 . 15 1 1 A 56 56 ASN CB C 56 37.852 38.361 -0.509 1
1 593 . 15 1 1 A 56 56 ASN N N 56 119.048 119.960 -0.912 1
1 595 . 15 1 1 A 57 57 TRP H H 57 8.373 8.406 -0.033 1
1 596 . 15 1 1 A 57 57 TRP HA H 57 4.065 4.334 -0.269 1
1 605 . 15 1 1 A 57 57 TRP C C 57 179.392 178.294 1.098 1
1 606 . 15 1 1 A 57 57 TRP CA C 57 63.204 61.235 1.969 1
1 607 . 15 1 1 A 57 57 TRP CB C 57 28.376 29.212 -0.836 1
1 613 . 15 1 1 A 57 57 TRP N N 57 122.950 123.055 -0.105 1
1 615 . 15 1 1 A 58 58 PHE H H 58 8.428 8.212 0.216 1
1 616 . 15 1 1 A 58 58 PHE HA H 58 3.922 4.208 -0.286 1
1 624 . 15 1 1 A 58 58 PHE C C 58 178.237 178.019 0.218 1
1 625 . 15 1 1 A 58 58 PHE CA C 58 64.015 61.155 2.860 1
1 626 . 15 1 1 A 58 58 PHE CB C 58 39.602 38.194 1.408 1
1 632 . 15 1 1 A 58 58 PHE N N 58 116.774 117.381 -0.607 1
1 633 . 15 1 1 A 59 59 ILE H H 59 7.925 8.063 -0.138 1
1 634 . 15 1 1 A 59 59 ILE HA H 59 3.773 3.602 0.171 1
1 644 . 15 1 1 A 59 59 ILE C C 59 178.745 177.436 1.309 1
1 645 . 15 1 1 A 59 59 ILE CA C 59 65.531 65.017 0.514 1
1 646 . 15 1 1 A 59 59 ILE CB C 59 38.480 37.610 0.870 1
1 650 . 15 1 1 A 59 59 ILE N N 59 119.560 120.363 -0.803 1
1 651 . 15 1 1 A 60 60 ASN H H 60 7.506 8.081 -0.575 1
1 652 . 15 1 1 A 60 60 ASN HA H 60 4.407 4.367 0.040 1
1 657 . 15 1 1 A 60 60 ASN C C 60 177.163 177.654 -0.491 1
1 658 . 15 1 1 A 60 60 ASN CA C 60 55.871 56.363 -0.492 1
1 659 . 15 1 1 A 60 60 ASN CB C 60 38.878 37.839 1.039 1
1 660 . 15 1 1 A 60 60 ASN N N 60 116.868 118.124 -1.256 1
1 662 . 15 1 1 A 61 61 ALA H H 61 8.410 7.765 0.645 1
1 663 . 15 1 1 A 61 61 ALA HA H 61 3.667 3.713 -0.046 1
1 667 . 15 1 1 A 61 61 ALA C C 61 180.061 179.510 0.551 1
1 668 . 15 1 1 A 61 61 ALA CA C 61 54.601 54.462 0.139 1
1 669 . 15 1 1 A 61 61 ALA CB C 61 18.241 17.475 0.766 1
1 670 . 15 1 1 A 61 61 ALA N N 61 123.022 122.640 0.382 1
1 671 . 15 1 1 A 62 62 ARG H H 62 8.036 7.584 0.452 1
1 672 . 15 1 1 A 62 62 ARG HA H 62 4.092 4.062 0.030 1
1 679 . 15 1 1 A 62 62 ARG C C 62 176.756 177.939 -1.183 1
1 680 . 15 1 1 A 62 62 ARG CA C 62 58.762 58.165 0.597 1
1 681 . 15 1 1 A 62 62 ARG CB C 62 30.601 30.019 0.582 1
1 684 . 15 1 1 A 62 62 ARG N N 62 117.168 118.456 -1.288 1
1 685 . 15 1 1 A 63 63 ARG H H 63 7.214 7.846 -0.632 1
1 686 . 15 1 1 A 63 63 ARG HA H 63 4.249 4.261 -0.012 1
1 693 . 15 1 1 A 63 63 ARG C C 63 176.945 176.761 0.184 1
1 694 . 15 1 1 A 63 63 ARG CA C 63 57.669 57.768 -0.099 1
1 695 . 15 1 1 A 63 63 ARG CB C 63 30.765 30.930 -0.165 1
1 698 . 15 1 1 A 63 63 ARG N N 63 116.514 118.062 -1.548 1
1 699 . 15 1 1 A 64 64 ARG H H 64 7.913 7.772 0.141 1
1 700 . 15 1 1 A 64 64 ARG HA H 64 4.351 4.595 -0.244 1
1 707 . 15 1 1 A 64 64 ARG C C 64 176.413 178.452 -2.039 1
1 708 . 15 1 1 A 64 64 ARG CA C 64 57.105 57.073 0.032 1
1 709 . 15 1 1 A 64 64 ARG CB C 64 31.672 32.530 -0.858 1
1 712 . 15 1 1 A 64 64 ARG N N 64 116.818 118.829 -2.011 1
1 713 . 15 1 1 A 65 65 ILE H H 65 8.169 8.226 -0.057 1
1 714 . 15 1 1 A 65 65 ILE HA H 65 4.285 3.611 0.674 1
1 724 . 15 1 1 A 65 65 ILE C C 65 176.208 178.064 -1.856 1
1 725 . 15 1 1 A 65 65 ILE CA C 65 62.005 65.318 -3.313 1
1 726 . 15 1 1 A 65 65 ILE CB C 65 39.088 37.778 1.310 1
1 730 . 15 1 1 A 65 65 ILE N N 65 119.185 119.406 -0.221 1
1 731 . 15 1 1 A 66 66 LEU H H 66 7.962 7.834 0.128 1
1 732 . 15 1 1 A 66 66 LEU HA H 66 4.485 4.105 0.380 1
1 742 . 15 1 1 A 66 66 LEU C C 66 176.216 175.322 0.894 1
1 743 . 15 1 1 A 66 66 LEU CA C 66 56.153 59.918 -3.765 1
1 744 . 15 1 1 A 66 66 LEU CB C 66 40.792 40.142 0.650 1
1 748 . 15 1 1 A 66 66 LEU N N 66 124.389 122.038 2.351 1
1 749 . 15 1 1 A 67 67 PRO HA H 67 4.283 4.411 -0.128 1
1 756 . 15 1 1 A 67 67 PRO C C 67 178.294 177.732 0.562 1
1 757 . 15 1 1 A 67 67 PRO CA C 67 65.390 64.959 0.431 1
1 758 . 15 1 1 A 67 67 PRO CB C 67 31.095 31.291 -0.196 1
1 761 . 15 1 1 A 68 68 ASP H H 68 7.913 8.893 -0.980 1
1 762 . 15 1 1 A 68 68 ASP HA H 68 4.507 4.505 0.002 1
1 765 . 15 1 1 A 68 68 ASP C C 68 177.927 178.435 -0.508 1
1 766 . 15 1 1 A 68 68 ASP CA C 68 55.906 56.051 -0.145 1
1 767 . 15 1 1 A 68 68 ASP CB C 68 40.736 41.187 -0.451 1
1 768 . 15 1 1 A 68 68 ASP N N 68 117.231 117.284 -0.053 1
1 769 . 15 1 1 A 69 69 MET H H 69 8.083 8.464 -0.381 1
1 770 . 15 1 1 A 69 69 MET HA H 69 4.362 4.244 0.118 1
1 778 . 15 1 1 A 69 69 MET C C 69 177.374 179.071 -1.697 1
1 779 . 15 1 1 A 69 69 MET CA C 69 57.634 58.166 -0.532 1
1 780 . 15 1 1 A 69 69 MET CB C 69 32.816 32.383 0.433 1
1 783 . 15 1 1 A 69 69 MET N N 69 119.391 118.775 0.616 1
1 784 . 15 1 1 A 70 70 LEU H H 70 7.907 7.377 0.530 1
1 785 . 15 1 1 A 70 70 LEU HA H 70 4.232 4.150 0.082 1
1 795 . 15 1 1 A 70 70 LEU C C 70 177.745 177.734 0.011 1
1 796 . 15 1 1 A 70 70 LEU CA C 70 55.835 58.075 -2.240 1
1 797 . 15 1 1 A 70 70 LEU CB C 70 42.174 41.408 0.766 1
1 801 . 15 1 1 A 70 70 LEU N N 70 119.266 119.653 -0.387 1
1 802 . 15 1 1 A 71 71 GLN H H 71 7.865 7.629 0.236 1
1 803 . 15 1 1 A 71 71 GLN HA H 71 4.287 4.428 -0.141 1
1 809 . 15 1 1 A 71 71 GLN C C 71 178.855 175.914 2.941 1
1 810 . 15 1 1 A 71 71 GLN CA C 71 56.383 56.328 0.055 1
1 811 . 15 1 1 A 71 71 GLN CB C 71 29.092 29.424 -0.332 1
1 813 . 15 1 1 A 71 71 GLN N N 71 118.603 117.995 0.608 1
1 815 . 15 1 1 A 72 72 GLN H H 72 8.189 8.107 0.082 1
1 816 . 15 1 1 A 72 72 GLN HA H 72 4.302 4.328 -0.026 1
1 821 . 15 1 1 A 72 72 GLN CA C 72 56.206 57.005 -0.799 1
1 822 . 15 1 1 A 72 72 GLN CB C 72 29.298 29.494 -0.196 1
1 824 . 15 1 1 A 72 72 GLN N N 72 120.267 121.823 -1.556 1
1 825 . 15 1 1 A 73 73 ARG C C 73 176.105 176.147 -0.042 1
1 826 . 15 1 1 A 74 74 ARG HA H 74 4.334 3.883 0.451 1
1 833 . 15 1 1 A 74 74 ARG C C 74 176.188 176.096 0.092 1
1 834 . 15 1 1 A 74 74 ARG CA C 74 56.300 59.931 -3.631 1
1 835 . 15 1 1 A 74 74 ARG CB C 74 30.668 30.015 0.653 1
1 838 . 15 1 1 A 75 75 ASN C C 75 174.462 174.881 -0.419 1
1 839 . 15 1 1 A 75 75 ASN CA C 75 53.148 53.452 -0.304 1
1 840 . 15 1 1 A 75 75 ASN CB C 75 39.046 38.586 0.460 1
1 841 . 15 1 1 A 76 76 ASP H H 76 8.257 8.680 -0.423 1
1 842 . 15 1 1 A 76 76 ASP HA H 76 4.877 5.289 -0.412 1
1 845 . 15 1 1 A 76 76 ASP C C 76 174.759 174.893 -0.134 1
1 846 . 15 1 1 A 76 76 ASP CA C 76 52.380 51.694 0.686 1
1 847 . 15 1 1 A 76 76 ASP CB C 76 41.267 42.074 -0.807 1
1 848 . 15 1 1 A 76 76 ASP N N 76 122.030 119.200 2.830 1
1 849 . 15 1 1 A 77 77 PRO HA H 77 4.466 4.520 -0.054 1
1 856 . 15 1 1 A 77 77 PRO C C 77 177.133 177.349 -0.216 1
1 857 . 15 1 1 A 77 77 PRO CA C 77 63.733 62.881 0.852 1
1 858 . 15 1 1 A 77 77 PRO CB C 77 31.919 32.250 -0.331 1
1 861 . 15 1 1 A 78 78 SER H H 78 8.457 8.219 0.238 1
1 862 . 15 1 1 A 78 78 SER HA H 78 4.479 4.369 0.110 1
1 865 . 15 1 1 A 78 78 SER C C 78 174.731 174.679 0.052 1
1 866 . 15 1 1 A 78 78 SER CA C 78 58.691 60.160 -1.469 1
1 867 . 15 1 1 A 78 78 SER CB C 78 63.973 64.414 -0.441 1
1 868 . 15 1 1 A 78 78 SER N N 78 115.711 118.583 -2.872 1
1 869 . 15 1 1 A 79 79 GLY H H 79 8.090 8.536 -0.446 1
1 870 . 15 1 1 A 79 79 GLY HA2 H 79 4.179 4.394 -0.215 1
1 871 . 15 1 1 A 79 79 GLY HA3 H 79 4.065 4.404 -0.339 1
1 872 . 15 1 1 A 79 79 GLY CA C 79 44.746 46.679 -1.933 1
1 873 . 15 1 1 A 79 79 GLY N N 79 110.429 113.590 -3.161 1
1 874 . 15 1 1 A 80 80 PRO HA H 80 4.464 4.605 -0.141 1
1 880 . 15 1 1 A 80 80 PRO C C 80 177.499 175.851 1.648 1
1 881 . 15 1 1 A 80 80 PRO CA C 80 63.275 62.994 0.281 1
1 882 . 15 1 1 A 80 80 PRO CB C 80 32.249 32.342 -0.093 1
1 1 . 16 1 1 A 13 13 ASN HA H 13 4.787 4.896 -0.109 1
1 6 . 16 1 1 A 13 13 ASN CA C 13 53.148 53.501 -0.353 1
1 7 . 16 1 1 A 13 13 ASN CB C 13 39.378 40.301 -0.923 1
1 9 . 16 1 1 A 14 14 LEU H H 14 8.418 8.464 -0.046 1
1 10 . 16 1 1 A 14 14 LEU HA H 14 4.654 4.694 -0.040 1
1 20 . 16 1 1 A 14 14 LEU CA C 14 52.999 51.655 1.344 1
1 21 . 16 1 1 A 14 14 LEU CB C 14 41.919 43.398 -1.479 1
1 25 . 16 1 1 A 14 14 LEU N N 14 122.671 121.021 1.650 1
1 26 . 16 1 1 A 15 15 PRO HA H 15 4.460 4.626 -0.166 1
1 33 . 16 1 1 A 15 15 PRO C C 15 178.156 177.594 0.562 1
1 34 . 16 1 1 A 15 15 PRO CA C 15 63.101 62.642 0.459 1
1 35 . 16 1 1 A 15 15 PRO CB C 15 32.304 32.096 0.208 1
1 38 . 16 1 1 A 16 16 ALA H H 16 8.973 8.625 0.348 1
1 39 . 16 1 1 A 16 16 ALA HA H 16 4.021 3.956 0.065 1
1 43 . 16 1 1 A 16 16 ALA C C 16 180.695 179.620 1.075 1
1 44 . 16 1 1 A 16 16 ALA CA C 16 55.642 55.628 0.014 1
1 45 . 16 1 1 A 16 16 ALA CB C 16 18.552 18.637 -0.085 1
1 46 . 16 1 1 A 16 16 ALA N N 16 128.311 127.158 1.153 1
1 47 . 16 1 1 A 17 17 GLU H H 17 9.558 8.451 1.107 1
1 48 . 16 1 1 A 17 17 GLU HA H 17 4.065 4.015 0.050 1
1 53 . 16 1 1 A 17 17 GLU C C 17 178.886 179.057 -0.171 1
1 54 . 16 1 1 A 17 17 GLU CA C 17 59.400 59.770 -0.370 1
1 55 . 16 1 1 A 17 17 GLU CB C 17 28.742 29.523 -0.781 1
1 57 . 16 1 1 A 17 17 GLU N N 17 117.113 118.820 -1.707 1
1 58 . 16 1 1 A 18 18 SER H H 18 7.263 7.927 -0.664 1
1 59 . 16 1 1 A 18 18 SER HA H 18 4.180 4.117 0.063 1
1 62 . 16 1 1 A 18 18 SER C C 18 174.951 175.948 -0.997 1
1 63 . 16 1 1 A 18 18 SER CA C 18 61.969 62.457 -0.488 1
1 64 . 16 1 1 A 18 18 SER CB C 18 62.554 62.803 -0.249 1
1 65 . 16 1 1 A 18 18 SER N N 18 114.932 117.315 -2.383 1
1 66 . 16 1 1 A 19 19 VAL H H 19 7.620 8.212 -0.592 1
1 67 . 16 1 1 A 19 19 VAL HA H 19 3.011 3.252 -0.241 1
1 75 . 16 1 1 A 19 19 VAL C C 19 176.953 177.600 -0.647 1
1 76 . 16 1 1 A 19 19 VAL CA C 19 66.479 66.766 -0.287 1
1 77 . 16 1 1 A 19 19 VAL CB C 19 31.569 31.481 0.088 1
1 80 . 16 1 1 A 19 19 VAL N N 19 121.086 121.436 -0.350 1
1 81 . 16 1 1 A 20 20 LYS H H 20 7.745 8.343 -0.598 1
1 82 . 16 1 1 A 20 20 LYS HA H 20 3.884 3.988 -0.104 1
1 91 . 16 1 1 A 20 20 LYS C C 20 178.150 178.557 -0.407 1
1 92 . 16 1 1 A 20 20 LYS CA C 20 59.984 59.810 0.174 1
1 93 . 16 1 1 A 20 20 LYS CB C 20 32.351 32.158 0.193 1
1 97 . 16 1 1 A 20 20 LYS N N 20 119.366 119.696 -0.330 1
1 98 . 16 1 1 A 21 21 ILE H H 21 6.943 7.962 -1.019 1
1 99 . 16 1 1 A 21 21 ILE HA H 21 3.783 3.638 0.145 1
1 109 . 16 1 1 A 21 21 ILE C C 21 178.996 178.695 0.301 1
1 110 . 16 1 1 A 21 21 ILE CA C 21 64.642 65.757 -1.115 1
1 111 . 16 1 1 A 21 21 ILE CB C 21 38.014 37.966 0.048 1
1 115 . 16 1 1 A 21 21 ILE N N 21 118.163 119.541 -1.378 1
1 116 . 16 1 1 A 22 22 LEU H H 22 7.267 7.936 -0.669 1
1 117 . 16 1 1 A 22 22 LEU HA H 22 3.748 3.834 -0.086 1
1 127 . 16 1 1 A 22 22 LEU C C 22 178.289 178.631 -0.342 1
1 128 . 16 1 1 A 22 22 LEU CA C 22 58.092 58.120 -0.028 1
1 129 . 16 1 1 A 22 22 LEU CB C 22 38.551 40.751 -2.200 1
1 133 . 16 1 1 A 22 22 LEU N N 22 120.609 119.334 1.275 1
1 134 . 16 1 1 A 23 23 ARG H H 23 8.676 8.782 -0.106 1
1 135 . 16 1 1 A 23 23 ARG HA H 23 4.030 4.173 -0.143 1
1 142 . 16 1 1 A 23 23 ARG C C 23 178.861 178.332 0.529 1
1 143 . 16 1 1 A 23 23 ARG CA C 23 60.404 60.072 0.332 1
1 144 . 16 1 1 A 23 23 ARG CB C 23 30.351 30.196 0.155 1
1 147 . 16 1 1 A 23 23 ARG N N 23 119.148 117.698 1.450 1
1 148 . 16 1 1 A 24 24 ASP H H 24 8.515 8.427 0.088 1
1 149 . 16 1 1 A 24 24 ASP HA H 24 4.519 4.374 0.145 1
1 152 . 16 1 1 A 24 24 ASP C C 24 178.759 178.563 0.196 1
1 153 . 16 1 1 A 24 24 ASP CA C 24 57.556 57.149 0.407 1
1 154 . 16 1 1 A 24 24 ASP CB C 24 40.569 40.887 -0.318 1
1 155 . 16 1 1 A 24 24 ASP N N 24 120.027 119.340 0.687 1
1 156 . 16 1 1 A 25 25 TRP H H 25 8.158 7.767 0.391 1
1 157 . 16 1 1 A 25 25 TRP HA H 25 4.181 4.465 -0.284 1
1 166 . 16 1 1 A 25 25 TRP C C 25 179.946 178.393 1.553 1
1 167 . 16 1 1 A 25 25 TRP CA C 25 63.346 61.429 1.917 1
1 168 . 16 1 1 A 25 25 TRP CB C 25 29.433 29.757 -0.324 1
1 174 . 16 1 1 A 25 25 TRP N N 25 121.350 121.622 -0.272 1
1 176 . 16 1 1 A 26 26 MET H H 26 8.977 8.633 0.344 1
1 177 . 16 1 1 A 26 26 MET HA H 26 4.076 4.617 -0.541 1
1 185 . 16 1 1 A 26 26 MET C C 26 177.371 178.005 -0.634 1
1 186 . 16 1 1 A 26 26 MET CA C 26 60.454 58.854 1.600 1
1 187 . 16 1 1 A 26 26 MET CB C 26 33.567 32.537 1.030 1
1 190 . 16 1 1 A 26 26 MET N N 26 119.977 118.811 1.166 1
1 191 . 16 1 1 A 27 27 TYR H H 27 8.604 8.354 0.250 1
1 192 . 16 1 1 A 27 27 TYR HA H 27 4.138 4.118 0.020 1
1 199 . 16 1 1 A 27 27 TYR C C 27 178.901 177.550 1.351 1
1 200 . 16 1 1 A 27 27 TYR CA C 27 61.846 61.222 0.624 1
1 201 . 16 1 1 A 27 27 TYR CB C 27 38.165 38.566 -0.401 1
1 206 . 16 1 1 A 27 27 TYR N N 27 117.797 121.433 -3.636 1
1 207 . 16 1 1 A 28 28 LYS H H 28 7.867 7.693 0.174 1
1 208 . 16 1 1 A 28 28 LYS HA H 28 3.797 3.615 0.182 1
1 217 . 16 1 1 A 28 28 LYS C C 28 176.858 177.555 -0.697 1
1 218 . 16 1 1 A 28 28 LYS CA C 28 58.174 58.994 -0.820 1
1 219 . 16 1 1 A 28 28 LYS CB C 28 32.516 31.997 0.519 1
1 223 . 16 1 1 A 28 28 LYS N N 28 118.982 117.701 1.281 1
1 224 . 16 1 1 A 29 29 HIS H H 29 7.443 7.134 0.309 1
1 225 . 16 1 1 A 29 29 HIS HA H 29 4.386 4.343 0.043 1
1 230 . 16 1 1 A 29 29 HIS C C 29 176.085 175.715 0.370 1
1 231 . 16 1 1 A 29 29 HIS CA C 29 55.213 55.281 -0.068 1
1 232 . 16 1 1 A 29 29 HIS CB C 29 27.085 28.714 -1.629 1
1 235 . 16 1 1 A 29 29 HIS N N 29 117.138 115.633 1.505 1
1 236 . 16 1 1 A 30 30 ARG H H 30 6.921 8.058 -1.137 1
1 237 . 16 1 1 A 30 30 ARG HA H 30 3.898 4.245 -0.347 1
1 244 . 16 1 1 A 30 30 ARG C C 30 175.808 177.974 -2.166 1
1 245 . 16 1 1 A 30 30 ARG CA C 30 58.609 58.418 0.191 1
1 246 . 16 1 1 A 30 30 ARG CB C 30 28.739 29.590 -0.851 1
1 249 . 16 1 1 A 30 30 ARG N N 30 117.911 119.252 -1.341 1
1 250 . 16 1 1 A 31 31 PHE H H 31 7.819 7.548 0.271 1
1 251 . 16 1 1 A 31 31 PHE HA H 31 4.533 4.309 0.224 1
1 259 . 16 1 1 A 31 31 PHE C C 31 175.577 176.568 -0.991 1
1 260 . 16 1 1 A 31 31 PHE CA C 31 58.029 60.904 -2.875 1
1 261 . 16 1 1 A 31 31 PHE CB C 31 37.792 38.830 -1.038 1
1 267 . 16 1 1 A 31 31 PHE N N 31 115.408 118.797 -3.389 1
1 268 . 16 1 1 A 32 32 LYS H H 32 7.858 7.944 -0.086 1
1 269 . 16 1 1 A 32 32 LYS HA H 32 4.487 4.597 -0.110 1
1 277 . 16 1 1 A 32 32 LYS C C 32 175.557 176.345 -0.788 1
1 278 . 16 1 1 A 32 32 LYS CA C 32 56.329 56.477 -0.148 1
1 279 . 16 1 1 A 32 32 LYS CB C 32 32.743 34.784 -2.041 1
1 283 . 16 1 1 A 32 32 LYS N N 32 122.453 113.006 9.447 1
1 284 . 16 1 1 A 33 33 ALA H H 33 8.643 8.128 0.515 1
1 285 . 16 1 1 A 33 33 ALA HA H 33 4.403 4.094 0.309 1
1 289 . 16 1 1 A 33 33 ALA C C 33 176.273 175.364 0.909 1
1 290 . 16 1 1 A 33 33 ALA CA C 33 53.579 53.241 0.338 1
1 291 . 16 1 1 A 33 33 ALA CB C 33 18.653 17.177 1.476 1
1 292 . 16 1 1 A 33 33 ALA N N 33 127.853 120.534 7.319 1
1 293 . 16 1 1 A 34 34 TYR H H 34 7.878 8.049 -0.171 1
1 294 . 16 1 1 A 34 34 TYR HA H 34 4.686 4.901 -0.215 1
1 301 . 16 1 1 A 34 34 TYR C C 34 173.133 173.265 -0.132 1
1 302 . 16 1 1 A 34 34 TYR CA C 34 54.778 54.910 -0.132 1
1 303 . 16 1 1 A 34 34 TYR CB C 34 39.619 40.582 -0.963 1
1 308 . 16 1 1 A 34 34 TYR N N 34 116.539 116.597 -0.058 1
1 309 . 16 1 1 A 35 35 PRO HA H 35 4.526 4.562 -0.036 1
1 316 . 16 1 1 A 35 35 PRO C C 35 176.837 175.571 1.266 1
1 317 . 16 1 1 A 35 35 PRO CA C 35 61.864 62.072 -0.208 1
1 318 . 16 1 1 A 35 35 PRO CB C 35 30.904 32.255 -1.351 1
1 321 . 16 1 1 A 36 36 SER H H 36 9.634 8.436 1.198 1
1 322 . 16 1 1 A 36 36 SER HA H 36 4.518 4.751 -0.233 1
1 325 . 16 1 1 A 36 36 SER C C 36 175.001 175.213 -0.212 1
1 326 . 16 1 1 A 36 36 SER CA C 36 57.129 56.479 0.650 1
1 327 . 16 1 1 A 36 36 SER CB C 36 65.374 65.495 -0.121 1
1 328 . 16 1 1 A 36 36 SER N N 36 119.984 116.611 3.373 1
1 329 . 16 1 1 A 37 37 GLU H H 37 9.091 9.103 -0.012 1
1 330 . 16 1 1 A 37 37 GLU HA H 37 3.884 3.943 -0.059 1
1 335 . 16 1 1 A 37 37 GLU C C 37 179.347 178.353 0.994 1
1 336 . 16 1 1 A 37 37 GLU CA C 37 60.454 59.385 1.069 1
1 337 . 16 1 1 A 37 37 GLU CB C 37 28.623 29.215 -0.592 1
1 339 . 16 1 1 A 37 37 GLU N N 37 120.748 126.601 -5.853 1
1 340 . 16 1 1 A 38 38 GLU H H 38 8.760 7.940 0.820 1
1 341 . 16 1 1 A 38 38 GLU HA H 38 4.048 4.083 -0.035 1
1 346 . 16 1 1 A 38 38 GLU C C 38 179.975 178.841 1.134 1
1 347 . 16 1 1 A 38 38 GLU CA C 38 60.243 59.115 1.128 1
1 348 . 16 1 1 A 38 38 GLU CB C 38 29.117 29.874 -0.757 1
1 350 . 16 1 1 A 38 38 GLU N N 38 119.272 120.129 -0.857 1
1 351 . 16 1 1 A 39 39 GLU H H 39 7.856 7.953 -0.097 1
1 352 . 16 1 1 A 39 39 GLU HA H 39 3.976 3.886 0.090 1
1 357 . 16 1 1 A 39 39 GLU C C 39 178.912 178.647 0.265 1
1 358 . 16 1 1 A 39 39 GLU CA C 39 59.131 59.133 -0.002 1
1 359 . 16 1 1 A 39 39 GLU CB C 39 29.612 28.843 0.769 1
1 361 . 16 1 1 A 39 39 GLU N N 39 121.658 120.790 0.868 1
1 362 . 16 1 1 A 40 40 LYS H H 40 8.653 7.747 0.906 1
1 363 . 16 1 1 A 40 40 LYS HA H 40 3.508 3.869 -0.361 1
1 372 . 16 1 1 A 40 40 LYS C C 40 177.974 178.855 -0.881 1
1 373 . 16 1 1 A 40 40 LYS CA C 40 60.948 59.511 1.437 1
1 374 . 16 1 1 A 40 40 LYS CB C 40 32.714 32.056 0.658 1
1 378 . 16 1 1 A 40 40 LYS N N 40 119.152 119.438 -0.286 1
1 379 . 16 1 1 A 41 41 GLN H H 41 7.876 7.573 0.303 1
1 380 . 16 1 1 A 41 41 GLN HA H 41 3.911 3.945 -0.034 1
1 387 . 16 1 1 A 41 41 GLN C C 41 178.352 178.183 0.169 1
1 388 . 16 1 1 A 41 41 GLN CA C 41 58.973 58.757 0.216 1
1 389 . 16 1 1 A 41 41 GLN CB C 41 27.552 28.501 -0.949 1
1 391 . 16 1 1 A 41 41 GLN N N 41 118.910 119.535 -0.625 1
1 393 . 16 1 1 A 42 42 MET H H 42 7.771 7.663 0.108 1
1 394 . 16 1 1 A 42 42 MET HA H 42 4.158 4.270 -0.112 1
1 402 . 16 1 1 A 42 42 MET C C 42 179.310 178.253 1.057 1
1 403 . 16 1 1 A 42 42 MET CA C 42 59.079 57.900 1.179 1
1 404 . 16 1 1 A 42 42 MET CB C 42 31.023 32.443 -1.420 1
1 407 . 16 1 1 A 42 42 MET N N 42 121.131 119.556 1.575 1
1 408 . 16 1 1 A 43 43 LEU H H 43 8.400 8.268 0.132 1
1 409 . 16 1 1 A 43 43 LEU HA H 43 3.888 3.956 -0.068 1
1 419 . 16 1 1 A 43 43 LEU C C 43 180.721 178.732 1.989 1
1 420 . 16 1 1 A 43 43 LEU CA C 43 57.916 58.079 -0.163 1
1 421 . 16 1 1 A 43 43 LEU CB C 43 42.080 41.348 0.732 1
1 425 . 16 1 1 A 43 43 LEU N N 43 120.124 120.822 -0.698 1
1 426 . 16 1 1 A 44 44 SER H H 44 8.658 8.485 0.173 1
1 427 . 16 1 1 A 44 44 SER HA H 44 4.088 4.055 0.033 1
1 430 . 16 1 1 A 44 44 SER C C 44 176.859 176.609 0.250 1
1 431 . 16 1 1 A 44 44 SER CA C 44 61.371 61.092 0.279 1
1 432 . 16 1 1 A 44 44 SER CB C 44 63.314 62.916 0.398 1
1 433 . 16 1 1 A 44 44 SER N N 44 119.795 113.622 6.173 1
1 434 . 16 1 1 A 45 45 GLU H H 45 7.905 7.606 0.299 1
1 435 . 16 1 1 A 45 45 GLU HA H 45 4.094 4.204 -0.110 1
1 440 . 16 1 1 A 45 45 GLU C C 45 179.095 179.408 -0.313 1
1 441 . 16 1 1 A 45 45 GLU CA C 45 59.255 59.008 0.247 1
1 442 . 16 1 1 A 45 45 GLU CB C 45 29.200 29.655 -0.455 1
1 444 . 16 1 1 A 45 45 GLU N N 45 120.609 121.221 -0.612 1
1 445 . 16 1 1 A 46 46 LYS H H 46 7.837 8.143 -0.306 1
1 446 . 16 1 1 A 46 46 LYS HA H 46 4.231 4.140 0.091 1
1 453 . 16 1 1 A 46 46 LYS C C 46 177.964 178.545 -0.581 1
1 454 . 16 1 1 A 46 46 LYS CA C 46 58.278 58.966 -0.688 1
1 455 . 16 1 1 A 46 46 LYS CB C 46 34.110 32.578 1.532 1
1 459 . 16 1 1 A 46 46 LYS N N 46 115.471 119.379 -3.908 1
1 460 . 16 1 1 A 47 47 THR H H 47 7.763 8.091 -0.328 1
1 461 . 16 1 1 A 47 47 THR HA H 47 4.271 4.295 -0.024 1
1 466 . 16 1 1 A 47 47 THR C C 47 175.472 174.977 0.495 1
1 467 . 16 1 1 A 47 47 THR CA C 47 62.429 62.144 0.285 1
1 468 . 16 1 1 A 47 47 THR CB C 47 71.966 70.216 1.750 1
1 470 . 16 1 1 A 47 47 THR N N 47 104.286 108.017 -3.731 1
1 471 . 16 1 1 A 48 48 ASN H H 48 8.169 8.166 0.003 1
1 472 . 16 1 1 A 48 48 ASN HA H 48 4.437 4.605 -0.168 1
1 477 . 16 1 1 A 48 48 ASN C C 48 173.874 173.895 -0.021 1
1 478 . 16 1 1 A 48 48 ASN CA C 48 55.377 54.412 0.965 1
1 479 . 16 1 1 A 48 48 ASN CB C 48 37.770 36.502 1.268 1
1 480 . 16 1 1 A 48 48 ASN N N 48 117.458 116.052 1.406 1
1 482 . 16 1 1 A 49 49 LEU H H 49 7.532 7.196 0.336 1
1 483 . 16 1 1 A 49 49 LEU HA H 49 4.733 4.876 -0.143 1
1 493 . 16 1 1 A 49 49 LEU C C 49 176.625 175.629 0.996 1
1 494 . 16 1 1 A 49 49 LEU CA C 49 53.226 53.138 0.088 1
1 495 . 16 1 1 A 49 49 LEU CB C 49 44.114 44.250 -0.136 1
1 499 . 16 1 1 A 49 49 LEU N N 49 118.220 119.032 -0.812 1
1 500 . 16 1 1 A 50 50 SER H H 50 9.140 8.752 0.388 1
1 501 . 16 1 1 A 50 50 SER HA H 50 4.475 4.966 -0.491 1
1 504 . 16 1 1 A 50 50 SER C C 50 174.907 175.036 -0.129 1
1 505 . 16 1 1 A 50 50 SER CA C 50 56.964 57.673 -0.709 1
1 506 . 16 1 1 A 50 50 SER CB C 50 65.372 65.006 0.366 1
1 507 . 16 1 1 A 50 50 SER N N 50 117.569 117.629 -0.060 1
1 508 . 16 1 1 A 51 51 LEU H H 51 8.756 8.770 -0.014 1
1 509 . 16 1 1 A 51 51 LEU HA H 51 3.874 3.918 -0.044 1
1 519 . 16 1 1 A 51 51 LEU C C 51 179.910 178.883 1.027 1
1 520 . 16 1 1 A 51 51 LEU CA C 51 58.916 58.161 0.755 1
1 521 . 16 1 1 A 51 51 LEU CB C 51 41.148 41.410 -0.262 1
1 525 . 16 1 1 A 51 51 LEU N N 51 120.905 125.749 -4.844 1
1 526 . 16 1 1 A 52 52 LEU H H 52 8.146 8.218 -0.072 1
1 527 . 16 1 1 A 52 52 LEU HA H 52 4.179 4.013 0.166 1
1 537 . 16 1 1 A 52 52 LEU C C 52 178.936 178.630 0.306 1
1 538 . 16 1 1 A 52 52 LEU CA C 52 58.162 58.452 -0.290 1
1 539 . 16 1 1 A 52 52 LEU CB C 52 42.137 41.505 0.632 1
1 543 . 16 1 1 A 52 52 LEU N N 52 120.685 120.119 0.566 1
1 544 . 16 1 1 A 53 53 GLN H H 53 7.924 8.010 -0.086 1
1 545 . 16 1 1 A 53 53 GLN HA H 53 4.102 4.159 -0.057 1
1 552 . 16 1 1 A 53 53 GLN C C 53 180.308 178.673 1.635 1
1 553 . 16 1 1 A 53 53 GLN CA C 53 59.326 58.707 0.619 1
1 554 . 16 1 1 A 53 53 GLN CB C 53 29.900 28.372 1.528 1
1 556 . 16 1 1 A 53 53 GLN N N 53 118.473 117.438 1.035 1
1 558 . 16 1 1 A 54 54 ILE H H 54 8.380 8.289 0.091 1
1 559 . 16 1 1 A 54 54 ILE HA H 54 3.677 3.663 0.014 1
1 569 . 16 1 1 A 54 54 ILE C C 54 177.673 178.166 -0.493 1
1 570 . 16 1 1 A 54 54 ILE CA C 54 64.650 65.486 -0.836 1
1 571 . 16 1 1 A 54 54 ILE CB C 54 37.476 37.876 -0.400 1
1 575 . 16 1 1 A 54 54 ILE N N 54 120.113 121.615 -1.502 1
1 576 . 16 1 1 A 55 55 SER H H 55 8.854 8.192 0.662 1
1 577 . 16 1 1 A 55 55 SER HA H 55 4.267 4.283 -0.016 1
1 580 . 16 1 1 A 55 55 SER C C 55 177.127 177.622 -0.495 1
1 581 . 16 1 1 A 55 55 SER CA C 55 62.852 61.813 1.039 1
1 582 . 16 1 1 A 55 55 SER CB C 55 62.727 63.141 -0.414 1
1 583 . 16 1 1 A 55 55 SER N N 55 116.646 115.805 0.841 1
1 584 . 16 1 1 A 56 56 ASN H H 56 8.634 8.250 0.384 1
1 585 . 16 1 1 A 56 56 ASN HA H 56 4.549 4.453 0.096 1
1 590 . 16 1 1 A 56 56 ASN C C 56 177.481 178.398 -0.917 1
1 591 . 16 1 1 A 56 56 ASN CA C 56 55.951 56.425 -0.474 1
1 592 . 16 1 1 A 56 56 ASN CB C 56 37.852 38.355 -0.503 1
1 593 . 16 1 1 A 56 56 ASN N N 56 119.048 118.841 0.207 1
1 595 . 16 1 1 A 57 57 TRP H H 57 8.373 8.152 0.221 1
1 596 . 16 1 1 A 57 57 TRP HA H 57 4.065 4.394 -0.329 1
1 605 . 16 1 1 A 57 57 TRP C C 57 179.392 178.137 1.255 1
1 606 . 16 1 1 A 57 57 TRP CA C 57 63.204 61.269 1.935 1
1 607 . 16 1 1 A 57 57 TRP CB C 57 28.376 29.863 -1.487 1
1 613 . 16 1 1 A 57 57 TRP N N 57 122.950 122.787 0.163 1
1 615 . 16 1 1 A 58 58 PHE H H 58 8.428 8.555 -0.127 1
1 616 . 16 1 1 A 58 58 PHE HA H 58 3.922 3.658 0.264 1
1 624 . 16 1 1 A 58 58 PHE C C 58 178.237 177.768 0.469 1
1 625 . 16 1 1 A 58 58 PHE CA C 58 64.015 61.430 2.585 1
1 626 . 16 1 1 A 58 58 PHE CB C 58 39.602 38.374 1.228 1
1 632 . 16 1 1 A 58 58 PHE N N 58 116.774 117.532 -0.758 1
1 633 . 16 1 1 A 59 59 ILE H H 59 7.925 7.906 0.019 1
1 634 . 16 1 1 A 59 59 ILE HA H 59 3.773 3.535 0.238 1
1 644 . 16 1 1 A 59 59 ILE C C 59 178.745 177.899 0.846 1
1 645 . 16 1 1 A 59 59 ILE CA C 59 65.531 64.981 0.550 1
1 646 . 16 1 1 A 59 59 ILE CB C 59 38.480 37.568 0.912 1
1 650 . 16 1 1 A 59 59 ILE N N 59 119.560 120.120 -0.560 1
1 651 . 16 1 1 A 60 60 ASN H H 60 7.506 7.934 -0.428 1
1 652 . 16 1 1 A 60 60 ASN HA H 60 4.407 4.430 -0.023 1
1 657 . 16 1 1 A 60 60 ASN C C 60 177.163 177.373 -0.210 1
1 658 . 16 1 1 A 60 60 ASN CA C 60 55.871 55.302 0.569 1
1 659 . 16 1 1 A 60 60 ASN CB C 60 38.878 38.817 0.061 1
1 660 . 16 1 1 A 60 60 ASN N N 60 116.868 119.539 -2.671 1
1 662 . 16 1 1 A 61 61 ALA H H 61 8.410 7.985 0.425 1
1 663 . 16 1 1 A 61 61 ALA HA H 61 3.667 3.800 -0.133 1
1 667 . 16 1 1 A 61 61 ALA C C 61 180.061 179.519 0.542 1
1 668 . 16 1 1 A 61 61 ALA CA C 61 54.601 54.550 0.051 1
1 669 . 16 1 1 A 61 61 ALA CB C 61 18.241 17.599 0.642 1
1 670 . 16 1 1 A 61 61 ALA N N 61 123.022 121.239 1.783 1
1 671 . 16 1 1 A 62 62 ARG H H 62 8.036 8.219 -0.183 1
1 672 . 16 1 1 A 62 62 ARG HA H 62 4.092 4.058 0.034 1
1 679 . 16 1 1 A 62 62 ARG C C 62 176.756 177.084 -0.328 1
1 680 . 16 1 1 A 62 62 ARG CA C 62 58.762 57.614 1.148 1
1 681 . 16 1 1 A 62 62 ARG CB C 62 30.601 28.934 1.667 1
1 684 . 16 1 1 A 62 62 ARG N N 62 117.168 116.938 0.230 1
1 685 . 16 1 1 A 63 63 ARG H H 63 7.214 7.779 -0.565 1
1 686 . 16 1 1 A 63 63 ARG HA H 63 4.249 4.259 -0.010 1
1 693 . 16 1 1 A 63 63 ARG C C 63 176.945 176.741 0.204 1
1 694 . 16 1 1 A 63 63 ARG CA C 63 57.669 57.391 0.278 1
1 695 . 16 1 1 A 63 63 ARG CB C 63 30.765 30.759 0.006 1
1 698 . 16 1 1 A 63 63 ARG N N 63 116.514 118.406 -1.892 1
1 699 . 16 1 1 A 64 64 ARG H H 64 7.913 7.684 0.229 1
1 700 . 16 1 1 A 64 64 ARG HA H 64 4.351 4.520 -0.169 1
1 707 . 16 1 1 A 64 64 ARG C C 64 176.413 177.243 -0.830 1
1 708 . 16 1 1 A 64 64 ARG CA C 64 57.105 56.169 0.936 1
1 709 . 16 1 1 A 64 64 ARG CB C 64 31.672 31.438 0.234 1
1 712 . 16 1 1 A 64 64 ARG N N 64 116.818 119.114 -2.296 1
1 713 . 16 1 1 A 65 65 ILE H H 65 8.169 8.087 0.082 1
1 714 . 16 1 1 A 65 65 ILE HA H 65 4.285 4.080 0.205 1
1 724 . 16 1 1 A 65 65 ILE C C 65 176.208 177.298 -1.090 1
1 725 . 16 1 1 A 65 65 ILE CA C 65 62.005 63.382 -1.377 1
1 726 . 16 1 1 A 65 65 ILE CB C 65 39.088 38.703 0.385 1
1 730 . 16 1 1 A 65 65 ILE N N 65 119.185 118.700 0.485 1
1 731 . 16 1 1 A 66 66 LEU H H 66 7.962 7.975 -0.013 1
1 732 . 16 1 1 A 66 66 LEU HA H 66 4.485 4.058 0.427 1
1 742 . 16 1 1 A 66 66 LEU C C 66 176.216 175.322 0.894 1
1 743 . 16 1 1 A 66 66 LEU CA C 66 56.153 59.810 -3.657 1
1 744 . 16 1 1 A 66 66 LEU CB C 66 40.792 39.941 0.851 1
1 748 . 16 1 1 A 66 66 LEU N N 66 124.389 121.351 3.038 1
1 749 . 16 1 1 A 67 67 PRO HA H 67 4.283 4.385 -0.102 1
1 756 . 16 1 1 A 67 67 PRO C C 67 178.294 178.583 -0.289 1
1 757 . 16 1 1 A 67 67 PRO CA C 67 65.390 65.392 -0.002 1
1 758 . 16 1 1 A 67 67 PRO CB C 67 31.095 31.305 -0.210 1
1 761 . 16 1 1 A 68 68 ASP H H 68 7.913 8.374 -0.461 1
1 762 . 16 1 1 A 68 68 ASP HA H 68 4.507 4.411 0.096 1
1 765 . 16 1 1 A 68 68 ASP C C 68 177.927 178.396 -0.469 1
1 766 . 16 1 1 A 68 68 ASP CA C 68 55.906 57.049 -1.143 1
1 767 . 16 1 1 A 68 68 ASP CB C 68 40.736 40.844 -0.108 1
1 768 . 16 1 1 A 68 68 ASP N N 68 117.231 117.511 -0.280 1
1 769 . 16 1 1 A 69 69 MET H H 69 8.083 8.637 -0.554 1
1 770 . 16 1 1 A 69 69 MET HA H 69 4.362 4.222 0.140 1
1 778 . 16 1 1 A 69 69 MET C C 69 177.374 179.382 -2.008 1
1 779 . 16 1 1 A 69 69 MET CA C 69 57.634 58.772 -1.138 1
1 780 . 16 1 1 A 69 69 MET CB C 69 32.816 32.452 0.364 1
1 783 . 16 1 1 A 69 69 MET N N 69 119.391 119.133 0.258 1
1 784 . 16 1 1 A 70 70 LEU H H 70 7.907 7.967 -0.060 1
1 785 . 16 1 1 A 70 70 LEU HA H 70 4.232 4.014 0.218 1
1 795 . 16 1 1 A 70 70 LEU C C 70 177.745 177.521 0.224 1
1 796 . 16 1 1 A 70 70 LEU CA C 70 55.835 57.888 -2.053 1
1 797 . 16 1 1 A 70 70 LEU CB C 70 42.174 41.160 1.014 1
1 801 . 16 1 1 A 70 70 LEU N N 70 119.266 120.421 -1.155 1
1 802 . 16 1 1 A 71 71 GLN H H 71 7.865 7.436 0.429 1
1 803 . 16 1 1 A 71 71 GLN HA H 71 4.287 4.215 0.072 1
1 809 . 16 1 1 A 71 71 GLN C C 71 178.855 176.197 2.658 1
1 810 . 16 1 1 A 71 71 GLN CA C 71 56.383 56.333 0.050 1
1 811 . 16 1 1 A 71 71 GLN CB C 71 29.092 29.136 -0.044 1
1 813 . 16 1 1 A 71 71 GLN N N 71 118.603 119.260 -0.657 1
1 815 . 16 1 1 A 72 72 GLN H H 72 8.189 8.837 -0.648 1
1 816 . 16 1 1 A 72 72 GLN HA H 72 4.302 3.882 0.420 1
1 821 . 16 1 1 A 72 72 GLN CA C 72 56.206 56.739 -0.533 1
1 822 . 16 1 1 A 72 72 GLN CB C 72 29.298 26.452 2.846 1
1 824 . 16 1 1 A 72 72 GLN N N 72 120.267 117.679 2.588 1
1 825 . 16 1 1 A 73 73 ARG C C 73 176.105 176.388 -0.283 1
1 826 . 16 1 1 A 74 74 ARG HA H 74 4.334 4.145 0.189 1
1 833 . 16 1 1 A 74 74 ARG C C 74 176.188 175.678 0.510 1
1 834 . 16 1 1 A 74 74 ARG CA C 74 56.300 57.181 -0.881 1
1 835 . 16 1 1 A 74 74 ARG CB C 74 30.668 30.696 -0.028 1
1 838 . 16 1 1 A 75 75 ASN C C 75 174.462 174.075 0.387 1
1 839 . 16 1 1 A 75 75 ASN CA C 75 53.148 54.812 -1.664 1
1 840 . 16 1 1 A 75 75 ASN CB C 75 39.046 40.872 -1.826 1
1 841 . 16 1 1 A 76 76 ASP H H 76 8.257 7.992 0.265 1
1 842 . 16 1 1 A 76 76 ASP HA H 76 4.877 4.975 -0.098 1
1 845 . 16 1 1 A 76 76 ASP C C 76 174.759 174.767 -0.008 1
1 846 . 16 1 1 A 76 76 ASP CA C 76 52.380 51.369 1.011 1
1 847 . 16 1 1 A 76 76 ASP CB C 76 41.267 42.336 -1.069 1
1 848 . 16 1 1 A 76 76 ASP N N 76 122.030 119.408 2.622 1
1 849 . 16 1 1 A 77 77 PRO HA H 77 4.466 4.656 -0.190 1
1 856 . 16 1 1 A 77 77 PRO C C 77 177.133 176.356 0.777 1
1 857 . 16 1 1 A 77 77 PRO CA C 77 63.733 62.881 0.852 1
1 858 . 16 1 1 A 77 77 PRO CB C 77 31.919 31.769 0.150 1
1 861 . 16 1 1 A 78 78 SER H H 78 8.457 8.403 0.054 1
1 862 . 16 1 1 A 78 78 SER HA H 78 4.479 4.888 -0.409 1
1 865 . 16 1 1 A 78 78 SER C C 78 174.731 174.783 -0.052 1
1 866 . 16 1 1 A 78 78 SER CA C 78 58.691 56.634 2.057 1
1 867 . 16 1 1 A 78 78 SER CB C 78 63.973 65.652 -1.679 1
1 868 . 16 1 1 A 78 78 SER N N 78 115.711 114.871 0.840 1
1 869 . 16 1 1 A 79 79 GLY H H 79 8.090 8.509 -0.419 1
1 870 . 16 1 1 A 79 79 GLY HA2 H 79 4.179 3.988 0.191 1
1 871 . 16 1 1 A 79 79 GLY HA3 H 79 4.065 3.989 0.076 1
1 872 . 16 1 1 A 79 79 GLY CA C 79 44.746 45.390 -0.644 1
1 873 . 16 1 1 A 79 79 GLY N N 79 110.429 108.871 1.558 1
1 874 . 16 1 1 A 80 80 PRO HA H 80 4.464 4.388 0.076 1
1 880 . 16 1 1 A 80 80 PRO C C 80 177.499 176.025 1.474 1
1 881 . 16 1 1 A 80 80 PRO CA C 80 63.275 64.820 -1.545 1
1 882 . 16 1 1 A 80 80 PRO CB C 80 32.249 32.081 0.168 1
1 1 . 17 1 1 A 13 13 ASN HA H 13 4.787 4.962 -0.175 1
1 6 . 17 1 1 A 13 13 ASN CA C 13 53.148 53.160 -0.012 1
1 7 . 17 1 1 A 13 13 ASN CB C 13 39.378 39.933 -0.555 1
1 9 . 17 1 1 A 14 14 LEU H H 14 8.418 8.500 -0.082 1
1 10 . 17 1 1 A 14 14 LEU HA H 14 4.654 4.678 -0.024 1
1 20 . 17 1 1 A 14 14 LEU CA C 14 52.999 52.794 0.205 1
1 21 . 17 1 1 A 14 14 LEU CB C 14 41.919 40.852 1.067 1
1 25 . 17 1 1 A 14 14 LEU N N 14 122.671 121.401 1.270 1
1 26 . 17 1 1 A 15 15 PRO HA H 15 4.460 4.616 -0.156 1
1 33 . 17 1 1 A 15 15 PRO C C 15 178.156 177.573 0.583 1
1 34 . 17 1 1 A 15 15 PRO CA C 15 63.101 62.693 0.408 1
1 35 . 17 1 1 A 15 15 PRO CB C 15 32.304 32.290 0.014 1
1 38 . 17 1 1 A 16 16 ALA H H 16 8.973 8.628 0.345 1
1 39 . 17 1 1 A 16 16 ALA HA H 16 4.021 3.954 0.067 1
1 43 . 17 1 1 A 16 16 ALA C C 16 180.695 179.191 1.504 1
1 44 . 17 1 1 A 16 16 ALA CA C 16 55.642 55.580 0.062 1
1 45 . 17 1 1 A 16 16 ALA CB C 16 18.552 18.626 -0.074 1
1 46 . 17 1 1 A 16 16 ALA N N 16 128.311 127.061 1.250 1
1 47 . 17 1 1 A 17 17 GLU H H 17 9.558 8.213 1.345 1
1 48 . 17 1 1 A 17 17 GLU HA H 17 4.065 4.084 -0.019 1
1 53 . 17 1 1 A 17 17 GLU C C 17 178.886 178.540 0.346 1
1 54 . 17 1 1 A 17 17 GLU CA C 17 59.400 59.334 0.066 1
1 55 . 17 1 1 A 17 17 GLU CB C 17 28.742 29.274 -0.532 1
1 57 . 17 1 1 A 17 17 GLU N N 17 117.113 117.335 -0.222 1
1 58 . 17 1 1 A 18 18 SER H H 18 7.263 7.872 -0.609 1
1 59 . 17 1 1 A 18 18 SER HA H 18 4.180 4.141 0.039 1
1 62 . 17 1 1 A 18 18 SER C C 18 174.951 176.120 -1.169 1
1 63 . 17 1 1 A 18 18 SER CA C 18 61.969 62.507 -0.538 1
1 64 . 17 1 1 A 18 18 SER CB C 18 62.554 62.892 -0.338 1
1 65 . 17 1 1 A 18 18 SER N N 18 114.932 116.656 -1.724 1
1 66 . 17 1 1 A 19 19 VAL H H 19 7.620 8.307 -0.687 1
1 67 . 17 1 1 A 19 19 VAL HA H 19 3.011 3.226 -0.215 1
1 75 . 17 1 1 A 19 19 VAL C C 19 176.953 177.772 -0.819 1
1 76 . 17 1 1 A 19 19 VAL CA C 19 66.479 66.647 -0.168 1
1 77 . 17 1 1 A 19 19 VAL CB C 19 31.569 31.450 0.119 1
1 80 . 17 1 1 A 19 19 VAL N N 19 121.086 121.415 -0.329 1
1 81 . 17 1 1 A 20 20 LYS H H 20 7.745 8.443 -0.698 1
1 82 . 17 1 1 A 20 20 LYS HA H 20 3.884 4.016 -0.132 1
1 91 . 17 1 1 A 20 20 LYS C C 20 178.150 178.811 -0.661 1
1 92 . 17 1 1 A 20 20 LYS CA C 20 59.984 59.693 0.291 1
1 93 . 17 1 1 A 20 20 LYS CB C 20 32.351 32.242 0.109 1
1 97 . 17 1 1 A 20 20 LYS N N 20 119.366 119.635 -0.269 1
1 98 . 17 1 1 A 21 21 ILE H H 21 6.943 7.759 -0.816 1
1 99 . 17 1 1 A 21 21 ILE HA H 21 3.783 3.669 0.114 1
1 109 . 17 1 1 A 21 21 ILE C C 21 178.996 178.626 0.370 1
1 110 . 17 1 1 A 21 21 ILE CA C 21 64.642 65.641 -0.999 1
1 111 . 17 1 1 A 21 21 ILE CB C 21 38.014 37.840 0.174 1
1 115 . 17 1 1 A 21 21 ILE N N 21 118.163 120.391 -2.228 1
1 116 . 17 1 1 A 22 22 LEU H H 22 7.267 8.159 -0.892 1
1 117 . 17 1 1 A 22 22 LEU HA H 22 3.748 3.964 -0.216 1
1 127 . 17 1 1 A 22 22 LEU C C 22 178.289 178.810 -0.521 1
1 128 . 17 1 1 A 22 22 LEU CA C 22 58.092 57.913 0.179 1
1 129 . 17 1 1 A 22 22 LEU CB C 22 38.551 40.808 -2.257 1
1 133 . 17 1 1 A 22 22 LEU N N 22 120.609 119.176 1.433 1
1 134 . 17 1 1 A 23 23 ARG H H 23 8.676 8.770 -0.094 1
1 135 . 17 1 1 A 23 23 ARG HA H 23 4.030 4.244 -0.214 1
1 142 . 17 1 1 A 23 23 ARG C C 23 178.861 178.226 0.635 1
1 143 . 17 1 1 A 23 23 ARG CA C 23 60.404 59.959 0.445 1
1 144 . 17 1 1 A 23 23 ARG CB C 23 30.351 30.175 0.176 1
1 147 . 17 1 1 A 23 23 ARG N N 23 119.148 117.831 1.317 1
1 148 . 17 1 1 A 24 24 ASP H H 24 8.515 8.333 0.182 1
1 149 . 17 1 1 A 24 24 ASP HA H 24 4.519 4.377 0.142 1
1 152 . 17 1 1 A 24 24 ASP C C 24 178.759 178.541 0.218 1
1 153 . 17 1 1 A 24 24 ASP CA C 24 57.556 57.153 0.403 1
1 154 . 17 1 1 A 24 24 ASP CB C 24 40.569 40.955 -0.386 1
1 155 . 17 1 1 A 24 24 ASP N N 24 120.027 119.329 0.698 1
1 156 . 17 1 1 A 25 25 TRP H H 25 8.158 8.138 0.020 1
1 157 . 17 1 1 A 25 25 TRP HA H 25 4.181 4.456 -0.275 1
1 166 . 17 1 1 A 25 25 TRP C C 25 179.946 178.561 1.385 1
1 167 . 17 1 1 A 25 25 TRP CA C 25 63.346 61.383 1.963 1
1 168 . 17 1 1 A 25 25 TRP CB C 25 29.433 29.652 -0.219 1
1 174 . 17 1 1 A 25 25 TRP N N 25 121.350 121.610 -0.260 1
1 176 . 17 1 1 A 26 26 MET H H 26 8.977 8.559 0.418 1
1 177 . 17 1 1 A 26 26 MET HA H 26 4.076 4.527 -0.451 1
1 185 . 17 1 1 A 26 26 MET C C 26 177.371 178.064 -0.693 1
1 186 . 17 1 1 A 26 26 MET CA C 26 60.454 58.964 1.490 1
1 187 . 17 1 1 A 26 26 MET CB C 26 33.567 32.405 1.162 1
1 190 . 17 1 1 A 26 26 MET N N 26 119.977 118.789 1.188 1
1 191 . 17 1 1 A 27 27 TYR H H 27 8.604 8.259 0.345 1
1 192 . 17 1 1 A 27 27 TYR HA H 27 4.138 4.174 -0.036 1
1 199 . 17 1 1 A 27 27 TYR C C 27 178.901 177.507 1.394 1
1 200 . 17 1 1 A 27 27 TYR CA C 27 61.846 61.263 0.583 1
1 201 . 17 1 1 A 27 27 TYR CB C 27 38.165 38.540 -0.375 1
1 206 . 17 1 1 A 27 27 TYR N N 27 117.797 121.207 -3.410 1
1 207 . 17 1 1 A 28 28 LYS H H 28 7.867 7.794 0.073 1
1 208 . 17 1 1 A 28 28 LYS HA H 28 3.797 3.800 -0.003 1
1 217 . 17 1 1 A 28 28 LYS C C 28 176.858 177.799 -0.941 1
1 218 . 17 1 1 A 28 28 LYS CA C 28 58.174 59.331 -1.157 1
1 219 . 17 1 1 A 28 28 LYS CB C 28 32.516 32.004 0.512 1
1 223 . 17 1 1 A 28 28 LYS N N 28 118.982 117.966 1.016 1
1 224 . 17 1 1 A 29 29 HIS H H 29 7.443 7.203 0.240 1
1 225 . 17 1 1 A 29 29 HIS HA H 29 4.386 4.335 0.051 1
1 230 . 17 1 1 A 29 29 HIS C C 29 176.085 175.886 0.199 1
1 231 . 17 1 1 A 29 29 HIS CA C 29 55.213 55.497 -0.284 1
1 232 . 17 1 1 A 29 29 HIS CB C 29 27.085 28.571 -1.486 1
1 235 . 17 1 1 A 29 29 HIS N N 29 117.138 115.595 1.543 1
1 236 . 17 1 1 A 30 30 ARG H H 30 6.921 8.131 -1.210 1
1 237 . 17 1 1 A 30 30 ARG HA H 30 3.898 4.191 -0.293 1
1 244 . 17 1 1 A 30 30 ARG C C 30 175.808 178.011 -2.203 1
1 245 . 17 1 1 A 30 30 ARG CA C 30 58.609 58.402 0.207 1
1 246 . 17 1 1 A 30 30 ARG CB C 30 28.739 29.499 -0.760 1
1 249 . 17 1 1 A 30 30 ARG N N 30 117.911 119.199 -1.288 1
1 250 . 17 1 1 A 31 31 PHE H H 31 7.819 7.668 0.151 1
1 251 . 17 1 1 A 31 31 PHE HA H 31 4.533 4.335 0.198 1
1 259 . 17 1 1 A 31 31 PHE C C 31 175.577 176.656 -1.079 1
1 260 . 17 1 1 A 31 31 PHE CA C 31 58.029 60.827 -2.798 1
1 261 . 17 1 1 A 31 31 PHE CB C 31 37.792 38.868 -1.076 1
1 267 . 17 1 1 A 31 31 PHE N N 31 115.408 118.651 -3.243 1
1 268 . 17 1 1 A 32 32 LYS H H 32 7.858 7.896 -0.038 1
1 269 . 17 1 1 A 32 32 LYS HA H 32 4.487 4.502 -0.015 1
1 277 . 17 1 1 A 32 32 LYS C C 32 175.557 176.303 -0.746 1
1 278 . 17 1 1 A 32 32 LYS CA C 32 56.329 56.711 -0.382 1
1 279 . 17 1 1 A 32 32 LYS CB C 32 32.743 34.711 -1.968 1
1 283 . 17 1 1 A 32 32 LYS N N 32 122.453 113.211 9.242 1
1 284 . 17 1 1 A 33 33 ALA H H 33 8.643 8.035 0.608 1
1 285 . 17 1 1 A 33 33 ALA HA H 33 4.403 4.033 0.370 1
1 289 . 17 1 1 A 33 33 ALA C C 33 176.273 175.250 1.023 1
1 290 . 17 1 1 A 33 33 ALA CA C 33 53.579 53.168 0.411 1
1 291 . 17 1 1 A 33 33 ALA CB C 33 18.653 17.148 1.505 1
1 292 . 17 1 1 A 33 33 ALA N N 33 127.853 120.493 7.360 1
1 293 . 17 1 1 A 34 34 TYR H H 34 7.878 8.012 -0.134 1
1 294 . 17 1 1 A 34 34 TYR HA H 34 4.686 4.868 -0.182 1
1 301 . 17 1 1 A 34 34 TYR C C 34 173.133 173.269 -0.136 1
1 302 . 17 1 1 A 34 34 TYR CA C 34 54.778 54.894 -0.116 1
1 303 . 17 1 1 A 34 34 TYR CB C 34 39.619 40.730 -1.111 1
1 308 . 17 1 1 A 34 34 TYR N N 34 116.539 116.557 -0.018 1
1 309 . 17 1 1 A 35 35 PRO HA H 35 4.526 4.658 -0.132 1
1 316 . 17 1 1 A 35 35 PRO C C 35 176.837 175.576 1.261 1
1 317 . 17 1 1 A 35 35 PRO CA C 35 61.864 62.104 -0.240 1
1 318 . 17 1 1 A 35 35 PRO CB C 35 30.904 32.172 -1.268 1
1 321 . 17 1 1 A 36 36 SER H H 36 9.634 8.436 1.198 1
1 322 . 17 1 1 A 36 36 SER HA H 36 4.518 4.769 -0.251 1
1 325 . 17 1 1 A 36 36 SER C C 36 175.001 175.347 -0.346 1
1 326 . 17 1 1 A 36 36 SER CA C 36 57.129 56.620 0.509 1
1 327 . 17 1 1 A 36 36 SER CB C 36 65.374 65.265 0.109 1
1 328 . 17 1 1 A 36 36 SER N N 36 119.984 117.033 2.951 1
1 329 . 17 1 1 A 37 37 GLU H H 37 9.091 8.935 0.156 1
1 330 . 17 1 1 A 37 37 GLU HA H 37 3.884 3.920 -0.036 1
1 335 . 17 1 1 A 37 37 GLU C C 37 179.347 178.372 0.975 1
1 336 . 17 1 1 A 37 37 GLU CA C 37 60.454 59.482 0.972 1
1 337 . 17 1 1 A 37 37 GLU CB C 37 28.623 29.138 -0.515 1
1 339 . 17 1 1 A 37 37 GLU N N 37 120.748 126.438 -5.690 1
1 340 . 17 1 1 A 38 38 GLU H H 38 8.760 7.999 0.761 1
1 341 . 17 1 1 A 38 38 GLU HA H 38 4.048 4.104 -0.056 1
1 346 . 17 1 1 A 38 38 GLU C C 38 179.975 179.010 0.965 1
1 347 . 17 1 1 A 38 38 GLU CA C 38 60.243 59.231 1.012 1
1 348 . 17 1 1 A 38 38 GLU CB C 38 29.117 29.771 -0.654 1
1 350 . 17 1 1 A 38 38 GLU N N 38 119.272 120.171 -0.899 1
1 351 . 17 1 1 A 39 39 GLU H H 39 7.856 8.064 -0.208 1
1 352 . 17 1 1 A 39 39 GLU HA H 39 3.976 3.906 0.070 1
1 357 . 17 1 1 A 39 39 GLU C C 39 178.912 178.617 0.295 1
1 358 . 17 1 1 A 39 39 GLU CA C 39 59.131 59.197 -0.066 1
1 359 . 17 1 1 A 39 39 GLU CB C 39 29.612 28.784 0.828 1
1 361 . 17 1 1 A 39 39 GLU N N 39 121.658 120.783 0.875 1
1 362 . 17 1 1 A 40 40 LYS H H 40 8.653 7.731 0.922 1
1 363 . 17 1 1 A 40 40 LYS HA H 40 3.508 3.828 -0.320 1
1 372 . 17 1 1 A 40 40 LYS C C 40 177.974 178.847 -0.873 1
1 373 . 17 1 1 A 40 40 LYS CA C 40 60.948 59.402 1.546 1
1 374 . 17 1 1 A 40 40 LYS CB C 40 32.714 32.084 0.630 1
1 378 . 17 1 1 A 40 40 LYS N N 40 119.152 119.578 -0.426 1
1 379 . 17 1 1 A 41 41 GLN H H 41 7.876 7.565 0.311 1
1 380 . 17 1 1 A 41 41 GLN HA H 41 3.911 3.939 -0.028 1
1 387 . 17 1 1 A 41 41 GLN C C 41 178.352 178.184 0.168 1
1 388 . 17 1 1 A 41 41 GLN CA C 41 58.973 58.826 0.147 1
1 389 . 17 1 1 A 41 41 GLN CB C 41 27.552 28.461 -0.909 1
1 391 . 17 1 1 A 41 41 GLN N N 41 118.910 119.535 -0.625 1
1 393 . 17 1 1 A 42 42 MET H H 42 7.771 7.699 0.072 1
1 394 . 17 1 1 A 42 42 MET HA H 42 4.158 4.269 -0.111 1
1 402 . 17 1 1 A 42 42 MET C C 42 179.310 178.316 0.994 1
1 403 . 17 1 1 A 42 42 MET CA C 42 59.079 57.906 1.173 1
1 404 . 17 1 1 A 42 42 MET CB C 42 31.023 32.417 -1.394 1
1 407 . 17 1 1 A 42 42 MET N N 42 121.131 119.555 1.576 1
1 408 . 17 1 1 A 43 43 LEU H H 43 8.400 8.447 -0.047 1
1 409 . 17 1 1 A 43 43 LEU HA H 43 3.888 3.973 -0.085 1
1 419 . 17 1 1 A 43 43 LEU C C 43 180.721 178.991 1.730 1
1 420 . 17 1 1 A 43 43 LEU CA C 43 57.916 58.035 -0.119 1
1 421 . 17 1 1 A 43 43 LEU CB C 43 42.080 41.479 0.601 1
1 425 . 17 1 1 A 43 43 LEU N N 43 120.124 120.694 -0.570 1
1 426 . 17 1 1 A 44 44 SER H H 44 8.658 8.471 0.187 1
1 427 . 17 1 1 A 44 44 SER HA H 44 4.088 4.100 -0.012 1
1 430 . 17 1 1 A 44 44 SER C C 44 176.859 176.635 0.224 1
1 431 . 17 1 1 A 44 44 SER CA C 44 61.371 60.975 0.396 1
1 432 . 17 1 1 A 44 44 SER CB C 44 63.314 62.942 0.372 1
1 433 . 17 1 1 A 44 44 SER N N 44 119.795 113.908 5.887 1
1 434 . 17 1 1 A 45 45 GLU H H 45 7.905 7.530 0.375 1
1 435 . 17 1 1 A 45 45 GLU HA H 45 4.094 4.203 -0.109 1
1 440 . 17 1 1 A 45 45 GLU C C 45 179.095 179.140 -0.045 1
1 441 . 17 1 1 A 45 45 GLU CA C 45 59.255 59.031 0.224 1
1 442 . 17 1 1 A 45 45 GLU CB C 45 29.200 29.718 -0.518 1
1 444 . 17 1 1 A 45 45 GLU N N 45 120.609 121.094 -0.485 1
1 445 . 17 1 1 A 46 46 LYS H H 46 7.837 7.785 0.052 1
1 446 . 17 1 1 A 46 46 LYS HA H 46 4.231 4.124 0.107 1
1 453 . 17 1 1 A 46 46 LYS C C 46 177.964 178.670 -0.706 1
1 454 . 17 1 1 A 46 46 LYS CA C 46 58.278 59.096 -0.818 1
1 455 . 17 1 1 A 46 46 LYS CB C 46 34.110 32.447 1.663 1
1 459 . 17 1 1 A 46 46 LYS N N 46 115.471 119.485 -4.014 1
1 460 . 17 1 1 A 47 47 THR H H 47 7.763 8.264 -0.501 1
1 461 . 17 1 1 A 47 47 THR HA H 47 4.271 4.197 0.074 1
1 466 . 17 1 1 A 47 47 THR C C 47 175.472 175.193 0.279 1
1 467 . 17 1 1 A 47 47 THR CA C 47 62.429 62.704 -0.275 1
1 468 . 17 1 1 A 47 47 THR CB C 47 71.966 70.114 1.852 1
1 470 . 17 1 1 A 47 47 THR N N 47 104.286 108.270 -3.984 1
1 471 . 17 1 1 A 48 48 ASN H H 48 8.169 8.248 -0.079 1
1 472 . 17 1 1 A 48 48 ASN HA H 48 4.437 4.593 -0.156 1
1 477 . 17 1 1 A 48 48 ASN C C 48 173.874 173.915 -0.041 1
1 478 . 17 1 1 A 48 48 ASN CA C 48 55.377 54.324 1.053 1
1 479 . 17 1 1 A 48 48 ASN CB C 48 37.770 37.431 0.339 1
1 480 . 17 1 1 A 48 48 ASN N N 48 117.458 119.774 -2.316 1
1 482 . 17 1 1 A 49 49 LEU H H 49 7.532 7.074 0.458 1
1 483 . 17 1 1 A 49 49 LEU HA H 49 4.733 4.805 -0.072 1
1 493 . 17 1 1 A 49 49 LEU C C 49 176.625 175.523 1.102 1
1 494 . 17 1 1 A 49 49 LEU CA C 49 53.226 53.288 -0.062 1
1 495 . 17 1 1 A 49 49 LEU CB C 49 44.114 43.672 0.442 1
1 499 . 17 1 1 A 49 49 LEU N N 49 118.220 120.103 -1.883 1
1 500 . 17 1 1 A 50 50 SER H H 50 9.140 8.824 0.316 1
1 501 . 17 1 1 A 50 50 SER HA H 50 4.475 4.826 -0.351 1
1 504 . 17 1 1 A 50 50 SER C C 50 174.907 175.201 -0.294 1
1 505 . 17 1 1 A 50 50 SER CA C 50 56.964 57.780 -0.816 1
1 506 . 17 1 1 A 50 50 SER CB C 50 65.372 65.077 0.295 1
1 507 . 17 1 1 A 50 50 SER N N 50 117.569 117.516 0.053 1
1 508 . 17 1 1 A 51 51 LEU H H 51 8.756 8.966 -0.210 1
1 509 . 17 1 1 A 51 51 LEU HA H 51 3.874 3.964 -0.090 1
1 519 . 17 1 1 A 51 51 LEU C C 51 179.910 178.940 0.970 1
1 520 . 17 1 1 A 51 51 LEU CA C 51 58.916 57.714 1.202 1
1 521 . 17 1 1 A 51 51 LEU CB C 51 41.148 41.653 -0.505 1
1 525 . 17 1 1 A 51 51 LEU N N 51 120.905 125.503 -4.598 1
1 526 . 17 1 1 A 52 52 LEU H H 52 8.146 7.929 0.217 1
1 527 . 17 1 1 A 52 52 LEU HA H 52 4.179 4.131 0.048 1
1 537 . 17 1 1 A 52 52 LEU C C 52 178.936 178.632 0.304 1
1 538 . 17 1 1 A 52 52 LEU CA C 52 58.162 57.947 0.215 1
1 539 . 17 1 1 A 52 52 LEU CB C 52 42.137 41.515 0.622 1
1 543 . 17 1 1 A 52 52 LEU N N 52 120.685 119.562 1.123 1
1 544 . 17 1 1 A 53 53 GLN H H 53 7.924 8.093 -0.169 1
1 545 . 17 1 1 A 53 53 GLN HA H 53 4.102 4.173 -0.071 1
1 552 . 17 1 1 A 53 53 GLN C C 53 180.308 178.575 1.733 1
1 553 . 17 1 1 A 53 53 GLN CA C 53 59.326 58.474 0.852 1
1 554 . 17 1 1 A 53 53 GLN CB C 53 29.900 28.526 1.374 1
1 556 . 17 1 1 A 53 53 GLN N N 53 118.473 118.140 0.333 1
1 558 . 17 1 1 A 54 54 ILE H H 54 8.380 8.287 0.093 1
1 559 . 17 1 1 A 54 54 ILE HA H 54 3.677 3.739 -0.062 1
1 569 . 17 1 1 A 54 54 ILE C C 54 177.673 177.911 -0.238 1
1 570 . 17 1 1 A 54 54 ILE CA C 54 64.650 65.530 -0.880 1
1 571 . 17 1 1 A 54 54 ILE CB C 54 37.476 37.830 -0.354 1
1 575 . 17 1 1 A 54 54 ILE N N 54 120.113 121.711 -1.598 1
1 576 . 17 1 1 A 55 55 SER H H 55 8.854 7.960 0.894 1
1 577 . 17 1 1 A 55 55 SER HA H 55 4.267 4.248 0.019 1
1 580 . 17 1 1 A 55 55 SER C C 55 177.127 176.905 0.222 1
1 581 . 17 1 1 A 55 55 SER CA C 55 62.852 62.266 0.586 1
1 582 . 17 1 1 A 55 55 SER CB C 55 62.727 63.039 -0.312 1
1 583 . 17 1 1 A 55 55 SER N N 55 116.646 116.098 0.548 1
1 584 . 17 1 1 A 56 56 ASN H H 56 8.634 8.043 0.591 1
1 585 . 17 1 1 A 56 56 ASN HA H 56 4.549 4.463 0.086 1
1 590 . 17 1 1 A 56 56 ASN C C 56 177.481 178.195 -0.714 1
1 591 . 17 1 1 A 56 56 ASN CA C 56 55.951 56.556 -0.605 1
1 592 . 17 1 1 A 56 56 ASN CB C 56 37.852 38.297 -0.445 1
1 593 . 17 1 1 A 56 56 ASN N N 56 119.048 120.071 -1.023 1
1 595 . 17 1 1 A 57 57 TRP H H 57 8.373 8.277 0.096 1
1 596 . 17 1 1 A 57 57 TRP HA H 57 4.065 4.411 -0.346 1
1 605 . 17 1 1 A 57 57 TRP C C 57 179.392 178.110 1.282 1
1 606 . 17 1 1 A 57 57 TRP CA C 57 63.204 61.085 2.119 1
1 607 . 17 1 1 A 57 57 TRP CB C 57 28.376 29.623 -1.247 1
1 613 . 17 1 1 A 57 57 TRP N N 57 122.950 123.134 -0.184 1
1 615 . 17 1 1 A 58 58 PHE H H 58 8.428 8.361 0.067 1
1 616 . 17 1 1 A 58 58 PHE HA H 58 3.922 3.651 0.271 1
1 624 . 17 1 1 A 58 58 PHE C C 58 178.237 177.779 0.458 1
1 625 . 17 1 1 A 58 58 PHE CA C 58 64.015 61.456 2.559 1
1 626 . 17 1 1 A 58 58 PHE CB C 58 39.602 38.106 1.496 1
1 632 . 17 1 1 A 58 58 PHE N N 58 116.774 117.561 -0.787 1
1 633 . 17 1 1 A 59 59 ILE H H 59 7.925 8.091 -0.166 1
1 634 . 17 1 1 A 59 59 ILE HA H 59 3.773 3.644 0.129 1
1 644 . 17 1 1 A 59 59 ILE C C 59 178.745 177.734 1.011 1
1 645 . 17 1 1 A 59 59 ILE CA C 59 65.531 65.240 0.291 1
1 646 . 17 1 1 A 59 59 ILE CB C 59 38.480 37.822 0.658 1
1 650 . 17 1 1 A 59 59 ILE N N 59 119.560 120.263 -0.703 1
1 651 . 17 1 1 A 60 60 ASN H H 60 7.506 8.230 -0.724 1
1 652 . 17 1 1 A 60 60 ASN HA H 60 4.407 4.450 -0.043 1
1 657 . 17 1 1 A 60 60 ASN C C 60 177.163 176.971 0.192 1
1 658 . 17 1 1 A 60 60 ASN CA C 60 55.871 55.237 0.634 1
1 659 . 17 1 1 A 60 60 ASN CB C 60 38.878 38.257 0.621 1
1 660 . 17 1 1 A 60 60 ASN N N 60 116.868 117.585 -0.717 1
1 662 . 17 1 1 A 61 61 ALA H H 61 8.410 7.663 0.747 1
1 663 . 17 1 1 A 61 61 ALA HA H 61 3.667 3.729 -0.062 1
1 667 . 17 1 1 A 61 61 ALA C C 61 180.061 179.853 0.208 1
1 668 . 17 1 1 A 61 61 ALA CA C 61 54.601 54.066 0.535 1
1 669 . 17 1 1 A 61 61 ALA CB C 61 18.241 17.111 1.130 1
1 670 . 17 1 1 A 61 61 ALA N N 61 123.022 121.520 1.502 1
1 671 . 17 1 1 A 62 62 ARG H H 62 8.036 8.140 -0.104 1
1 672 . 17 1 1 A 62 62 ARG HA H 62 4.092 3.965 0.127 1
1 679 . 17 1 1 A 62 62 ARG C C 62 176.756 177.459 -0.703 1
1 680 . 17 1 1 A 62 62 ARG CA C 62 58.762 58.346 0.416 1
1 681 . 17 1 1 A 62 62 ARG CB C 62 30.601 29.869 0.732 1
1 684 . 17 1 1 A 62 62 ARG N N 62 117.168 118.846 -1.678 1
1 685 . 17 1 1 A 63 63 ARG H H 63 7.214 7.804 -0.590 1
1 686 . 17 1 1 A 63 63 ARG HA H 63 4.249 4.309 -0.060 1
1 693 . 17 1 1 A 63 63 ARG C C 63 176.945 176.923 0.022 1
1 694 . 17 1 1 A 63 63 ARG CA C 63 57.669 57.103 0.566 1
1 695 . 17 1 1 A 63 63 ARG CB C 63 30.765 30.843 -0.078 1
1 698 . 17 1 1 A 63 63 ARG N N 63 116.514 116.619 -0.105 1
1 699 . 17 1 1 A 64 64 ARG H H 64 7.913 8.052 -0.139 1
1 700 . 17 1 1 A 64 64 ARG HA H 64 4.351 4.581 -0.230 1
1 707 . 17 1 1 A 64 64 ARG C C 64 176.413 178.259 -1.846 1
1 708 . 17 1 1 A 64 64 ARG CA C 64 57.105 57.183 -0.078 1
1 709 . 17 1 1 A 64 64 ARG CB C 64 31.672 33.014 -1.342 1
1 712 . 17 1 1 A 64 64 ARG N N 64 116.818 118.460 -1.642 1
1 713 . 17 1 1 A 65 65 ILE H H 65 8.169 8.373 -0.204 1
1 714 . 17 1 1 A 65 65 ILE HA H 65 4.285 3.809 0.476 1
1 724 . 17 1 1 A 65 65 ILE C C 65 176.208 177.920 -1.712 1
1 725 . 17 1 1 A 65 65 ILE CA C 65 62.005 64.656 -2.651 1
1 726 . 17 1 1 A 65 65 ILE CB C 65 39.088 37.495 1.593 1
1 730 . 17 1 1 A 65 65 ILE N N 65 119.185 119.576 -0.391 1
1 731 . 17 1 1 A 66 66 LEU H H 66 7.962 7.819 0.143 1
1 732 . 17 1 1 A 66 66 LEU HA H 66 4.485 3.948 0.537 1
1 742 . 17 1 1 A 66 66 LEU C C 66 176.216 174.982 1.234 1
1 743 . 17 1 1 A 66 66 LEU CA C 66 56.153 59.721 -3.568 1
1 744 . 17 1 1 A 66 66 LEU CB C 66 40.792 40.467 0.325 1
1 748 . 17 1 1 A 66 66 LEU N N 66 124.389 121.878 2.511 1
1 749 . 17 1 1 A 67 67 PRO HA H 67 4.283 4.305 -0.022 1
1 756 . 17 1 1 A 67 67 PRO C C 67 178.294 178.362 -0.068 1
1 757 . 17 1 1 A 67 67 PRO CA C 67 65.390 65.388 0.002 1
1 758 . 17 1 1 A 67 67 PRO CB C 67 31.095 30.689 0.406 1
1 761 . 17 1 1 A 68 68 ASP H H 68 7.913 8.438 -0.525 1
1 762 . 17 1 1 A 68 68 ASP HA H 68 4.507 4.416 0.091 1
1 765 . 17 1 1 A 68 68 ASP C C 68 177.927 177.606 0.321 1
1 766 . 17 1 1 A 68 68 ASP CA C 68 55.906 56.562 -0.656 1
1 767 . 17 1 1 A 68 68 ASP CB C 68 40.736 40.375 0.361 1
1 768 . 17 1 1 A 68 68 ASP N N 68 117.231 117.235 -0.004 1
1 769 . 17 1 1 A 69 69 MET H H 69 8.083 8.474 -0.391 1
1 770 . 17 1 1 A 69 69 MET HA H 69 4.362 4.365 -0.003 1
1 778 . 17 1 1 A 69 69 MET C C 69 177.374 178.761 -1.387 1
1 779 . 17 1 1 A 69 69 MET CA C 69 57.634 58.130 -0.496 1
1 780 . 17 1 1 A 69 69 MET CB C 69 32.816 32.937 -0.121 1
1 783 . 17 1 1 A 69 69 MET N N 69 119.391 116.955 2.436 1
1 784 . 17 1 1 A 70 70 LEU H H 70 7.907 8.146 -0.239 1
1 785 . 17 1 1 A 70 70 LEU HA H 70 4.232 3.778 0.454 1
1 795 . 17 1 1 A 70 70 LEU C C 70 177.745 178.759 -1.014 1
1 796 . 17 1 1 A 70 70 LEU CA C 70 55.835 58.081 -2.246 1
1 797 . 17 1 1 A 70 70 LEU CB C 70 42.174 41.140 1.034 1
1 801 . 17 1 1 A 70 70 LEU N N 70 119.266 122.071 -2.805 1
1 802 . 17 1 1 A 71 71 GLN H H 71 7.865 8.215 -0.350 1
1 803 . 17 1 1 A 71 71 GLN HA H 71 4.287 4.096 0.191 1
1 809 . 17 1 1 A 71 71 GLN C C 71 178.855 176.606 2.249 1
1 810 . 17 1 1 A 71 71 GLN CA C 71 56.383 58.524 -2.141 1
1 811 . 17 1 1 A 71 71 GLN CB C 71 29.092 28.437 0.655 1
1 813 . 17 1 1 A 71 71 GLN N N 71 118.603 117.179 1.424 1
1 815 . 17 1 1 A 72 72 GLN H H 72 8.189 7.680 0.509 1
1 816 . 17 1 1 A 72 72 GLN HA H 72 4.302 4.406 -0.104 1
1 821 . 17 1 1 A 72 72 GLN CA C 72 56.206 56.049 0.157 1
1 822 . 17 1 1 A 72 72 GLN CB C 72 29.298 29.081 0.217 1
1 824 . 17 1 1 A 72 72 GLN N N 72 120.267 120.444 -0.177 1
1 825 . 17 1 1 A 73 73 ARG C C 73 176.105 175.942 0.163 1
1 826 . 17 1 1 A 74 74 ARG HA H 74 4.334 5.233 -0.899 1
1 833 . 17 1 1 A 74 74 ARG C C 74 176.188 175.020 1.168 1
1 834 . 17 1 1 A 74 74 ARG CA C 74 56.300 54.004 2.296 1
1 835 . 17 1 1 A 74 74 ARG CB C 74 30.668 34.325 -3.657 1
1 838 . 17 1 1 A 75 75 ASN C C 75 174.462 173.188 1.274 1
1 839 . 17 1 1 A 75 75 ASN CA C 75 53.148 52.459 0.689 1
1 840 . 17 1 1 A 75 75 ASN CB C 75 39.046 39.043 0.003 1
1 841 . 17 1 1 A 76 76 ASP H H 76 8.257 7.831 0.426 1
1 842 . 17 1 1 A 76 76 ASP HA H 76 4.877 5.076 -0.199 1
1 845 . 17 1 1 A 76 76 ASP C C 76 174.759 174.107 0.652 1
1 846 . 17 1 1 A 76 76 ASP CA C 76 52.380 49.982 2.398 1
1 847 . 17 1 1 A 76 76 ASP CB C 76 41.267 43.089 -1.822 1
1 848 . 17 1 1 A 76 76 ASP N N 76 122.030 119.446 2.584 1
1 849 . 17 1 1 A 77 77 PRO HA H 77 4.466 4.627 -0.161 1
1 856 . 17 1 1 A 77 77 PRO C C 77 177.133 176.468 0.665 1
1 857 . 17 1 1 A 77 77 PRO CA C 77 63.733 62.340 1.393 1
1 858 . 17 1 1 A 77 77 PRO CB C 77 31.919 32.987 -1.068 1
1 861 . 17 1 1 A 78 78 SER H H 78 8.457 8.531 -0.074 1
1 862 . 17 1 1 A 78 78 SER HA H 78 4.479 4.457 0.022 1
1 865 . 17 1 1 A 78 78 SER C C 78 174.731 175.887 -1.156 1
1 866 . 17 1 1 A 78 78 SER CA C 78 58.691 58.498 0.193 1
1 867 . 17 1 1 A 78 78 SER CB C 78 63.973 64.564 -0.591 1
1 868 . 17 1 1 A 78 78 SER N N 78 115.711 117.869 -2.158 1
1 869 . 17 1 1 A 79 79 GLY H H 79 8.090 8.676 -0.586 1
1 870 . 17 1 1 A 79 79 GLY HA2 H 79 4.179 3.870 0.309 1
1 871 . 17 1 1 A 79 79 GLY HA3 H 79 4.065 3.871 0.194 1
1 872 . 17 1 1 A 79 79 GLY CA C 79 44.746 47.828 -3.082 1
1 873 . 17 1 1 A 79 79 GLY N N 79 110.429 113.911 -3.482 1
1 874 . 17 1 1 A 80 80 PRO HA H 80 4.464 4.601 -0.137 1
1 880 . 17 1 1 A 80 80 PRO C C 80 177.499 175.396 2.103 1
1 881 . 17 1 1 A 80 80 PRO CA C 80 63.275 62.549 0.726 1
1 882 . 17 1 1 A 80 80 PRO CB C 80 32.249 32.566 -0.317 1
1 1 . 18 1 1 A 13 13 ASN HA H 13 4.787 4.719 0.068 1
1 6 . 18 1 1 A 13 13 ASN CA C 13 53.148 54.347 -1.199 1
1 7 . 18 1 1 A 13 13 ASN CB C 13 39.378 39.098 0.280 1
1 9 . 18 1 1 A 14 14 LEU H H 14 8.418 8.519 -0.101 1
1 10 . 18 1 1 A 14 14 LEU HA H 14 4.654 4.617 0.037 1
1 20 . 18 1 1 A 14 14 LEU CA C 14 52.999 53.107 -0.108 1
1 21 . 18 1 1 A 14 14 LEU CB C 14 41.919 40.832 1.087 1
1 25 . 18 1 1 A 14 14 LEU N N 14 122.671 123.007 -0.336 1
1 26 . 18 1 1 A 15 15 PRO HA H 15 4.460 4.583 -0.123 1
1 33 . 18 1 1 A 15 15 PRO C C 15 178.156 177.595 0.561 1
1 34 . 18 1 1 A 15 15 PRO CA C 15 63.101 62.679 0.422 1
1 35 . 18 1 1 A 15 15 PRO CB C 15 32.304 32.603 -0.299 1
1 38 . 18 1 1 A 16 16 ALA H H 16 8.973 8.636 0.337 1
1 39 . 18 1 1 A 16 16 ALA HA H 16 4.021 3.971 0.050 1
1 43 . 18 1 1 A 16 16 ALA C C 16 180.695 179.324 1.371 1
1 44 . 18 1 1 A 16 16 ALA CA C 16 55.642 55.407 0.235 1
1 45 . 18 1 1 A 16 16 ALA CB C 16 18.552 18.630 -0.078 1
1 46 . 18 1 1 A 16 16 ALA N N 16 128.311 126.924 1.387 1
1 47 . 18 1 1 A 17 17 GLU H H 17 9.558 8.207 1.351 1
1 48 . 18 1 1 A 17 17 GLU HA H 17 4.065 4.077 -0.012 1
1 53 . 18 1 1 A 17 17 GLU C C 17 178.886 178.216 0.670 1
1 54 . 18 1 1 A 17 17 GLU CA C 17 59.400 59.317 0.083 1
1 55 . 18 1 1 A 17 17 GLU CB C 17 28.742 29.381 -0.639 1
1 57 . 18 1 1 A 17 17 GLU N N 17 117.113 117.088 0.025 1
1 58 . 18 1 1 A 18 18 SER H H 18 7.263 7.792 -0.529 1
1 59 . 18 1 1 A 18 18 SER HA H 18 4.180 4.118 0.062 1
1 62 . 18 1 1 A 18 18 SER C C 18 174.951 175.673 -0.722 1
1 63 . 18 1 1 A 18 18 SER CA C 18 61.969 62.661 -0.692 1
1 64 . 18 1 1 A 18 18 SER CB C 18 62.554 62.933 -0.379 1
1 65 . 18 1 1 A 18 18 SER N N 18 114.932 117.144 -2.212 1
1 66 . 18 1 1 A 19 19 VAL H H 19 7.620 8.325 -0.705 1
1 67 . 18 1 1 A 19 19 VAL HA H 19 3.011 3.150 -0.139 1
1 75 . 18 1 1 A 19 19 VAL C C 19 176.953 177.810 -0.857 1
1 76 . 18 1 1 A 19 19 VAL CA C 19 66.479 66.957 -0.478 1
1 77 . 18 1 1 A 19 19 VAL CB C 19 31.569 31.423 0.146 1
1 80 . 18 1 1 A 19 19 VAL N N 19 121.086 121.776 -0.690 1
1 81 . 18 1 1 A 20 20 LYS H H 20 7.745 8.290 -0.545 1
1 82 . 18 1 1 A 20 20 LYS HA H 20 3.884 3.974 -0.090 1
1 91 . 18 1 1 A 20 20 LYS C C 20 178.150 178.773 -0.623 1
1 92 . 18 1 1 A 20 20 LYS CA C 20 59.984 59.724 0.260 1
1 93 . 18 1 1 A 20 20 LYS CB C 20 32.351 32.161 0.190 1
1 97 . 18 1 1 A 20 20 LYS N N 20 119.366 119.643 -0.277 1
1 98 . 18 1 1 A 21 21 ILE H H 21 6.943 7.786 -0.843 1
1 99 . 18 1 1 A 21 21 ILE HA H 21 3.783 3.675 0.108 1
1 109 . 18 1 1 A 21 21 ILE C C 21 178.996 178.499 0.497 1
1 110 . 18 1 1 A 21 21 ILE CA C 21 64.642 65.667 -1.025 1
1 111 . 18 1 1 A 21 21 ILE CB C 21 38.014 37.715 0.299 1
1 115 . 18 1 1 A 21 21 ILE N N 21 118.163 120.347 -2.184 1
1 116 . 18 1 1 A 22 22 LEU H H 22 7.267 8.033 -0.766 1
1 117 . 18 1 1 A 22 22 LEU HA H 22 3.748 3.842 -0.094 1
1 127 . 18 1 1 A 22 22 LEU C C 22 178.289 178.779 -0.490 1
1 128 . 18 1 1 A 22 22 LEU CA C 22 58.092 58.057 0.035 1
1 129 . 18 1 1 A 22 22 LEU CB C 22 38.551 40.853 -2.302 1
1 133 . 18 1 1 A 22 22 LEU N N 22 120.609 119.329 1.280 1
1 134 . 18 1 1 A 23 23 ARG H H 23 8.676 8.683 -0.007 1
1 135 . 18 1 1 A 23 23 ARG HA H 23 4.030 4.180 -0.150 1
1 142 . 18 1 1 A 23 23 ARG C C 23 178.861 178.323 0.538 1
1 143 . 18 1 1 A 23 23 ARG CA C 23 60.404 60.060 0.344 1
1 144 . 18 1 1 A 23 23 ARG CB C 23 30.351 30.201 0.150 1
1 147 . 18 1 1 A 23 23 ARG N N 23 119.148 117.684 1.464 1
1 148 . 18 1 1 A 24 24 ASP H H 24 8.515 8.212 0.303 1
1 149 . 18 1 1 A 24 24 ASP HA H 24 4.519 4.378 0.141 1
1 152 . 18 1 1 A 24 24 ASP C C 24 178.759 178.657 0.102 1
1 153 . 18 1 1 A 24 24 ASP CA C 24 57.556 57.152 0.404 1
1 154 . 18 1 1 A 24 24 ASP CB C 24 40.569 41.004 -0.435 1
1 155 . 18 1 1 A 24 24 ASP N N 24 120.027 119.412 0.615 1
1 156 . 18 1 1 A 25 25 TRP H H 25 8.158 7.542 0.616 1
1 157 . 18 1 1 A 25 25 TRP HA H 25 4.181 4.457 -0.276 1
1 166 . 18 1 1 A 25 25 TRP C C 25 179.946 178.506 1.440 1
1 167 . 18 1 1 A 25 25 TRP CA C 25 63.346 61.280 2.066 1
1 168 . 18 1 1 A 25 25 TRP CB C 25 29.433 29.621 -0.188 1
1 174 . 18 1 1 A 25 25 TRP N N 25 121.350 121.701 -0.351 1
1 176 . 18 1 1 A 26 26 MET H H 26 8.977 8.753 0.224 1
1 177 . 18 1 1 A 26 26 MET HA H 26 4.076 4.673 -0.597 1
1 185 . 18 1 1 A 26 26 MET C C 26 177.371 178.132 -0.761 1
1 186 . 18 1 1 A 26 26 MET CA C 26 60.454 58.904 1.550 1
1 187 . 18 1 1 A 26 26 MET CB C 26 33.567 32.473 1.094 1
1 190 . 18 1 1 A 26 26 MET N N 26 119.977 118.815 1.162 1
1 191 . 18 1 1 A 27 27 TYR H H 27 8.604 8.543 0.061 1
1 192 . 18 1 1 A 27 27 TYR HA H 27 4.138 4.201 -0.063 1
1 199 . 18 1 1 A 27 27 TYR C C 27 178.901 177.444 1.457 1
1 200 . 18 1 1 A 27 27 TYR CA C 27 61.846 61.352 0.494 1
1 201 . 18 1 1 A 27 27 TYR CB C 27 38.165 38.494 -0.329 1
1 206 . 18 1 1 A 27 27 TYR N N 27 117.797 121.430 -3.633 1
1 207 . 18 1 1 A 28 28 LYS H H 28 7.867 7.788 0.079 1
1 208 . 18 1 1 A 28 28 LYS HA H 28 3.797 3.605 0.192 1
1 217 . 18 1 1 A 28 28 LYS C C 28 176.858 177.792 -0.934 1
1 218 . 18 1 1 A 28 28 LYS CA C 28 58.174 59.066 -0.892 1
1 219 . 18 1 1 A 28 28 LYS CB C 28 32.516 31.978 0.538 1
1 223 . 18 1 1 A 28 28 LYS N N 28 118.982 117.748 1.234 1
1 224 . 18 1 1 A 29 29 HIS H H 29 7.443 7.202 0.241 1
1 225 . 18 1 1 A 29 29 HIS HA H 29 4.386 4.368 0.018 1
1 230 . 18 1 1 A 29 29 HIS C C 29 176.085 175.812 0.273 1
1 231 . 18 1 1 A 29 29 HIS CA C 29 55.213 55.812 -0.599 1
1 232 . 18 1 1 A 29 29 HIS CB C 29 27.085 28.395 -1.310 1
1 235 . 18 1 1 A 29 29 HIS N N 29 117.138 115.672 1.466 1
1 236 . 18 1 1 A 30 30 ARG H H 30 6.921 7.993 -1.072 1
1 237 . 18 1 1 A 30 30 ARG HA H 30 3.898 4.301 -0.403 1
1 244 . 18 1 1 A 30 30 ARG C C 30 175.808 177.937 -2.129 1
1 245 . 18 1 1 A 30 30 ARG CA C 30 58.609 58.503 0.106 1
1 246 . 18 1 1 A 30 30 ARG CB C 30 28.739 29.689 -0.950 1
1 249 . 18 1 1 A 30 30 ARG N N 30 117.911 119.248 -1.337 1
1 250 . 18 1 1 A 31 31 PHE H H 31 7.819 7.672 0.147 1
1 251 . 18 1 1 A 31 31 PHE HA H 31 4.533 4.333 0.200 1
1 259 . 18 1 1 A 31 31 PHE C C 31 175.577 177.025 -1.448 1
1 260 . 18 1 1 A 31 31 PHE CA C 31 58.029 60.978 -2.949 1
1 261 . 18 1 1 A 31 31 PHE CB C 31 37.792 38.699 -0.907 1
1 267 . 18 1 1 A 31 31 PHE N N 31 115.408 118.726 -3.318 1
1 268 . 18 1 1 A 32 32 LYS H H 32 7.858 8.072 -0.214 1
1 269 . 18 1 1 A 32 32 LYS HA H 32 4.487 4.493 -0.006 1
1 277 . 18 1 1 A 32 32 LYS C C 32 175.557 176.810 -1.253 1
1 278 . 18 1 1 A 32 32 LYS CA C 32 56.329 56.908 -0.579 1
1 279 . 18 1 1 A 32 32 LYS CB C 32 32.743 34.598 -1.855 1
1 283 . 18 1 1 A 32 32 LYS N N 32 122.453 113.894 8.559 1
1 284 . 18 1 1 A 33 33 ALA H H 33 8.643 8.438 0.205 1
1 285 . 18 1 1 A 33 33 ALA HA H 33 4.403 4.158 0.245 1
1 289 . 18 1 1 A 33 33 ALA C C 33 176.273 175.523 0.750 1
1 290 . 18 1 1 A 33 33 ALA CA C 33 53.579 53.374 0.205 1
1 291 . 18 1 1 A 33 33 ALA CB C 33 18.653 17.089 1.564 1
1 292 . 18 1 1 A 33 33 ALA N N 33 127.853 120.028 7.825 1
1 293 . 18 1 1 A 34 34 TYR H H 34 7.878 8.032 -0.154 1
1 294 . 18 1 1 A 34 34 TYR HA H 34 4.686 4.980 -0.294 1
1 301 . 18 1 1 A 34 34 TYR C C 34 173.133 172.929 0.204 1
1 302 . 18 1 1 A 34 34 TYR CA C 34 54.778 54.900 -0.122 1
1 303 . 18 1 1 A 34 34 TYR CB C 34 39.619 38.968 0.651 1
1 308 . 18 1 1 A 34 34 TYR N N 34 116.539 118.010 -1.471 1
1 309 . 18 1 1 A 35 35 PRO HA H 35 4.526 4.563 -0.037 1
1 316 . 18 1 1 A 35 35 PRO C C 35 176.837 175.593 1.244 1
1 317 . 18 1 1 A 35 35 PRO CA C 35 61.864 62.100 -0.236 1
1 318 . 18 1 1 A 35 35 PRO CB C 35 30.904 31.911 -1.007 1
1 321 . 18 1 1 A 36 36 SER H H 36 9.634 8.405 1.229 1
1 322 . 18 1 1 A 36 36 SER HA H 36 4.518 4.755 -0.237 1
1 325 . 18 1 1 A 36 36 SER C C 36 175.001 175.342 -0.341 1
1 326 . 18 1 1 A 36 36 SER CA C 36 57.129 56.609 0.520 1
1 327 . 18 1 1 A 36 36 SER CB C 36 65.374 65.233 0.141 1
1 328 . 18 1 1 A 36 36 SER N N 36 119.984 117.024 2.960 1
1 329 . 18 1 1 A 37 37 GLU H H 37 9.091 8.927 0.164 1
1 330 . 18 1 1 A 37 37 GLU HA H 37 3.884 3.905 -0.021 1
1 335 . 18 1 1 A 37 37 GLU C C 37 179.347 178.373 0.974 1
1 336 . 18 1 1 A 37 37 GLU CA C 37 60.454 59.591 0.863 1
1 337 . 18 1 1 A 37 37 GLU CB C 37 28.623 29.120 -0.497 1
1 339 . 18 1 1 A 37 37 GLU N N 37 120.748 126.438 -5.690 1
1 340 . 18 1 1 A 38 38 GLU H H 38 8.760 7.928 0.832 1
1 341 . 18 1 1 A 38 38 GLU HA H 38 4.048 4.074 -0.026 1
1 346 . 18 1 1 A 38 38 GLU C C 38 179.975 179.134 0.841 1
1 347 . 18 1 1 A 38 38 GLU CA C 38 60.243 59.197 1.046 1
1 348 . 18 1 1 A 38 38 GLU CB C 38 29.117 29.928 -0.811 1
1 350 . 18 1 1 A 38 38 GLU N N 38 119.272 119.919 -0.647 1
1 351 . 18 1 1 A 39 39 GLU H H 39 7.856 7.970 -0.114 1
1 352 . 18 1 1 A 39 39 GLU HA H 39 3.976 3.876 0.100 1
1 357 . 18 1 1 A 39 39 GLU C C 39 178.912 178.823 0.089 1
1 358 . 18 1 1 A 39 39 GLU CA C 39 59.131 59.154 -0.023 1
1 359 . 18 1 1 A 39 39 GLU CB C 39 29.612 28.782 0.830 1
1 361 . 18 1 1 A 39 39 GLU N N 39 121.658 120.715 0.943 1
1 362 . 18 1 1 A 40 40 LYS H H 40 8.653 7.742 0.911 1
1 363 . 18 1 1 A 40 40 LYS HA H 40 3.508 3.839 -0.331 1
1 372 . 18 1 1 A 40 40 LYS C C 40 177.974 179.009 -1.035 1
1 373 . 18 1 1 A 40 40 LYS CA C 40 60.948 59.505 1.443 1
1 374 . 18 1 1 A 40 40 LYS CB C 40 32.714 32.085 0.629 1
1 378 . 18 1 1 A 40 40 LYS N N 40 119.152 119.569 -0.417 1
1 379 . 18 1 1 A 41 41 GLN H H 41 7.876 7.540 0.336 1
1 380 . 18 1 1 A 41 41 GLN HA H 41 3.911 3.989 -0.078 1
1 387 . 18 1 1 A 41 41 GLN C C 41 178.352 178.045 0.307 1
1 388 . 18 1 1 A 41 41 GLN CA C 41 58.973 59.132 -0.159 1
1 389 . 18 1 1 A 41 41 GLN CB C 41 27.552 28.256 -0.704 1
1 391 . 18 1 1 A 41 41 GLN N N 41 118.910 119.612 -0.702 1
1 393 . 18 1 1 A 42 42 MET H H 42 7.771 7.974 -0.203 1
1 394 . 18 1 1 A 42 42 MET HA H 42 4.158 4.456 -0.298 1
1 402 . 18 1 1 A 42 42 MET C C 42 179.310 178.366 0.944 1
1 403 . 18 1 1 A 42 42 MET CA C 42 59.079 58.459 0.620 1
1 404 . 18 1 1 A 42 42 MET CB C 42 31.023 32.120 -1.097 1
1 407 . 18 1 1 A 42 42 MET N N 42 121.131 119.124 2.007 1
1 408 . 18 1 1 A 43 43 LEU H H 43 8.400 8.223 0.177 1
1 409 . 18 1 1 A 43 43 LEU HA H 43 3.888 3.984 -0.096 1
1 419 . 18 1 1 A 43 43 LEU C C 43 180.721 179.045 1.676 1
1 420 . 18 1 1 A 43 43 LEU CA C 43 57.916 57.966 -0.050 1
1 421 . 18 1 1 A 43 43 LEU CB C 43 42.080 41.592 0.488 1
1 425 . 18 1 1 A 43 43 LEU N N 43 120.124 120.638 -0.514 1
1 426 . 18 1 1 A 44 44 SER H H 44 8.658 8.483 0.175 1
1 427 . 18 1 1 A 44 44 SER HA H 44 4.088 4.153 -0.065 1
1 430 . 18 1 1 A 44 44 SER C C 44 176.859 176.703 0.156 1
1 431 . 18 1 1 A 44 44 SER CA C 44 61.371 60.981 0.390 1
1 432 . 18 1 1 A 44 44 SER CB C 44 63.314 63.099 0.215 1
1 433 . 18 1 1 A 44 44 SER N N 44 119.795 113.946 5.849 1
1 434 . 18 1 1 A 45 45 GLU H H 45 7.905 7.579 0.326 1
1 435 . 18 1 1 A 45 45 GLU HA H 45 4.094 4.184 -0.090 1
1 440 . 18 1 1 A 45 45 GLU C C 45 179.095 179.089 0.006 1
1 441 . 18 1 1 A 45 45 GLU CA C 45 59.255 59.045 0.210 1
1 442 . 18 1 1 A 45 45 GLU CB C 45 29.200 29.319 -0.119 1
1 444 . 18 1 1 A 45 45 GLU N N 45 120.609 121.143 -0.534 1
1 445 . 18 1 1 A 46 46 LYS H H 46 7.837 7.959 -0.122 1
1 446 . 18 1 1 A 46 46 LYS HA H 46 4.231 4.134 0.097 1
1 453 . 18 1 1 A 46 46 LYS C C 46 177.964 178.719 -0.755 1
1 454 . 18 1 1 A 46 46 LYS CA C 46 58.278 58.731 -0.453 1
1 455 . 18 1 1 A 46 46 LYS CB C 46 34.110 32.805 1.305 1
1 459 . 18 1 1 A 46 46 LYS N N 46 115.471 119.426 -3.955 1
1 460 . 18 1 1 A 47 47 THR H H 47 7.763 8.157 -0.394 1
1 461 . 18 1 1 A 47 47 THR HA H 47 4.271 4.253 0.018 1
1 466 . 18 1 1 A 47 47 THR C C 47 175.472 174.617 0.855 1
1 467 . 18 1 1 A 47 47 THR CA C 47 62.429 62.215 0.214 1
1 468 . 18 1 1 A 47 47 THR CB C 47 71.966 69.928 2.038 1
1 470 . 18 1 1 A 47 47 THR N N 47 104.286 108.644 -4.358 1
1 471 . 18 1 1 A 48 48 ASN H H 48 8.169 7.897 0.272 1
1 472 . 18 1 1 A 48 48 ASN HA H 48 4.437 4.567 -0.130 1
1 477 . 18 1 1 A 48 48 ASN C C 48 173.874 173.944 -0.070 1
1 478 . 18 1 1 A 48 48 ASN CA C 48 55.377 54.380 0.997 1
1 479 . 18 1 1 A 48 48 ASN CB C 48 37.770 36.814 0.956 1
1 480 . 18 1 1 A 48 48 ASN N N 48 117.458 116.278 1.180 1
1 482 . 18 1 1 A 49 49 LEU H H 49 7.532 7.183 0.349 1
1 483 . 18 1 1 A 49 49 LEU HA H 49 4.733 4.656 0.077 1
1 493 . 18 1 1 A 49 49 LEU C C 49 176.625 175.757 0.868 1
1 494 . 18 1 1 A 49 49 LEU CA C 49 53.226 53.609 -0.383 1
1 495 . 18 1 1 A 49 49 LEU CB C 49 44.114 42.822 1.292 1
1 499 . 18 1 1 A 49 49 LEU N N 49 118.220 119.057 -0.837 1
1 500 . 18 1 1 A 50 50 SER H H 50 9.140 8.730 0.410 1
1 501 . 18 1 1 A 50 50 SER HA H 50 4.475 4.965 -0.490 1
1 504 . 18 1 1 A 50 50 SER C C 50 174.907 174.854 0.053 1
1 505 . 18 1 1 A 50 50 SER CA C 50 56.964 57.638 -0.674 1
1 506 . 18 1 1 A 50 50 SER CB C 50 65.372 65.065 0.307 1
1 507 . 18 1 1 A 50 50 SER N N 50 117.569 117.264 0.305 1
1 508 . 18 1 1 A 51 51 LEU H H 51 8.756 8.776 -0.020 1
1 509 . 18 1 1 A 51 51 LEU HA H 51 3.874 3.925 -0.051 1
1 519 . 18 1 1 A 51 51 LEU C C 51 179.910 178.886 1.024 1
1 520 . 18 1 1 A 51 51 LEU CA C 51 58.916 58.198 0.718 1
1 521 . 18 1 1 A 51 51 LEU CB C 51 41.148 41.537 -0.389 1
1 525 . 18 1 1 A 51 51 LEU N N 51 120.905 125.763 -4.858 1
1 526 . 18 1 1 A 52 52 LEU H H 52 8.146 8.302 -0.156 1
1 527 . 18 1 1 A 52 52 LEU HA H 52 4.179 4.012 0.167 1
1 537 . 18 1 1 A 52 52 LEU C C 52 178.936 178.681 0.255 1
1 538 . 18 1 1 A 52 52 LEU CA C 52 58.162 58.376 -0.214 1
1 539 . 18 1 1 A 52 52 LEU CB C 52 42.137 41.280 0.857 1
1 543 . 18 1 1 A 52 52 LEU N N 52 120.685 119.951 0.734 1
1 544 . 18 1 1 A 53 53 GLN H H 53 7.924 8.064 -0.140 1
1 545 . 18 1 1 A 53 53 GLN HA H 53 4.102 4.144 -0.042 1
1 552 . 18 1 1 A 53 53 GLN C C 53 180.308 178.742 1.566 1
1 553 . 18 1 1 A 53 53 GLN CA C 53 59.326 58.490 0.836 1
1 554 . 18 1 1 A 53 53 GLN CB C 53 29.900 28.330 1.570 1
1 556 . 18 1 1 A 53 53 GLN N N 53 118.473 117.461 1.012 1
1 558 . 18 1 1 A 54 54 ILE H H 54 8.380 8.341 0.039 1
1 559 . 18 1 1 A 54 54 ILE HA H 54 3.677 3.699 -0.022 1
1 569 . 18 1 1 A 54 54 ILE C C 54 177.673 178.138 -0.465 1
1 570 . 18 1 1 A 54 54 ILE CA C 54 64.650 65.518 -0.868 1
1 571 . 18 1 1 A 54 54 ILE CB C 54 37.476 37.835 -0.359 1
1 575 . 18 1 1 A 54 54 ILE N N 54 120.113 121.435 -1.322 1
1 576 . 18 1 1 A 55 55 SER H H 55 8.854 8.029 0.825 1
1 577 . 18 1 1 A 55 55 SER HA H 55 4.267 4.334 -0.067 1
1 580 . 18 1 1 A 55 55 SER C C 55 177.127 177.648 -0.521 1
1 581 . 18 1 1 A 55 55 SER CA C 55 62.852 61.813 1.039 1
1 582 . 18 1 1 A 55 55 SER CB C 55 62.727 63.041 -0.314 1
1 583 . 18 1 1 A 55 55 SER N N 55 116.646 115.900 0.746 1
1 584 . 18 1 1 A 56 56 ASN H H 56 8.634 8.303 0.331 1
1 585 . 18 1 1 A 56 56 ASN HA H 56 4.549 4.452 0.097 1
1 590 . 18 1 1 A 56 56 ASN C C 56 177.481 178.346 -0.865 1
1 591 . 18 1 1 A 56 56 ASN CA C 56 55.951 56.470 -0.519 1
1 592 . 18 1 1 A 56 56 ASN CB C 56 37.852 38.307 -0.455 1
1 593 . 18 1 1 A 56 56 ASN N N 56 119.048 119.337 -0.289 1
1 595 . 18 1 1 A 57 57 TRP H H 57 8.373 8.347 0.026 1
1 596 . 18 1 1 A 57 57 TRP HA H 57 4.065 4.314 -0.249 1
1 605 . 18 1 1 A 57 57 TRP C C 57 179.392 178.313 1.079 1
1 606 . 18 1 1 A 57 57 TRP CA C 57 63.204 61.465 1.739 1
1 607 . 18 1 1 A 57 57 TRP CB C 57 28.376 29.693 -1.317 1
1 613 . 18 1 1 A 57 57 TRP N N 57 122.950 122.731 0.219 1
1 615 . 18 1 1 A 58 58 PHE H H 58 8.428 8.412 0.016 1
1 616 . 18 1 1 A 58 58 PHE HA H 58 3.922 3.805 0.117 1
1 624 . 18 1 1 A 58 58 PHE C C 58 178.237 177.808 0.429 1
1 625 . 18 1 1 A 58 58 PHE CA C 58 64.015 61.870 2.145 1
1 626 . 18 1 1 A 58 58 PHE CB C 58 39.602 38.603 0.999 1
1 632 . 18 1 1 A 58 58 PHE N N 58 116.774 117.966 -1.192 1
1 633 . 18 1 1 A 59 59 ILE H H 59 7.925 8.315 -0.390 1
1 634 . 18 1 1 A 59 59 ILE HA H 59 3.773 3.637 0.136 1
1 644 . 18 1 1 A 59 59 ILE C C 59 178.745 177.644 1.101 1
1 645 . 18 1 1 A 59 59 ILE CA C 59 65.531 65.262 0.269 1
1 646 . 18 1 1 A 59 59 ILE CB C 59 38.480 37.812 0.668 1
1 650 . 18 1 1 A 59 59 ILE N N 59 119.560 119.869 -0.309 1
1 651 . 18 1 1 A 60 60 ASN H H 60 7.506 7.872 -0.366 1
1 652 . 18 1 1 A 60 60 ASN HA H 60 4.407 4.397 0.010 1
1 657 . 18 1 1 A 60 60 ASN C C 60 177.163 177.552 -0.389 1
1 658 . 18 1 1 A 60 60 ASN CA C 60 55.871 55.995 -0.124 1
1 659 . 18 1 1 A 60 60 ASN CB C 60 38.878 37.871 1.007 1
1 660 . 18 1 1 A 60 60 ASN N N 60 116.868 117.801 -0.933 1
1 662 . 18 1 1 A 61 61 ALA H H 61 8.410 7.963 0.447 1
1 663 . 18 1 1 A 61 61 ALA HA H 61 3.667 3.655 0.012 1
1 667 . 18 1 1 A 61 61 ALA C C 61 180.061 179.943 0.118 1
1 668 . 18 1 1 A 61 61 ALA CA C 61 54.601 54.045 0.556 1
1 669 . 18 1 1 A 61 61 ALA CB C 61 18.241 16.965 1.276 1
1 670 . 18 1 1 A 61 61 ALA N N 61 123.022 121.231 1.791 1
1 671 . 18 1 1 A 62 62 ARG H H 62 8.036 8.117 -0.081 1
1 672 . 18 1 1 A 62 62 ARG HA H 62 4.092 4.006 0.086 1
1 679 . 18 1 1 A 62 62 ARG C C 62 176.756 177.502 -0.746 1
1 680 . 18 1 1 A 62 62 ARG CA C 62 58.762 58.460 0.302 1
1 681 . 18 1 1 A 62 62 ARG CB C 62 30.601 29.939 0.662 1
1 684 . 18 1 1 A 62 62 ARG N N 62 117.168 118.672 -1.504 1
1 685 . 18 1 1 A 63 63 ARG H H 63 7.214 7.817 -0.603 1
1 686 . 18 1 1 A 63 63 ARG HA H 63 4.249 4.332 -0.083 1
1 693 . 18 1 1 A 63 63 ARG C C 63 176.945 176.799 0.146 1
1 694 . 18 1 1 A 63 63 ARG CA C 63 57.669 56.944 0.725 1
1 695 . 18 1 1 A 63 63 ARG CB C 63 30.765 30.727 0.038 1
1 698 . 18 1 1 A 63 63 ARG N N 63 116.514 116.361 0.153 1
1 699 . 18 1 1 A 64 64 ARG H H 64 7.913 8.065 -0.152 1
1 700 . 18 1 1 A 64 64 ARG HA H 64 4.351 4.591 -0.240 1
1 707 . 18 1 1 A 64 64 ARG C C 64 176.413 178.142 -1.729 1
1 708 . 18 1 1 A 64 64 ARG CA C 64 57.105 57.194 -0.089 1
1 709 . 18 1 1 A 64 64 ARG CB C 64 31.672 33.023 -1.351 1
1 712 . 18 1 1 A 64 64 ARG N N 64 116.818 118.545 -1.727 1
1 713 . 18 1 1 A 65 65 ILE H H 65 8.169 8.178 -0.009 1
1 714 . 18 1 1 A 65 65 ILE HA H 65 4.285 3.868 0.417 1
1 724 . 18 1 1 A 65 65 ILE C C 65 176.208 177.980 -1.772 1
1 725 . 18 1 1 A 65 65 ILE CA C 65 62.005 64.534 -2.529 1
1 726 . 18 1 1 A 65 65 ILE CB C 65 39.088 37.706 1.382 1
1 730 . 18 1 1 A 65 65 ILE N N 65 119.185 119.674 -0.489 1
1 731 . 18 1 1 A 66 66 LEU H H 66 7.962 7.905 0.057 1
1 732 . 18 1 1 A 66 66 LEU HA H 66 4.485 4.057 0.428 1
1 742 . 18 1 1 A 66 66 LEU C C 66 176.216 175.116 1.100 1
1 743 . 18 1 1 A 66 66 LEU CA C 66 56.153 59.862 -3.709 1
1 744 . 18 1 1 A 66 66 LEU CB C 66 40.792 40.080 0.712 1
1 748 . 18 1 1 A 66 66 LEU N N 66 124.389 121.608 2.781 1
1 749 . 18 1 1 A 67 67 PRO HA H 67 4.283 4.382 -0.099 1
1 756 . 18 1 1 A 67 67 PRO C C 67 178.294 178.484 -0.190 1
1 757 . 18 1 1 A 67 67 PRO CA C 67 65.390 65.243 0.147 1
1 758 . 18 1 1 A 67 67 PRO CB C 67 31.095 31.081 0.014 1
1 761 . 18 1 1 A 68 68 ASP H H 68 7.913 8.620 -0.707 1
1 762 . 18 1 1 A 68 68 ASP HA H 68 4.507 4.418 0.089 1
1 765 . 18 1 1 A 68 68 ASP C C 68 177.927 178.376 -0.449 1
1 766 . 18 1 1 A 68 68 ASP CA C 68 55.906 56.763 -0.857 1
1 767 . 18 1 1 A 68 68 ASP CB C 68 40.736 40.537 0.199 1
1 768 . 18 1 1 A 68 68 ASP N N 68 117.231 117.866 -0.635 1
1 769 . 18 1 1 A 69 69 MET H H 69 8.083 8.845 -0.762 1
1 770 . 18 1 1 A 69 69 MET HA H 69 4.362 4.185 0.177 1
1 778 . 18 1 1 A 69 69 MET C C 69 177.374 178.735 -1.361 1
1 779 . 18 1 1 A 69 69 MET CA C 69 57.634 58.770 -1.136 1
1 780 . 18 1 1 A 69 69 MET CB C 69 32.816 32.420 0.396 1
1 783 . 18 1 1 A 69 69 MET N N 69 119.391 118.479 0.912 1
1 784 . 18 1 1 A 70 70 LEU H H 70 7.907 7.952 -0.045 1
1 785 . 18 1 1 A 70 70 LEU HA H 70 4.232 4.009 0.223 1
1 795 . 18 1 1 A 70 70 LEU C C 70 177.745 178.169 -0.424 1
1 796 . 18 1 1 A 70 70 LEU CA C 70 55.835 58.050 -2.215 1
1 797 . 18 1 1 A 70 70 LEU CB C 70 42.174 41.447 0.727 1
1 801 . 18 1 1 A 70 70 LEU N N 70 119.266 121.028 -1.762 1
1 802 . 18 1 1 A 71 71 GLN H H 71 7.865 8.192 -0.327 1
1 803 . 18 1 1 A 71 71 GLN HA H 71 4.287 4.403 -0.116 1
1 809 . 18 1 1 A 71 71 GLN C C 71 178.855 174.594 4.261 1
1 810 . 18 1 1 A 71 71 GLN CA C 71 56.383 55.719 0.664 1
1 811 . 18 1 1 A 71 71 GLN CB C 71 29.092 27.763 1.329 1
1 813 . 18 1 1 A 71 71 GLN N N 71 118.603 114.859 3.744 1
1 815 . 18 1 1 A 72 72 GLN H H 72 8.189 8.119 0.070 1
1 816 . 18 1 1 A 72 72 GLN HA H 72 4.302 5.024 -0.722 1
1 821 . 18 1 1 A 72 72 GLN CA C 72 56.206 53.925 2.281 1
1 822 . 18 1 1 A 72 72 GLN CB C 72 29.298 32.378 -3.080 1
1 824 . 18 1 1 A 72 72 GLN N N 72 120.267 124.751 -4.484 1
1 825 . 18 1 1 A 73 73 ARG C C 73 176.105 175.974 0.131 1
1 826 . 18 1 1 A 74 74 ARG HA H 74 4.334 4.464 -0.130 1
1 833 . 18 1 1 A 74 74 ARG C C 74 176.188 175.457 0.731 1
1 834 . 18 1 1 A 74 74 ARG CA C 74 56.300 55.165 1.135 1
1 835 . 18 1 1 A 74 74 ARG CB C 74 30.668 29.325 1.343 1
1 838 . 18 1 1 A 75 75 ASN C C 75 174.462 174.525 -0.063 1
1 839 . 18 1 1 A 75 75 ASN CA C 75 53.148 52.811 0.337 1
1 840 . 18 1 1 A 75 75 ASN CB C 75 39.046 39.507 -0.461 1
1 841 . 18 1 1 A 76 76 ASP H H 76 8.257 8.568 -0.311 1
1 842 . 18 1 1 A 76 76 ASP HA H 76 4.877 5.275 -0.398 1
1 845 . 18 1 1 A 76 76 ASP C C 76 174.759 173.963 0.796 1
1 846 . 18 1 1 A 76 76 ASP CA C 76 52.380 50.854 1.526 1
1 847 . 18 1 1 A 76 76 ASP CB C 76 41.267 42.213 -0.946 1
1 848 . 18 1 1 A 76 76 ASP N N 76 122.030 123.157 -1.127 1
1 849 . 18 1 1 A 77 77 PRO HA H 77 4.466 4.509 -0.043 1
1 856 . 18 1 1 A 77 77 PRO C C 77 177.133 177.112 0.021 1
1 857 . 18 1 1 A 77 77 PRO CA C 77 63.733 62.875 0.858 1
1 858 . 18 1 1 A 77 77 PRO CB C 77 31.919 31.738 0.181 1
1 861 . 18 1 1 A 78 78 SER H H 78 8.457 8.553 -0.096 1
1 862 . 18 1 1 A 78 78 SER HA H 78 4.479 4.496 -0.017 1
1 865 . 18 1 1 A 78 78 SER C C 78 174.731 174.927 -0.196 1
1 866 . 18 1 1 A 78 78 SER CA C 78 58.691 58.109 0.582 1
1 867 . 18 1 1 A 78 78 SER CB C 78 63.973 63.312 0.661 1
1 868 . 18 1 1 A 78 78 SER N N 78 115.711 114.992 0.719 1
1 869 . 18 1 1 A 79 79 GLY H H 79 8.090 8.692 -0.602 1
1 870 . 18 1 1 A 79 79 GLY HA2 H 79 4.179 4.348 -0.169 1
1 871 . 18 1 1 A 79 79 GLY HA3 H 79 4.065 4.349 -0.284 1
1 872 . 18 1 1 A 79 79 GLY CA C 79 44.746 44.396 0.350 1
1 873 . 18 1 1 A 79 79 GLY N N 79 110.429 110.864 -0.435 1
1 874 . 18 1 1 A 80 80 PRO HA H 80 4.464 4.639 -0.175 1
1 880 . 18 1 1 A 80 80 PRO C C 80 177.499 176.266 1.233 1
1 881 . 18 1 1 A 80 80 PRO CA C 80 63.275 62.592 0.683 1
1 882 . 18 1 1 A 80 80 PRO CB C 80 32.249 33.398 -1.149 1
1 1 . 19 1 1 A 13 13 ASN HA H 13 4.787 5.655 -0.868 1
1 6 . 19 1 1 A 13 13 ASN CA C 13 53.148 52.210 0.938 1
1 7 . 19 1 1 A 13 13 ASN CB C 13 39.378 41.460 -2.082 1
1 9 . 19 1 1 A 14 14 LEU H H 14 8.418 8.913 -0.495 1
1 10 . 19 1 1 A 14 14 LEU HA H 14 4.654 4.710 -0.056 1
1 20 . 19 1 1 A 14 14 LEU CA C 14 52.999 51.392 1.607 1
1 21 . 19 1 1 A 14 14 LEU CB C 14 41.919 44.764 -2.845 1
1 25 . 19 1 1 A 14 14 LEU N N 14 122.671 121.264 1.407 1
1 26 . 19 1 1 A 15 15 PRO HA H 15 4.460 4.623 -0.163 1
1 33 . 19 1 1 A 15 15 PRO C C 15 178.156 177.595 0.561 1
1 34 . 19 1 1 A 15 15 PRO CA C 15 63.101 62.656 0.445 1
1 35 . 19 1 1 A 15 15 PRO CB C 15 32.304 32.343 -0.039 1
1 38 . 19 1 1 A 16 16 ALA H H 16 8.973 8.632 0.341 1
1 39 . 19 1 1 A 16 16 ALA HA H 16 4.021 3.958 0.063 1
1 43 . 19 1 1 A 16 16 ALA C C 16 180.695 179.192 1.503 1
1 44 . 19 1 1 A 16 16 ALA CA C 16 55.642 55.631 0.011 1
1 45 . 19 1 1 A 16 16 ALA CB C 16 18.552 18.693 -0.141 1
1 46 . 19 1 1 A 16 16 ALA N N 16 128.311 127.058 1.253 1
1 47 . 19 1 1 A 17 17 GLU H H 17 9.558 8.217 1.341 1
1 48 . 19 1 1 A 17 17 GLU HA H 17 4.065 4.095 -0.030 1
1 53 . 19 1 1 A 17 17 GLU C C 17 178.886 178.580 0.306 1
1 54 . 19 1 1 A 17 17 GLU CA C 17 59.400 59.301 0.099 1
1 55 . 19 1 1 A 17 17 GLU CB C 17 28.742 29.384 -0.642 1
1 57 . 19 1 1 A 17 17 GLU N N 17 117.113 117.188 -0.075 1
1 58 . 19 1 1 A 18 18 SER H H 18 7.263 7.970 -0.707 1
1 59 . 19 1 1 A 18 18 SER HA H 18 4.180 4.132 0.048 1
1 62 . 19 1 1 A 18 18 SER C C 18 174.951 175.804 -0.853 1
1 63 . 19 1 1 A 18 18 SER CA C 18 61.969 62.592 -0.623 1
1 64 . 19 1 1 A 18 18 SER CB C 18 62.554 63.029 -0.475 1
1 65 . 19 1 1 A 18 18 SER N N 18 114.932 115.946 -1.014 1
1 66 . 19 1 1 A 19 19 VAL H H 19 7.620 8.181 -0.561 1
1 67 . 19 1 1 A 19 19 VAL HA H 19 3.011 3.134 -0.123 1
1 75 . 19 1 1 A 19 19 VAL C C 19 176.953 177.711 -0.758 1
1 76 . 19 1 1 A 19 19 VAL CA C 19 66.479 66.724 -0.245 1
1 77 . 19 1 1 A 19 19 VAL CB C 19 31.569 31.396 0.173 1
1 80 . 19 1 1 A 19 19 VAL N N 19 121.086 121.683 -0.597 1
1 81 . 19 1 1 A 20 20 LYS H H 20 7.745 8.415 -0.670 1
1 82 . 19 1 1 A 20 20 LYS HA H 20 3.884 3.991 -0.107 1
1 91 . 19 1 1 A 20 20 LYS C C 20 178.150 178.815 -0.665 1
1 92 . 19 1 1 A 20 20 LYS CA C 20 59.984 59.716 0.268 1
1 93 . 19 1 1 A 20 20 LYS CB C 20 32.351 32.234 0.117 1
1 97 . 19 1 1 A 20 20 LYS N N 20 119.366 119.635 -0.269 1
1 98 . 19 1 1 A 21 21 ILE H H 21 6.943 7.451 -0.508 1
1 99 . 19 1 1 A 21 21 ILE HA H 21 3.783 3.674 0.109 1
1 109 . 19 1 1 A 21 21 ILE C C 21 178.996 178.813 0.183 1
1 110 . 19 1 1 A 21 21 ILE CA C 21 64.642 65.622 -0.980 1
1 111 . 19 1 1 A 21 21 ILE CB C 21 38.014 37.685 0.329 1
1 115 . 19 1 1 A 21 21 ILE N N 21 118.163 119.755 -1.592 1
1 116 . 19 1 1 A 22 22 LEU H H 22 7.267 8.083 -0.816 1
1 117 . 19 1 1 A 22 22 LEU HA H 22 3.748 3.943 -0.195 1
1 127 . 19 1 1 A 22 22 LEU C C 22 178.289 178.691 -0.402 1
1 128 . 19 1 1 A 22 22 LEU CA C 22 58.092 58.134 -0.042 1
1 129 . 19 1 1 A 22 22 LEU CB C 22 38.551 40.913 -2.362 1
1 133 . 19 1 1 A 22 22 LEU N N 22 120.609 119.710 0.899 1
1 134 . 19 1 1 A 23 23 ARG H H 23 8.676 8.742 -0.066 1
1 135 . 19 1 1 A 23 23 ARG HA H 23 4.030 4.283 -0.253 1
1 142 . 19 1 1 A 23 23 ARG C C 23 178.861 178.649 0.212 1
1 143 . 19 1 1 A 23 23 ARG CA C 23 60.404 60.155 0.249 1
1 144 . 19 1 1 A 23 23 ARG CB C 23 30.351 30.187 0.164 1
1 147 . 19 1 1 A 23 23 ARG N N 23 119.148 117.442 1.706 1
1 148 . 19 1 1 A 24 24 ASP H H 24 8.515 8.251 0.264 1
1 149 . 19 1 1 A 24 24 ASP HA H 24 4.519 4.396 0.123 1
1 152 . 19 1 1 A 24 24 ASP C C 24 178.759 178.573 0.186 1
1 153 . 19 1 1 A 24 24 ASP CA C 24 57.556 57.230 0.326 1
1 154 . 19 1 1 A 24 24 ASP CB C 24 40.569 41.142 -0.573 1
1 155 . 19 1 1 A 24 24 ASP N N 24 120.027 119.347 0.680 1
1 156 . 19 1 1 A 25 25 TRP H H 25 8.158 8.098 0.060 1
1 157 . 19 1 1 A 25 25 TRP HA H 25 4.181 4.485 -0.304 1
1 166 . 19 1 1 A 25 25 TRP C C 25 179.946 178.427 1.519 1
1 167 . 19 1 1 A 25 25 TRP CA C 25 63.346 61.228 2.118 1
1 168 . 19 1 1 A 25 25 TRP CB C 25 29.433 29.719 -0.286 1
1 174 . 19 1 1 A 25 25 TRP N N 25 121.350 121.719 -0.369 1
1 176 . 19 1 1 A 26 26 MET H H 26 8.977 8.697 0.280 1
1 177 . 19 1 1 A 26 26 MET HA H 26 4.076 4.697 -0.621 1
1 185 . 19 1 1 A 26 26 MET C C 26 177.371 178.209 -0.838 1
1 186 . 19 1 1 A 26 26 MET CA C 26 60.454 58.764 1.690 1
1 187 . 19 1 1 A 26 26 MET CB C 26 33.567 32.735 0.832 1
1 190 . 19 1 1 A 26 26 MET N N 26 119.977 118.841 1.136 1
1 191 . 19 1 1 A 27 27 TYR H H 27 8.604 8.323 0.281 1
1 192 . 19 1 1 A 27 27 TYR HA H 27 4.138 4.305 -0.167 1
1 199 . 19 1 1 A 27 27 TYR C C 27 178.901 177.796 1.105 1
1 200 . 19 1 1 A 27 27 TYR CA C 27 61.846 61.476 0.370 1
1 201 . 19 1 1 A 27 27 TYR CB C 27 38.165 38.567 -0.402 1
1 206 . 19 1 1 A 27 27 TYR N N 27 117.797 121.114 -3.317 1
1 207 . 19 1 1 A 28 28 LYS H H 28 7.867 7.984 -0.117 1
1 208 . 19 1 1 A 28 28 LYS HA H 28 3.797 3.932 -0.135 1
1 217 . 19 1 1 A 28 28 LYS C C 28 176.858 177.748 -0.890 1
1 218 . 19 1 1 A 28 28 LYS CA C 28 58.174 59.140 -0.966 1
1 219 . 19 1 1 A 28 28 LYS CB C 28 32.516 32.186 0.330 1
1 223 . 19 1 1 A 28 28 LYS N N 28 118.982 118.160 0.822 1
1 224 . 19 1 1 A 29 29 HIS H H 29 7.443 7.424 0.019 1
1 225 . 19 1 1 A 29 29 HIS HA H 29 4.386 4.416 -0.030 1
1 230 . 19 1 1 A 29 29 HIS C C 29 176.085 175.704 0.381 1
1 231 . 19 1 1 A 29 29 HIS CA C 29 55.213 55.157 0.056 1
1 232 . 19 1 1 A 29 29 HIS CB C 29 27.085 28.915 -1.830 1
1 235 . 19 1 1 A 29 29 HIS N N 29 117.138 115.367 1.771 1
1 236 . 19 1 1 A 30 30 ARG H H 30 6.921 8.203 -1.282 1
1 237 . 19 1 1 A 30 30 ARG HA H 30 3.898 4.403 -0.505 1
1 244 . 19 1 1 A 30 30 ARG C C 30 175.808 178.001 -2.193 1
1 245 . 19 1 1 A 30 30 ARG CA C 30 58.609 58.582 0.027 1
1 246 . 19 1 1 A 30 30 ARG CB C 30 28.739 29.822 -1.083 1
1 249 . 19 1 1 A 30 30 ARG N N 30 117.911 119.511 -1.600 1
1 250 . 19 1 1 A 31 31 PHE H H 31 7.819 8.349 -0.530 1
1 251 . 19 1 1 A 31 31 PHE HA H 31 4.533 4.243 0.290 1
1 259 . 19 1 1 A 31 31 PHE C C 31 175.577 176.757 -1.180 1
1 260 . 19 1 1 A 31 31 PHE CA C 31 58.029 60.804 -2.775 1
1 261 . 19 1 1 A 31 31 PHE CB C 31 37.792 38.869 -1.077 1
1 267 . 19 1 1 A 31 31 PHE N N 31 115.408 118.618 -3.210 1
1 268 . 19 1 1 A 32 32 LYS H H 32 7.858 8.082 -0.224 1
1 269 . 19 1 1 A 32 32 LYS HA H 32 4.487 4.423 0.064 1
1 277 . 19 1 1 A 32 32 LYS C C 32 175.557 176.296 -0.739 1
1 278 . 19 1 1 A 32 32 LYS CA C 32 56.329 56.687 -0.358 1
1 279 . 19 1 1 A 32 32 LYS CB C 32 32.743 34.529 -1.786 1
1 283 . 19 1 1 A 32 32 LYS N N 32 122.453 113.453 9.000 1
1 284 . 19 1 1 A 33 33 ALA H H 33 8.643 8.397 0.246 1
1 285 . 19 1 1 A 33 33 ALA HA H 33 4.403 4.177 0.226 1
1 289 . 19 1 1 A 33 33 ALA C C 33 176.273 175.433 0.840 1
1 290 . 19 1 1 A 33 33 ALA CA C 33 53.579 53.280 0.299 1
1 291 . 19 1 1 A 33 33 ALA CB C 33 18.653 17.106 1.547 1
1 292 . 19 1 1 A 33 33 ALA N N 33 127.853 120.031 7.822 1
1 293 . 19 1 1 A 34 34 TYR H H 34 7.878 8.024 -0.146 1
1 294 . 19 1 1 A 34 34 TYR HA H 34 4.686 4.911 -0.225 1
1 301 . 19 1 1 A 34 34 TYR C C 34 173.133 173.095 0.038 1
1 302 . 19 1 1 A 34 34 TYR CA C 34 54.778 54.860 -0.082 1
1 303 . 19 1 1 A 34 34 TYR CB C 34 39.619 38.826 0.793 1
1 308 . 19 1 1 A 34 34 TYR N N 34 116.539 117.839 -1.300 1
1 309 . 19 1 1 A 35 35 PRO HA H 35 4.526 4.364 0.162 1
1 316 . 19 1 1 A 35 35 PRO C C 35 176.837 176.864 -0.027 1
1 317 . 19 1 1 A 35 35 PRO CA C 35 61.864 62.586 -0.722 1
1 318 . 19 1 1 A 35 35 PRO CB C 35 30.904 31.340 -0.436 1
1 321 . 19 1 1 A 36 36 SER H H 36 9.634 8.479 1.155 1
1 322 . 19 1 1 A 36 36 SER HA H 36 4.518 4.603 -0.085 1
1 325 . 19 1 1 A 36 36 SER C C 36 175.001 175.911 -0.910 1
1 326 . 19 1 1 A 36 36 SER CA C 36 57.129 58.823 -1.694 1
1 327 . 19 1 1 A 36 36 SER CB C 36 65.374 64.262 1.112 1
1 328 . 19 1 1 A 36 36 SER N N 36 119.984 117.810 2.174 1
1 329 . 19 1 1 A 37 37 GLU H H 37 9.091 8.965 0.126 1
1 330 . 19 1 1 A 37 37 GLU HA H 37 3.884 3.914 -0.030 1
1 335 . 19 1 1 A 37 37 GLU C C 37 179.347 178.356 0.991 1
1 336 . 19 1 1 A 37 37 GLU CA C 37 60.454 59.394 1.060 1
1 337 . 19 1 1 A 37 37 GLU CB C 37 28.623 29.287 -0.664 1
1 339 . 19 1 1 A 37 37 GLU N N 37 120.748 123.957 -3.209 1
1 340 . 19 1 1 A 38 38 GLU H H 38 8.760 7.938 0.822 1
1 341 . 19 1 1 A 38 38 GLU HA H 38 4.048 4.076 -0.028 1
1 346 . 19 1 1 A 38 38 GLU C C 38 179.975 179.075 0.900 1
1 347 . 19 1 1 A 38 38 GLU CA C 38 60.243 59.046 1.197 1
1 348 . 19 1 1 A 38 38 GLU CB C 38 29.117 29.865 -0.748 1
1 350 . 19 1 1 A 38 38 GLU N N 38 119.272 120.109 -0.837 1
1 351 . 19 1 1 A 39 39 GLU H H 39 7.856 7.947 -0.091 1
1 352 . 19 1 1 A 39 39 GLU HA H 39 3.976 3.880 0.096 1
1 357 . 19 1 1 A 39 39 GLU C C 39 178.912 178.572 0.340 1
1 358 . 19 1 1 A 39 39 GLU CA C 39 59.131 59.274 -0.143 1
1 359 . 19 1 1 A 39 39 GLU CB C 39 29.612 28.855 0.757 1
1 361 . 19 1 1 A 39 39 GLU N N 39 121.658 120.707 0.951 1
1 362 . 19 1 1 A 40 40 LYS H H 40 8.653 7.729 0.924 1
1 363 . 19 1 1 A 40 40 LYS HA H 40 3.508 3.841 -0.333 1
1 372 . 19 1 1 A 40 40 LYS C C 40 177.974 178.937 -0.963 1
1 373 . 19 1 1 A 40 40 LYS CA C 40 60.948 59.414 1.534 1
1 374 . 19 1 1 A 40 40 LYS CB C 40 32.714 32.112 0.602 1
1 378 . 19 1 1 A 40 40 LYS N N 40 119.152 119.442 -0.290 1
1 379 . 19 1 1 A 41 41 GLN H H 41 7.876 7.529 0.347 1
1 380 . 19 1 1 A 41 41 GLN HA H 41 3.911 3.991 -0.080 1
1 387 . 19 1 1 A 41 41 GLN C C 41 178.352 178.159 0.193 1
1 388 . 19 1 1 A 41 41 GLN CA C 41 58.973 58.956 0.017 1
1 389 . 19 1 1 A 41 41 GLN CB C 41 27.552 28.560 -1.008 1
1 391 . 19 1 1 A 41 41 GLN N N 41 118.910 119.744 -0.834 1
1 393 . 19 1 1 A 42 42 MET H H 42 7.771 7.898 -0.127 1
1 394 . 19 1 1 A 42 42 MET HA H 42 4.158 4.197 -0.039 1
1 402 . 19 1 1 A 42 42 MET C C 42 179.310 178.243 1.067 1
1 403 . 19 1 1 A 42 42 MET CA C 42 59.079 58.329 0.750 1
1 404 . 19 1 1 A 42 42 MET CB C 42 31.023 32.375 -1.352 1
1 407 . 19 1 1 A 42 42 MET N N 42 121.131 119.163 1.968 1
1 408 . 19 1 1 A 43 43 LEU H H 43 8.400 8.211 0.189 1
1 409 . 19 1 1 A 43 43 LEU HA H 43 3.888 4.026 -0.138 1
1 419 . 19 1 1 A 43 43 LEU C C 43 180.721 179.088 1.633 1
1 420 . 19 1 1 A 43 43 LEU CA C 43 57.916 57.980 -0.064 1
1 421 . 19 1 1 A 43 43 LEU CB C 43 42.080 41.603 0.477 1
1 425 . 19 1 1 A 43 43 LEU N N 43 120.124 120.706 -0.582 1
1 426 . 19 1 1 A 44 44 SER H H 44 8.658 8.534 0.124 1
1 427 . 19 1 1 A 44 44 SER HA H 44 4.088 4.222 -0.134 1
1 430 . 19 1 1 A 44 44 SER C C 44 176.859 176.675 0.184 1
1 431 . 19 1 1 A 44 44 SER CA C 44 61.371 60.998 0.373 1
1 432 . 19 1 1 A 44 44 SER CB C 44 63.314 63.044 0.270 1
1 433 . 19 1 1 A 44 44 SER N N 44 119.795 113.920 5.875 1
1 434 . 19 1 1 A 45 45 GLU H H 45 7.905 7.455 0.450 1
1 435 . 19 1 1 A 45 45 GLU HA H 45 4.094 4.274 -0.180 1
1 440 . 19 1 1 A 45 45 GLU C C 45 179.095 179.055 0.040 1
1 441 . 19 1 1 A 45 45 GLU CA C 45 59.255 58.974 0.281 1
1 442 . 19 1 1 A 45 45 GLU CB C 45 29.200 29.957 -0.757 1
1 444 . 19 1 1 A 45 45 GLU N N 45 120.609 120.932 -0.323 1
1 445 . 19 1 1 A 46 46 LYS H H 46 7.837 7.876 -0.039 1
1 446 . 19 1 1 A 46 46 LYS HA H 46 4.231 4.112 0.119 1
1 453 . 19 1 1 A 46 46 LYS C C 46 177.964 178.676 -0.712 1
1 454 . 19 1 1 A 46 46 LYS CA C 46 58.278 58.947 -0.669 1
1 455 . 19 1 1 A 46 46 LYS CB C 46 34.110 32.486 1.624 1
1 459 . 19 1 1 A 46 46 LYS N N 46 115.471 118.925 -3.454 1
1 460 . 19 1 1 A 47 47 THR H H 47 7.763 7.980 -0.217 1
1 461 . 19 1 1 A 47 47 THR HA H 47 4.271 4.288 -0.017 1
1 466 . 19 1 1 A 47 47 THR C C 47 175.472 174.761 0.711 1
1 467 . 19 1 1 A 47 47 THR CA C 47 62.429 62.085 0.344 1
1 468 . 19 1 1 A 47 47 THR CB C 47 71.966 70.154 1.812 1
1 470 . 19 1 1 A 47 47 THR N N 47 104.286 108.091 -3.805 1
1 471 . 19 1 1 A 48 48 ASN H H 48 8.169 8.071 0.098 1
1 472 . 19 1 1 A 48 48 ASN HA H 48 4.437 4.667 -0.230 1
1 477 . 19 1 1 A 48 48 ASN C C 48 173.874 173.994 -0.120 1
1 478 . 19 1 1 A 48 48 ASN CA C 48 55.377 54.422 0.955 1
1 479 . 19 1 1 A 48 48 ASN CB C 48 37.770 36.709 1.061 1
1 480 . 19 1 1 A 48 48 ASN N N 48 117.458 116.204 1.254 1
1 482 . 19 1 1 A 49 49 LEU H H 49 7.532 7.251 0.281 1
1 483 . 19 1 1 A 49 49 LEU HA H 49 4.733 4.799 -0.066 1
1 493 . 19 1 1 A 49 49 LEU C C 49 176.625 175.628 0.997 1
1 494 . 19 1 1 A 49 49 LEU CA C 49 53.226 53.337 -0.111 1
1 495 . 19 1 1 A 49 49 LEU CB C 49 44.114 43.497 0.617 1
1 499 . 19 1 1 A 49 49 LEU N N 49 118.220 119.157 -0.937 1
1 500 . 19 1 1 A 50 50 SER H H 50 9.140 8.772 0.368 1
1 501 . 19 1 1 A 50 50 SER HA H 50 4.475 4.886 -0.411 1
1 504 . 19 1 1 A 50 50 SER C C 50 174.907 175.043 -0.136 1
1 505 . 19 1 1 A 50 50 SER CA C 50 56.964 57.678 -0.714 1
1 506 . 19 1 1 A 50 50 SER CB C 50 65.372 65.003 0.369 1
1 507 . 19 1 1 A 50 50 SER N N 50 117.569 117.383 0.186 1
1 508 . 19 1 1 A 51 51 LEU H H 51 8.756 8.748 0.008 1
1 509 . 19 1 1 A 51 51 LEU HA H 51 3.874 3.921 -0.047 1
1 519 . 19 1 1 A 51 51 LEU C C 51 179.910 178.825 1.085 1
1 520 . 19 1 1 A 51 51 LEU CA C 51 58.916 58.163 0.753 1
1 521 . 19 1 1 A 51 51 LEU CB C 51 41.148 41.341 -0.193 1
1 525 . 19 1 1 A 51 51 LEU N N 51 120.905 125.886 -4.981 1
1 526 . 19 1 1 A 52 52 LEU H H 52 8.146 8.360 -0.214 1
1 527 . 19 1 1 A 52 52 LEU HA H 52 4.179 4.048 0.131 1
1 537 . 19 1 1 A 52 52 LEU C C 52 178.936 178.739 0.197 1
1 538 . 19 1 1 A 52 52 LEU CA C 52 58.162 58.439 -0.277 1
1 539 . 19 1 1 A 52 52 LEU CB C 52 42.137 41.797 0.340 1
1 543 . 19 1 1 A 52 52 LEU N N 52 120.685 120.231 0.454 1
1 544 . 19 1 1 A 53 53 GLN H H 53 7.924 8.280 -0.356 1
1 545 . 19 1 1 A 53 53 GLN HA H 53 4.102 4.142 -0.040 1
1 552 . 19 1 1 A 53 53 GLN C C 53 180.308 178.347 1.961 1
1 553 . 19 1 1 A 53 53 GLN CA C 53 59.326 58.355 0.971 1
1 554 . 19 1 1 A 53 53 GLN CB C 53 29.900 28.422 1.478 1
1 556 . 19 1 1 A 53 53 GLN N N 53 118.473 117.696 0.777 1
1 558 . 19 1 1 A 54 54 ILE H H 54 8.380 8.232 0.148 1
1 559 . 19 1 1 A 54 54 ILE HA H 54 3.677 3.744 -0.067 1
1 569 . 19 1 1 A 54 54 ILE C C 54 177.673 178.276 -0.603 1
1 570 . 19 1 1 A 54 54 ILE CA C 54 64.650 65.335 -0.685 1
1 571 . 19 1 1 A 54 54 ILE CB C 54 37.476 37.796 -0.320 1
1 575 . 19 1 1 A 54 54 ILE N N 54 120.113 121.583 -1.470 1
1 576 . 19 1 1 A 55 55 SER H H 55 8.854 7.902 0.952 1
1 577 . 19 1 1 A 55 55 SER HA H 55 4.267 4.345 -0.078 1
1 580 . 19 1 1 A 55 55 SER C C 55 177.127 177.693 -0.566 1
1 581 . 19 1 1 A 55 55 SER CA C 55 62.852 61.822 1.030 1
1 582 . 19 1 1 A 55 55 SER CB C 55 62.727 63.067 -0.340 1
1 583 . 19 1 1 A 55 55 SER N N 55 116.646 115.905 0.741 1
1 584 . 19 1 1 A 56 56 ASN H H 56 8.634 8.339 0.295 1
1 585 . 19 1 1 A 56 56 ASN HA H 56 4.549 4.449 0.100 1
1 590 . 19 1 1 A 56 56 ASN C C 56 177.481 178.434 -0.953 1
1 591 . 19 1 1 A 56 56 ASN CA C 56 55.951 56.516 -0.565 1
1 592 . 19 1 1 A 56 56 ASN CB C 56 37.852 38.311 -0.459 1
1 593 . 19 1 1 A 56 56 ASN N N 56 119.048 118.994 0.054 1
1 595 . 19 1 1 A 57 57 TRP H H 57 8.373 8.218 0.155 1
1 596 . 19 1 1 A 57 57 TRP HA H 57 4.065 4.339 -0.274 1
1 605 . 19 1 1 A 57 57 TRP C C 57 179.392 178.300 1.092 1
1 606 . 19 1 1 A 57 57 TRP CA C 57 63.204 61.401 1.803 1
1 607 . 19 1 1 A 57 57 TRP CB C 57 28.376 29.264 -0.888 1
1 613 . 19 1 1 A 57 57 TRP N N 57 122.950 123.250 -0.300 1
1 615 . 19 1 1 A 58 58 PHE H H 58 8.428 8.311 0.117 1
1 616 . 19 1 1 A 58 58 PHE HA H 58 3.922 3.783 0.139 1
1 624 . 19 1 1 A 58 58 PHE C C 58 178.237 177.907 0.330 1
1 625 . 19 1 1 A 58 58 PHE CA C 58 64.015 61.766 2.249 1
1 626 . 19 1 1 A 58 58 PHE CB C 58 39.602 38.317 1.285 1
1 632 . 19 1 1 A 58 58 PHE N N 58 116.774 118.052 -1.278 1
1 633 . 19 1 1 A 59 59 ILE H H 59 7.925 8.302 -0.377 1
1 634 . 19 1 1 A 59 59 ILE HA H 59 3.773 3.718 0.055 1
1 644 . 19 1 1 A 59 59 ILE C C 59 178.745 177.532 1.213 1
1 645 . 19 1 1 A 59 59 ILE CA C 59 65.531 65.278 0.253 1
1 646 . 19 1 1 A 59 59 ILE CB C 59 38.480 37.699 0.781 1
1 650 . 19 1 1 A 59 59 ILE N N 59 119.560 120.018 -0.458 1
1 651 . 19 1 1 A 60 60 ASN H H 60 7.506 7.949 -0.443 1
1 652 . 19 1 1 A 60 60 ASN HA H 60 4.407 4.432 -0.025 1
1 657 . 19 1 1 A 60 60 ASN C C 60 177.163 177.775 -0.612 1
1 658 . 19 1 1 A 60 60 ASN CA C 60 55.871 56.133 -0.262 1
1 659 . 19 1 1 A 60 60 ASN CB C 60 38.878 37.760 1.118 1
1 660 . 19 1 1 A 60 60 ASN N N 60 116.868 118.027 -1.159 1
1 662 . 19 1 1 A 61 61 ALA H H 61 8.410 8.266 0.144 1
1 663 . 19 1 1 A 61 61 ALA HA H 61 3.667 3.722 -0.055 1
1 667 . 19 1 1 A 61 61 ALA C C 61 180.061 179.399 0.662 1
1 668 . 19 1 1 A 61 61 ALA CA C 61 54.601 54.643 -0.042 1
1 669 . 19 1 1 A 61 61 ALA CB C 61 18.241 17.242 0.999 1
1 670 . 19 1 1 A 61 61 ALA N N 61 123.022 122.612 0.410 1
1 671 . 19 1 1 A 62 62 ARG H H 62 8.036 8.171 -0.135 1
1 672 . 19 1 1 A 62 62 ARG HA H 62 4.092 4.115 -0.023 1
1 679 . 19 1 1 A 62 62 ARG C C 62 176.756 177.137 -0.381 1
1 680 . 19 1 1 A 62 62 ARG CA C 62 58.762 58.195 0.567 1
1 681 . 19 1 1 A 62 62 ARG CB C 62 30.601 29.711 0.890 1
1 684 . 19 1 1 A 62 62 ARG N N 62 117.168 116.960 0.208 1
1 685 . 19 1 1 A 63 63 ARG H H 63 7.214 7.719 -0.505 1
1 686 . 19 1 1 A 63 63 ARG HA H 63 4.249 4.420 -0.171 1
1 693 . 19 1 1 A 63 63 ARG C C 63 176.945 176.624 0.321 1
1 694 . 19 1 1 A 63 63 ARG CA C 63 57.669 56.576 1.093 1
1 695 . 19 1 1 A 63 63 ARG CB C 63 30.765 31.248 -0.483 1
1 698 . 19 1 1 A 63 63 ARG N N 63 116.514 117.715 -1.201 1
1 699 . 19 1 1 A 64 64 ARG H H 64 7.913 7.850 0.063 1
1 700 . 19 1 1 A 64 64 ARG HA H 64 4.351 4.599 -0.248 1
1 707 . 19 1 1 A 64 64 ARG C C 64 176.413 178.347 -1.934 1
1 708 . 19 1 1 A 64 64 ARG CA C 64 57.105 57.255 -0.150 1
1 709 . 19 1 1 A 64 64 ARG CB C 64 31.672 32.915 -1.243 1
1 712 . 19 1 1 A 64 64 ARG N N 64 116.818 119.156 -2.338 1
1 713 . 19 1 1 A 65 65 ILE H H 65 8.169 8.227 -0.058 1
1 714 . 19 1 1 A 65 65 ILE HA H 65 4.285 3.654 0.631 1
1 724 . 19 1 1 A 65 65 ILE C C 65 176.208 177.856 -1.648 1
1 725 . 19 1 1 A 65 65 ILE CA C 65 62.005 65.537 -3.532 1
1 726 . 19 1 1 A 65 65 ILE CB C 65 39.088 37.861 1.227 1
1 730 . 19 1 1 A 65 65 ILE N N 65 119.185 119.943 -0.758 1
1 731 . 19 1 1 A 66 66 LEU H H 66 7.962 8.201 -0.239 1
1 732 . 19 1 1 A 66 66 LEU HA H 66 4.485 4.002 0.483 1
1 742 . 19 1 1 A 66 66 LEU C C 66 176.216 175.319 0.897 1
1 743 . 19 1 1 A 66 66 LEU CA C 66 56.153 59.748 -3.595 1
1 744 . 19 1 1 A 66 66 LEU CB C 66 40.792 39.928 0.864 1
1 748 . 19 1 1 A 66 66 LEU N N 66 124.389 121.558 2.831 1
1 749 . 19 1 1 A 67 67 PRO HA H 67 4.283 4.364 -0.081 1
1 756 . 19 1 1 A 67 67 PRO C C 67 178.294 178.199 0.095 1
1 757 . 19 1 1 A 67 67 PRO CA C 67 65.390 64.660 0.730 1
1 758 . 19 1 1 A 67 67 PRO CB C 67 31.095 31.392 -0.297 1
1 761 . 19 1 1 A 68 68 ASP H H 68 7.913 8.709 -0.796 1
1 762 . 19 1 1 A 68 68 ASP HA H 68 4.507 4.571 -0.064 1
1 765 . 19 1 1 A 68 68 ASP C C 68 177.927 177.929 -0.002 1
1 766 . 19 1 1 A 68 68 ASP CA C 68 55.906 56.574 -0.668 1
1 767 . 19 1 1 A 68 68 ASP CB C 68 40.736 41.549 -0.813 1
1 768 . 19 1 1 A 68 68 ASP N N 68 117.231 118.907 -1.676 1
1 769 . 19 1 1 A 69 69 MET H H 69 8.083 8.108 -0.025 1
1 770 . 19 1 1 A 69 69 MET HA H 69 4.362 4.198 0.164 1
1 778 . 19 1 1 A 69 69 MET C C 69 177.374 178.988 -1.614 1
1 779 . 19 1 1 A 69 69 MET CA C 69 57.634 58.451 -0.817 1
1 780 . 19 1 1 A 69 69 MET CB C 69 32.816 32.533 0.283 1
1 783 . 19 1 1 A 69 69 MET N N 69 119.391 118.602 0.789 1
1 784 . 19 1 1 A 70 70 LEU H H 70 7.907 7.609 0.298 1
1 785 . 19 1 1 A 70 70 LEU HA H 70 4.232 3.786 0.446 1
1 795 . 19 1 1 A 70 70 LEU C C 70 177.745 177.868 -0.123 1
1 796 . 19 1 1 A 70 70 LEU CA C 70 55.835 58.010 -2.175 1
1 797 . 19 1 1 A 70 70 LEU CB C 70 42.174 41.679 0.495 1
1 801 . 19 1 1 A 70 70 LEU N N 70 119.266 120.415 -1.149 1
1 802 . 19 1 1 A 71 71 GLN H H 71 7.865 7.635 0.230 1
1 803 . 19 1 1 A 71 71 GLN HA H 71 4.287 4.262 0.025 1
1 809 . 19 1 1 A 71 71 GLN C C 71 178.855 176.397 2.458 1
1 810 . 19 1 1 A 71 71 GLN CA C 71 56.383 56.944 -0.561 1
1 811 . 19 1 1 A 71 71 GLN CB C 71 29.092 28.761 0.331 1
1 813 . 19 1 1 A 71 71 GLN N N 71 118.603 118.370 0.233 1
1 815 . 19 1 1 A 72 72 GLN H H 72 8.189 8.339 -0.150 1
1 816 . 19 1 1 A 72 72 GLN HA H 72 4.302 4.180 0.122 1
1 821 . 19 1 1 A 72 72 GLN CA C 72 56.206 57.229 -1.023 1
1 822 . 19 1 1 A 72 72 GLN CB C 72 29.298 28.901 0.397 1
1 824 . 19 1 1 A 72 72 GLN N N 72 120.267 121.655 -1.388 1
1 825 . 19 1 1 A 73 73 ARG C C 73 176.105 177.294 -1.189 1
1 826 . 19 1 1 A 74 74 ARG HA H 74 4.334 3.977 0.357 1
1 833 . 19 1 1 A 74 74 ARG C C 74 176.188 175.945 0.243 1
1 834 . 19 1 1 A 74 74 ARG CA C 74 56.300 59.316 -3.016 1
1 835 . 19 1 1 A 74 74 ARG CB C 74 30.668 30.607 0.061 1
1 838 . 19 1 1 A 75 75 ASN C C 75 174.462 172.608 1.854 1
1 839 . 19 1 1 A 75 75 ASN CA C 75 53.148 52.273 0.875 1
1 840 . 19 1 1 A 75 75 ASN CB C 75 39.046 41.365 -2.319 1
1 841 . 19 1 1 A 76 76 ASP H H 76 8.257 8.799 -0.542 1
1 842 . 19 1 1 A 76 76 ASP HA H 76 4.877 5.280 -0.403 1
1 845 . 19 1 1 A 76 76 ASP C C 76 174.759 174.378 0.381 1
1 846 . 19 1 1 A 76 76 ASP CA C 76 52.380 51.068 1.312 1
1 847 . 19 1 1 A 76 76 ASP CB C 76 41.267 41.431 -0.164 1
1 848 . 19 1 1 A 76 76 ASP N N 76 122.030 120.875 1.155 1
1 849 . 19 1 1 A 77 77 PRO HA H 77 4.466 4.646 -0.180 1
1 856 . 19 1 1 A 77 77 PRO C C 77 177.133 176.242 0.891 1
1 857 . 19 1 1 A 77 77 PRO CA C 77 63.733 62.685 1.048 1
1 858 . 19 1 1 A 77 77 PRO CB C 77 31.919 31.751 0.168 1
1 861 . 19 1 1 A 78 78 SER H H 78 8.457 8.612 -0.155 1
1 862 . 19 1 1 A 78 78 SER HA H 78 4.479 4.938 -0.459 1
1 865 . 19 1 1 A 78 78 SER C C 78 174.731 173.652 1.079 1
1 866 . 19 1 1 A 78 78 SER CA C 78 58.691 57.071 1.620 1
1 867 . 19 1 1 A 78 78 SER CB C 78 63.973 64.795 -0.822 1
1 868 . 19 1 1 A 78 78 SER N N 78 115.711 118.035 -2.324 1
1 869 . 19 1 1 A 79 79 GLY H H 79 8.090 8.374 -0.284 1
1 870 . 19 1 1 A 79 79 GLY HA2 H 79 4.179 4.237 -0.058 1
1 871 . 19 1 1 A 79 79 GLY HA3 H 79 4.065 4.242 -0.177 1
1 872 . 19 1 1 A 79 79 GLY CA C 79 44.746 45.449 -0.703 1
1 873 . 19 1 1 A 79 79 GLY N N 79 110.429 111.056 -0.627 1
1 874 . 19 1 1 A 80 80 PRO HA H 80 4.464 4.639 -0.175 1
1 880 . 19 1 1 A 80 80 PRO C C 80 177.499 175.132 2.367 1
1 881 . 19 1 1 A 80 80 PRO CA C 80 63.275 62.438 0.837 1
1 882 . 19 1 1 A 80 80 PRO CB C 80 32.249 33.294 -1.045 1
1 1 . 20 1 1 A 13 13 ASN HA H 13 4.787 5.579 -0.792 1
1 6 . 20 1 1 A 13 13 ASN CA C 13 53.148 52.385 0.763 1
1 7 . 20 1 1 A 13 13 ASN CB C 13 39.378 41.791 -2.413 1
1 9 . 20 1 1 A 14 14 LEU H H 14 8.418 8.756 -0.338 1
1 10 . 20 1 1 A 14 14 LEU HA H 14 4.654 4.654 0.000 1
1 20 . 20 1 1 A 14 14 LEU CA C 14 52.999 52.881 0.118 1
1 21 . 20 1 1 A 14 14 LEU CB C 14 41.919 40.859 1.060 1
1 25 . 20 1 1 A 14 14 LEU N N 14 122.671 122.575 0.096 1
1 26 . 20 1 1 A 15 15 PRO HA H 15 4.460 4.571 -0.111 1
1 33 . 20 1 1 A 15 15 PRO C C 15 178.156 177.561 0.595 1
1 34 . 20 1 1 A 15 15 PRO CA C 15 63.101 62.615 0.486 1
1 35 . 20 1 1 A 15 15 PRO CB C 15 32.304 32.352 -0.048 1
1 38 . 20 1 1 A 16 16 ALA H H 16 8.973 8.624 0.349 1
1 39 . 20 1 1 A 16 16 ALA HA H 16 4.021 3.941 0.080 1
1 43 . 20 1 1 A 16 16 ALA C C 16 180.695 179.636 1.059 1
1 44 . 20 1 1 A 16 16 ALA CA C 16 55.642 55.594 0.048 1
1 45 . 20 1 1 A 16 16 ALA CB C 16 18.552 18.683 -0.131 1
1 46 . 20 1 1 A 16 16 ALA N N 16 128.311 126.982 1.329 1
1 47 . 20 1 1 A 17 17 GLU H H 17 9.558 8.403 1.155 1
1 48 . 20 1 1 A 17 17 GLU HA H 17 4.065 3.999 0.066 1
1 53 . 20 1 1 A 17 17 GLU C C 17 178.886 178.757 0.129 1
1 54 . 20 1 1 A 17 17 GLU CA C 17 59.400 59.685 -0.285 1
1 55 . 20 1 1 A 17 17 GLU CB C 17 28.742 29.583 -0.841 1
1 57 . 20 1 1 A 17 17 GLU N N 17 117.113 118.668 -1.555 1
1 58 . 20 1 1 A 18 18 SER H H 18 7.263 8.032 -0.769 1
1 59 . 20 1 1 A 18 18 SER HA H 18 4.180 4.137 0.043 1
1 62 . 20 1 1 A 18 18 SER C C 18 174.951 176.185 -1.234 1
1 63 . 20 1 1 A 18 18 SER CA C 18 61.969 62.465 -0.496 1
1 64 . 20 1 1 A 18 18 SER CB C 18 62.554 62.940 -0.386 1
1 65 . 20 1 1 A 18 18 SER N N 18 114.932 117.077 -2.145 1
1 66 . 20 1 1 A 19 19 VAL H H 19 7.620 8.212 -0.592 1
1 67 . 20 1 1 A 19 19 VAL HA H 19 3.011 3.203 -0.192 1
1 75 . 20 1 1 A 19 19 VAL C C 19 176.953 177.759 -0.806 1
1 76 . 20 1 1 A 19 19 VAL CA C 19 66.479 66.647 -0.168 1
1 77 . 20 1 1 A 19 19 VAL CB C 19 31.569 31.473 0.096 1
1 80 . 20 1 1 A 19 19 VAL N N 19 121.086 121.415 -0.329 1
1 81 . 20 1 1 A 20 20 LYS H H 20 7.745 8.422 -0.677 1
1 82 . 20 1 1 A 20 20 LYS HA H 20 3.884 3.998 -0.114 1
1 91 . 20 1 1 A 20 20 LYS C C 20 178.150 178.898 -0.748 1
1 92 . 20 1 1 A 20 20 LYS CA C 20 59.984 59.641 0.343 1
1 93 . 20 1 1 A 20 20 LYS CB C 20 32.351 32.167 0.184 1
1 97 . 20 1 1 A 20 20 LYS N N 20 119.366 119.620 -0.254 1
1 98 . 20 1 1 A 21 21 ILE H H 21 6.943 7.801 -0.858 1
1 99 . 20 1 1 A 21 21 ILE HA H 21 3.783 3.705 0.078 1
1 109 . 20 1 1 A 21 21 ILE C C 21 178.996 178.791 0.205 1
1 110 . 20 1 1 A 21 21 ILE CA C 21 64.642 65.624 -0.982 1
1 111 . 20 1 1 A 21 21 ILE CB C 21 38.014 37.876 0.138 1
1 115 . 20 1 1 A 21 21 ILE N N 21 118.163 120.252 -2.089 1
1 116 . 20 1 1 A 22 22 LEU H H 22 7.267 8.023 -0.756 1
1 117 . 20 1 1 A 22 22 LEU HA H 22 3.748 3.881 -0.133 1
1 127 . 20 1 1 A 22 22 LEU C C 22 178.289 178.690 -0.401 1
1 128 . 20 1 1 A 22 22 LEU CA C 22 58.092 58.111 -0.019 1
1 129 . 20 1 1 A 22 22 LEU CB C 22 38.551 40.816 -2.265 1
1 133 . 20 1 1 A 22 22 LEU N N 22 120.609 119.278 1.331 1
1 134 . 20 1 1 A 23 23 ARG H H 23 8.676 8.738 -0.062 1
1 135 . 20 1 1 A 23 23 ARG HA H 23 4.030 4.211 -0.181 1
1 142 . 20 1 1 A 23 23 ARG C C 23 178.861 178.381 0.480 1
1 143 . 20 1 1 A 23 23 ARG CA C 23 60.404 60.035 0.369 1
1 144 . 20 1 1 A 23 23 ARG CB C 23 30.351 30.169 0.182 1
1 147 . 20 1 1 A 23 23 ARG N N 23 119.148 117.528 1.620 1
1 148 . 20 1 1 A 24 24 ASP H H 24 8.515 8.189 0.326 1
1 149 . 20 1 1 A 24 24 ASP HA H 24 4.519 4.395 0.124 1
1 152 . 20 1 1 A 24 24 ASP C C 24 178.759 178.433 0.326 1
1 153 . 20 1 1 A 24 24 ASP CA C 24 57.556 57.251 0.305 1
1 154 . 20 1 1 A 24 24 ASP CB C 24 40.569 40.892 -0.323 1
1 155 . 20 1 1 A 24 24 ASP N N 24 120.027 119.148 0.879 1
1 156 . 20 1 1 A 25 25 TRP H H 25 8.158 8.014 0.144 1
1 157 . 20 1 1 A 25 25 TRP HA H 25 4.181 4.478 -0.297 1
1 166 . 20 1 1 A 25 25 TRP C C 25 179.946 178.352 1.594 1
1 167 . 20 1 1 A 25 25 TRP CA C 25 63.346 61.269 2.077 1
1 168 . 20 1 1 A 25 25 TRP CB C 25 29.433 29.620 -0.187 1
1 174 . 20 1 1 A 25 25 TRP N N 25 121.350 121.568 -0.218 1
1 176 . 20 1 1 A 26 26 MET H H 26 8.977 8.971 0.006 1
1 177 . 20 1 1 A 26 26 MET HA H 26 4.076 4.570 -0.494 1
1 185 . 20 1 1 A 26 26 MET C C 26 177.371 178.337 -0.966 1
1 186 . 20 1 1 A 26 26 MET CA C 26 60.454 58.877 1.577 1
1 187 . 20 1 1 A 26 26 MET CB C 26 33.567 32.539 1.028 1
1 190 . 20 1 1 A 26 26 MET N N 26 119.977 118.750 1.227 1
1 191 . 20 1 1 A 27 27 TYR H H 27 8.604 8.326 0.278 1
1 192 . 20 1 1 A 27 27 TYR HA H 27 4.138 4.151 -0.013 1
1 199 . 20 1 1 A 27 27 TYR C C 27 178.901 177.437 1.464 1
1 200 . 20 1 1 A 27 27 TYR CA C 27 61.846 61.587 0.259 1
1 201 . 20 1 1 A 27 27 TYR CB C 27 38.165 38.760 -0.595 1
1 206 . 20 1 1 A 27 27 TYR N N 27 117.797 121.302 -3.505 1
1 207 . 20 1 1 A 28 28 LYS H H 28 7.867 7.848 0.019 1
1 208 . 20 1 1 A 28 28 LYS HA H 28 3.797 3.720 0.077 1
1 217 . 20 1 1 A 28 28 LYS C C 28 176.858 177.636 -0.778 1
1 218 . 20 1 1 A 28 28 LYS CA C 28 58.174 58.839 -0.665 1
1 219 . 20 1 1 A 28 28 LYS CB C 28 32.516 32.215 0.301 1
1 223 . 20 1 1 A 28 28 LYS N N 28 118.982 117.972 1.010 1
1 224 . 20 1 1 A 29 29 HIS H H 29 7.443 7.293 0.150 1
1 225 . 20 1 1 A 29 29 HIS HA H 29 4.386 4.477 -0.091 1
1 230 . 20 1 1 A 29 29 HIS C C 29 176.085 175.898 0.187 1
1 231 . 20 1 1 A 29 29 HIS CA C 29 55.213 55.219 -0.006 1
1 232 . 20 1 1 A 29 29 HIS CB C 29 27.085 29.108 -2.023 1
1 235 . 20 1 1 A 29 29 HIS N N 29 117.138 115.424 1.714 1
1 236 . 20 1 1 A 30 30 ARG H H 30 6.921 8.694 -1.773 1
1 237 . 20 1 1 A 30 30 ARG HA H 30 3.898 4.356 -0.458 1
1 244 . 20 1 1 A 30 30 ARG C C 30 175.808 177.962 -2.154 1
1 245 . 20 1 1 A 30 30 ARG CA C 30 58.609 58.663 -0.054 1
1 246 . 20 1 1 A 30 30 ARG CB C 30 28.739 29.832 -1.093 1
1 249 . 20 1 1 A 30 30 ARG N N 30 117.911 119.675 -1.764 1
1 250 . 20 1 1 A 31 31 PHE H H 31 7.819 8.371 -0.552 1
1 251 . 20 1 1 A 31 31 PHE HA H 31 4.533 4.261 0.272 1
1 259 . 20 1 1 A 31 31 PHE C C 31 175.577 177.450 -1.873 1
1 260 . 20 1 1 A 31 31 PHE CA C 31 58.029 60.961 -2.932 1
1 261 . 20 1 1 A 31 31 PHE CB C 31 37.792 38.993 -1.201 1
1 267 . 20 1 1 A 31 31 PHE N N 31 115.408 118.963 -3.555 1
1 268 . 20 1 1 A 32 32 LYS H H 32 7.858 8.203 -0.345 1
1 269 . 20 1 1 A 32 32 LYS HA H 32 4.487 4.543 -0.056 1
1 277 . 20 1 1 A 32 32 LYS C C 32 175.557 176.833 -1.276 1
1 278 . 20 1 1 A 32 32 LYS CA C 32 56.329 57.970 -1.641 1
1 279 . 20 1 1 A 32 32 LYS CB C 32 32.743 34.272 -1.529 1
1 283 . 20 1 1 A 32 32 LYS N N 32 122.453 114.283 8.170 1
1 284 . 20 1 1 A 33 33 ALA H H 33 8.643 8.060 0.583 1
1 285 . 20 1 1 A 33 33 ALA HA H 33 4.403 4.147 0.256 1
1 289 . 20 1 1 A 33 33 ALA C C 33 176.273 175.293 0.980 1
1 290 . 20 1 1 A 33 33 ALA CA C 33 53.579 53.436 0.143 1
1 291 . 20 1 1 A 33 33 ALA CB C 33 18.653 17.247 1.406 1
1 292 . 20 1 1 A 33 33 ALA N N 33 127.853 119.799 8.054 1
1 293 . 20 1 1 A 34 34 TYR H H 34 7.878 8.049 -0.171 1
1 294 . 20 1 1 A 34 34 TYR HA H 34 4.686 4.842 -0.156 1
1 301 . 20 1 1 A 34 34 TYR C C 34 173.133 173.247 -0.114 1
1 302 . 20 1 1 A 34 34 TYR CA C 34 54.778 54.897 -0.119 1
1 303 . 20 1 1 A 34 34 TYR CB C 34 39.619 40.760 -1.141 1
1 308 . 20 1 1 A 34 34 TYR N N 34 116.539 116.593 -0.054 1
1 309 . 20 1 1 A 35 35 PRO HA H 35 4.526 4.518 0.008 1
1 316 . 20 1 1 A 35 35 PRO C C 35 176.837 175.489 1.348 1
1 317 . 20 1 1 A 35 35 PRO CA C 35 61.864 62.049 -0.185 1
1 318 . 20 1 1 A 35 35 PRO CB C 35 30.904 32.232 -1.328 1
1 321 . 20 1 1 A 36 36 SER H H 36 9.634 8.444 1.190 1
1 322 . 20 1 1 A 36 36 SER HA H 36 4.518 4.763 -0.245 1
1 325 . 20 1 1 A 36 36 SER C C 36 175.001 175.235 -0.234 1
1 326 . 20 1 1 A 36 36 SER CA C 36 57.129 56.471 0.658 1
1 327 . 20 1 1 A 36 36 SER CB C 36 65.374 65.523 -0.149 1
1 328 . 20 1 1 A 36 36 SER N N 36 119.984 116.629 3.355 1
1 329 . 20 1 1 A 37 37 GLU H H 37 9.091 9.187 -0.096 1
1 330 . 20 1 1 A 37 37 GLU HA H 37 3.884 3.945 -0.061 1
1 335 . 20 1 1 A 37 37 GLU C C 37 179.347 178.359 0.988 1
1 336 . 20 1 1 A 37 37 GLU CA C 37 60.454 59.419 1.035 1
1 337 . 20 1 1 A 37 37 GLU CB C 37 28.623 29.214 -0.591 1
1 339 . 20 1 1 A 37 37 GLU N N 37 120.748 126.591 -5.843 1
1 340 . 20 1 1 A 38 38 GLU H H 38 8.760 7.967 0.793 1
1 341 . 20 1 1 A 38 38 GLU HA H 38 4.048 4.087 -0.039 1
1 346 . 20 1 1 A 38 38 GLU C C 38 179.975 178.936 1.039 1
1 347 . 20 1 1 A 38 38 GLU CA C 38 60.243 59.038 1.205 1
1 348 . 20 1 1 A 38 38 GLU CB C 38 29.117 29.871 -0.754 1
1 350 . 20 1 1 A 38 38 GLU N N 38 119.272 120.130 -0.858 1
1 351 . 20 1 1 A 39 39 GLU H H 39 7.856 7.993 -0.137 1
1 352 . 20 1 1 A 39 39 GLU HA H 39 3.976 3.918 0.058 1
1 357 . 20 1 1 A 39 39 GLU C C 39 178.912 178.818 0.094 1
1 358 . 20 1 1 A 39 39 GLU CA C 39 59.131 59.195 -0.064 1
1 359 . 20 1 1 A 39 39 GLU CB C 39 29.612 28.822 0.790 1
1 361 . 20 1 1 A 39 39 GLU N N 39 121.658 120.815 0.843 1
1 362 . 20 1 1 A 40 40 LYS H H 40 8.653 7.852 0.801 1
1 363 . 20 1 1 A 40 40 LYS HA H 40 3.508 3.825 -0.317 1
1 372 . 20 1 1 A 40 40 LYS C C 40 177.974 179.060 -1.086 1
1 373 . 20 1 1 A 40 40 LYS CA C 40 60.948 59.504 1.444 1
1 374 . 20 1 1 A 40 40 LYS CB C 40 32.714 32.093 0.621 1
1 378 . 20 1 1 A 40 40 LYS N N 40 119.152 119.786 -0.634 1
1 379 . 20 1 1 A 41 41 GLN H H 41 7.876 7.510 0.366 1
1 380 . 20 1 1 A 41 41 GLN HA H 41 3.911 3.978 -0.067 1
1 387 . 20 1 1 A 41 41 GLN C C 41 178.352 178.123 0.229 1
1 388 . 20 1 1 A 41 41 GLN CA C 41 58.973 58.920 0.053 1
1 389 . 20 1 1 A 41 41 GLN CB C 41 27.552 28.626 -1.074 1
1 391 . 20 1 1 A 41 41 GLN N N 41 118.910 119.620 -0.710 1
1 393 . 20 1 1 A 42 42 MET H H 42 7.771 7.846 -0.075 1
1 394 . 20 1 1 A 42 42 MET HA H 42 4.158 4.215 -0.057 1
1 402 . 20 1 1 A 42 42 MET C C 42 179.310 178.244 1.066 1
1 403 . 20 1 1 A 42 42 MET CA C 42 59.079 58.318 0.761 1
1 404 . 20 1 1 A 42 42 MET CB C 42 31.023 32.512 -1.489 1
1 407 . 20 1 1 A 42 42 MET N N 42 121.131 119.182 1.949 1
1 408 . 20 1 1 A 43 43 LEU H H 43 8.400 8.437 -0.037 1
1 409 . 20 1 1 A 43 43 LEU HA H 43 3.888 3.961 -0.073 1
1 419 . 20 1 1 A 43 43 LEU C C 43 180.721 178.989 1.732 1
1 420 . 20 1 1 A 43 43 LEU CA C 43 57.916 58.140 -0.224 1
1 421 . 20 1 1 A 43 43 LEU CB C 43 42.080 41.247 0.833 1
1 425 . 20 1 1 A 43 43 LEU N N 43 120.124 120.845 -0.721 1
1 426 . 20 1 1 A 44 44 SER H H 44 8.658 8.525 0.133 1
1 427 . 20 1 1 A 44 44 SER HA H 44 4.088 4.111 -0.023 1
1 430 . 20 1 1 A 44 44 SER C C 44 176.859 176.683 0.176 1
1 431 . 20 1 1 A 44 44 SER CA C 44 61.371 61.069 0.302 1
1 432 . 20 1 1 A 44 44 SER CB C 44 63.314 63.057 0.257 1
1 433 . 20 1 1 A 44 44 SER N N 44 119.795 113.643 6.152 1
1 434 . 20 1 1 A 45 45 GLU H H 45 7.905 7.629 0.276 1
1 435 . 20 1 1 A 45 45 GLU HA H 45 4.094 4.225 -0.131 1
1 440 . 20 1 1 A 45 45 GLU C C 45 179.095 179.146 -0.051 1
1 441 . 20 1 1 A 45 45 GLU CA C 45 59.255 58.971 0.284 1
1 442 . 20 1 1 A 45 45 GLU CB C 45 29.200 29.832 -0.632 1
1 444 . 20 1 1 A 45 45 GLU N N 45 120.609 121.070 -0.461 1
1 445 . 20 1 1 A 46 46 LYS H H 46 7.837 7.994 -0.157 1
1 446 . 20 1 1 A 46 46 LYS HA H 46 4.231 4.143 0.088 1
1 453 . 20 1 1 A 46 46 LYS C C 46 177.964 178.738 -0.774 1
1 454 . 20 1 1 A 46 46 LYS CA C 46 58.278 58.993 -0.715 1
1 455 . 20 1 1 A 46 46 LYS CB C 46 34.110 32.700 1.410 1
1 459 . 20 1 1 A 46 46 LYS N N 46 115.471 119.339 -3.868 1
1 460 . 20 1 1 A 47 47 THR H H 47 7.763 8.240 -0.477 1
1 461 . 20 1 1 A 47 47 THR HA H 47 4.271 4.237 0.034 1
1 466 . 20 1 1 A 47 47 THR C C 47 175.472 175.046 0.426 1
1 467 . 20 1 1 A 47 47 THR CA C 47 62.429 62.367 0.062 1
1 468 . 20 1 1 A 47 47 THR CB C 47 71.966 70.091 1.875 1
1 470 . 20 1 1 A 47 47 THR N N 47 104.286 108.659 -4.373 1
1 471 . 20 1 1 A 48 48 ASN H H 48 8.169 8.038 0.131 1
1 472 . 20 1 1 A 48 48 ASN HA H 48 4.437 4.657 -0.220 1
1 477 . 20 1 1 A 48 48 ASN C C 48 173.874 174.113 -0.239 1
1 478 . 20 1 1 A 48 48 ASN CA C 48 55.377 54.421 0.956 1
1 479 . 20 1 1 A 48 48 ASN CB C 48 37.770 36.878 0.892 1
1 480 . 20 1 1 A 48 48 ASN N N 48 117.458 116.090 1.368 1
1 482 . 20 1 1 A 49 49 LEU H H 49 7.532 7.310 0.222 1
1 483 . 20 1 1 A 49 49 LEU HA H 49 4.733 4.656 0.077 1
1 493 . 20 1 1 A 49 49 LEU C C 49 176.625 175.722 0.903 1
1 494 . 20 1 1 A 49 49 LEU CA C 49 53.226 53.740 -0.514 1
1 495 . 20 1 1 A 49 49 LEU CB C 49 44.114 42.794 1.320 1
1 499 . 20 1 1 A 49 49 LEU N N 49 118.220 119.109 -0.889 1
1 500 . 20 1 1 A 50 50 SER H H 50 9.140 8.797 0.343 1
1 501 . 20 1 1 A 50 50 SER HA H 50 4.475 4.843 -0.368 1
1 504 . 20 1 1 A 50 50 SER C C 50 174.907 174.924 -0.017 1
1 505 . 20 1 1 A 50 50 SER CA C 50 56.964 57.609 -0.645 1
1 506 . 20 1 1 A 50 50 SER CB C 50 65.372 65.003 0.369 1
1 507 . 20 1 1 A 50 50 SER N N 50 117.569 117.632 -0.063 1
1 508 . 20 1 1 A 51 51 LEU H H 51 8.756 8.812 -0.056 1
1 509 . 20 1 1 A 51 51 LEU HA H 51 3.874 3.927 -0.053 1
1 519 . 20 1 1 A 51 51 LEU C C 51 179.910 178.868 1.042 1
1 520 . 20 1 1 A 51 51 LEU CA C 51 58.916 58.280 0.636 1
1 521 . 20 1 1 A 51 51 LEU CB C 51 41.148 41.288 -0.140 1
1 525 . 20 1 1 A 51 51 LEU N N 51 120.905 125.528 -4.623 1
1 526 . 20 1 1 A 52 52 LEU H H 52 8.146 8.367 -0.221 1
1 527 . 20 1 1 A 52 52 LEU HA H 52 4.179 4.044 0.135 1
1 537 . 20 1 1 A 52 52 LEU C C 52 178.936 178.772 0.164 1
1 538 . 20 1 1 A 52 52 LEU CA C 52 58.162 58.403 -0.241 1
1 539 . 20 1 1 A 52 52 LEU CB C 52 42.137 41.812 0.325 1
1 543 . 20 1 1 A 52 52 LEU N N 52 120.685 120.271 0.414 1
1 544 . 20 1 1 A 53 53 GLN H H 53 7.924 7.935 -0.011 1
1 545 . 20 1 1 A 53 53 GLN HA H 53 4.102 4.144 -0.042 1
1 552 . 20 1 1 A 53 53 GLN C C 53 180.308 178.448 1.860 1
1 553 . 20 1 1 A 53 53 GLN CA C 53 59.326 58.449 0.877 1
1 554 . 20 1 1 A 53 53 GLN CB C 53 29.900 28.343 1.557 1
1 556 . 20 1 1 A 53 53 GLN N N 53 118.473 117.499 0.974 1
1 558 . 20 1 1 A 54 54 ILE H H 54 8.380 8.358 0.022 1
1 559 . 20 1 1 A 54 54 ILE HA H 54 3.677 3.728 -0.051 1
1 569 . 20 1 1 A 54 54 ILE C C 54 177.673 178.130 -0.457 1
1 570 . 20 1 1 A 54 54 ILE CA C 54 64.650 65.515 -0.865 1
1 571 . 20 1 1 A 54 54 ILE CB C 54 37.476 37.753 -0.277 1
1 575 . 20 1 1 A 54 54 ILE N N 54 120.113 121.480 -1.367 1
1 576 . 20 1 1 A 55 55 SER H H 55 8.854 7.925 0.929 1
1 577 . 20 1 1 A 55 55 SER HA H 55 4.267 4.263 0.004 1
1 580 . 20 1 1 A 55 55 SER C C 55 177.127 177.625 -0.498 1
1 581 . 20 1 1 A 55 55 SER CA C 55 62.852 61.717 1.135 1
1 582 . 20 1 1 A 55 55 SER CB C 55 62.727 62.972 -0.245 1
1 583 . 20 1 1 A 55 55 SER N N 55 116.646 115.864 0.782 1
1 584 . 20 1 1 A 56 56 ASN H H 56 8.634 8.258 0.376 1
1 585 . 20 1 1 A 56 56 ASN HA H 56 4.549 4.459 0.090 1
1 590 . 20 1 1 A 56 56 ASN C C 56 177.481 178.018 -0.537 1
1 591 . 20 1 1 A 56 56 ASN CA C 56 55.951 56.549 -0.598 1
1 592 . 20 1 1 A 56 56 ASN CB C 56 37.852 38.253 -0.401 1
1 593 . 20 1 1 A 56 56 ASN N N 56 119.048 119.879 -0.831 1
1 595 . 20 1 1 A 57 57 TRP H H 57 8.373 8.504 -0.131 1
1 596 . 20 1 1 A 57 57 TRP HA H 57 4.065 4.338 -0.273 1
1 605 . 20 1 1 A 57 57 TRP C C 57 179.392 178.352 1.040 1
1 606 . 20 1 1 A 57 57 TRP CA C 57 63.204 61.025 2.179 1
1 607 . 20 1 1 A 57 57 TRP CB C 57 28.376 29.374 -0.998 1
1 613 . 20 1 1 A 57 57 TRP N N 57 122.950 122.494 0.456 1
1 615 . 20 1 1 A 58 58 PHE H H 58 8.428 8.185 0.243 1
1 616 . 20 1 1 A 58 58 PHE HA H 58 3.922 3.771 0.151 1
1 624 . 20 1 1 A 58 58 PHE C C 58 178.237 177.838 0.399 1
1 625 . 20 1 1 A 58 58 PHE CA C 58 64.015 61.741 2.274 1
1 626 . 20 1 1 A 58 58 PHE CB C 58 39.602 38.242 1.360 1
1 632 . 20 1 1 A 58 58 PHE N N 58 116.774 117.732 -0.958 1
1 633 . 20 1 1 A 59 59 ILE H H 59 7.925 8.288 -0.363 1
1 634 . 20 1 1 A 59 59 ILE HA H 59 3.773 3.707 0.066 1
1 644 . 20 1 1 A 59 59 ILE C C 59 178.745 178.274 0.471 1
1 645 . 20 1 1 A 59 59 ILE CA C 59 65.531 65.331 0.200 1
1 646 . 20 1 1 A 59 59 ILE CB C 59 38.480 37.850 0.630 1
1 650 . 20 1 1 A 59 59 ILE N N 59 119.560 120.057 -0.497 1
1 651 . 20 1 1 A 60 60 ASN H H 60 7.506 8.316 -0.810 1
1 652 . 20 1 1 A 60 60 ASN HA H 60 4.407 4.345 0.062 1
1 657 . 20 1 1 A 60 60 ASN C C 60 177.163 177.043 0.120 1
1 658 . 20 1 1 A 60 60 ASN CA C 60 55.871 56.402 -0.531 1
1 659 . 20 1 1 A 60 60 ASN CB C 60 38.878 38.537 0.341 1
1 660 . 20 1 1 A 60 60 ASN N N 60 116.868 119.522 -2.654 1
1 662 . 20 1 1 A 61 61 ALA H H 61 8.410 8.247 0.163 1
1 663 . 20 1 1 A 61 61 ALA HA H 61 3.667 3.587 0.080 1
1 667 . 20 1 1 A 61 61 ALA C C 61 180.061 179.604 0.457 1
1 668 . 20 1 1 A 61 61 ALA CA C 61 54.601 54.442 0.159 1
1 669 . 20 1 1 A 61 61 ALA CB C 61 18.241 17.032 1.209 1
1 670 . 20 1 1 A 61 61 ALA N N 61 123.022 121.100 1.922 1
1 671 . 20 1 1 A 62 62 ARG H H 62 8.036 8.019 0.017 1
1 672 . 20 1 1 A 62 62 ARG HA H 62 4.092 3.992 0.100 1
1 679 . 20 1 1 A 62 62 ARG C C 62 176.756 177.286 -0.530 1
1 680 . 20 1 1 A 62 62 ARG CA C 62 58.762 58.236 0.526 1
1 681 . 20 1 1 A 62 62 ARG CB C 62 30.601 29.984 0.617 1
1 684 . 20 1 1 A 62 62 ARG N N 62 117.168 118.629 -1.461 1
1 685 . 20 1 1 A 63 63 ARG H H 63 7.214 7.989 -0.775 1
1 686 . 20 1 1 A 63 63 ARG HA H 63 4.249 4.374 -0.125 1
1 693 . 20 1 1 A 63 63 ARG C C 63 176.945 176.723 0.222 1
1 694 . 20 1 1 A 63 63 ARG CA C 63 57.669 56.176 1.493 1
1 695 . 20 1 1 A 63 63 ARG CB C 63 30.765 31.043 -0.278 1
1 698 . 20 1 1 A 63 63 ARG N N 63 116.514 117.812 -1.298 1
1 699 . 20 1 1 A 64 64 ARG H H 64 7.913 7.415 0.498 1
1 700 . 20 1 1 A 64 64 ARG HA H 64 4.351 4.401 -0.050 1
1 707 . 20 1 1 A 64 64 ARG C C 64 176.413 177.452 -1.039 1
1 708 . 20 1 1 A 64 64 ARG CA C 64 57.105 56.855 0.250 1
1 709 . 20 1 1 A 64 64 ARG CB C 64 31.672 32.532 -0.860 1
1 712 . 20 1 1 A 64 64 ARG N N 64 116.818 116.808 0.010 1
1 713 . 20 1 1 A 65 65 ILE H H 65 8.169 8.358 -0.189 1
1 714 . 20 1 1 A 65 65 ILE HA H 65 4.285 3.698 0.587 1
1 724 . 20 1 1 A 65 65 ILE C C 65 176.208 177.961 -1.753 1
1 725 . 20 1 1 A 65 65 ILE CA C 65 62.005 65.036 -3.031 1
1 726 . 20 1 1 A 65 65 ILE CB C 65 39.088 37.811 1.277 1
1 730 . 20 1 1 A 65 65 ILE N N 65 119.185 121.075 -1.890 1
1 731 . 20 1 1 A 66 66 LEU H H 66 7.962 7.884 0.078 1
1 732 . 20 1 1 A 66 66 LEU HA H 66 4.485 4.082 0.403 1
1 742 . 20 1 1 A 66 66 LEU C C 66 176.216 175.292 0.924 1
1 743 . 20 1 1 A 66 66 LEU CA C 66 56.153 59.834 -3.681 1
1 744 . 20 1 1 A 66 66 LEU CB C 66 40.792 39.847 0.945 1
1 748 . 20 1 1 A 66 66 LEU N N 66 124.389 121.676 2.713 1
1 749 . 20 1 1 A 67 67 PRO HA H 67 4.283 4.378 -0.095 1
1 756 . 20 1 1 A 67 67 PRO C C 67 178.294 177.972 0.322 1
1 757 . 20 1 1 A 67 67 PRO CA C 67 65.390 65.121 0.269 1
1 758 . 20 1 1 A 67 67 PRO CB C 67 31.095 31.250 -0.155 1
1 761 . 20 1 1 A 68 68 ASP H H 68 7.913 8.764 -0.851 1
1 762 . 20 1 1 A 68 68 ASP HA H 68 4.507 4.534 -0.027 1
1 765 . 20 1 1 A 68 68 ASP C C 68 177.927 177.508 0.419 1
1 766 . 20 1 1 A 68 68 ASP CA C 68 55.906 56.127 -0.221 1
1 767 . 20 1 1 A 68 68 ASP CB C 68 40.736 40.748 -0.012 1
1 768 . 20 1 1 A 68 68 ASP N N 68 117.231 117.765 -0.534 1
1 769 . 20 1 1 A 69 69 MET H H 69 8.083 7.900 0.183 1
1 770 . 20 1 1 A 69 69 MET HA H 69 4.362 4.422 -0.060 1
1 778 . 20 1 1 A 69 69 MET C C 69 177.374 178.595 -1.221 1
1 779 . 20 1 1 A 69 69 MET CA C 69 57.634 58.200 -0.566 1
1 780 . 20 1 1 A 69 69 MET CB C 69 32.816 33.294 -0.478 1
1 783 . 20 1 1 A 69 69 MET N N 69 119.391 116.984 2.407 1
1 784 . 20 1 1 A 70 70 LEU H H 70 7.907 7.739 0.168 1
1 785 . 20 1 1 A 70 70 LEU HA H 70 4.232 4.022 0.210 1
1 795 . 20 1 1 A 70 70 LEU C C 70 177.745 176.653 1.092 1
1 796 . 20 1 1 A 70 70 LEU CA C 70 55.835 57.718 -1.883 1
1 797 . 20 1 1 A 70 70 LEU CB C 70 42.174 41.871 0.303 1
1 801 . 20 1 1 A 70 70 LEU N N 70 119.266 121.848 -2.582 1
1 802 . 20 1 1 A 71 71 GLN H H 71 7.865 7.833 0.032 1
1 803 . 20 1 1 A 71 71 GLN HA H 71 4.287 4.002 0.285 1
1 809 . 20 1 1 A 71 71 GLN C C 71 178.855 175.496 3.359 1
1 810 . 20 1 1 A 71 71 GLN CA C 71 56.383 56.940 -0.557 1
1 811 . 20 1 1 A 71 71 GLN CB C 71 29.092 26.250 2.842 1
1 813 . 20 1 1 A 71 71 GLN N N 71 118.603 115.076 3.527 1
1 815 . 20 1 1 A 72 72 GLN H H 72 8.189 8.171 0.018 1
1 816 . 20 1 1 A 72 72 GLN HA H 72 4.302 4.289 0.013 1
1 821 . 20 1 1 A 72 72 GLN CA C 72 56.206 57.316 -1.110 1
1 822 . 20 1 1 A 72 72 GLN CB C 72 29.298 29.701 -0.403 1
1 824 . 20 1 1 A 72 72 GLN N N 72 120.267 117.231 3.036 1
1 825 . 20 1 1 A 73 73 ARG C C 73 176.105 174.412 1.693 1
1 826 . 20 1 1 A 74 74 ARG HA H 74 4.334 4.967 -0.633 1
1 833 . 20 1 1 A 74 74 ARG C C 74 176.188 175.224 0.964 1
1 834 . 20 1 1 A 74 74 ARG CA C 74 56.300 54.452 1.848 1
1 835 . 20 1 1 A 74 74 ARG CB C 74 30.668 33.958 -3.290 1
1 838 . 20 1 1 A 75 75 ASN C C 75 174.462 175.486 -1.024 1
1 839 . 20 1 1 A 75 75 ASN CA C 75 53.148 53.869 -0.721 1
1 840 . 20 1 1 A 75 75 ASN CB C 75 39.046 38.603 0.443 1
1 841 . 20 1 1 A 76 76 ASP H H 76 8.257 8.942 -0.685 1
1 842 . 20 1 1 A 76 76 ASP HA H 76 4.877 5.257 -0.380 1
1 845 . 20 1 1 A 76 76 ASP C C 76 174.759 173.521 1.238 1
1 846 . 20 1 1 A 76 76 ASP CA C 76 52.380 51.174 1.206 1
1 847 . 20 1 1 A 76 76 ASP CB C 76 41.267 43.548 -2.281 1
1 848 . 20 1 1 A 76 76 ASP N N 76 122.030 121.244 0.786 1
1 849 . 20 1 1 A 77 77 PRO HA H 77 4.466 4.728 -0.262 1
1 856 . 20 1 1 A 77 77 PRO C C 77 177.133 175.816 1.317 1
1 857 . 20 1 1 A 77 77 PRO CA C 77 63.733 62.292 1.441 1
1 858 . 20 1 1 A 77 77 PRO CB C 77 31.919 29.543 2.376 1
1 861 . 20 1 1 A 78 78 SER H H 78 8.457 8.460 -0.003 1
1 862 . 20 1 1 A 78 78 SER HA H 78 4.479 4.463 0.016 1
1 865 . 20 1 1 A 78 78 SER C C 78 174.731 174.783 -0.052 1
1 866 . 20 1 1 A 78 78 SER CA C 78 58.691 59.248 -0.557 1
1 867 . 20 1 1 A 78 78 SER CB C 78 63.973 63.712 0.261 1
1 868 . 20 1 1 A 78 78 SER N N 78 115.711 118.996 -3.285 1
1 869 . 20 1 1 A 79 79 GLY H H 79 8.090 8.755 -0.665 1
1 870 . 20 1 1 A 79 79 GLY HA2 H 79 4.179 3.844 0.335 1
1 871 . 20 1 1 A 79 79 GLY HA3 H 79 4.065 3.844 0.221 1
1 872 . 20 1 1 A 79 79 GLY CA C 79 44.746 47.751 -3.005 1
1 873 . 20 1 1 A 79 79 GLY N N 79 110.429 112.812 -2.383 1
1 874 . 20 1 1 A 80 80 PRO HA H 80 4.464 4.660 -0.196 1
1 880 . 20 1 1 A 80 80 PRO C C 80 177.499 176.919 0.580 1
1 881 . 20 1 1 A 80 80 PRO CA C 80 63.275 62.225 1.050 1
1 882 . 20 1 1 A 80 80 PRO CB C 80 32.249 29.845 2.404 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 64 1.060 1
2 1 1 1 "RMS(OBS, PRED)" CA 67 1.172 1
3 1 1 1 "RMS(OBS, PRED)" CB 66 0.981 1
4 1 1 1 "RMS(OBS, PRED)" H 59 0.504 1
5 1 1 1 "RMS(OBS, PRED)" HA 67 0.200 1
6 1 1 1 "RMS(OBS, PRED)" N 59 2.614 1
7 1 2 1 "RMS(OBS, PRED)" C 64 0.977 1
8 1 2 1 "RMS(OBS, PRED)" CA 67 1.153 1
9 1 2 1 "RMS(OBS, PRED)" CB 66 1.046 1
10 1 2 1 "RMS(OBS, PRED)" H 59 0.479 1
11 1 2 1 "RMS(OBS, PRED)" HA 67 0.232 1
12 1 2 1 "RMS(OBS, PRED)" N 59 2.598 1
13 1 3 1 "RMS(OBS, PRED)" C 64 1.074 1
14 1 3 1 "RMS(OBS, PRED)" CA 67 1.133 1
15 1 3 1 "RMS(OBS, PRED)" CB 66 1.012 1
16 1 3 1 "RMS(OBS, PRED)" H 59 0.503 1
17 1 3 1 "RMS(OBS, PRED)" HA 67 0.241 1
18 1 3 1 "RMS(OBS, PRED)" N 59 2.560 1
19 1 4 1 "RMS(OBS, PRED)" C 64 1.094 1
20 1 4 1 "RMS(OBS, PRED)" CA 67 1.137 1
21 1 4 1 "RMS(OBS, PRED)" CB 66 1.012 1
22 1 4 1 "RMS(OBS, PRED)" H 59 0.487 1
23 1 4 1 "RMS(OBS, PRED)" HA 67 0.196 1
24 1 4 1 "RMS(OBS, PRED)" N 59 2.512 1
25 1 5 1 "RMS(OBS, PRED)" C 64 0.988 1
26 1 5 1 "RMS(OBS, PRED)" CA 67 1.191 1
27 1 5 1 "RMS(OBS, PRED)" CB 66 0.943 1
28 1 5 1 "RMS(OBS, PRED)" H 59 0.492 1
29 1 5 1 "RMS(OBS, PRED)" HA 67 0.220 1
30 1 5 1 "RMS(OBS, PRED)" N 59 2.516 1
31 1 6 1 "RMS(OBS, PRED)" C 64 1.019 1
32 1 6 1 "RMS(OBS, PRED)" CA 67 1.184 1
33 1 6 1 "RMS(OBS, PRED)" CB 66 0.881 1
34 1 6 1 "RMS(OBS, PRED)" H 59 0.517 1
35 1 6 1 "RMS(OBS, PRED)" HA 67 0.203 1
36 1 6 1 "RMS(OBS, PRED)" N 59 2.535 1
37 1 7 1 "RMS(OBS, PRED)" C 64 1.052 1
38 1 7 1 "RMS(OBS, PRED)" CA 67 1.105 1
39 1 7 1 "RMS(OBS, PRED)" CB 66 1.057 1
40 1 7 1 "RMS(OBS, PRED)" H 59 0.484 1
41 1 7 1 "RMS(OBS, PRED)" HA 67 0.213 1
42 1 7 1 "RMS(OBS, PRED)" N 59 2.527 1
43 1 8 1 "RMS(OBS, PRED)" C 64 1.030 1
44 1 8 1 "RMS(OBS, PRED)" CA 67 1.083 1
45 1 8 1 "RMS(OBS, PRED)" CB 66 0.981 1
46 1 8 1 "RMS(OBS, PRED)" H 59 0.484 1
47 1 8 1 "RMS(OBS, PRED)" HA 67 0.200 1
48 1 8 1 "RMS(OBS, PRED)" N 59 2.506 1
49 1 9 1 "RMS(OBS, PRED)" C 64 1.156 1
50 1 9 1 "RMS(OBS, PRED)" CA 67 1.173 1
51 1 9 1 "RMS(OBS, PRED)" CB 66 1.173 1
52 1 9 1 "RMS(OBS, PRED)" H 59 0.513 1
53 1 9 1 "RMS(OBS, PRED)" HA 67 0.239 1
54 1 9 1 "RMS(OBS, PRED)" N 59 2.459 1
55 1 10 1 "RMS(OBS, PRED)" C 64 1.016 1
56 1 10 1 "RMS(OBS, PRED)" CA 67 1.092 1
57 1 10 1 "RMS(OBS, PRED)" CB 66 0.981 1
58 1 10 1 "RMS(OBS, PRED)" H 59 0.534 1
59 1 10 1 "RMS(OBS, PRED)" HA 67 0.257 1
60 1 10 1 "RMS(OBS, PRED)" N 59 2.590 1
61 1 11 1 "RMS(OBS, PRED)" C 64 0.977 1
62 1 11 1 "RMS(OBS, PRED)" CA 67 1.055 1
63 1 11 1 "RMS(OBS, PRED)" CB 66 0.969 1
64 1 11 1 "RMS(OBS, PRED)" H 59 0.486 1
65 1 11 1 "RMS(OBS, PRED)" HA 67 0.208 1
66 1 11 1 "RMS(OBS, PRED)" N 59 2.649 1
67 1 12 1 "RMS(OBS, PRED)" C 64 1.009 1
68 1 12 1 "RMS(OBS, PRED)" CA 67 1.151 1
69 1 12 1 "RMS(OBS, PRED)" CB 66 1.072 1
70 1 12 1 "RMS(OBS, PRED)" H 59 0.503 1
71 1 12 1 "RMS(OBS, PRED)" HA 67 0.237 1
72 1 12 1 "RMS(OBS, PRED)" N 59 2.656 1
73 1 13 1 "RMS(OBS, PRED)" C 64 0.992 1
74 1 13 1 "RMS(OBS, PRED)" CA 67 1.163 1
75 1 13 1 "RMS(OBS, PRED)" CB 66 0.923 1
76 1 13 1 "RMS(OBS, PRED)" H 59 0.479 1
77 1 13 1 "RMS(OBS, PRED)" HA 67 0.210 1
78 1 13 1 "RMS(OBS, PRED)" N 59 2.562 1
79 1 14 1 "RMS(OBS, PRED)" C 64 1.077 1
80 1 14 1 "RMS(OBS, PRED)" CA 67 1.214 1
81 1 14 1 "RMS(OBS, PRED)" CB 66 1.015 1
82 1 14 1 "RMS(OBS, PRED)" H 59 0.478 1
83 1 14 1 "RMS(OBS, PRED)" HA 67 0.237 1
84 1 14 1 "RMS(OBS, PRED)" N 59 2.683 1
85 1 15 1 "RMS(OBS, PRED)" C 64 1.034 1
86 1 15 1 "RMS(OBS, PRED)" CA 67 1.251 1
87 1 15 1 "RMS(OBS, PRED)" CB 66 0.875 1
88 1 15 1 "RMS(OBS, PRED)" H 59 0.507 1
89 1 15 1 "RMS(OBS, PRED)" HA 67 0.224 1
90 1 15 1 "RMS(OBS, PRED)" N 59 2.414 1
91 1 16 1 "RMS(OBS, PRED)" C 64 0.919 1
92 1 16 1 "RMS(OBS, PRED)" CA 67 1.098 1
93 1 16 1 "RMS(OBS, PRED)" CB 66 1.005 1
94 1 16 1 "RMS(OBS, PRED)" H 59 0.466 1
95 1 16 1 "RMS(OBS, PRED)" HA 67 0.197 1
96 1 16 1 "RMS(OBS, PRED)" N 59 2.595 1
97 1 17 1 "RMS(OBS, PRED)" C 64 1.000 1
98 1 17 1 "RMS(OBS, PRED)" CA 67 1.209 1
99 1 17 1 "RMS(OBS, PRED)" CB 66 1.021 1
100 1 17 1 "RMS(OBS, PRED)" H 59 0.509 1
101 1 17 1 "RMS(OBS, PRED)" HA 67 0.225 1
102 1 17 1 "RMS(OBS, PRED)" N 59 2.584 1
103 1 18 1 "RMS(OBS, PRED)" C 64 1.043 1
104 1 18 1 "RMS(OBS, PRED)" CA 67 1.086 1
105 1 18 1 "RMS(OBS, PRED)" CB 66 0.988 1
106 1 18 1 "RMS(OBS, PRED)" H 59 0.482 1
107 1 18 1 "RMS(OBS, PRED)" HA 67 0.214 1
108 1 18 1 "RMS(OBS, PRED)" N 59 2.592 1
109 1 19 1 "RMS(OBS, PRED)" C 64 1.023 1
110 1 19 1 "RMS(OBS, PRED)" CA 67 1.205 1
111 1 19 1 "RMS(OBS, PRED)" CB 66 1.024 1
112 1 19 1 "RMS(OBS, PRED)" H 59 0.479 1
113 1 19 1 "RMS(OBS, PRED)" HA 67 0.249 1
114 1 19 1 "RMS(OBS, PRED)" N 59 2.389 1
115 1 20 1 "RMS(OBS, PRED)" C 64 1.037 1
116 1 20 1 "RMS(OBS, PRED)" CA 67 1.179 1
117 1 20 1 "RMS(OBS, PRED)" CB 66 1.184 1
118 1 20 1 "RMS(OBS, PRED)" H 59 0.531 1
119 1 20 1 "RMS(OBS, PRED)" HA 67 0.231 1
120 1 20 1 "RMS(OBS, PRED)" N 59 2.673 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 13 13 ASN HA H 13 4.787 5.276 -0.489 2
1 6 . 1 1 A 13 13 ASN CA C 13 53.148 52.602 0.546 2
1 7 . 1 1 A 13 13 ASN CB C 13 39.378 41.035 -1.657 2
1 9 . 1 1 A 14 14 LEU H H 14 8.418 8.671 -0.253 2
1 10 . 1 1 A 14 14 LEU HA H 14 4.654 4.664 -0.010 2
1 20 . 1 1 A 14 14 LEU CA C 14 52.999 52.487 0.512 2
1 21 . 1 1 A 14 14 LEU CB C 14 41.919 41.844 0.075 2
1 25 . 1 1 A 14 14 LEU N N 14 122.671 122.858 -0.187 2
1 26 . 1 1 A 15 15 PRO HA H 15 4.460 4.600 -0.140 2
1 33 . 1 1 A 15 15 PRO C C 15 178.156 177.579 0.577 2
1 34 . 1 1 A 15 15 PRO CA C 15 63.101 62.661 0.440 2
1 35 . 1 1 A 15 15 PRO CB C 15 32.304 32.364 -0.059 2
1 38 . 1 1 A 16 16 ALA H H 16 8.973 8.635 0.338 2
1 39 . 1 1 A 16 16 ALA HA H 16 4.021 3.955 0.066 2
1 43 . 1 1 A 16 16 ALA C C 16 180.695 179.513 1.181 2
1 44 . 1 1 A 16 16 ALA CA C 16 55.642 55.560 0.082 2
1 45 . 1 1 A 16 16 ALA CB C 16 18.552 18.647 -0.095 2
1 46 . 1 1 A 16 16 ALA N N 16 128.311 126.939 1.372 2
1 47 . 1 1 A 17 17 GLU H H 17 9.558 8.352 1.206 2
1 48 . 1 1 A 17 17 GLU HA H 17 4.065 4.035 0.030 2
1 53 . 1 1 A 17 17 GLU C C 17 178.886 178.641 0.245 2
1 54 . 1 1 A 17 17 GLU CA C 17 59.400 59.609 -0.209 2
1 55 . 1 1 A 17 17 GLU CB C 17 28.742 29.438 -0.696 2
1 57 . 1 1 A 17 17 GLU N N 17 117.113 118.153 -1.040 2
1 58 . 1 1 A 18 18 SER H H 18 7.263 7.967 -0.704 2
1 59 . 1 1 A 18 18 SER HA H 18 4.180 4.136 0.044 2
1 62 . 1 1 A 18 18 SER C C 18 174.951 176.408 -1.457 2
1 63 . 1 1 A 18 18 SER CA C 18 61.969 61.980 -0.011 2
1 64 . 1 1 A 18 18 SER CB C 18 62.554 62.808 -0.254 2
1 65 . 1 1 A 18 18 SER N N 18 114.932 116.215 -1.283 2
1 66 . 1 1 A 19 19 VAL H H 19 7.620 8.237 -0.617 2
1 67 . 1 1 A 19 19 VAL HA H 19 3.011 3.150 -0.139 2
1 75 . 1 1 A 19 19 VAL C C 19 176.953 177.693 -0.740 2
1 76 . 1 1 A 19 19 VAL CA C 19 66.479 66.799 -0.320 2
1 77 . 1 1 A 19 19 VAL CB C 19 31.569 31.431 0.138 2
1 80 . 1 1 A 19 19 VAL N N 19 121.086 121.629 -0.543 2
1 81 . 1 1 A 20 20 LYS H H 20 7.745 8.367 -0.622 2
1 82 . 1 1 A 20 20 LYS HA H 20 3.884 3.986 -0.102 2
1 91 . 1 1 A 20 20 LYS C C 20 178.150 178.744 -0.594 2
1 92 . 1 1 A 20 20 LYS CA C 20 59.984 59.739 0.245 2
1 93 . 1 1 A 20 20 LYS CB C 20 32.351 32.184 0.167 2
1 97 . 1 1 A 20 20 LYS N N 20 119.366 119.655 -0.289 2
1 98 . 1 1 A 21 21 ILE H H 21 6.943 7.740 -0.797 2
1 99 . 1 1 A 21 21 ILE HA H 21 3.783 3.659 0.124 2
1 109 . 1 1 A 21 21 ILE C C 21 178.996 178.662 0.334 2
1 110 . 1 1 A 21 21 ILE CA C 21 64.642 65.711 -1.069 2
1 111 . 1 1 A 21 21 ILE CB C 21 38.014 37.855 0.159 2
1 115 . 1 1 A 21 21 ILE N N 21 118.163 119.962 -1.799 2
1 116 . 1 1 A 22 22 LEU H H 22 7.267 8.033 -0.766 2
1 117 . 1 1 A 22 22 LEU HA H 22 3.748 3.892 -0.144 2
1 127 . 1 1 A 22 22 LEU C C 22 178.289 178.711 -0.422 2
1 128 . 1 1 A 22 22 LEU CA C 22 58.092 58.043 0.049 2
1 129 . 1 1 A 22 22 LEU CB C 22 38.551 40.819 -2.268 2
1 133 . 1 1 A 22 22 LEU N N 22 120.609 119.249 1.360 2
1 134 . 1 1 A 23 23 ARG H H 23 8.676 8.740 -0.064 2
1 135 . 1 1 A 23 23 ARG HA H 23 4.030 4.199 -0.169 2
1 142 . 1 1 A 23 23 ARG C C 23 178.861 178.359 0.502 2
1 143 . 1 1 A 23 23 ARG CA C 23 60.404 60.055 0.349 2
1 144 . 1 1 A 23 23 ARG CB C 23 30.351 30.194 0.157 2
1 147 . 1 1 A 23 23 ARG N N 23 119.148 117.690 1.458 2
1 148 . 1 1 A 24 24 ASP H H 24 8.515 8.288 0.227 2
1 149 . 1 1 A 24 24 ASP HA H 24 4.519 4.387 0.132 2
1 152 . 1 1 A 24 24 ASP C C 24 178.759 178.504 0.255 2
1 153 . 1 1 A 24 24 ASP CA C 24 57.556 57.200 0.356 2
1 154 . 1 1 A 24 24 ASP CB C 24 40.569 40.950 -0.381 2
1 155 . 1 1 A 24 24 ASP N N 24 120.027 119.343 0.684 2
1 156 . 1 1 A 25 25 TRP H H 25 8.158 7.975 0.183 2
1 157 . 1 1 A 25 25 TRP HA H 25 4.181 4.464 -0.283 2
1 166 . 1 1 A 25 25 TRP C C 25 179.946 178.481 1.465 2
1 167 . 1 1 A 25 25 TRP CA C 25 63.346 61.264 2.082 2
1 168 . 1 1 A 25 25 TRP CB C 25 29.433 29.662 -0.229 2
1 174 . 1 1 A 25 25 TRP N N 25 121.350 121.634 -0.284 2
1 176 . 1 1 A 26 26 MET H H 26 8.977 8.777 0.200 2
1 177 . 1 1 A 26 26 MET HA H 26 4.076 4.553 -0.477 2
1 185 . 1 1 A 26 26 MET C C 26 177.371 178.150 -0.779 2
1 186 . 1 1 A 26 26 MET CA C 26 60.454 58.833 1.621 2
1 187 . 1 1 A 26 26 MET CB C 26 33.567 32.653 0.914 2
1 190 . 1 1 A 26 26 MET N N 26 119.977 118.769 1.208 2
1 191 . 1 1 A 27 27 TYR H H 27 8.604 8.313 0.291 2
1 192 . 1 1 A 27 27 TYR HA H 27 4.138 4.189 -0.051 2
1 199 . 1 1 A 27 27 TYR C C 27 178.901 177.627 1.274 2
1 200 . 1 1 A 27 27 TYR CA C 27 61.846 61.374 0.472 2
1 201 . 1 1 A 27 27 TYR CB C 27 38.165 38.616 -0.451 2
1 206 . 1 1 A 27 27 TYR N N 27 117.797 121.332 -3.535 2
1 207 . 1 1 A 28 28 LYS H H 28 7.867 7.885 -0.018 2
1 208 . 1 1 A 28 28 LYS HA H 28 3.797 3.725 0.072 2
1 217 . 1 1 A 28 28 LYS C C 28 176.858 177.735 -0.877 2
1 218 . 1 1 A 28 28 LYS CA C 28 58.174 59.090 -0.917 2
1 219 . 1 1 A 28 28 LYS CB C 28 32.516 32.041 0.475 2
1 223 . 1 1 A 28 28 LYS N N 28 118.982 117.937 1.045 2
1 224 . 1 1 A 29 29 HIS H H 29 7.443 7.256 0.187 2
1 225 . 1 1 A 29 29 HIS HA H 29 4.386 4.412 -0.026 2
1 230 . 1 1 A 29 29 HIS C C 29 176.085 175.836 0.249 2
1 231 . 1 1 A 29 29 HIS CA C 29 55.213 55.412 -0.199 2
1 232 . 1 1 A 29 29 HIS CB C 29 27.085 28.791 -1.706 2
1 235 . 1 1 A 29 29 HIS N N 29 117.138 115.567 1.571 2
1 236 . 1 1 A 30 30 ARG H H 30 6.921 8.176 -1.255 2
1 237 . 1 1 A 30 30 ARG HA H 30 3.898 4.310 -0.412 2
1 244 . 1 1 A 30 30 ARG C C 30 175.808 177.979 -2.171 2
1 245 . 1 1 A 30 30 ARG CA C 30 58.609 58.544 0.065 2
1 246 . 1 1 A 30 30 ARG CB C 30 28.739 29.694 -0.955 2
1 249 . 1 1 A 30 30 ARG N N 30 117.911 119.381 -1.470 2
1 250 . 1 1 A 31 31 PHE H H 31 7.819 7.921 -0.102 2
1 251 . 1 1 A 31 31 PHE HA H 31 4.533 4.251 0.282 2
1 259 . 1 1 A 31 31 PHE C C 31 175.577 177.191 -1.614 2
1 260 . 1 1 A 31 31 PHE CA C 31 58.029 60.967 -2.938 2
1 261 . 1 1 A 31 31 PHE CB C 31 37.792 38.900 -1.108 2
1 267 . 1 1 A 31 31 PHE N N 31 115.408 119.010 -3.602 2
1 268 . 1 1 A 32 32 LYS H H 32 7.858 8.027 -0.169 2
1 269 . 1 1 A 32 32 LYS HA H 32 4.487 4.441 0.047 2
1 277 . 1 1 A 32 32 LYS C C 32 175.557 176.471 -0.914 2
1 278 . 1 1 A 32 32 LYS CA C 32 56.329 57.333 -1.004 2
1 279 . 1 1 A 32 32 LYS CB C 32 32.743 34.271 -1.528 2
1 283 . 1 1 A 32 32 LYS N N 32 122.453 114.214 8.239 2
1 284 . 1 1 A 33 33 ALA H H 33 8.643 8.242 0.401 2
1 285 . 1 1 A 33 33 ALA HA H 33 4.403 4.103 0.300 2
1 289 . 1 1 A 33 33 ALA C C 33 176.273 175.375 0.898 2
1 290 . 1 1 A 33 33 ALA CA C 33 53.579 53.294 0.285 2
1 291 . 1 1 A 33 33 ALA CB C 33 18.653 17.201 1.452 2
1 292 . 1 1 A 33 33 ALA N N 33 127.853 120.266 7.587 2
1 293 . 1 1 A 34 34 TYR H H 34 7.878 8.030 -0.153 2
1 294 . 1 1 A 34 34 TYR HA H 34 4.686 4.920 -0.234 2
1 301 . 1 1 A 34 34 TYR C C 34 173.133 173.179 -0.046 2
1 302 . 1 1 A 34 34 TYR CA C 34 54.778 54.901 -0.123 2
1 303 . 1 1 A 34 34 TYR CB C 34 39.619 39.953 -0.334 2
1 308 . 1 1 A 34 34 TYR N N 34 116.539 117.257 -0.718 2
1 309 . 1 1 A 35 35 PRO HA H 35 4.526 4.628 -0.102 2
1 316 . 1 1 A 35 35 PRO C C 35 176.837 175.678 1.159 2
1 317 . 1 1 A 35 35 PRO CA C 35 61.864 62.162 -0.298 2
1 318 . 1 1 A 35 35 PRO CB C 35 30.904 31.977 -1.073 2
1 321 . 1 1 A 36 36 SER H H 36 9.634 8.409 1.225 2
1 322 . 1 1 A 36 36 SER HA H 36 4.518 4.774 -0.256 2
1 325 . 1 1 A 36 36 SER C C 36 175.001 175.302 -0.301 2
1 326 . 1 1 A 36 36 SER CA C 36 57.129 57.126 0.003 2
1 327 . 1 1 A 36 36 SER CB C 36 65.374 65.179 0.195 2
1 328 . 1 1 A 36 36 SER N N 36 119.984 116.834 3.150 2
1 329 . 1 1 A 37 37 GLU H H 37 9.091 9.032 0.059 2
1 330 . 1 1 A 37 37 GLU HA H 37 3.884 3.921 -0.037 2
1 335 . 1 1 A 37 37 GLU C C 37 179.347 178.298 1.049 2
1 336 . 1 1 A 37 37 GLU CA C 37 60.454 59.514 0.940 2
1 337 . 1 1 A 37 37 GLU CB C 37 28.623 29.322 -0.699 2
1 339 . 1 1 A 37 37 GLU N N 37 120.748 125.527 -4.779 2
1 340 . 1 1 A 38 38 GLU H H 38 8.760 7.972 0.788 2
1 341 . 1 1 A 38 38 GLU HA H 38 4.048 4.082 -0.034 2
1 346 . 1 1 A 38 38 GLU C C 38 179.975 178.992 0.983 2
1 347 . 1 1 A 38 38 GLU CA C 38 60.243 59.132 1.111 2
1 348 . 1 1 A 38 38 GLU CB C 38 29.117 29.790 -0.673 2
1 350 . 1 1 A 38 38 GLU N N 38 119.272 119.766 -0.494 2
1 351 . 1 1 A 39 39 GLU H H 39 7.856 8.009 -0.153 2
1 352 . 1 1 A 39 39 GLU HA H 39 3.976 3.898 0.078 2
1 357 . 1 1 A 39 39 GLU C C 39 178.912 178.776 0.136 2
1 358 . 1 1 A 39 39 GLU CA C 39 59.131 59.154 -0.023 2
1 359 . 1 1 A 39 39 GLU CB C 39 29.612 28.841 0.771 2
1 361 . 1 1 A 39 39 GLU N N 39 121.658 120.614 1.044 2
1 362 . 1 1 A 40 40 LYS H H 40 8.653 7.744 0.909 2
1 363 . 1 1 A 40 40 LYS HA H 40 3.508 3.822 -0.314 2
1 372 . 1 1 A 40 40 LYS C C 40 177.974 178.985 -1.011 2
1 373 . 1 1 A 40 40 LYS CA C 40 60.948 59.500 1.448 2
1 374 . 1 1 A 40 40 LYS CB C 40 32.714 32.098 0.616 2
1 378 . 1 1 A 40 40 LYS N N 40 119.152 119.608 -0.456 2
1 379 . 1 1 A 41 41 GLN H H 41 7.876 7.577 0.299 2
1 380 . 1 1 A 41 41 GLN HA H 41 3.911 3.973 -0.062 2
1 387 . 1 1 A 41 41 GLN C C 41 178.352 178.128 0.224 2
1 388 . 1 1 A 41 41 GLN CA C 41 58.973 58.907 0.066 2
1 389 . 1 1 A 41 41 GLN CB C 41 27.552 28.553 -1.001 2
1 391 . 1 1 A 41 41 GLN N N 41 118.910 119.572 -0.662 2
1 393 . 1 1 A 42 42 MET H H 42 7.771 7.831 -0.060 2
1 394 . 1 1 A 42 42 MET HA H 42 4.158 4.217 -0.059 2
1 402 . 1 1 A 42 42 MET C C 42 179.310 178.269 1.041 2
1 403 . 1 1 A 42 42 MET CA C 42 59.079 58.270 0.809 2
1 404 . 1 1 A 42 42 MET CB C 42 31.023 32.363 -1.340 2
1 407 . 1 1 A 42 42 MET N N 42 121.131 119.272 1.859 2
1 408 . 1 1 A 43 43 LEU H H 43 8.400 8.335 0.065 2
1 409 . 1 1 A 43 43 LEU HA H 43 3.888 3.969 -0.081 2
1 419 . 1 1 A 43 43 LEU C C 43 180.721 179.009 1.712 2
1 420 . 1 1 A 43 43 LEU CA C 43 57.916 58.030 -0.114 2
1 421 . 1 1 A 43 43 LEU CB C 43 42.080 41.363 0.717 2
1 425 . 1 1 A 43 43 LEU N N 43 120.124 120.729 -0.605 2
1 426 . 1 1 A 44 44 SER H H 44 8.658 8.533 0.125 2
1 427 . 1 1 A 44 44 SER HA H 44 4.088 4.216 -0.128 2
1 430 . 1 1 A 44 44 SER C C 44 176.859 176.799 0.060 2
1 431 . 1 1 A 44 44 SER CA C 44 61.371 61.125 0.246 2
1 432 . 1 1 A 44 44 SER CB C 44 63.314 62.902 0.412 2
1 433 . 1 1 A 44 44 SER N N 44 119.795 113.720 6.075 2
1 434 . 1 1 A 45 45 GLU H H 45 7.905 7.614 0.291 2
1 435 . 1 1 A 45 45 GLU HA H 45 4.094 4.209 -0.115 2
1 440 . 1 1 A 45 45 GLU C C 45 179.095 179.138 -0.043 2
1 441 . 1 1 A 45 45 GLU CA C 45 59.255 58.980 0.275 2
1 442 . 1 1 A 45 45 GLU CB C 45 29.200 29.647 -0.447 2
1 444 . 1 1 A 45 45 GLU N N 45 120.609 121.583 -0.974 2
1 445 . 1 1 A 46 46 LYS H H 46 7.837 7.956 -0.119 2
1 446 . 1 1 A 46 46 LYS HA H 46 4.231 4.143 0.088 2
1 453 . 1 1 A 46 46 LYS C C 46 177.964 178.558 -0.594 2
1 454 . 1 1 A 46 46 LYS CA C 46 58.278 58.815 -0.537 2
1 455 . 1 1 A 46 46 LYS CB C 46 34.110 32.624 1.486 2
1 459 . 1 1 A 46 46 LYS N N 46 115.471 119.118 -3.647 2
1 460 . 1 1 A 47 47 THR H H 47 7.763 8.126 -0.363 2
1 461 . 1 1 A 47 47 THR HA H 47 4.271 4.255 0.016 2
1 466 . 1 1 A 47 47 THR C C 47 175.472 174.946 0.526 2
1 467 . 1 1 A 47 47 THR CA C 47 62.429 62.294 0.135 2
1 468 . 1 1 A 47 47 THR CB C 47 71.966 70.128 1.838 2
1 470 . 1 1 A 47 47 THR N N 47 104.286 108.383 -4.097 2
1 471 . 1 1 A 48 48 ASN H H 48 8.169 8.206 -0.037 2
1 472 . 1 1 A 48 48 ASN HA H 48 4.437 4.543 -0.106 2
1 477 . 1 1 A 48 48 ASN C C 48 173.874 173.935 -0.061 2
1 478 . 1 1 A 48 48 ASN CA C 48 55.377 54.366 1.011 2
1 479 . 1 1 A 48 48 ASN CB C 48 37.770 37.110 0.660 2
1 480 . 1 1 A 48 48 ASN N N 48 117.458 117.892 -0.434 2
1 482 . 1 1 A 49 49 LEU H H 49 7.532 7.240 0.292 2
1 483 . 1 1 A 49 49 LEU HA H 49 4.733 4.774 -0.041 2
1 493 . 1 1 A 49 49 LEU C C 49 176.625 175.709 0.916 2
1 494 . 1 1 A 49 49 LEU CA C 49 53.226 53.364 -0.138 2
1 495 . 1 1 A 49 49 LEU CB C 49 44.114 43.489 0.625 2
1 499 . 1 1 A 49 49 LEU N N 49 118.220 119.635 -1.415 2
1 500 . 1 1 A 50 50 SER H H 50 9.140 8.737 0.403 2
1 501 . 1 1 A 50 50 SER HA H 50 4.475 4.891 -0.416 2
1 504 . 1 1 A 50 50 SER C C 50 174.907 175.094 -0.187 2
1 505 . 1 1 A 50 50 SER CA C 50 56.964 57.575 -0.611 2
1 506 . 1 1 A 50 50 SER CB C 50 65.372 64.973 0.399 2
1 507 . 1 1 A 50 50 SER N N 50 117.569 117.036 0.533 2
1 508 . 1 1 A 51 51 LEU H H 51 8.756 8.771 -0.015 2
1 509 . 1 1 A 51 51 LEU HA H 51 3.874 3.924 -0.050 2
1 519 . 1 1 A 51 51 LEU C C 51 179.910 178.860 1.050 2
1 520 . 1 1 A 51 51 LEU CA C 51 58.916 58.101 0.815 2
1 521 . 1 1 A 51 51 LEU CB C 51 41.148 41.421 -0.273 2
1 525 . 1 1 A 51 51 LEU N N 51 120.905 125.574 -4.669 2
1 526 . 1 1 A 52 52 LEU H H 52 8.146 8.244 -0.098 2
1 527 . 1 1 A 52 52 LEU HA H 52 4.179 4.041 0.138 2
1 537 . 1 1 A 52 52 LEU C C 52 178.936 178.701 0.235 2
1 538 . 1 1 A 52 52 LEU CA C 52 58.162 58.365 -0.203 2
1 539 . 1 1 A 52 52 LEU CB C 52 42.137 41.576 0.561 2
1 543 . 1 1 A 52 52 LEU N N 52 120.685 120.130 0.555 2
1 544 . 1 1 A 53 53 GLN H H 53 7.924 8.135 -0.211 2
1 545 . 1 1 A 53 53 GLN HA H 53 4.102 4.156 -0.054 2
1 552 . 1 1 A 53 53 GLN C C 53 180.308 178.595 1.713 2
1 553 . 1 1 A 53 53 GLN CA C 53 59.326 58.521 0.805 2
1 554 . 1 1 A 53 53 GLN CB C 53 29.900 28.388 1.512 2
1 556 . 1 1 A 53 53 GLN N N 53 118.473 117.579 0.894 2
1 558 . 1 1 A 54 54 ILE H H 54 8.380 8.273 0.107 2
1 559 . 1 1 A 54 54 ILE HA H 54 3.677 3.723 -0.045 2
1 569 . 1 1 A 54 54 ILE C C 54 177.673 178.112 -0.439 2
1 570 . 1 1 A 54 54 ILE CA C 54 64.650 65.456 -0.806 2
1 571 . 1 1 A 54 54 ILE CB C 54 37.476 37.826 -0.350 2
1 575 . 1 1 A 54 54 ILE N N 54 120.113 121.535 -1.422 2
1 576 . 1 1 A 55 55 SER H H 55 8.854 8.017 0.837 2
1 577 . 1 1 A 55 55 SER HA H 55 4.267 4.297 -0.030 2
1 580 . 1 1 A 55 55 SER C C 55 177.127 177.408 -0.281 2
1 581 . 1 1 A 55 55 SER CA C 55 62.852 61.926 0.926 2
1 582 . 1 1 A 55 55 SER CB C 55 62.727 62.987 -0.260 2
1 583 . 1 1 A 55 55 SER N N 55 116.646 115.887 0.759 2
1 584 . 1 1 A 56 56 ASN H H 56 8.634 8.211 0.423 2
1 585 . 1 1 A 56 56 ASN HA H 56 4.549 4.462 0.087 2
1 590 . 1 1 A 56 56 ASN C C 56 177.481 178.290 -0.809 2
1 591 . 1 1 A 56 56 ASN CA C 56 55.951 56.524 -0.573 2
1 592 . 1 1 A 56 56 ASN CB C 56 37.852 38.245 -0.393 2
1 593 . 1 1 A 56 56 ASN N N 56 119.048 119.582 -0.534 2
1 595 . 1 1 A 57 57 TRP H H 57 8.373 8.271 0.102 2
1 596 . 1 1 A 57 57 TRP HA H 57 4.065 4.359 -0.294 2
1 605 . 1 1 A 57 57 TRP C C 57 179.392 178.272 1.120 2
1 606 . 1 1 A 57 57 TRP CA C 57 63.204 61.234 1.970 2
1 607 . 1 1 A 57 57 TRP CB C 57 28.376 29.558 -1.182 2
1 613 . 1 1 A 57 57 TRP N N 57 122.950 122.902 0.048 2
1 615 . 1 1 A 58 58 PHE H H 58 8.428 8.319 0.109 2
1 616 . 1 1 A 58 58 PHE HA H 58 3.922 3.818 0.104 2
1 624 . 1 1 A 58 58 PHE C C 58 178.237 177.883 0.354 2
1 625 . 1 1 A 58 58 PHE CA C 58 64.015 61.556 2.459 2
1 626 . 1 1 A 58 58 PHE CB C 58 39.602 38.384 1.218 2
1 632 . 1 1 A 58 58 PHE N N 58 116.774 117.634 -0.860 2
1 633 . 1 1 A 59 59 ILE H H 59 7.925 8.203 -0.278 2
1 634 . 1 1 A 59 59 ILE HA H 59 3.773 3.668 0.105 2
1 644 . 1 1 A 59 59 ILE C C 59 178.745 177.793 0.952 2
1 645 . 1 1 A 59 59 ILE CA C 59 65.531 65.251 0.280 2
1 646 . 1 1 A 59 59 ILE CB C 59 38.480 37.793 0.687 2
1 650 . 1 1 A 59 59 ILE N N 59 119.560 120.137 -0.577 2
1 651 . 1 1 A 60 60 ASN H H 60 7.506 7.956 -0.450 2
1 652 . 1 1 A 60 60 ASN HA H 60 4.407 4.392 0.015 2
1 657 . 1 1 A 60 60 ASN C C 60 177.163 177.517 -0.354 2
1 658 . 1 1 A 60 60 ASN CA C 60 55.871 56.059 -0.188 2
1 659 . 1 1 A 60 60 ASN CB C 60 38.878 38.111 0.767 2
1 660 . 1 1 A 60 60 ASN N N 60 116.868 118.106 -1.238 2
1 662 . 1 1 A 61 61 ALA H H 61 8.410 8.012 0.398 2
1 663 . 1 1 A 61 61 ALA HA H 61 3.667 3.688 -0.021 2
1 667 . 1 1 A 61 61 ALA C C 61 180.061 179.560 0.501 2
1 668 . 1 1 A 61 61 ALA CA C 61 54.601 54.461 0.140 2
1 669 . 1 1 A 61 61 ALA CB C 61 18.241 17.145 1.096 2
1 670 . 1 1 A 61 61 ALA N N 61 123.022 121.853 1.169 2
1 671 . 1 1 A 62 62 ARG H H 62 8.036 8.032 0.004 2
1 672 . 1 1 A 62 62 ARG HA H 62 4.092 4.031 0.061 2
1 679 . 1 1 A 62 62 ARG C C 62 176.756 177.360 -0.604 2
1 680 . 1 1 A 62 62 ARG CA C 62 58.762 58.181 0.581 2
1 681 . 1 1 A 62 62 ARG CB C 62 30.601 29.818 0.783 2
1 684 . 1 1 A 62 62 ARG N N 62 117.168 118.189 -1.021 2
1 685 . 1 1 A 63 63 ARG H H 63 7.214 7.864 -0.650 2
1 686 . 1 1 A 63 63 ARG HA H 63 4.249 4.351 -0.102 2
1 693 . 1 1 A 63 63 ARG C C 63 176.945 176.727 0.218 2
1 694 . 1 1 A 63 63 ARG CA C 63 57.669 56.892 0.777 2
1 695 . 1 1 A 63 63 ARG CB C 63 30.765 30.989 -0.224 2
1 698 . 1 1 A 63 63 ARG N N 63 116.514 117.534 -1.020 2
1 699 . 1 1 A 64 64 ARG H H 64 7.913 7.833 0.080 2
1 700 . 1 1 A 64 64 ARG HA H 64 4.351 4.555 -0.204 2
1 707 . 1 1 A 64 64 ARG C C 64 176.413 178.111 -1.698 2
1 708 . 1 1 A 64 64 ARG CA C 64 57.105 56.996 0.109 2
1 709 . 1 1 A 64 64 ARG CB C 64 31.672 32.651 -0.979 2
1 712 . 1 1 A 64 64 ARG N N 64 116.818 118.498 -1.680 2
1 713 . 1 1 A 65 65 ILE H H 65 8.169 8.248 -0.079 2
1 714 . 1 1 A 65 65 ILE HA H 65 4.285 3.741 0.544 2
1 724 . 1 1 A 65 65 ILE C C 65 176.208 177.842 -1.634 2
1 725 . 1 1 A 65 65 ILE CA C 65 62.005 64.951 -2.946 2
1 726 . 1 1 A 65 65 ILE CB C 65 39.088 37.844 1.244 2
1 730 . 1 1 A 65 65 ILE N N 65 119.185 119.843 -0.658 2
1 731 . 1 1 A 66 66 LEU H H 66 7.962 7.958 0.004 2
1 732 . 1 1 A 66 66 LEU HA H 66 4.485 4.049 0.436 2
1 742 . 1 1 A 66 66 LEU C C 66 176.216 175.207 1.009 2
1 743 . 1 1 A 66 66 LEU CA C 66 56.153 59.825 -3.672 2
1 744 . 1 1 A 66 66 LEU CB C 66 40.792 40.100 0.692 2
1 748 . 1 1 A 66 66 LEU N N 66 124.389 121.679 2.710 2
1 749 . 1 1 A 67 67 PRO HA H 67 4.283 4.376 -0.093 2
1 756 . 1 1 A 67 67 PRO C C 67 178.294 178.261 0.033 2
1 757 . 1 1 A 67 67 PRO CA C 67 65.390 65.100 0.290 2
1 758 . 1 1 A 67 67 PRO CB C 67 31.095 31.165 -0.070 2
1 761 . 1 1 A 68 68 ASP H H 68 7.913 8.641 -0.728 2
1 762 . 1 1 A 68 68 ASP HA H 68 4.507 4.468 0.039 2
1 765 . 1 1 A 68 68 ASP C C 68 177.927 177.984 -0.058 2
1 766 . 1 1 A 68 68 ASP CA C 68 55.906 56.606 -0.700 2
1 767 . 1 1 A 68 68 ASP CB C 68 40.736 40.950 -0.214 2
1 768 . 1 1 A 68 68 ASP N N 68 117.231 117.839 -0.608 2
1 769 . 1 1 A 69 69 MET H H 69 8.083 8.476 -0.393 2
1 770 . 1 1 A 69 69 MET HA H 69 4.362 4.298 0.064 2
1 778 . 1 1 A 69 69 MET C C 69 177.374 178.775 -1.401 2
1 779 . 1 1 A 69 69 MET CA C 69 57.634 58.457 -0.823 2
1 780 . 1 1 A 69 69 MET CB C 69 32.816 32.706 0.110 2
1 783 . 1 1 A 69 69 MET N N 69 119.391 118.067 1.324 2
1 784 . 1 1 A 70 70 LEU H H 70 7.907 8.030 -0.123 2
1 785 . 1 1 A 70 70 LEU HA H 70 4.232 3.988 0.244 2
1 795 . 1 1 A 70 70 LEU C C 70 177.745 177.451 0.294 2
1 796 . 1 1 A 70 70 LEU CA C 70 55.835 57.861 -2.026 2
1 797 . 1 1 A 70 70 LEU CB C 70 42.174 41.635 0.539 2
1 801 . 1 1 A 70 70 LEU N N 70 119.266 121.776 -2.510 2
1 802 . 1 1 A 71 71 GLN H H 71 7.865 7.777 0.088 2
1 803 . 1 1 A 71 71 GLN HA H 71 4.287 4.201 0.086 2
1 809 . 1 1 A 71 71 GLN C C 71 178.855 175.605 3.250 2
1 810 . 1 1 A 71 71 GLN CA C 71 56.383 56.704 -0.321 2
1 811 . 1 1 A 71 71 GLN CB C 71 29.092 28.135 0.957 2
1 813 . 1 1 A 71 71 GLN N N 71 118.603 117.382 1.221 2
1 815 . 1 1 A 72 72 GLN H H 72 8.189 8.168 0.021 2
1 816 . 1 1 A 72 72 GLN HA H 72 4.302 4.357 -0.055 2
1 821 . 1 1 A 72 72 GLN CA C 72 56.206 55.941 0.265 2
1 822 . 1 1 A 72 72 GLN CB C 72 29.298 29.143 0.155 2
1 824 . 1 1 A 72 72 GLN N N 72 120.267 120.469 -0.202 2
1 825 . 1 1 A 73 73 ARG C C 73 176.105 175.984 0.121 2
1 826 . 1 1 A 74 74 ARG HA H 74 4.334 4.496 -0.162 2
1 833 . 1 1 A 74 74 ARG C C 74 176.188 175.760 0.428 2
1 834 . 1 1 A 74 74 ARG CA C 74 56.300 56.396 -0.096 2
1 835 . 1 1 A 74 74 ARG CB C 74 30.668 31.445 -0.777 2
1 838 . 1 1 A 75 75 ASN C C 75 174.462 174.152 0.310 2
1 839 . 1 1 A 75 75 ASN CA C 75 53.148 53.215 -0.067 2
1 840 . 1 1 A 75 75 ASN CB C 75 39.046 39.415 -0.369 2
1 841 . 1 1 A 76 76 ASP H H 76 8.257 8.511 -0.255 2
1 842 . 1 1 A 76 76 ASP HA H 76 4.877 5.194 -0.317 2
1 845 . 1 1 A 76 76 ASP C C 76 174.759 174.140 0.619 2
1 846 . 1 1 A 76 76 ASP CA C 76 52.380 51.034 1.346 2
1 847 . 1 1 A 76 76 ASP CB C 76 41.267 42.386 -1.119 2
1 848 . 1 1 A 76 76 ASP N N 76 122.030 122.428 -0.398 2
1 849 . 1 1 A 77 77 PRO HA H 77 4.466 4.596 -0.130 2
1 856 . 1 1 A 77 77 PRO C C 77 177.133 176.448 0.685 2
1 857 . 1 1 A 77 77 PRO CA C 77 63.733 62.592 1.141 2
1 858 . 1 1 A 77 77 PRO CB C 77 31.919 31.912 0.007 2
1 861 . 1 1 A 78 78 SER H H 78 8.457 8.460 -0.003 2
1 862 . 1 1 A 78 78 SER HA H 78 4.479 4.647 -0.168 2
1 865 . 1 1 A 78 78 SER C C 78 174.731 174.545 0.186 2
1 866 . 1 1 A 78 78 SER CA C 78 58.691 58.376 0.315 2
1 867 . 1 1 A 78 78 SER CB C 78 63.973 64.140 -0.167 2
1 868 . 1 1 A 78 78 SER N N 78 115.711 117.301 -1.590 2
1 869 . 1 1 A 79 79 GLY H H 79 8.090 8.524 -0.433 2
1 870 . 1 1 A 79 79 GLY HA2 H 79 4.179 4.143 0.036 2
1 871 . 1 1 A 79 79 GLY HA3 H 79 4.065 4.150 -0.085 2
1 872 . 1 1 A 79 79 GLY CA C 79 44.746 45.519 -0.773 2
1 873 . 1 1 A 79 79 GLY N N 79 110.429 112.106 -1.677 2
1 874 . 1 1 A 80 80 PRO HA H 80 4.464 4.604 -0.140 2
1 880 . 1 1 A 80 80 PRO C C 80 177.499 176.124 1.375 2
1 881 . 1 1 A 80 80 PRO CA C 80 63.275 63.029 0.246 2
1 882 . 1 1 A 80 80 PRO CB C 80 32.249 32.479 -0.230 2
stop_
save_